data_2l1r_residue save_MolProbity _Software.Sf_category software _Software.Sf_framecode MolProbity _Software.Entry_ID ? _Software.ID 1 _Software.Name MolProbity _Software.Version 4.0 _Software.Details . save_ save_CYRANGE _Software.Sf_category software _Software.Sf_framecode CYRANGE _Software.Entry_ID ? _Software.ID 2 _Software.Name CYRANGE _Software.Version 2.0 _Software.Details . save_ save_Structure_validation_residue _Structure_validation_residue.Sf_category structure_validation _Structure_validation_residue.Sf_framecode Structure_validation_residue _Structure_validation_residue.Entry_ID ? _Structure_validation_residue.List_ID 1 _Structure_validation_residue.PDB_accession_code 2l1r _Structure_validation_residue.Date_analyzed 2016-10-07 loop_ _Residue_analysis_software.Software_ID _Residue_analysis_software.Software_label _Residue_analysis_software.Method_ID _Residue_analysis_software.Method_label _Residue_analysis_software.Entry_ID _Residue_analysis_software.Structure_validation_oneline_list_ID 1 MolProbity . . ? 1 2 CYRANGE . . ? 1 stop_ loop_ _Residue_analysis.ID _Residue_analysis.PDB_model_num _Residue_analysis.Hydrogen_positions _Residue_analysis.MolProbity_flips _Residue_analysis.Cyrange_core_flag _Residue_analysis.Two_letter_chain_ID _Residue_analysis.PDB_strand_ID _Residue_analysis.PDB_residue_no _Residue_analysis.PDB_ins_code _Residue_analysis.PDB_residue_name _Residue_analysis.Assembly_ID _Residue_analysis.Entity_assembly_ID _Residue_analysis.Entity_ID _Residue_analysis.Comp_ID _Residue_analysis.Comp_index_ID _Residue_analysis.Clash_value _Residue_analysis.Clash_source_PDB_atom_name _Residue_analysis.Clash_destination_PDB_atom_name _Residue_analysis.Clash_destination_PDB_strand_ID _Residue_analysis.Clash_destination_PDB_residue_no _Residue_analysis.Clash_destination_PDB_ins_code _Residue_analysis.Clash_destination_PDB_residue_name _Residue_analysis.Cbeta_deviation_value _Residue_analysis.Rotamer_score _Residue_analysis.Rotamer_name _Residue_analysis.Ramachandran_phi _Residue_analysis.Ramachandran_psi _Residue_analysis.Ramachandran_score _Residue_analysis.Ramachandran_evaluation _Residue_analysis.Ramachandran_type _Residue_analysis.Bond_outlier_count _Residue_analysis.Worst_bond _Residue_analysis.Worst_bond_value _Residue_analysis.Worst_bond_sigma _Residue_analysis.Angle_outlier_count _Residue_analysis.Worst_angle _Residue_analysis.Worst_angle_value _Residue_analysis.Worst_angle_sigma _Residue_analysis.RNA_phosphate_perpendicular_outlier _Residue_analysis.RNA_suitness_score _Residue_analysis.RNA_suite_conformer _Residue_analysis.RNA_suite_triage _Residue_analysis.Max_b_factor _Residue_analysis.Tau_angle _Residue_analysis.Omega_dihedral _Residue_analysis.Disulfide_chi1 _Residue_analysis.Disulfide_chi2 _Residue_analysis.Disulfide_chi3 _Residue_analysis.Disulfide_ss_angle _Residue_analysis.Disulfide_ss _Residue_analysis.Disulfide_ss_angle_prime _Residue_analysis.Disulfide_chi2prime _Residue_analysis.Disulfide_chi1prime _Residue_analysis.Outlier_count_separate_geometry _Residue_analysis.Outlier_count _Residue_analysis.Entry_ID _Residue_analysis.Structure_validation_residue_list_ID . 001 nuclear orig core ' A' A ' 4' ' ' ILE . . . . . . . . . . . . . 2.8 mp . . . . . 0 N--CA 1.496 1.87 0 CA-C-O 121.004 0.43 . . . . 0.0 110.05 . . . . . . . . . 0 0 . 1 . 001 nuclear orig core ' A' A ' 5' ' ' TYR . . . . . . . . . . . . . 9.6 m-85 -71.04 -37.85 72.56 Favored 'General case' 0 N--CA 1.496 1.863 0 O-C-N 121.226 -0.921 . . . . 0.0 110.585 179.849 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -70.49 -32.09 69.46 Favored 'General case' 0 N--CA 1.498 1.963 0 O-C-N 121.16 -0.962 . . . . 0.0 110.04 179.336 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 7' ' ' ALA . . . . . . . . . . . . . . . -55.6 -41.38 73.34 Favored 'General case' 0 N--CA 1.497 1.92 0 O-C-N 121.384 -0.823 . . . . 0.0 109.254 178.54 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 8' ' ' ALA . . . . . . . . . . . . . . . -69.94 -37.04 75.75 Favored 'General case' 0 N--CA 1.495 1.78 0 O-C-N 121.705 -0.622 . . . . 0.0 109.423 178.487 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 9' ' ' VAL . . . . . 0.439 HG21 ' HA ' ' A' ' 79' ' ' VAL . 53.3 t -60.58 -45.11 97.74 Favored 'Isoleucine or valine' 0 N--CA 1.5 2.048 0 O-C-N 121.637 -0.664 . . . . 0.0 109.806 179.148 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 10' ' ' GLU . . . . . . . . . . . . . 25.3 mt-10 -66.06 -46.25 78.47 Favored 'General case' 0 N--CA 1.498 1.932 0 O-C-N 121.567 -0.708 . . . . 0.0 110.068 179.602 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 11' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -80.71 -84.76 0.1 Allowed 'General case' 0 N--CA 1.488 1.455 0 O-C-N 121.531 -0.731 . . . . 0.0 109.661 179.655 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 12' ' ' LEU . . . . . . . . . . . . . 0.8 OUTLIER 53.23 -159.59 0.14 Allowed 'General case' 0 N--CA 1.501 2.08 0 O-C-N 121.428 -0.795 . . . . 0.0 111.047 179.472 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 13' ' ' THR . . . . . 0.448 HG22 ' HB2' ' A' ' 16' ' ' GLN . 0.0 OUTLIER -142.96 154.69 44.3 Favored 'General case' 0 N--CA 1.495 1.824 0 O-C-N 121.301 -0.874 . . . . 0.0 109.913 179.813 . . . . . . . . 3 3 . 1 . 001 nuclear orig core ' A' A ' 14' ' ' GLU . . . . . . . . . . . . . 0.7 OUTLIER -54.15 -39.82 66.88 Favored 'General case' 0 N--CA 1.491 1.6 0 O-C-N 121.696 -0.627 . . . . 0.0 111.015 -179.58 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 1.4 mp0 -55.56 -45.4 77.28 Favored 'General case' 0 N--CA 1.498 1.943 0 O-C-N 121.475 -0.766 . . . . 0.0 110.629 179.742 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 16' ' ' GLN . . . . . 0.448 ' HB2' HG22 ' A' ' 13' ' ' THR . 69.0 mt-30 -86.01 -33.19 21.12 Favored 'General case' 0 N--CA 1.499 1.991 0 O-C-N 121.344 -0.848 . . . . 0.0 110.983 179.929 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 17' ' ' LYS . . . . . . . . . . . . . 0.4 OUTLIER -65.03 -52.88 53.46 Favored 'General case' 0 N--CA 1.5 2.063 0 O-C-N 121.596 -0.69 . . . . 0.0 110.035 -179.963 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 18' ' ' ASN . . . . . . . . . . . . . 1.3 t-20 -62.37 -32.22 72.99 Favored 'General case' 0 N--CA 1.497 1.902 0 O-C-N 121.545 -0.722 . . . . 0.0 109.462 178.9 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 0.7 OUTLIER -61.37 -45.07 95.91 Favored 'General case' 0 N--CA 1.495 1.817 0 O-C-N 121.558 -0.714 . . . . 0.0 109.687 178.966 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 20' ' ' PHE . . . . . . . . . . . . . 13.4 m-85 -62.77 -35.92 81.37 Favored 'General case' 0 N--CA 1.498 1.974 0 O-C-N 121.409 -0.807 . . . . 0.0 109.438 178.873 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 21' ' ' LYS . . . . . . . . . . . . . 9.5 tptp -64.76 -46.22 83.08 Favored 'General case' 0 N--CA 1.498 1.938 0 O-C-N 121.516 -0.74 . . . . 0.0 109.389 178.602 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 22' ' ' ALA . . . . . . . . . . . . . . . -66.8 -31.15 71.59 Favored 'General case' 0 N--CA 1.498 1.949 0 O-C-N 121.599 -0.688 . . . . 0.0 110.202 179.085 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 23' ' ' ALA . . . . . . . . . . . . . . . -87.17 -7.97 57.41 Favored 'General case' 0 N--CA 1.497 1.899 0 O-C-N 121.231 -0.918 . . . . 0.0 110.806 179.448 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 24' ' ' PHE . . . . . . . . . . . . . 93.1 t80 -87.6 -49.89 6.87 Favored 'General case' 0 N--CA 1.498 1.937 0 O-C-N 121.236 -0.915 . . . . 0.0 111.631 -179.265 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 25' ' ' ASP . . . . . . . . . . . . . 5.4 p-10 -58.05 -38.45 76.3 Favored 'General case' 0 N--CA 1.503 2.22 0 O-C-N 121.086 -1.009 . . . . 0.0 111.535 -178.817 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 26' ' ' ILE . . . . . . . . . . . . . 34.2 mt -65.84 -35.54 75.38 Favored 'Isoleucine or valine' 0 N--CA 1.5 2.055 0 O-C-N 120.854 -1.154 . . . . 0.0 109.386 178.918 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 27' ' ' PHE . . . . . 0.544 ' HB3' HG12 ' A' ' 36' ' ' ILE . 0.2 OUTLIER -66.13 -48.48 70.7 Favored 'General case' 0 N--CA 1.497 1.912 0 O-C-N 121.346 -0.846 . . . . 0.0 109.292 178.843 . . . . . . . . 3 3 . 1 . 001 nuclear orig core ' A' A ' 28' ' ' VAL . . . . . 0.448 HG13 HG13 ' A' ' 36' ' ' ILE . 2.2 p -112.18 95.75 4.1 Favored 'Isoleucine or valine' 0 N--CA 1.497 1.882 0 O-C-N 121.678 -0.638 . . . . 0.0 109.658 178.986 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 29' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -96.18 -39.56 9.63 Favored 'General case' 0 N--CA 1.5 2.06 0 O-C-N 121.371 -0.83 . . . . 0.0 109.879 -179.898 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 30' ' ' GLY . . . . . . . . . . . . . . . -135.32 55.86 0.72 Allowed Glycine 0 N--CA 1.494 2.559 0 N-CA-C 109.121 -1.591 . . . . 0.0 109.121 179.615 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 31' ' ' ALA . . . . . 0.412 ' HB3' ' HG3' ' A' ' 40' ' ' GLU . . . . . . . . 0 N--CA 1.492 1.642 0 O-C-N 121.479 -1.012 . . . . 0.0 110.43 -179.712 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 35' ' ' CYS . . . . . . . . . . . . . 84.0 m . . . . . 0 N--CA 1.492 1.644 0 N-CA-C 109.612 -0.514 . . . . 0.0 109.612 . . . . . . . . . 0 0 . 1 . 001 nuclear orig core ' A' A ' 36' ' ' ILE . . . . . 0.544 HG12 ' HB3' ' A' ' 27' ' ' PHE . 87.2 mt -59.2 113.89 0.8 Allowed 'Isoleucine or valine' 0 N--CA 1.498 1.974 0 O-C-N 121.369 -0.832 . . . . 0.0 110.133 -179.724 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 37' ' ' SER . . . . . . . . . . . . . 0.2 OUTLIER -107.47 -172.96 2.17 Favored 'General case' 0 N--CA 1.496 1.854 0 O-C-N 121.581 -0.699 . . . . 0.0 110.373 -179.684 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 38' ' ' THR . . . . . . . . . . . . . 17.6 p -59.23 -42.63 91.49 Favored 'General case' 0 N--CA 1.504 2.228 0 O-C-N 121.338 -0.851 . . . . 0.0 110.831 -179.861 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 39' ' ' LYS . . . . . . . . . . . . . 4.1 ttmt -64.54 -41.44 96.34 Favored 'General case' 0 N--CA 1.5 2.056 0 O-C-N 121.454 -0.779 . . . . 0.0 111.298 -179.602 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 40' ' ' GLU . . . . . 0.412 ' HG3' ' HB3' ' A' ' 31' ' ' ALA . 8.8 mm-40 -67.31 -46.0 74.82 Favored 'General case' 0 N--CA 1.499 2.025 0 O-C-N 121.257 -0.902 . . . . 0.0 109.925 -179.85 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 41' ' ' LEU . . . . . 0.48 HD21 ' HB3' ' A' ' 57' ' ' LEU . 3.9 tp -63.58 -40.33 96.69 Favored 'General case' 0 N--CA 1.496 1.838 0 O-C-N 121.344 -0.848 . . . . 0.0 109.561 179.0 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 42' ' ' GLY . . . . . . . . . . . . . . . -60.5 -31.57 74.97 Favored Glycine 0 N--CA 1.494 2.524 0 N-CA-C 110.144 -1.182 . . . . 0.0 110.144 179.576 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 43' ' ' LYS . . . . . . . . . . . . . 0.5 OUTLIER -58.59 -47.97 82.51 Favored 'General case' 0 N--CA 1.5 2.038 0 O-C-N 121.272 -1.134 . . . . 0.0 109.563 179.219 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 44' ' ' VAL . . . . . . . . . . . . . 86.9 t -71.5 -29.78 36.42 Favored 'Isoleucine or valine' 0 N--CA 1.498 1.961 0 O-C-N 121.511 -0.743 . . . . 0.0 109.847 178.889 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 45' ' ' MET . . . . . . . . . . . . . 5.6 mmt -58.9 -39.04 80.31 Favored 'General case' 0 N--CA 1.501 2.079 0 O-C-N 121.344 -0.848 . . . . 0.0 109.861 179.147 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 46' ' ' ARG . . . . . . . . . . . . . 1.6 ttp180 -64.32 -32.41 74.01 Favored 'General case' 0 N--CA 1.496 1.875 0 O-C-N 121.624 -0.673 . . . . 0.0 110.434 179.408 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 47' ' ' MET . . . . . . . . . . . . . 12.0 mmm -61.24 -37.83 84.47 Favored 'General case' 0 N--CA 1.502 2.165 0 O-C-N 121.392 -0.818 . . . . 0.0 110.102 179.524 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 48' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -68.17 -37.98 81.56 Favored 'General case' 0 N--CA 1.497 1.904 0 O-C-N 121.413 -0.805 . . . . 0.0 110.186 179.537 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 49' ' ' GLY . . . . . . . . . . . . . . . 130.77 11.1 2.42 Favored Glycine 0 N--CA 1.497 2.716 0 C-N-CA 120.506 -0.854 . . . . 0.0 111.18 179.537 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 50' ' ' GLN . . . . . . . . . . . . . 0.1 OUTLIER -127.78 138.01 52.6 Favored 'General case' 0 N--CA 1.495 1.789 0 O-C-N 120.887 -1.361 . . . . 0.0 110.524 179.934 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 51' ' ' ASN . . . . . . . . . . . . . 1.4 m120 -122.18 80.32 44.07 Favored Pre-proline 0 N--CA 1.495 1.787 0 O-C-N 121.551 -0.718 . . . . 0.0 109.721 179.713 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 52' ' ' PRO . . . . . . . . . . . . . 49.8 Cg_endo -78.03 168.18 22.39 Favored 'Trans proline' 0 C--N 1.316 -1.136 0 O-C-N 123.885 1.466 . . . . 0.0 111.078 -179.292 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 53' ' ' THR . . . . . 0.542 ' HB ' ' HD2' ' A' ' 54' ' ' PRO . 41.3 p -76.56 168.81 24.8 Favored Pre-proline 0 N--CA 1.498 1.951 0 O-C-N 121.473 -0.767 . . . . 0.0 109.694 179.411 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 54' ' ' PRO . . . . . 0.542 ' HD2' ' HB ' ' A' ' 53' ' ' THR . 40.8 Cg_endo -64.83 -25.62 60.33 Favored 'Trans proline' 0 N--CA 1.491 1.338 0 O-C-N 123.45 1.237 . . . . 0.0 110.888 -179.984 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 55' ' ' GLU . . . . . . . . . . . . . 0.6 OUTLIER -64.79 -39.49 93.68 Favored 'General case' 0 N--CA 1.498 1.962 0 O-C-N 121.437 -0.789 . . . . 0.0 109.974 179.091 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 0.6 OUTLIER -54.22 -46.48 72.51 Favored 'General case' 0 N--CA 1.499 1.988 0 O-C-N 121.634 -0.666 . . . . 0.0 109.985 179.526 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 57' ' ' LEU . . . . . 0.48 ' HB3' HD21 ' A' ' 41' ' ' LEU . 0.7 OUTLIER -77.83 -28.01 50.1 Favored 'General case' 0 N--CA 1.492 1.673 0 O-C-N 121.334 -0.854 . . . . 0.0 110.245 179.545 . . . . . . . . 3 3 . 1 . 001 nuclear orig core ' A' A ' 58' ' ' GLN . . . . . 0.593 ' HG3' ' N ' ' A' ' 59' ' ' GLU . 0.0 OUTLIER -59.76 -34.2 72.68 Favored 'General case' 0 N--CA 1.497 1.884 0 O-C-N 121.08 -1.012 . . . . 0.0 109.077 179.054 . . . . . . . . 3 3 . 1 . 001 nuclear orig core ' A' A ' 59' ' ' GLU . . . . . 0.593 ' N ' ' HG3' ' A' ' 58' ' ' GLN . 0.5 OUTLIER -69.63 -37.05 76.65 Favored 'General case' 0 N--CA 1.494 1.763 0 N-CA-C 108.505 -0.924 . . . . 0.0 108.505 177.781 . . . . . . . . 3 3 . 1 . 001 nuclear orig core ' A' A ' 60' ' ' MET . . . . . . . . . . . . . 4.1 mtm -63.1 -44.62 95.16 Favored 'General case' 0 N--CA 1.496 1.867 0 O-C-N 121.809 -0.557 . . . . 0.0 109.835 178.602 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 61' ' ' ILE . . . . . 0.467 HG13 HG23 ' A' ' 72' ' ' VAL . 0.2 OUTLIER -66.93 -33.6 64.45 Favored 'Isoleucine or valine' 0 N--CA 1.498 1.968 0 O-C-N 121.624 -0.673 . . . . 0.0 110.472 179.826 . . . . . . . . 3 3 . 1 . 001 nuclear orig core ' A' A ' 62' ' ' ASP . . . . . 0.421 ' N ' HG21 ' A' ' 61' ' ' ILE . 0.9 OUTLIER -70.2 -35.86 74.22 Favored 'General case' 0 N--CA 1.498 1.947 0 O-C-N 121.27 -0.894 . . . . 0.0 110.276 179.607 . . . . . . . . 3 3 . 1 . 001 nuclear orig core ' A' A ' 63' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER -65.78 -35.73 81.54 Favored 'General case' 0 N--CA 1.497 1.912 0 O-C-N 121.355 -0.841 . . . . 0.0 111.174 -179.882 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 64' ' ' VAL . . . . . . . . . . . . . 33.4 m -102.54 -15.58 7.8 Favored 'Isoleucine or valine' 0 N--CA 1.502 2.126 0 O-C-N 121.212 -0.93 . . . . 0.0 111.964 -179.359 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 65' ' ' ASP . . . . . . . . . . . . . 21.6 t0 -131.74 140.74 49.34 Favored 'General case' 0 N--CA 1.498 1.956 0 O-C-N 120.843 -1.16 . . . . 0.0 111.6 -179.774 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 66' ' ' GLU . . . . . . . . . . . . . 3.3 tp10 -155.46 40.01 0.4 Allowed 'General case' 0 N--CA 1.492 1.631 0 CA-C-O 121.477 0.656 . . . . 0.0 109.43 179.017 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 67' ' ' ASP . . . . . . . . . . . . . 12.1 p-10 -99.15 4.49 46.85 Favored 'General case' 0 N--CA 1.498 1.962 0 O-C-N 121.437 -0.789 . . . . 0.0 111.536 -179.532 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 68' ' ' GLY . . . . . . . . . . . . . . . 105.8 -32.39 7.45 Favored Glycine 0 N--CA 1.493 2.452 0 N-CA-C 109.543 -1.423 . . . . 0.0 109.543 -179.724 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 69' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER -69.07 -42.8 75.73 Favored 'General case' 0 N--CA 1.495 1.823 0 O-C-N 121.396 -1.061 . . . . 0.0 110.428 179.826 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 70' ' ' GLY . . . . . . . . . . . . . . . 72.78 29.76 64.82 Favored Glycine 0 N--CA 1.496 2.688 0 N-CA-C 109.248 -1.541 . . . . 0.0 109.248 -179.781 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 71' ' ' THR . . . . . 0.423 ' HA ' HD12 ' A' ' 61' ' ' ILE . 0.2 OUTLIER -136.39 143.07 43.8 Favored 'General case' 0 N--CA 1.492 1.638 0 O-C-N 121.622 -0.928 . . . . 0.0 108.968 179.938 . . . . . . . . 3 3 . 1 . 001 nuclear orig core ' A' A ' 72' ' ' VAL . . . . . 0.467 HG23 HG13 ' A' ' 61' ' ' ILE . 3.9 t -75.5 110.63 10.71 Favored 'Isoleucine or valine' 0 N--CA 1.497 1.891 0 O-C-N 121.635 -0.665 . . . . 0.0 110.235 -179.585 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 73' ' ' ASP . . . . . . . . . . . . . 46.0 m-20 -83.03 -174.57 5.37 Favored 'General case' 0 N--CA 1.496 1.848 0 O-C-N 121.596 -0.69 . . . . 0.0 109.431 179.72 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 74' ' ' PHE . . . . . . . . . . . . . 52.2 t80 -60.62 -47.69 85.09 Favored 'General case' 0 N--CA 1.5 2.027 0 O-C-N 121.093 -1.004 . . . . 0.0 109.792 179.701 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 75' ' ' ASP . . . . . 0.456 ' HA ' HD21 ' A' ' 78' ' ' LEU . 23.6 t70 -62.14 -52.33 64.29 Favored 'General case' 0 N--CA 1.494 1.729 0 O-C-N 121.66 -0.65 . . . . 0.0 110.148 179.534 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 76' ' ' GLU . . . . . . . . . . . . . 18.4 mt-10 -57.65 -38.38 74.98 Favored 'General case' 0 N--CA 1.5 2.028 0 O-C-N 121.534 -0.729 . . . . 0.0 110.508 179.631 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 77' ' ' PHE . . . . . . . . . . . . . 58.0 t80 -63.48 -48.15 78.85 Favored 'General case' 0 N--CA 1.496 1.848 0 O-C-N 121.367 -0.833 . . . . 0.0 109.619 179.019 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 78' ' ' LEU . . . . . 0.456 HD21 ' HA ' ' A' ' 75' ' ' ASP . 0.1 OUTLIER -71.13 -30.93 67.11 Favored 'General case' 0 N--CA 1.496 1.867 0 O-C-N 121.45 -0.781 . . . . 0.0 109.734 179.117 . . . . . . . . 3 3 . 1 . 001 nuclear orig core ' A' A ' 79' ' ' VAL . . . . . 0.442 ' N ' ' HG ' ' A' ' 78' ' ' LEU . 4.8 t -68.4 -39.71 81.23 Favored 'Isoleucine or valine' 0 N--CA 1.501 2.093 0 O-C-N 121.216 -0.927 . . . . 0.0 109.102 178.276 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 80' ' ' MET . . . . . . . . . . . . . 26.0 ttp -68.5 -27.46 66.15 Favored 'General case' 0 N--CA 1.495 1.822 0 O-C-N 121.562 -0.711 . . . . 0.0 109.936 179.057 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 81' ' ' MET . . . . . 0.4 ' O ' ' HB2' ' A' ' 85' ' ' MET . 8.1 mmt -67.01 -55.17 15.58 Favored 'General case' 0 N--CA 1.496 1.845 0 O-C-N 121.467 -0.77 . . . . 0.0 110.793 179.948 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 82' ' ' VAL . . . . . . . . . . . . . 20.2 m -59.46 -30.66 44.9 Favored 'Isoleucine or valine' 0 N--CA 1.503 2.177 0 O-C-N 121.424 -0.798 . . . . 0.0 110.681 -179.829 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 83' ' ' ARG . . . . . . . . . . . . . 5.3 mtp-105 -52.6 -47.27 67.05 Favored 'General case' 0 N--CA 1.5 2.047 0 O-C-N 121.468 -0.77 . . . . 0.0 110.297 179.424 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 84' ' ' CYS . . . . . . . . . . . . . 36.1 m -94.3 -4.35 48.88 Favored 'General case' 0 N--CA 1.499 2.0 0 O-C-N 121.426 -0.796 . . . . 0.0 110.465 178.968 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 85' ' ' MET . . . . . 0.4 ' HB2' ' O ' ' A' ' 81' ' ' MET . 3.3 ttm . . . . . 0 N--CA 1.497 1.923 0 O-C-N 121.219 -0.925 . . . . 0.0 111.118 179.503 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' B' B ' 149' ' ' SER . . . . . 0.442 ' HB3' ' HB2' ' B' ' 152' ' ' ALA . 2.2 t . . . . . 0 N--CA 1.497 1.895 0 N-CA-C 109.563 -0.532 . . . . 0.0 109.563 . . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' B' B ' 150' ' ' ALA . . . . . . . . . . . . . . . -57.79 -55.47 34.47 Favored 'General case' 0 N--CA 1.499 2.008 0 O-C-N 121.261 -0.899 . . . . 0.0 110.542 -179.828 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' B' B ' 151' ' ' ASP . . . . . . . . . . . . . 18.5 t70 -65.27 -41.54 94.12 Favored 'General case' 0 N--CA 1.497 1.894 0 O-C-N 121.328 -0.858 . . . . 0.0 110.58 179.752 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' B' B ' 152' ' ' ALA . . . . . 0.442 ' HB2' ' HB3' ' B' ' 149' ' ' SER . . . -59.84 -52.37 65.74 Favored 'General case' 0 N--CA 1.499 2.013 0 O-C-N 121.414 -0.804 . . . . 0.0 110.649 179.981 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' B' B ' 153' ' ' MET . . . . . . . . . . . . . 1.3 tpt -63.22 -40.56 97.8 Favored 'General case' 0 N--CA 1.497 1.892 0 O-C-N 121.291 -0.881 . . . . 0.0 110.183 179.779 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' B' B ' 154' ' ' MET . . . . . . . . . . . . . 1.7 mtp -63.34 -43.85 96.53 Favored 'General case' 0 N--CA 1.501 2.118 0 O-C-N 121.346 -0.846 . . . . 0.0 110.121 179.345 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' B' B ' 155' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -60.25 -40.17 89.35 Favored 'General case' 0 N--CA 1.498 1.965 0 O-C-N 121.635 -0.666 . . . . 0.0 110.049 179.493 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' B' B ' 156' ' ' ALA . . . . . . . . . . . . . . . -78.29 -25.11 46.5 Favored 'General case' 0 N--CA 1.495 1.816 0 O-C-N 121.434 -0.791 . . . . 0.0 110.33 179.213 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' B' B ' 157' ' ' LEU . . . . . 0.492 HD21 ' HA ' ' B' ' 157' ' ' LEU . 0.5 OUTLIER -69.65 -50.36 44.84 Favored 'General case' 0 N--CA 1.497 1.921 0 O-C-N 121.349 -0.844 . . . . 0.0 110.503 179.951 . . . . . . . . 3 3 . 1 . 001 nuclear orig core ' B' B ' 158' ' ' LEU . . . . . . . . . . . . . 1.6 mt . . . . . 0 N--CA 1.496 1.874 0 O-C-N 121.224 -0.922 . . . . 0.0 110.245 179.713 . . . . . . . . 0 0 . 1 . 002 nuclear orig core ' A' A ' 4' ' ' ILE . . . . . 0.408 HG13 ' N ' ' A' ' 5' ' ' TYR . 35.3 pt . . . . . 0 N--CA 1.501 2.094 0 CA-C-O 120.829 0.347 . . . . 0.0 110.615 . . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 5' ' ' TYR . . . . . 0.408 ' N ' HG13 ' A' ' 4' ' ' ILE . 56.8 m-85 -71.1 -21.78 62.18 Favored 'General case' 0 N--CA 1.496 1.834 0 O-C-N 121.297 -0.877 . . . . 0.0 109.749 179.022 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -69.32 -49.64 53.88 Favored 'General case' 0 N--CA 1.494 1.762 0 O-C-N 121.492 -0.755 . . . . 0.0 109.722 178.916 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 7' ' ' ALA . . . . . . . . . . . . . . . -50.56 -38.84 47.4 Favored 'General case' 0 N--CA 1.499 2.017 0 O-C-N 121.572 -0.705 . . . . 0.0 110.345 179.422 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 8' ' ' ALA . . . . . . . . . . . . . . . -59.07 -42.31 90.05 Favored 'General case' 0 N--CA 1.497 1.889 0 O-C-N 121.561 -0.712 . . . . 0.0 109.758 178.978 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 9' ' ' VAL . . . . . 0.488 HG23 HG21 ' A' ' 79' ' ' VAL . 55.3 t -66.91 -42.67 89.22 Favored 'Isoleucine or valine' 0 N--CA 1.498 1.967 0 O-C-N 121.602 -0.686 . . . . 0.0 109.552 178.969 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 10' ' ' GLU . . . . . . . . . . . . . 0.9 OUTLIER -57.93 -39.83 78.96 Favored 'General case' 0 N--CA 1.499 1.989 0 O-C-N 121.484 -0.76 . . . . 0.0 110.041 178.949 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 11' ' ' GLN . . . . . . . . . . . . . 5.4 mt-30 -109.1 48.22 0.88 Allowed 'General case' 0 N--CA 1.495 1.786 0 O-C-N 121.486 -0.759 . . . . 0.0 109.926 179.501 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 12' ' ' LEU . . . . . 0.469 HD22 ' HB3' ' A' ' 16' ' ' GLN . 2.8 mt -82.8 158.73 22.66 Favored 'General case' 0 N--CA 1.5 2.027 0 O-C-N 121.309 -0.869 . . . . 0.0 110.636 -179.874 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 13' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -80.15 153.36 28.7 Favored 'General case' 0 N--CA 1.498 1.945 0 O-C-N 121.49 -0.756 . . . . 0.0 110.488 179.876 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 14' ' ' GLU . . . . . . . . . . . . . 12.4 tp10 -58.17 -47.18 84.2 Favored 'General case' 0 N--CA 1.492 1.673 0 C-N-CA 120.106 -0.637 . . . . 0.0 109.966 179.81 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 5.0 tt0 -57.68 -45.51 85.51 Favored 'General case' 0 N--CA 1.499 2.0 0 O-C-N 121.443 -0.786 . . . . 0.0 109.906 179.157 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 16' ' ' GLN . . . . . 0.469 ' HB3' HD22 ' A' ' 12' ' ' LEU . 3.0 mp0 -63.29 -48.41 78.25 Favored 'General case' 0 N--CA 1.496 1.875 0 CA-C-O 121.648 0.737 . . . . 0.0 110.158 179.381 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 17' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -60.97 -49.33 77.87 Favored 'General case' 0 N--CA 1.496 1.871 0 CA-C-N 116.245 -0.434 . . . . 0.0 110.199 179.647 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 18' ' ' ASN . . . . . . . . . . . . . 0.5 OUTLIER -62.12 -39.95 94.25 Favored 'General case' 0 N--CA 1.497 1.896 0 O-C-N 121.504 -0.748 . . . . 0.0 110.129 179.619 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 7.6 mm-40 -63.89 -49.32 73.18 Favored 'General case' 0 N--CA 1.497 1.907 0 O-C-N 121.51 -0.744 . . . . 0.0 110.001 179.529 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 20' ' ' PHE . . . . . . . . . . . . . 15.6 m-85 -66.49 -35.04 79.28 Favored 'General case' 0 N--CA 1.499 2.0 0 O-C-N 121.365 -0.834 . . . . 0.0 110.235 179.497 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 21' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -58.58 -54.2 49.7 Favored 'General case' 0 N--CA 1.498 1.951 0 O-C-N 121.423 -0.798 . . . . 0.0 109.907 179.434 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 22' ' ' ALA . . . . . . . . . . . . . . . -66.04 -42.07 90.02 Favored 'General case' 0 N--CA 1.496 1.834 0 O-C-N 121.53 -0.732 . . . . 0.0 110.619 179.974 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 23' ' ' ALA . . . . . . . . . . . . . . . -61.99 -40.77 96.78 Favored 'General case' 0 N--CA 1.499 1.994 0 O-C-N 121.324 -0.86 . . . . 0.0 110.105 179.478 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 24' ' ' PHE . . . . . . . . . . . . . 67.9 t80 -60.82 -45.31 94.95 Favored 'General case' 0 N--CA 1.498 1.956 0 O-C-N 121.561 -0.712 . . . . 0.0 110.088 179.392 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 25' ' ' ASP . . . . . . . . . . . . . 3.2 m-20 -60.52 -38.2 83.62 Favored 'General case' 0 N--CA 1.498 1.942 0 O-C-N 121.595 -0.691 . . . . 0.0 110.246 179.694 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 26' ' ' ILE . . . . . . . . . . . . . 57.1 mt -74.68 -26.87 20.13 Favored 'Isoleucine or valine' 0 N--CA 1.5 2.043 0 O-C-N 121.311 -0.868 . . . . 0.0 109.919 179.285 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 27' ' ' PHE . . . . . 0.471 ' HB3' HD12 ' A' ' 36' ' ' ILE . 0.2 OUTLIER -71.4 -37.92 71.5 Favored 'General case' 0 N--CA 1.496 1.866 0 O-C-N 121.288 -0.883 . . . . 0.0 111.245 -179.836 . . . . . . . . 3 3 . 1 . 002 nuclear orig core ' A' A ' 28' ' ' VAL . . . . . 0.498 HG11 HG13 ' A' ' 36' ' ' ILE . 28.1 m -79.71 9.79 0.7 Allowed 'Isoleucine or valine' 0 N--CA 1.503 2.211 0 O-C-N 121.29 -0.881 . . . . 0.0 111.726 -179.518 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 29' ' ' LEU . . . . . . . . . . . . . 2.5 mt -70.63 96.11 1.17 Allowed 'General case' 0 N--CA 1.496 1.834 0 O-C-N 121.001 -1.062 . . . . 0.0 109.737 179.449 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 30' ' ' GLY . . . . . . . . . . . . . . . 143.47 -25.21 2.16 Favored Glycine 0 N--CA 1.493 2.471 0 N-CA-C 109.264 -1.534 . . . . 0.0 109.264 -178.963 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 31' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.494 1.757 0 O-C-N 121.42 -1.047 . . . . 0.0 109.951 179.679 . . . . . . . . 0 0 . 1 . 002 nuclear orig core ' A' A ' 35' ' ' CYS . . . . . . . . . . . . . 0.1 OUTLIER . . . . . 0 N--CA 1.498 1.975 0 CA-C-O 121.391 0.615 . . . . 0.0 111.353 . . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 36' ' ' ILE . . . . . 0.546 ' HB ' ' HB ' ' A' ' 72' ' ' VAL . 1.2 mp -113.75 126.74 71.28 Favored 'Isoleucine or valine' 0 N--CA 1.496 1.875 0 O-C-N 121.405 -0.809 . . . . 0.0 109.81 179.253 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 37' ' ' SER . . . . . . . . . . . . . 52.1 p -103.06 -168.34 1.5 Allowed 'General case' 0 N--CA 1.497 1.887 0 O-C-N 121.482 -0.761 . . . . 0.0 110.593 -179.902 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 38' ' ' THR . . . . . . . . . . . . . 30.1 p -65.49 -46.21 80.64 Favored 'General case' 0 N--CA 1.501 2.103 0 O-C-N 121.291 -0.88 . . . . 0.0 110.255 179.675 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 39' ' ' LYS . . . . . . . . . . . . . 10.8 mttm -65.75 -38.34 88.83 Favored 'General case' 0 N--CA 1.499 1.99 0 O-C-N 121.484 -0.76 . . . . 0.0 110.031 179.459 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 40' ' ' GLU . . . . . 0.454 ' HB3' HG23 ' A' ' 36' ' ' ILE . 4.2 tp10 -64.69 -30.74 71.76 Favored 'General case' 0 N--CA 1.496 1.832 0 O-C-N 121.528 -0.732 . . . . 0.0 110.22 179.465 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 41' ' ' LEU . . . . . 0.515 HD21 ' HB3' ' A' ' 57' ' ' LEU . 6.0 tp -85.96 -45.84 11.11 Favored 'General case' 0 N--CA 1.496 1.841 0 O-C-N 121.445 -0.784 . . . . 0.0 110.602 179.615 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 42' ' ' GLY . . . . . . . . . . . . . . . -51.71 -39.12 45.95 Favored Glycine 0 N--CA 1.497 2.754 0 N-CA-C 111.141 -0.783 . . . . 0.0 111.141 -178.939 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 43' ' ' LYS . . . . . . . . . . . . . 2.7 pttm -58.9 -30.83 68.08 Favored 'General case' 0 N--CA 1.5 2.056 0 O-C-N 121.242 -1.152 . . . . 0.0 110.793 -179.975 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 44' ' ' VAL . . . . . . . . . . . . . 93.4 t -86.66 -32.49 6.59 Favored 'Isoleucine or valine' 0 N--CA 1.499 2.002 0 O-C-N 121.232 -0.917 . . . . 0.0 109.658 178.765 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 45' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -57.28 -50.67 72.16 Favored 'General case' 0 N--CA 1.5 2.04 0 O-C-N 121.443 -0.785 . . . . 0.0 110.282 179.8 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 46' ' ' ARG . . . . . 0.413 ' N ' ' HB2' ' A' ' 51' ' ' ASN . 0.0 OUTLIER -69.28 -41.04 77.38 Favored 'General case' 0 N--CA 1.499 1.987 0 O-C-N 121.394 -0.816 . . . . 0.0 109.796 179.393 . . . . . . . . 3 3 . 1 . 002 nuclear orig core ' A' A ' 47' ' ' MET . . . . . . . . . . . . . 0.2 OUTLIER -62.2 -37.44 85.3 Favored 'General case' 0 N--CA 1.499 1.988 0 O-C-N 121.574 -0.704 . . . . 0.0 110.112 179.238 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 48' ' ' LEU . . . . . 0.512 HD13 ' HG3' ' B' ' 153' ' ' MET . 0.4 OUTLIER -75.86 -46.75 28.59 Favored 'General case' 0 N--CA 1.493 1.686 0 O-C-N 121.446 -0.784 . . . . 0.0 110.229 179.592 . . . . . . . . 3 3 . 1 . 002 nuclear orig core ' A' A ' 49' ' ' GLY . . . . . . . . . . . . . . . -161.8 -82.69 0.04 OUTLIER Glycine 0 N--CA 1.494 2.508 0 N-CA-C 110.237 -1.145 . . . . 0.0 110.237 -179.832 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 50' ' ' GLN . . . . . . . . . . . . . 78.2 mt-30 -127.28 143.07 51.31 Favored 'General case' 0 N--CA 1.497 1.891 0 O-C-N 121.408 -1.054 . . . . 0.0 111.144 -179.361 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 51' ' ' ASN . . . . . 0.413 ' HB2' ' N ' ' A' ' 46' ' ' ARG . 33.1 t30 -116.4 110.97 42.35 Favored Pre-proline 0 N--CA 1.493 1.712 0 O-C-N 121.485 -0.759 . . . . 0.0 109.574 178.859 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 52' ' ' PRO . . . . . . . . . . . . . 44.0 Cg_endo -71.34 -92.62 0.01 OUTLIER 'Trans proline' 0 C--N 1.312 -1.361 0 O-C-N 124.003 1.528 . . . . 0.0 111.014 -179.541 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 53' ' ' THR . . . . . . . . . . . . . 0.6 OUTLIER -144.92 160.38 46.91 Favored Pre-proline 0 N--CA 1.495 1.801 0 O-C-N 120.841 -1.162 . . . . 0.0 110.667 -179.532 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 54' ' ' PRO . . . . . . . . . . . . . 43.5 Cg_endo -69.42 -38.14 8.97 Favored 'Trans proline' 0 N--CA 1.492 1.392 0 O-C-N 124.039 1.547 . . . . 0.0 111.307 179.993 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 55' ' ' GLU . . . . . . . . . . . . . 32.6 mt-10 -61.31 -38.44 86.86 Favored 'General case' 0 N--CA 1.499 1.996 0 O-C-N 121.381 -0.825 . . . . 0.0 110.634 -179.837 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 15.1 mm-40 -62.19 -37.99 87.39 Favored 'General case' 0 N--CA 1.498 1.961 0 O-C-N 121.417 -0.802 . . . . 0.0 110.765 179.736 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 57' ' ' LEU . . . . . 0.515 ' HB3' HD21 ' A' ' 41' ' ' LEU . 74.4 mt -68.65 -31.91 71.38 Favored 'General case' 0 N--CA 1.496 1.871 0 O-C-N 121.228 -0.92 . . . . 0.0 110.405 179.952 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 58' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -55.13 -52.56 62.89 Favored 'General case' 0 N--CA 1.498 1.946 0 O-C-N 121.287 -0.883 . . . . 0.0 109.041 179.024 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 59' ' ' GLU . . . . . . . . . . . . . 1.5 tm-20 -66.37 -35.96 81.67 Favored 'General case' 0 N--CA 1.494 1.744 0 N-CA-C 108.958 -0.756 . . . . 0.0 108.958 178.033 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 60' ' ' MET . . . . . . . . . . . . . 3.0 tpp -55.98 -40.68 73.63 Favored 'General case' 0 N--CA 1.498 1.949 0 O-C-N 121.571 -0.705 . . . . 0.0 109.775 178.715 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 61' ' ' ILE . . . . . 0.519 HG21 ' CG2' ' A' ' 72' ' ' VAL . 69.2 mt -71.19 -50.14 43.64 Favored 'Isoleucine or valine' 0 N--CA 1.498 1.959 0 O-C-N 121.446 -0.784 . . . . 0.0 109.302 178.928 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 62' ' ' ASP . . . . . 0.42 ' HA ' ' CB ' ' A' ' 65' ' ' ASP . 5.1 m-20 -58.9 -26.97 64.79 Favored 'General case' 0 N--CA 1.498 1.965 0 O-C-N 121.704 -0.623 . . . . 0.0 110.865 179.64 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 63' ' ' GLU . . . . . . . . . . . . . 3.0 tt0 -50.94 -39.08 53.98 Favored 'General case' 0 N--CA 1.501 2.076 0 O-C-N 121.347 -0.846 . . . . 0.0 109.981 179.179 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 64' ' ' VAL . . . . . 0.404 ' CG2' HG12 ' A' ' 79' ' ' VAL . 9.8 p -125.83 25.78 2.87 Favored 'Isoleucine or valine' 0 N--CA 1.495 1.824 0 O-C-N 121.587 -0.696 . . . . 0.0 110.393 179.259 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 65' ' ' ASP . . . . . 0.42 ' CB ' ' HA ' ' A' ' 62' ' ' ASP . 9.3 t70 -86.74 116.36 24.79 Favored 'General case' 0 N--CA 1.498 1.934 0 O-C-N 121.099 -1.001 . . . . 0.0 110.397 179.886 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 66' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER -80.07 -20.98 43.91 Favored 'General case' 0 N--CA 1.497 1.895 0 O-C-N 121.505 -0.747 . . . . 0.0 110.627 179.457 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 67' ' ' ASP . . . . . . . . . . . . . 70.0 m-20 -80.52 -15.75 55.93 Favored 'General case' 0 N--CA 1.497 1.918 0 O-C-N 121.18 -0.95 . . . . 0.0 111.729 -179.7 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 68' ' ' GLY . . . . . . . . . . . . . . . 66.66 16.68 66.0 Favored Glycine 0 N--CA 1.494 2.56 0 N-CA-C 108.731 -1.747 . . . . 0.0 108.731 -178.17 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 69' ' ' SER . . . . . . . . . . . . . 88.7 p -94.22 -34.53 12.85 Favored 'General case' 0 N--CA 1.492 1.66 0 O-C-N 121.674 -0.898 . . . . 0.0 109.984 -179.86 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 70' ' ' GLY . . . . . . . . . . . . . . . 94.87 30.34 8.48 Favored Glycine 0 N--CA 1.499 2.877 0 N-CA-C 110.137 -1.185 . . . . 0.0 110.137 179.962 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 71' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -128.75 134.34 48.39 Favored 'General case' 0 N--CA 1.499 2.025 0 O-C-N 121.516 -0.991 . . . . 0.0 108.64 179.346 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 72' ' ' VAL . . . . . 0.546 ' HB ' ' HB ' ' A' ' 36' ' ' ILE . 74.0 t -75.61 113.66 14.75 Favored 'Isoleucine or valine' 0 N--CA 1.5 2.043 0 O-C-N 121.199 -0.938 . . . . 0.0 111.375 -178.87 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 73' ' ' ASP . . . . . . . . . . . . . 3.5 m-20 -96.9 -174.61 3.03 Favored 'General case' 0 N--CA 1.493 1.721 0 O-C-N 121.724 -0.61 . . . . 0.0 109.423 178.788 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 74' ' ' PHE . . . . . . . . . . . . . 27.6 t80 -72.37 -40.51 67.25 Favored 'General case' 0 N--CA 1.498 1.943 0 O-C-N 120.928 -1.107 . . . . 0.0 109.747 179.729 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 75' ' ' ASP . . . . . . . . . . . . . 3.0 p-10 -67.69 -36.37 80.53 Favored 'General case' 0 N--CA 1.494 1.734 0 O-C-N 121.705 -0.622 . . . . 0.0 109.977 179.251 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 76' ' ' GLU . . . . . . . . . . . . . 7.6 mt-10 -73.12 -41.46 63.99 Favored 'General case' 0 N--CA 1.494 1.763 0 O-C-N 121.485 -0.76 . . . . 0.0 109.826 179.247 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 77' ' ' PHE . . . . . 0.448 ' O ' ' HG2' ' A' ' 81' ' ' MET . 61.3 t80 -57.76 -49.92 74.98 Favored 'General case' 0 N--CA 1.498 1.963 0 O-C-N 121.669 -0.644 . . . . 0.0 110.653 179.803 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 78' ' ' LEU . . . . . . . . . . . . . 46.6 mt -54.42 -45.98 73.1 Favored 'General case' 0 N--CA 1.501 2.079 0 O-C-N 121.363 -0.836 . . . . 0.0 110.372 179.928 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 79' ' ' VAL . . . . . 0.488 HG21 HG23 ' A' ' 9' ' ' VAL . 75.5 t -66.33 -37.99 80.87 Favored 'Isoleucine or valine' 0 N--CA 1.5 2.035 0 O-C-N 121.51 -0.744 . . . . 0.0 109.773 179.196 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 80' ' ' MET . . . . . 0.454 ' HA ' ' HG2' ' A' ' 83' ' ' ARG . 25.8 ttp -65.74 -41.84 91.67 Favored 'General case' 0 N--CA 1.495 1.786 0 O-C-N 121.53 -0.731 . . . . 0.0 110.837 179.93 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 81' ' ' MET . . . . . 0.448 ' HG2' ' O ' ' A' ' 77' ' ' PHE . 22.8 mmm -66.06 -49.87 66.13 Favored 'General case' 0 N--CA 1.497 1.923 0 O-C-N 121.286 -0.884 . . . . 0.0 111.121 -179.351 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 82' ' ' VAL . . . . . 0.402 ' HA ' ' CE ' ' A' ' 85' ' ' MET . 34.9 m -64.4 -35.19 73.59 Favored 'Isoleucine or valine' 0 N--CA 1.503 2.215 0 O-C-N 121.135 -0.978 . . . . 0.0 111.197 -179.418 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 83' ' ' ARG . . . . . 0.476 ' HG3' ' N ' ' A' ' 84' ' ' CYS . 0.0 OUTLIER -79.33 -21.11 46.32 Favored 'General case' 0 N--CA 1.499 1.996 0 O-C-N 121.094 -1.004 . . . . 0.0 110.642 179.564 . . . . . . . . 3 3 . 1 . 002 nuclear orig core ' A' A ' 84' ' ' CYS . . . . . 0.476 ' N ' ' HG3' ' A' ' 83' ' ' ARG . 41.3 t -78.72 -25.17 44.58 Favored 'General case' 0 N--CA 1.498 1.967 0 O-C-N 121.103 -0.998 . . . . 0.0 110.614 179.74 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 85' ' ' MET . . . . . 0.402 ' CE ' ' HA ' ' A' ' 82' ' ' VAL . 7.6 mtm . . . . . 0 N--CA 1.501 2.111 0 O-C-N 121.449 -0.782 . . . . 0.0 110.988 -179.882 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B ' 149' ' ' SER . . . . . 0.425 ' HB3' ' HB1' ' B' ' 152' ' ' ALA . 0.1 OUTLIER . . . . . 0 N--CA 1.504 2.257 0 CA-C-O 121.474 0.654 . . . . 0.0 111.132 . . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' B' B ' 150' ' ' ALA . . . . . . . . . . . . . . . -56.89 -41.76 78.64 Favored 'General case' 0 N--CA 1.5 2.045 0 O-C-N 121.298 -0.876 . . . . 0.0 110.283 179.632 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B ' 151' ' ' ASP . . . . . . . . . . . . . 7.9 p-10 -61.56 -38.72 88.51 Favored 'General case' 0 N--CA 1.498 1.944 0 O-C-N 121.505 -0.747 . . . . 0.0 110.444 179.438 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B ' 152' ' ' ALA . . . . . 0.425 ' HB1' ' HB3' ' B' ' 149' ' ' SER . . . -67.02 -48.32 68.76 Favored 'General case' 0 N--CA 1.497 1.886 0 O-C-N 121.312 -0.868 . . . . 0.0 109.703 179.392 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' B' B ' 153' ' ' MET . . . . . 0.512 ' HG3' HD13 ' A' ' 48' ' ' LEU . 1.6 ttt -64.23 -36.85 85.42 Favored 'General case' 0 N--CA 1.498 1.927 0 O-C-N 121.545 -0.722 . . . . 0.0 110.155 179.221 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' B' B ' 154' ' ' MET . . . . . . . . . . . . . 15.8 mtp -58.82 -48.3 81.79 Favored 'General case' 0 N--CA 1.499 1.977 0 O-C-N 121.571 -0.706 . . . . 0.0 110.092 179.449 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B ' 155' ' ' GLN . . . . . . . . . . . . . 19.1 mt-30 -71.97 -33.33 68.07 Favored 'General case' 0 N--CA 1.498 1.95 0 O-C-N 121.479 -0.763 . . . . 0.0 110.387 179.46 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B ' 156' ' ' ALA . . . . . . . . . . . . . . . -62.98 -42.72 99.91 Favored 'General case' 0 N--CA 1.496 1.848 0 O-C-N 121.42 -0.8 . . . . 0.0 110.497 -179.889 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B ' 157' ' ' LEU . . . . . . . . . . . . . 0.8 OUTLIER -86.4 -54.03 4.66 Favored 'General case' 0 N--CA 1.497 1.9 0 O-C-N 121.356 -0.84 . . . . 0.0 110.298 179.803 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' B' B ' 158' ' ' LEU . . . . . . . . . . . . . 4.8 mt . . . . . 0 N--CA 1.495 1.803 0 O-C-N 121.368 -0.833 . . . . 0.0 109.907 179.751 . . . . . . . . 0 0 . 1 . 003 nuclear orig core ' A' A ' 4' ' ' ILE . . . . . . . . . . . . . 49.4 mt . . . . . 0 N--CA 1.504 2.252 0 N-CA-C 111.899 0.333 . . . . 0.0 111.899 . . . . . . . . . 0 0 . 1 . 003 nuclear orig core ' A' A ' 5' ' ' TYR . . . . . 0.485 ' CE1' ' HA ' ' A' ' 83' ' ' ARG . 31.7 m-85 -60.53 -32.66 71.68 Favored 'General case' 0 N--CA 1.502 2.147 0 O-C-N 121.053 -1.03 . . . . 0.0 111.246 -179.501 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -62.68 -38.93 92.3 Favored 'General case' 0 N--CA 1.498 1.941 0 O-C-N 121.117 -0.989 . . . . 0.0 109.741 178.811 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 7' ' ' ALA . . . . . . . . . . . . . . . -59.73 -38.49 81.86 Favored 'General case' 0 N--CA 1.497 1.909 0 O-C-N 121.544 -0.722 . . . . 0.0 110.251 179.13 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 8' ' ' ALA . . . . . . . . . . . . . . . -60.34 -33.93 73.11 Favored 'General case' 0 N--CA 1.498 1.928 0 O-C-N 121.364 -0.835 . . . . 0.0 110.308 179.232 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 9' ' ' VAL . . . . . . . . . . . . . 93.3 t -65.96 -34.88 73.22 Favored 'Isoleucine or valine' 0 N--CA 1.5 2.046 0 O-C-N 121.403 -0.81 . . . . 0.0 109.745 179.3 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 10' ' ' GLU . . . . . . . . . . . . . 22.7 mt-10 -62.98 -31.68 72.85 Favored 'General case' 0 N--CA 1.498 1.93 0 O-C-N 121.376 -0.828 . . . . 0.0 109.951 178.951 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 11' ' ' GLN . . . . . . . . . . . . . 1.0 OUTLIER -67.1 -28.63 68.33 Favored 'General case' 0 N--CA 1.499 1.978 0 O-C-N 121.413 -0.804 . . . . 0.0 110.247 179.202 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 12' ' ' LEU . . . . . . . . . . . . . 81.0 mt -77.11 98.56 5.08 Favored 'General case' 0 N--CA 1.496 1.838 0 O-C-N 121.227 -0.92 . . . . 0.0 109.797 179.661 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 13' ' ' THR . . . . . . . . . . . . . 11.6 p -77.31 -176.2 4.04 Favored 'General case' 0 N--CA 1.498 1.964 0 O-C-N 121.438 -0.789 . . . . 0.0 110.874 -179.588 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 14' ' ' GLU . . . . . . . . . . . . . 0.5 OUTLIER -50.54 -36.32 33.72 Favored 'General case' 0 N--CA 1.496 1.828 0 O-C-N 121.734 -0.604 . . . . 0.0 111.299 -178.848 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 1.9 mp0 -60.82 -46.62 89.83 Favored 'General case' 0 N--CA 1.5 2.033 0 O-C-N 121.422 -0.799 . . . . 0.0 109.972 179.516 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 16' ' ' GLN . . . . . . . . . . . . . 1.1 mp0 -75.96 -35.73 59.55 Favored 'General case' 0 N--CA 1.497 1.913 0 O-C-N 121.567 -0.708 . . . . 0.0 109.986 179.208 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 17' ' ' LYS . . . . . 0.498 ' HD3' HD13 ' A' ' 78' ' ' LEU . 14.0 mmtt -62.92 -41.45 99.48 Favored 'General case' 0 N--CA 1.495 1.812 0 O-C-N 121.925 -0.484 . . . . 0.0 109.811 179.271 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 18' ' ' ASN . . . . . . . . . . . . . 9.4 t30 -62.46 -40.46 96.7 Favored 'General case' 0 N--CA 1.496 1.863 0 O-C-N 121.598 -0.689 . . . . 0.0 110.399 179.587 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 19' ' ' GLU . . . . . 0.482 ' HB3' ' HE1' ' B' ' 154' ' ' MET . 4.5 mm-40 -61.0 -42.87 99.28 Favored 'General case' 0 N--CA 1.501 2.085 0 O-C-N 121.438 -0.789 . . . . 0.0 110.129 179.503 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 20' ' ' PHE . . . . . . . . . . . . . 5.7 m-85 -77.41 -36.42 53.33 Favored 'General case' 0 N--CA 1.499 2.008 0 O-C-N 121.326 -0.859 . . . . 0.0 109.978 179.221 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 21' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -57.79 -48.65 79.08 Favored 'General case' 0 N--CA 1.499 1.993 0 O-C-N 121.645 -0.659 . . . . 0.0 110.15 179.408 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 22' ' ' ALA . . . . . . . . . . . . . . . -59.98 -43.97 94.8 Favored 'General case' 0 N--CA 1.497 1.881 0 O-C-N 121.605 -0.685 . . . . 0.0 110.036 179.597 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 23' ' ' ALA . . . . . . . . . . . . . . . -66.67 -35.44 80.17 Favored 'General case' 0 N--CA 1.497 1.902 0 O-C-N 121.334 -0.854 . . . . 0.0 109.142 178.597 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 24' ' ' PHE . . . . . . . . . . . . . 56.5 t80 -62.4 -34.51 76.87 Favored 'General case' 0 N--CA 1.497 1.876 0 O-C-N 121.737 -0.602 . . . . 0.0 110.173 179.029 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 25' ' ' ASP . . . . . . . . . . . . . 16.5 m-20 -58.45 -52.62 64.85 Favored 'General case' 0 N--CA 1.5 2.026 0 O-C-N 121.523 -0.736 . . . . 0.0 110.503 179.675 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 26' ' ' ILE . . . . . . . . . . . . . 3.2 mt -63.38 -37.75 80.36 Favored 'Isoleucine or valine' 0 N--CA 1.498 1.966 0 O-C-N 121.393 -0.817 . . . . 0.0 109.678 179.527 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 27' ' ' PHE . . . . . . . . . . . . . 0.1 OUTLIER -61.62 -34.43 75.65 Favored 'General case' 0 N--CA 1.498 1.932 0 O-C-N 121.603 -0.685 . . . . 0.0 110.672 179.632 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 28' ' ' VAL . . . . . 0.479 ' HA ' ' HB2' ' A' ' 31' ' ' ALA . 16.0 m -101.93 -6.39 9.2 Favored 'Isoleucine or valine' 0 N--CA 1.502 2.169 0 O-C-N 121.166 -0.959 . . . . 0.0 111.527 -179.879 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 29' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -52.73 -56.97 11.76 Favored 'General case' 0 N--CA 1.501 2.112 0 O-C-N 121.129 -0.982 . . . . 0.0 110.886 -179.671 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 30' ' ' GLY . . . . . . . . . . . . . . . -105.28 51.4 0.77 Allowed Glycine 0 N--CA 1.494 2.525 0 N-CA-C 108.851 -1.7 . . . . 0.0 108.851 179.381 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 31' ' ' ALA . . . . . 0.587 ' HA ' ' HG2' ' A' ' 40' ' ' GLU . . . . . . . . 0 N--CA 1.495 1.775 0 O-C-N 121.37 -1.076 . . . . 0.0 111.562 -179.235 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 35' ' ' CYS . . . . . . . . . . . . . 94.9 m . . . . . 0 N--CA 1.499 1.998 0 CA-C-O 121.092 0.472 . . . . 0.0 110.652 . . . . . . . . . 0 0 . 1 . 003 nuclear orig core ' A' A ' 36' ' ' ILE . . . . . 0.422 HG13 HG12 ' A' ' 28' ' ' VAL . 4.7 mt -68.91 112.23 3.55 Favored 'Isoleucine or valine' 0 N--CA 1.499 1.999 0 O-C-N 121.339 -0.851 . . . . 0.0 110.27 -179.82 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 37' ' ' SER . . . . . . . . . . . . . 18.6 t -101.03 -174.61 2.65 Favored 'General case' 0 N--CA 1.495 1.823 0 O-C-N 121.517 -0.739 . . . . 0.0 109.825 179.558 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 38' ' ' THR . . . . . . . . . . . . . 8.3 p -60.55 -53.33 58.8 Favored 'General case' 0 N--CA 1.504 2.239 0 O-C-N 121.345 -0.847 . . . . 0.0 111.303 -179.447 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 39' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -59.14 -39.63 82.99 Favored 'General case' 0 N--CA 1.502 2.153 0 O-C-N 121.422 -0.799 . . . . 0.0 111.512 -179.22 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 40' ' ' GLU . . . . . 0.587 ' HG2' ' HA ' ' A' ' 31' ' ' ALA . 1.1 mp0 -63.09 -46.18 88.6 Favored 'General case' 0 N--CA 1.502 2.127 0 O-C-N 121.064 -1.023 . . . . 0.0 110.346 179.652 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 41' ' ' LEU . . . . . 0.456 HD12 ' HG3' ' A' ' 45' ' ' MET . 0.1 OUTLIER -58.71 -61.02 2.92 Favored 'General case' 0 N--CA 1.499 1.983 0 O-C-N 121.544 -0.723 . . . . 0.0 109.693 179.192 . . . . . . . . 3 3 . 1 . 003 nuclear orig core ' A' A ' 42' ' ' GLY . . . . . 0.456 ' CA ' HD12 ' A' ' 57' ' ' LEU . . . -48.99 -33.33 13.32 Favored Glycine 0 N--CA 1.5 2.907 0 N-CA-C 111.036 -0.826 . . . . 0.0 111.036 179.938 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 43' ' ' LYS . . . . . . . . . . . . . 2.4 tmtt? -56.7 -42.36 79.0 Favored 'General case' 0 N--CA 1.504 2.243 0 O-C-N 121.224 -1.162 . . . . 0.0 110.322 179.912 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 44' ' ' VAL . . . . . . . . . . . . . 76.8 t -76.84 -33.84 21.88 Favored 'Isoleucine or valine' 0 N--CA 1.494 1.762 0 O-C-N 121.296 -0.877 . . . . 0.0 109.265 179.191 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 45' ' ' MET . . . . . 0.493 ' SD ' ' HG3' ' A' ' 52' ' ' PRO . 1.2 mtt -57.73 -55.28 36.97 Favored 'General case' 0 N--CA 1.497 1.913 0 O-C-N 121.514 -0.741 . . . . 0.0 109.825 179.103 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 46' ' ' ARG . . . . . . . . . . . . . 15.4 ptp180 -61.45 -34.22 75.05 Favored 'General case' 0 N--CA 1.502 2.163 0 O-C-N 121.343 -0.848 . . . . 0.0 110.279 179.279 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 47' ' ' MET . . . . . . . . . . . . . 16.5 ttp -61.31 -32.9 72.76 Favored 'General case' 0 N--CA 1.499 2.007 0 O-C-N 121.281 -0.887 . . . . 0.0 109.388 178.557 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 48' ' ' LEU . . . . . . . . . . . . . 8.2 tp -85.06 -42.46 14.81 Favored 'General case' 0 N--CA 1.492 1.649 0 O-C-N 121.617 -0.677 . . . . 0.0 110.003 179.164 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 49' ' ' GLY . . . . . . . . . . . . . . . 169.9 -65.8 0.17 Allowed Glycine 0 N--CA 1.497 2.705 0 C-N-CA 119.759 -1.21 . . . . 0.0 110.896 179.882 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 50' ' ' GLN . . . . . . . . . . . . . 1.2 mt-30 -59.59 136.52 58.01 Favored 'General case' 0 N--CA 1.504 2.236 0 O-C-N 121.356 -1.085 . . . . 0.0 111.165 -179.03 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 51' ' ' ASN . . . . . . . . . . . . . 2.2 m-80 -118.74 77.98 15.22 Favored Pre-proline 0 N--CA 1.498 1.937 0 O-C-N 121.282 -0.887 . . . . 0.0 110.693 -179.97 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 52' ' ' PRO . . . . . 0.493 ' HG3' ' SD ' ' A' ' 45' ' ' MET . 54.2 Cg_endo -81.94 163.68 18.06 Favored 'Trans proline' 0 C--N 1.313 -1.294 0 O-C-N 123.814 1.428 . . . . 0.0 110.809 179.768 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 53' ' ' THR . . . . . . . . . . . . . 34.2 p -95.25 161.98 26.26 Favored Pre-proline 0 N--CA 1.496 1.854 0 O-C-N 121.325 -0.859 . . . . 0.0 109.826 179.245 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 54' ' ' PRO . . . . . . . . . . . . . 38.9 Cg_endo -65.85 -32.73 45.23 Favored 'Trans proline' 0 C--N 1.312 -1.362 0 O-C-N 123.703 1.37 . . . . 0.0 110.255 179.355 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 55' ' ' GLU . . . . . . . . . . . . . 12.2 mp0 -66.73 -38.47 86.74 Favored 'General case' 0 N--CA 1.496 1.834 0 O-C-N 121.401 -0.812 . . . . 0.0 109.425 178.558 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 0.3 OUTLIER -74.14 -40.78 62.39 Favored 'General case' 0 N--CA 1.495 1.804 0 O-C-N 121.568 -0.707 . . . . 0.0 110.078 179.298 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 57' ' ' LEU . . . . . 0.536 ' HA ' ' HG3' ' A' ' 60' ' ' MET . 6.7 mt -62.39 -20.25 64.26 Favored 'General case' 0 N--CA 1.5 2.037 0 O-C-N 121.259 -0.9 . . . . 0.0 110.93 179.69 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 58' ' ' GLN . . . . . 0.565 ' HG3' ' N ' ' A' ' 59' ' ' GLU . 0.0 OUTLIER -59.81 -37.55 79.47 Favored 'General case' 0 N--CA 1.496 1.865 0 O-C-N 121.05 -1.031 . . . . 0.0 109.095 179.131 . . . . . . . . 3 3 . 1 . 003 nuclear orig core ' A' A ' 59' ' ' GLU . . . . . 0.565 ' N ' ' HG3' ' A' ' 58' ' ' GLN . 0.4 OUTLIER -73.56 -35.81 65.53 Favored 'General case' 0 N--CA 1.497 1.879 0 N-CA-C 108.9 -0.778 . . . . 0.0 108.9 178.128 . . . . . . . . 3 3 . 1 . 003 nuclear orig core ' A' A ' 60' ' ' MET . . . . . 0.536 ' HG3' ' HA ' ' A' ' 57' ' ' LEU . 1.6 mmm -58.92 -42.64 90.2 Favored 'General case' 0 N--CA 1.497 1.881 0 O-C-N 121.708 -0.62 . . . . 0.0 109.679 179.04 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 61' ' ' ILE . . . . . 0.653 HG23 HG21 ' A' ' 72' ' ' VAL . 3.2 mt -76.86 -42.29 32.87 Favored 'Isoleucine or valine' 0 N--CA 1.497 1.923 0 O-C-N 121.511 -0.743 . . . . 0.0 109.913 179.226 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 62' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -58.9 -31.5 68.67 Favored 'General case' 0 N--CA 1.502 2.141 0 O-C-N 121.438 -0.789 . . . . 0.0 110.909 179.943 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 63' ' ' GLU . . . . . . . . . . . . . 2.7 tt0 -53.54 -34.73 59.27 Favored 'General case' 0 N--CA 1.5 2.035 0 O-C-N 121.7 -0.625 . . . . 0.0 111.099 179.893 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 64' ' ' VAL . . . . . . . . . . . . . 9.8 p -118.46 16.87 7.04 Favored 'Isoleucine or valine' 0 N--CA 1.497 1.888 0 O-C-N 121.25 -0.906 . . . . 0.0 111.16 179.999 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 65' ' ' ASP . . . . . . . . . . . . . 25.7 t70 -92.6 -88.43 0.21 Allowed 'General case' 0 N--CA 1.498 1.934 0 O-C-N 120.902 -1.124 . . . . 0.0 110.091 179.673 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 66' ' ' GLU . . . . . . . . . . . . . 3.3 mt-10 47.84 38.67 9.26 Favored 'General case' 0 N--CA 1.504 2.24 0 O-C-N 121.374 -0.828 . . . . 0.0 111.326 179.654 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 67' ' ' ASP . . . . . . . . . . . . . 0.8 OUTLIER -114.77 -32.74 5.72 Favored 'General case' 0 N--CA 1.5 2.058 0 O-C-N 121.062 -1.024 . . . . 0.0 111.455 -179.774 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 68' ' ' GLY . . . . . . . . . . . . . . . 140.13 -30.87 2.31 Favored Glycine 0 N--CA 1.497 2.703 0 C-N-CA 120.006 -1.092 . . . . 0.0 110.658 179.923 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 69' ' ' SER . . . . . . . . . . . . . 11.4 p -93.55 -29.68 15.38 Favored 'General case' 0 N--CA 1.499 2.006 0 O-C-N 121.189 -1.183 . . . . 0.0 111.847 -179.358 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 70' ' ' GLY . . . . . . . . . . . . . . . 89.2 -42.62 3.03 Favored Glycine 0 N--CA 1.498 2.824 0 C-N-CA 119.614 -1.279 . . . . 0.0 109.919 -179.383 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 71' ' ' THR . . . . . . . . . . . . . 26.7 m -71.41 153.25 42.42 Favored 'General case' 0 N--CA 1.502 2.128 0 O-C-N 121.373 -1.075 . . . . 0.0 110.38 179.966 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 72' ' ' VAL . . . . . 0.653 HG21 HG23 ' A' ' 61' ' ' ILE . 1.7 t -77.22 138.11 21.13 Favored 'Isoleucine or valine' 0 N--CA 1.501 2.11 0 O-C-N 121.29 -0.881 . . . . 0.0 111.016 -179.579 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 73' ' ' ASP . . . . . . . . . . . . . 5.0 m-20 -104.0 -162.0 0.87 Allowed 'General case' 0 N--CA 1.5 2.042 0 O-C-N 121.597 -0.689 . . . . 0.0 109.858 179.291 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 74' ' ' PHE . . . . . . . . . . . . . 16.9 t80 -78.66 -65.21 1.02 Allowed 'General case' 0 N--CA 1.502 2.16 0 O-C-N 120.927 -1.108 . . . . 0.0 110.015 179.642 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 75' ' ' ASP . . . . . . . . . . . . . 0.6 OUTLIER -60.17 -31.43 70.1 Favored 'General case' 0 N--CA 1.498 1.933 0 O-C-N 121.327 -0.858 . . . . 0.0 109.73 179.34 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 76' ' ' GLU . . . . . . . . . . . . . 3.8 tt0 -65.73 -36.37 83.39 Favored 'General case' 0 N--CA 1.498 1.971 0 O-C-N 121.365 -0.834 . . . . 0.0 108.793 178.07 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 77' ' ' PHE . . . . . 0.426 ' O ' ' HG2' ' A' ' 81' ' ' MET . 19.1 t80 -69.97 -37.98 75.94 Favored 'General case' 0 N--CA 1.494 1.732 0 N-CA-C 108.907 -0.775 . . . . 0.0 108.907 178.301 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 78' ' ' LEU . . . . . 0.498 HD13 ' HD3' ' A' ' 17' ' ' LYS . 17.4 mt -58.88 -44.51 91.12 Favored 'General case' 0 N--CA 1.498 1.954 0 O-C-N 121.581 -0.699 . . . . 0.0 110.292 179.308 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 79' ' ' VAL . . . . . 0.427 ' O ' HG13 ' A' ' 82' ' ' VAL . 9.0 p -72.74 -18.88 18.76 Favored 'Isoleucine or valine' 0 N--CA 1.5 2.034 0 O-C-N 121.334 -0.854 . . . . 0.0 110.211 178.803 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 80' ' ' MET . . . . . 0.423 ' N ' HG11 ' A' ' 79' ' ' VAL . 13.6 ttt -76.58 -39.03 53.89 Favored 'General case' 0 N--CA 1.497 1.91 0 O-C-N 121.226 -0.921 . . . . 0.0 109.783 179.035 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 81' ' ' MET . . . . . 0.426 ' HG2' ' O ' ' A' ' 77' ' ' PHE . 55.3 mmm -60.69 -45.64 93.4 Favored 'General case' 0 N--CA 1.497 1.91 0 O-C-N 121.441 -0.787 . . . . 0.0 110.209 179.479 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 82' ' ' VAL . . . . . 0.427 HG13 ' O ' ' A' ' 79' ' ' VAL . 1.8 p -69.91 -30.6 44.93 Favored 'Isoleucine or valine' 0 N--CA 1.496 1.826 0 O-C-N 121.364 -0.835 . . . . 0.0 110.111 179.558 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 83' ' ' ARG . . . . . 0.485 ' HA ' ' CE1' ' A' ' 5' ' ' TYR . 4.0 mtt-85 -65.5 -44.44 87.01 Favored 'General case' 0 N--CA 1.496 1.871 0 O-C-N 121.278 -0.888 . . . . 0.0 109.369 178.811 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 84' ' ' CYS . . . . . . . . . . . . . 23.9 t -72.63 -38.23 67.8 Favored 'General case' 0 N--CA 1.495 1.816 0 O-C-N 121.619 -0.676 . . . . 0.0 109.788 178.795 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 85' ' ' MET . . . . . . . . . . . . . 4.0 ttm . . . . . 0 N--CA 1.498 1.96 0 O-C-N 121.506 -0.746 . . . . 0.0 110.514 179.453 . . . . . . . . 0 0 . 1 . 003 nuclear orig core ' B' B ' 149' ' ' SER . . . . . 0.525 ' HB3' ' HB3' ' B' ' 152' ' ' ALA . 0.7 OUTLIER . . . . . 0 N--CA 1.496 1.826 0 CA-C-O 121.087 0.47 . . . . 0.0 110.443 . . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' B' B ' 150' ' ' ALA . . . . . . . . . . . . . . . -57.72 -45.57 85.58 Favored 'General case' 0 N--CA 1.499 1.993 0 O-C-N 121.577 -0.702 . . . . 0.0 110.742 -179.915 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' B' B ' 151' ' ' ASP . . . . . . . . . . . . . 6.9 p-10 -67.64 -37.53 82.57 Favored 'General case' 0 N--CA 1.499 2.007 0 O-C-N 121.511 -0.743 . . . . 0.0 110.414 179.703 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' B' B ' 152' ' ' ALA . . . . . 0.525 ' HB3' ' HB3' ' B' ' 149' ' ' SER . . . -62.55 -47.56 83.33 Favored 'General case' 0 N--CA 1.498 1.945 0 O-C-N 121.345 -0.847 . . . . 0.0 109.875 179.367 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' B' B ' 153' ' ' MET . . . . . . . . . . . . . 5.1 mtt -66.16 -39.9 90.14 Favored 'General case' 0 N--CA 1.496 1.846 0 O-C-N 121.692 -0.63 . . . . 0.0 110.029 179.254 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' B' B ' 154' ' ' MET . . . . . 0.482 ' HE1' ' HB3' ' A' ' 19' ' ' GLU . 0.3 OUTLIER -63.01 -51.88 65.11 Favored 'General case' 0 N--CA 1.496 1.83 0 O-C-N 121.622 -0.674 . . . . 0.0 110.314 179.815 . . . . . . . . 3 3 . 1 . 003 nuclear orig core ' B' B ' 155' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -64.15 -40.95 97.24 Favored 'General case' 0 N--CA 1.497 1.909 0 O-C-N 121.367 -0.833 . . . . 0.0 110.196 179.377 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' B' B ' 156' ' ' ALA . . . . . . . . . . . . . . . -62.43 -37.76 87.08 Favored 'General case' 0 N--CA 1.499 1.993 0 O-C-N 121.349 -0.844 . . . . 0.0 110.514 179.526 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' B' B ' 157' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -89.13 -1.71 58.21 Favored 'General case' 0 N--CA 1.5 2.03 0 O-C-N 121.205 -0.934 . . . . 0.0 111.284 179.722 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' B' B ' 158' ' ' LEU . . . . . . . . . . . . . 1.5 mt . . . . . 0 N--CA 1.5 2.037 0 O-C-N 120.943 -1.098 . . . . 0.0 110.541 179.985 . . . . . . . . 0 0 . 1 . 004 nuclear orig core ' A' A ' 4' ' ' ILE . . . . . . . . . . . . . 16.7 mt . . . . . 0 N--CA 1.497 1.889 0 CA-C-O 120.774 0.321 . . . . 0.0 110.595 . . . . . . . . . 0 0 . 1 . 004 nuclear orig core ' A' A ' 5' ' ' TYR . . . . . 0.424 ' CE1' ' HD3' ' A' ' 83' ' ' ARG . 72.2 m-85 -59.05 -42.97 91.59 Favored 'General case' 0 N--CA 1.5 2.062 0 O-C-N 121.428 -0.795 . . . . 0.0 110.148 -179.919 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -62.52 -41.22 98.71 Favored 'General case' 0 N--CA 1.497 1.921 0 O-C-N 121.363 -0.836 . . . . 0.0 108.995 178.586 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 7' ' ' ALA . . . . . . . . . . . . . . . -63.6 -38.19 90.19 Favored 'General case' 0 N--CA 1.496 1.838 0 O-C-N 121.562 -0.711 . . . . 0.0 109.94 178.752 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 8' ' ' ALA . . . . . . . . . . . . . . . -58.67 -35.08 72.02 Favored 'General case' 0 N--CA 1.499 1.993 0 O-C-N 121.405 -0.809 . . . . 0.0 109.887 179.193 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 9' ' ' VAL . . . . . 0.495 ' HA ' HD13 ' A' ' 12' ' ' LEU . 40.9 t -61.27 -41.59 90.26 Favored 'Isoleucine or valine' 0 N--CA 1.498 1.946 0 O-C-N 121.495 -0.753 . . . . 0.0 109.493 178.908 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 10' ' ' GLU . . . . . . . . . . . . . 10.1 mt-10 -69.37 -26.91 64.9 Favored 'General case' 0 N--CA 1.498 1.972 0 O-C-N 121.55 -0.719 . . . . 0.0 110.224 179.082 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 11' ' ' GLN . . . . . . . . . . . . . 8.9 mt-30 -73.55 -36.2 65.6 Favored 'General case' 0 N--CA 1.499 2.013 0 O-C-N 121.403 -0.811 . . . . 0.0 110.694 179.91 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 12' ' ' LEU . . . . . 0.495 HD13 ' HA ' ' A' ' 9' ' ' VAL . 18.9 mt -58.5 136.75 57.61 Favored 'General case' 0 N--CA 1.496 1.87 0 O-C-N 121.51 -0.744 . . . . 0.0 110.619 -179.673 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 13' ' ' THR . . . . . . . . . . . . . 82.7 p -81.65 171.98 13.97 Favored 'General case' 0 N--CA 1.499 1.977 0 O-C-N 121.348 -0.845 . . . . 0.0 110.359 179.971 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 14' ' ' GLU . . . . . . . . . . . . . 1.0 OUTLIER -57.27 -34.34 68.54 Favored 'General case' 0 N--CA 1.491 1.583 0 O-C-N 121.511 -0.743 . . . . 0.0 109.981 179.84 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 1.4 mp0 -57.7 -55.48 34.32 Favored 'General case' 0 N--CA 1.497 1.885 0 O-C-N 121.652 -0.655 . . . . 0.0 109.745 179.273 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 16' ' ' GLN . . . . . 0.406 ' HA ' ' HB2' ' A' ' 19' ' ' GLU . 1.7 mt-30 -65.6 -37.77 87.57 Favored 'General case' 0 N--CA 1.498 1.967 0 O-C-N 121.494 -0.754 . . . . 0.0 110.178 179.345 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 17' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -58.91 -49.14 78.9 Favored 'General case' 0 N--CA 1.496 1.872 0 N-CA-C 109.333 -0.618 . . . . 0.0 109.333 179.009 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 18' ' ' ASN . . . . . . . . . . . . . 2.1 t30 -71.05 -34.37 71.19 Favored 'General case' 0 N--CA 1.494 1.762 0 O-C-N 121.62 -0.675 . . . . 0.0 109.449 178.861 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 19' ' ' GLU . . . . . 0.625 ' HB3' ' HE3' ' B' ' 154' ' ' MET . 7.7 mt-10 -56.63 -48.03 78.4 Favored 'General case' 0 N--CA 1.5 2.062 0 O-C-N 121.567 -0.708 . . . . 0.0 110.064 178.991 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 20' ' ' PHE . . . . . . . . . . . . . 18.4 m-85 -66.8 -38.24 86.11 Favored 'General case' 0 N--CA 1.498 1.937 0 O-C-N 121.537 -0.727 . . . . 0.0 110.211 179.586 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 21' ' ' LYS . . . . . . . . . . . . . 14.2 tptt -56.7 -53.04 62.32 Favored 'General case' 0 N--CA 1.5 2.074 0 O-C-N 121.455 -0.778 . . . . 0.0 109.895 179.522 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 22' ' ' ALA . . . . . . . . . . . . . . . -60.1 -45.95 91.22 Favored 'General case' 0 N--CA 1.499 1.989 0 O-C-N 121.518 -0.739 . . . . 0.0 110.046 179.513 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 23' ' ' ALA . . . . . . . . . . . . . . . -61.73 -37.56 84.67 Favored 'General case' 0 N--CA 1.496 1.871 0 O-C-N 121.583 -0.698 . . . . 0.0 109.867 179.131 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 24' ' ' PHE . . . . . . . . . . . . . 25.6 t80 -62.72 -45.39 92.96 Favored 'General case' 0 N--CA 1.495 1.823 0 O-C-N 121.565 -0.709 . . . . 0.0 109.971 179.328 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 25' ' ' ASP . . . . . . . . . . . . . 18.7 m-20 -56.37 -43.75 79.47 Favored 'General case' 0 N--CA 1.498 1.962 0 O-C-N 121.562 -0.711 . . . . 0.0 109.973 179.468 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 26' ' ' ILE . . . . . . . . . . . . . 41.0 mt -71.68 -32.24 44.68 Favored 'Isoleucine or valine' 0 N--CA 1.498 1.974 0 O-C-N 121.523 -0.736 . . . . 0.0 109.825 179.14 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 27' ' ' PHE . . . . . 0.417 ' HB3' HG12 ' A' ' 36' ' ' ILE . 0.2 OUTLIER -63.11 -43.56 98.11 Favored 'General case' 0 N--CA 1.498 1.947 0 O-C-N 121.511 -0.743 . . . . 0.0 110.421 179.727 . . . . . . . . 3 3 . 1 . 004 nuclear orig core ' A' A ' 28' ' ' VAL . . . . . . . . . . . . . 5.7 p -110.02 63.6 0.17 Allowed 'Isoleucine or valine' 0 N--CA 1.498 1.951 0 O-C-N 121.283 -0.885 . . . . 0.0 110.952 -179.956 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 29' ' ' LEU . . . . . . . . . . . . . 28.0 mt -80.0 77.17 6.7 Favored 'General case' 0 N--CA 1.499 2.007 0 N-CA-C 107.618 -1.253 . . . . 0.0 107.618 177.87 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 30' ' ' GLY . . . . . . . . . . . . . . . 97.48 -55.43 1.23 Allowed Glycine 0 N--CA 1.491 2.337 0 N-CA-C 107.185 -2.366 . . . . 0.0 107.185 -176.963 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 31' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.5 2.043 0 CA-C-O 121.556 0.693 . . . . 0.0 111.946 178.367 . . . . . . . . 0 0 . 1 . 004 nuclear orig core ' A' A ' 35' ' ' CYS . . . . . . . . . . . . . 1.2 m . . . . . 0 N--CA 1.495 1.786 0 N-CA-C 109.464 -0.569 . . . . 0.0 109.464 . . . . . . . . . 0 0 . 1 . 004 nuclear orig core ' A' A ' 36' ' ' ILE . . . . . 0.436 ' HB ' ' HB ' ' A' ' 72' ' ' VAL . 2.5 mp -91.84 98.87 8.87 Favored 'Isoleucine or valine' 0 N--CA 1.495 1.795 0 O-C-N 121.023 -1.048 . . . . 0.0 110.168 179.823 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 37' ' ' SER . . . . . . . . . . . . . 10.1 p -94.0 -165.75 1.38 Allowed 'General case' 0 N--CA 1.498 1.935 0 O-C-N 121.396 -0.815 . . . . 0.0 110.132 179.776 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 38' ' ' THR . . . . . . . . . . . . . 17.7 p -58.93 -39.28 81.12 Favored 'General case' 0 N--CA 1.502 2.138 0 O-C-N 121.284 -0.885 . . . . 0.0 110.527 179.727 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 39' ' ' LYS . . . . . . . . . . . . . 32.7 mttt -67.62 -45.82 74.29 Favored 'General case' 0 N--CA 1.499 1.975 0 O-C-N 121.43 -0.794 . . . . 0.0 110.071 179.567 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 2.4 mp0 -65.21 -40.35 94.04 Favored 'General case' 0 N--CA 1.502 2.129 0 O-C-N 121.383 -0.823 . . . . 0.0 109.93 179.408 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 41' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -67.68 -59.27 3.46 Favored 'General case' 0 N--CA 1.496 1.843 0 O-C-N 121.556 -0.715 . . . . 0.0 109.645 179.343 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 42' ' ' GLY . . . . . 0.558 ' HA2' ' HB2' ' A' ' 45' ' ' MET . . . -49.53 -33.48 17.79 Favored Glycine 0 N--CA 1.498 2.819 0 N-CA-C 110.527 -1.029 . . . . 0.0 110.527 179.661 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 43' ' ' LYS . . . . . . . . . . . . . 16.0 ttpt -55.12 -37.39 66.84 Favored 'General case' 0 N--CA 1.502 2.142 0 O-C-N 121.294 -1.121 . . . . 0.0 110.514 179.464 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 44' ' ' VAL . . . . . 0.417 ' HA ' ' HE3' ' A' ' 47' ' ' MET . 42.6 t -90.81 -29.92 4.87 Favored 'Isoleucine or valine' 0 N--CA 1.497 1.912 0 O-C-N 121.277 -0.889 . . . . 0.0 109.815 179.165 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 45' ' ' MET . . . . . 0.558 ' HB2' ' HA2' ' A' ' 42' ' ' GLY . 5.4 mmt -57.57 -43.97 84.93 Favored 'General case' 0 N--CA 1.499 2.015 0 O-C-N 121.499 -0.75 . . . . 0.0 111.111 -179.949 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 46' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -53.3 -16.93 1.48 Allowed 'General case' 0 N--CA 1.504 2.261 0 O-C-N 121.35 -0.844 . . . . 0.0 112.298 -179.423 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 47' ' ' MET . . . . . 0.417 ' HE3' ' HA ' ' A' ' 44' ' ' VAL . 42.7 mtt -82.66 -30.39 29.33 Favored 'General case' 0 N--CA 1.499 2.022 0 O-C-N 120.833 -1.167 . . . . 0.0 111.072 179.717 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 48' ' ' LEU . . . . . . . . . . . . . 5.5 tp -143.43 -48.02 0.3 Allowed 'General case' 0 N--CA 1.495 1.786 0 O-C-N 121.134 -0.979 . . . . 0.0 111.453 -179.177 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 49' ' ' GLY . . . . . 0.42 ' O ' ' HB3' ' A' ' 45' ' ' MET . . . -95.11 102.48 2.86 Favored Glycine 0 N--CA 1.494 2.541 0 N-CA-C 110.09 -1.204 . . . . 0.0 110.09 -179.31 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 50' ' ' GLN . . . . . . . . . . . . . 0.9 OUTLIER -46.19 143.48 2.36 Favored 'General case' 0 N--CA 1.502 2.165 0 O-C-N 121.768 -0.842 . . . . 0.0 111.756 -179.941 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 51' ' ' ASN . . . . . . . . . . . . . 1.6 p-10 -130.59 92.69 34.14 Favored Pre-proline 0 N--CA 1.499 2.005 0 O-C-N 121.51 -0.744 . . . . 0.0 109.686 179.463 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 52' ' ' PRO . . . . . . . . . . . . . 43.6 Cg_endo -70.1 -38.67 6.75 Favored 'Trans proline' 0 N--CA 1.491 1.368 0 O-C-N 123.762 1.401 . . . . 0.0 111.4 -179.385 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 53' ' ' THR . . . . . 0.434 HG22 ' HB2' ' A' ' 56' ' ' GLU . 0.0 OUTLIER -145.16 153.54 52.99 Favored Pre-proline 0 N--CA 1.498 1.946 0 O-C-N 121.21 -0.931 . . . . 0.0 110.429 -179.862 . . . . . . . . 3 3 . 1 . 004 nuclear orig core ' A' A ' 54' ' ' PRO . . . . . . . . . . . . . 42.9 Cg_endo -68.59 -32.76 23.76 Favored 'Trans proline' 0 C--N 1.313 -1.332 0 O-C-N 124.126 1.593 . . . . 0.0 110.46 179.665 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 55' ' ' GLU . . . . . . . . . . . . . 33.7 mm-40 -61.26 -33.75 74.04 Favored 'General case' 0 N--CA 1.497 1.924 0 O-C-N 121.575 -0.703 . . . . 0.0 110.282 179.462 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 56' ' ' GLU . . . . . 0.434 ' HB2' HG22 ' A' ' 53' ' ' THR . 20.4 tt0 -57.06 -44.17 82.79 Favored 'General case' 0 N--CA 1.498 1.933 0 O-C-N 121.508 -0.745 . . . . 0.0 109.592 179.113 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 57' ' ' LEU . . . . . 0.451 ' O ' ' HB2' ' A' ' 60' ' ' MET . 0.8 OUTLIER -77.1 -31.35 55.85 Favored 'General case' 0 N--CA 1.495 1.789 0 O-C-N 121.51 -0.744 . . . . 0.0 109.753 178.954 . . . . . . . . 3 3 . 1 . 004 nuclear orig core ' A' A ' 58' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -54.47 -49.94 68.92 Favored 'General case' 0 N--CA 1.496 1.842 0 O-C-N 121.341 -0.849 . . . . 0.0 109.014 179.076 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 59' ' ' GLU . . . . . . . . . . . . . 4.2 mt-10 -65.53 -34.69 78.86 Favored 'General case' 0 N--CA 1.496 1.872 0 O-C-N 121.712 -0.617 . . . . 0.0 109.432 178.16 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 60' ' ' MET . . . . . 0.451 ' HB2' ' O ' ' A' ' 57' ' ' LEU . 2.1 mmm -59.99 -47.05 87.43 Favored 'General case' 0 N--CA 1.498 1.931 0 O-C-N 121.649 -0.657 . . . . 0.0 110.071 179.449 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 61' ' ' ILE . . . . . 0.589 HG12 HG22 ' A' ' 72' ' ' VAL . 59.5 mt -72.79 -42.15 61.48 Favored 'Isoleucine or valine' 0 N--CA 1.498 1.962 0 O-C-N 121.332 -0.855 . . . . 0.0 110.046 179.437 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 62' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -57.58 -31.27 66.01 Favored 'General case' 0 N--CA 1.501 2.079 0 O-C-N 121.299 -0.876 . . . . 0.0 110.219 179.174 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 63' ' ' GLU . . . . . . . . . . . . . 1.3 tt0 -66.16 -33.03 74.85 Favored 'General case' 0 N--CA 1.496 1.841 0 O-C-N 121.183 -0.948 . . . . 0.0 109.471 178.697 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 64' ' ' VAL . . . . . . . . . . . . . 51.4 t -84.14 -37.01 12.59 Favored 'Isoleucine or valine' 0 N--CA 1.495 1.784 0 O-C-N 121.571 -0.706 . . . . 0.0 110.471 179.418 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 65' ' ' ASP . . . . . . . . . . . . . 0.0 OUTLIER -128.2 146.16 50.81 Favored 'General case' 0 N--CA 1.496 1.848 0 O-C-N 121.155 -0.966 . . . . 0.0 111.93 -179.39 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 66' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -139.79 46.29 1.88 Allowed 'General case' 0 N--CA 1.491 1.597 0 N-CA-C 108.301 -1.0 . . . . 0.0 108.301 178.331 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 67' ' ' ASP . . . . . . . . . . . . . 0.9 OUTLIER -104.59 43.8 1.07 Allowed 'General case' 0 N--CA 1.498 1.93 0 O-C-N 121.702 -0.624 . . . . 0.0 111.118 -178.844 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 68' ' ' GLY . . . . . . . . . . . . . . . 56.83 43.61 92.22 Favored Glycine 0 N--CA 1.499 2.895 0 N-CA-C 110.415 -1.074 . . . . 0.0 110.415 179.26 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 69' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -146.44 -52.2 0.23 Allowed 'General case' 0 N--CA 1.496 1.826 0 O-C-N 121.338 -1.096 . . . . 0.0 110.359 179.968 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 70' ' ' GLY . . . . . . . . . . . . . . . 69.31 23.91 76.2 Favored Glycine 0 N--CA 1.497 2.707 0 N-CA-C 109.95 -1.26 . . . . 0.0 109.95 -179.807 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 71' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -123.86 138.65 54.46 Favored 'General case' 0 N--CA 1.499 1.994 0 O-C-N 121.42 -1.047 . . . . 0.0 109.107 179.755 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 72' ' ' VAL . . . . . 0.589 HG22 HG12 ' A' ' 61' ' ' ILE . 26.1 t -76.17 126.67 37.11 Favored 'Isoleucine or valine' 0 N--CA 1.499 1.991 0 O-C-N 121.422 -0.798 . . . . 0.0 111.527 -178.985 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 73' ' ' ASP . . . . . 0.401 ' O ' ' HB2' ' A' ' 77' ' ' PHE . 0.2 OUTLIER -110.47 -168.0 1.26 Allowed 'General case' 0 N--CA 1.496 1.835 0 O-C-N 121.471 -0.768 . . . . 0.0 109.042 178.369 . . . . . . . . 3 3 . 1 . 004 nuclear orig core ' A' A ' 74' ' ' PHE . . . . . . . . . . . . . 25.8 t80 -66.66 -45.81 77.74 Favored 'General case' 0 N--CA 1.501 2.094 0 O-C-N 120.825 -1.172 . . . . 0.0 110.857 -179.83 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 75' ' ' ASP . . . . . . . . . . . . . 24.8 t70 -60.46 -53.95 51.37 Favored 'General case' 0 N--CA 1.5 2.039 0 O-C-N 121.405 -0.809 . . . . 0.0 110.482 179.867 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 76' ' ' GLU . . . . . . . . . . . . . 25.0 mt-10 -59.67 -40.66 88.51 Favored 'General case' 0 N--CA 1.499 1.99 0 O-C-N 121.484 -0.76 . . . . 0.0 110.252 179.572 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 77' ' ' PHE . . . . . 0.436 ' O ' ' HG2' ' A' ' 81' ' ' MET . 38.3 t80 -60.86 -41.37 95.75 Favored 'General case' 0 N--CA 1.496 1.853 0 O-C-N 121.472 -0.768 . . . . 0.0 110.317 179.718 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 78' ' ' LEU . . . . . . . . . . . . . 38.1 mt -60.28 -49.59 76.99 Favored 'General case' 0 N--CA 1.497 1.892 0 O-C-N 121.338 -0.851 . . . . 0.0 110.749 -179.849 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 79' ' ' VAL . . . . . 0.406 ' O ' ' HG3' ' A' ' 83' ' ' ARG . 3.5 m -73.45 -32.42 36.68 Favored 'Isoleucine or valine' 0 N--CA 1.501 2.092 0 O-C-N 121.119 -0.988 . . . . 0.0 109.782 179.626 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 80' ' ' MET . . . . . . . . . . . . . 9.6 ttt -59.03 -49.52 77.57 Favored 'General case' 0 N--CA 1.498 1.944 0 O-C-N 121.372 -0.83 . . . . 0.0 109.616 179.215 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 81' ' ' MET . . . . . 0.476 ' HE2' ' HA ' ' B' ' 150' ' ' ALA . 83.8 mmm -62.64 -33.88 75.93 Favored 'General case' 0 N--CA 1.493 1.681 0 O-C-N 121.57 -0.706 . . . . 0.0 109.512 178.88 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 82' ' ' VAL . . . . . . . . . . . . . 3.2 t -66.34 -36.78 78.19 Favored 'Isoleucine or valine' 0 N--CA 1.497 1.893 0 O-C-N 121.6 -0.687 . . . . 0.0 109.985 179.13 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 83' ' ' ARG . . . . . 0.424 ' HD3' ' CE1' ' A' ' 5' ' ' TYR . 9.7 mtm180 -58.75 -39.5 81.12 Favored 'General case' 0 N--CA 1.502 2.136 0 O-C-N 121.431 -0.793 . . . . 0.0 110.328 179.511 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 84' ' ' CYS . . . . . . . . . . . . . 25.8 m -92.52 -15.88 26.46 Favored 'General case' 0 N--CA 1.499 1.992 0 O-C-N 121.367 -0.833 . . . . 0.0 111.118 179.71 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 85' ' ' MET . . . . . . . . . . . . . 30.7 ttp . . . . . 0 N--CA 1.498 1.957 0 O-C-N 121.196 -0.94 . . . . 0.0 110.405 -179.866 . . . . . . . . 0 0 . 1 . 004 nuclear orig core ' B' B ' 149' ' ' SER . . . . . 0.406 ' HB3' ' HB2' ' B' ' 152' ' ' ALA . 13.3 t . . . . . 0 N--CA 1.497 1.881 0 CA-C-O 121.06 0.457 . . . . 0.0 110.103 . . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 150' ' ' ALA . . . . . 0.476 ' HA ' ' HE2' ' A' ' 81' ' ' MET . . . -59.03 -40.13 84.07 Favored 'General case' 0 N--CA 1.499 2.017 0 O-C-N 121.442 -0.786 . . . . 0.0 110.721 179.926 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' B' B ' 151' ' ' ASP . . . . . . . . . . . . . 16.9 t70 -75.76 -49.33 18.49 Favored 'General case' 0 N--CA 1.497 1.88 0 O-C-N 121.318 -0.864 . . . . 0.0 110.256 179.648 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 152' ' ' ALA . . . . . 0.406 ' HB2' ' HB3' ' B' ' 149' ' ' SER . . . -58.58 -44.91 89.95 Favored 'General case' 0 N--CA 1.498 1.966 0 O-C-N 121.502 -0.749 . . . . 0.0 110.57 179.896 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' B' B ' 153' ' ' MET . . . . . . . . . . . . . 0.2 OUTLIER -65.83 -37.95 87.59 Favored 'General case' 0 N--CA 1.498 1.97 0 O-C-N 121.299 -0.876 . . . . 0.0 109.789 179.312 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' B' B ' 154' ' ' MET . . . . . 0.625 ' HE3' ' HB3' ' A' ' 19' ' ' GLU . 19.9 mmm -61.86 -42.27 98.85 Favored 'General case' 0 N--CA 1.497 1.915 0 O-C-N 121.454 -0.779 . . . . 0.0 109.635 178.862 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' B' B ' 155' ' ' GLN . . . . . . . . . . . . . 18.2 tt0 -67.02 -35.72 80.52 Favored 'General case' 0 N--CA 1.497 1.91 0 O-C-N 121.546 -0.721 . . . . 0.0 109.998 178.979 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 156' ' ' ALA . . . . . . . . . . . . . . . -67.72 -42.41 82.0 Favored 'General case' 0 N--CA 1.496 1.835 0 O-C-N 121.496 -0.753 . . . . 0.0 110.121 179.538 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 157' ' ' LEU . . . . . . . . . . . . . 2.4 mt -57.43 -33.76 68.25 Favored 'General case' 0 N--CA 1.499 1.981 0 O-C-N 121.615 -0.678 . . . . 0.0 111.031 179.705 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 158' ' ' LEU . . . . . . . . . . . . . 0.8 OUTLIER . . . . . 0 N--CA 1.495 1.824 0 O-C-N 121.377 -0.827 . . . . 0.0 110.793 -179.592 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 4' ' ' ILE . . . . . . . . . . . . . 6.1 tp . . . . . 0 N--CA 1.499 2.008 0 CA-C-O 120.813 0.34 . . . . 0.0 110.516 . . . . . . . . . 0 0 . 1 . 005 nuclear orig core ' A' A ' 5' ' ' TYR . . . . . . . . . . . . . 42.1 m-85 -83.82 -32.15 25.47 Favored 'General case' 0 N--CA 1.496 1.868 0 O-C-N 121.33 -0.856 . . . . 0.0 109.289 178.596 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 3.4 ttmt -59.73 -45.73 91.3 Favored 'General case' 0 N--CA 1.499 2.001 0 O-C-N 121.716 -0.615 . . . . 0.0 110.382 179.548 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 7' ' ' ALA . . . . . . . . . . . . . . . -54.25 -42.75 70.28 Favored 'General case' 0 N--CA 1.498 1.949 0 O-C-N 121.666 -0.646 . . . . 0.0 110.113 179.695 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 8' ' ' ALA . . . . . . . . . . . . . . . -66.32 -39.74 89.46 Favored 'General case' 0 N--CA 1.497 1.887 0 O-C-N 121.552 -0.717 . . . . 0.0 110.358 179.374 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 9' ' ' VAL . . . . . 0.501 HG23 ' HA ' ' A' ' 79' ' ' VAL . 97.7 t -60.89 -41.52 89.13 Favored 'Isoleucine or valine' 0 N--CA 1.502 2.165 0 O-C-N 121.474 -0.766 . . . . 0.0 110.447 179.834 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 10' ' ' GLU . . . . . . . . . . . . . 17.9 mt-10 -79.86 -44.13 21.04 Favored 'General case' 0 N--CA 1.495 1.808 0 O-C-N 121.495 -0.753 . . . . 0.0 111.02 -179.641 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 11' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -89.64 39.15 0.94 Allowed 'General case' 0 N--CA 1.499 1.996 0 O-C-N 121.289 -0.882 . . . . 0.0 111.49 -179.532 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 12' ' ' LEU . . . . . 0.494 ' HB3' ' HD3' ' A' ' 17' ' ' LYS . 0.8 OUTLIER -78.65 138.71 38.44 Favored 'General case' 0 N--CA 1.497 1.899 0 O-C-N 120.916 -1.115 . . . . 0.0 109.783 179.165 . . . . . . . . 3 3 . 1 . 005 nuclear orig core ' A' A ' 13' ' ' THR . . . . . 0.506 HG23 ' HB2' ' A' ' 15' ' ' GLU . 14.9 t -69.66 164.15 24.02 Favored 'General case' 0 N--CA 1.501 2.079 0 O-C-N 121.264 -0.897 . . . . 0.0 111.396 -179.567 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 14' ' ' GLU . . . . . . . . . . . . . 17.7 tt0 -62.35 -35.89 80.52 Favored 'General case' 0 N--CA 1.495 1.8 0 O-C-N 121.844 -0.535 . . . . 0.0 110.897 -179.422 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 15' ' ' GLU . . . . . 0.506 ' HB2' HG23 ' A' ' 13' ' ' THR . 1.3 mp0 -56.89 -41.71 78.55 Favored 'General case' 0 N--CA 1.499 2.024 0 O-C-N 121.415 -0.803 . . . . 0.0 110.776 -179.838 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 16' ' ' GLN . . . . . . . . . . . . . 81.0 mt-30 -86.35 -44.94 11.67 Favored 'General case' 0 N--CA 1.497 1.907 0 O-C-N 121.333 -0.854 . . . . 0.0 110.796 -179.946 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 17' ' ' LYS . . . . . 0.494 ' HD3' ' HB3' ' A' ' 12' ' ' LEU . 0.2 OUTLIER -59.78 -47.21 86.58 Favored 'General case' 0 N--CA 1.5 2.031 0 O-C-N 121.81 -0.556 . . . . 0.0 110.611 -179.889 . . . . . . . . 3 3 . 1 . 005 nuclear orig core ' A' A ' 18' ' ' ASN . . . . . 0.571 ' HA ' ' HG2' ' A' ' 21' ' ' LYS . 32.5 t30 -67.72 -29.49 68.74 Favored 'General case' 0 N--CA 1.495 1.799 0 O-C-N 121.461 -0.775 . . . . 0.0 110.447 179.593 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 12.7 tt0 -73.65 -43.43 59.5 Favored 'General case' 0 N--CA 1.492 1.669 0 O-C-N 121.237 -0.915 . . . . 0.0 109.876 179.444 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 20' ' ' PHE . . . . . . . . . . . . . 16.9 m-85 -73.59 -35.74 65.44 Favored 'General case' 0 N--CA 1.498 1.925 0 O-C-N 121.354 -0.841 . . . . 0.0 110.784 179.869 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 21' ' ' LYS . . . . . 0.571 ' HG2' ' HA ' ' A' ' 18' ' ' ASN . 0.0 OUTLIER -64.13 -30.86 71.9 Favored 'General case' 0 N--CA 1.496 1.868 0 O-C-N 121.14 -0.975 . . . . 0.0 110.207 179.546 . . . . . . . . 3 3 . 1 . 005 nuclear orig core ' A' A ' 22' ' ' ALA . . . . . 0.522 ' N ' ' HG3' ' A' ' 21' ' ' LYS . . . -77.15 -31.69 55.76 Favored 'General case' 0 N--CA 1.5 2.034 0 O-C-N 121.401 -0.812 . . . . 0.0 109.603 178.701 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 23' ' ' ALA . . . . . . . . . . . . . . . -85.73 -8.69 58.01 Favored 'General case' 0 N--CA 1.494 1.773 0 O-C-N 121.416 -0.803 . . . . 0.0 110.328 178.96 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 24' ' ' PHE . . . . . . . . . . . . . 73.1 t80 -88.07 -52.05 5.46 Favored 'General case' 0 N--CA 1.494 1.773 0 O-C-N 121.179 -0.951 . . . . 0.0 110.382 -179.823 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 25' ' ' ASP . . . . . . . . . . . . . 3.1 p-10 -60.71 -36.18 78.16 Favored 'General case' 0 N--CA 1.501 2.077 0 O-C-N 121.26 -0.9 . . . . 0.0 110.348 179.85 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 26' ' ' ILE . . . . . . . . . . . . . 81.9 mt -70.1 -34.55 59.77 Favored 'Isoleucine or valine' 0 N--CA 1.5 2.039 0 O-C-N 121.063 -1.023 . . . . 0.0 109.34 178.669 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 27' ' ' PHE . . . . . 0.437 ' CD2' HD11 ' B' ' 157' ' ' LEU . 0.3 OUTLIER -62.09 -43.86 97.91 Favored 'General case' 0 N--CA 1.497 1.888 0 O-C-N 121.463 -0.773 . . . . 0.0 110.248 179.244 . . . . . . . . 3 3 . 1 . 005 nuclear orig core ' A' A ' 28' ' ' VAL . . . . . . . . . . . . . 32.6 m -84.9 43.67 0.06 OUTLIER 'Isoleucine or valine' 0 N--CA 1.5 2.051 0 O-C-N 121.503 -0.748 . . . . 0.0 111.443 -179.675 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 29' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -63.11 -55.12 27.98 Favored 'General case' 0 N--CA 1.499 2.02 0 O-C-N 121.019 -1.05 . . . . 0.0 109.718 179.161 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 30' ' ' GLY . . . . . . . . . . . . . . . -103.1 52.89 0.77 Allowed Glycine 0 N--CA 1.497 2.721 0 N-CA-C 108.601 -1.8 . . . . 0.0 108.601 178.787 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 31' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.496 1.847 0 O-C-N 121.632 -0.922 . . . . 0.0 111.172 -179.269 . . . . . . . . 0 0 . 1 . 005 nuclear orig core ' A' A ' 35' ' ' CYS . . . . . . . . . . . . . 99.6 m . . . . . 0 N--CA 1.499 2.001 0 CA-C-O 121.02 0.438 . . . . 0.0 110.524 . . . . . . . . . 0 0 . 1 . 005 nuclear orig core ' A' A ' 36' ' ' ILE . . . . . . . . . . . . . 66.8 mt -67.07 128.57 30.52 Favored 'Isoleucine or valine' 0 N--CA 1.502 2.152 0 O-C-N 121.323 -0.861 . . . . 0.0 110.462 -179.841 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 37' ' ' SER . . . . . . . . . . . . . 9.1 t -103.81 171.25 7.46 Favored 'General case' 0 N--CA 1.498 1.932 0 O-C-N 121.665 -0.647 . . . . 0.0 110.535 179.812 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 38' ' ' THR . . . . . 0.506 HG22 ' HG2' ' A' ' 58' ' ' GLN . 68.9 p -67.94 -48.75 65.06 Favored 'General case' 0 N--CA 1.502 2.143 0 O-C-N 121.278 -0.889 . . . . 0.0 110.4 -179.983 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 39' ' ' LYS . . . . . . . . . . . . . 0.7 OUTLIER -61.2 -37.97 84.89 Favored 'General case' 0 N--CA 1.5 2.063 0 O-C-N 121.295 -0.878 . . . . 0.0 109.316 178.98 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 12.9 tt0 -63.97 -46.52 84.26 Favored 'General case' 0 N--CA 1.495 1.802 0 CA-C-O 121.305 0.574 . . . . 0.0 109.479 178.874 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 41' ' ' LEU . . . . . 0.414 ' C ' ' CD1' ' A' ' 41' ' ' LEU . 0.1 OUTLIER -65.56 -58.02 6.79 Favored 'General case' 0 N--CA 1.494 1.763 0 O-C-N 121.634 -0.666 . . . . 0.0 109.275 178.798 . . . . . . . . 3 3 . 1 . 005 nuclear orig core ' A' A ' 42' ' ' GLY . . . . . 0.4 ' O ' ' HB2' ' A' ' 45' ' ' MET . . . -47.27 -33.08 7.42 Favored Glycine 0 N--CA 1.502 3.057 0 N-CA-C 111.259 -0.737 . . . . 0.0 111.259 179.985 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 43' ' ' LYS . . . . . . . . . . . . . 1.8 tmtm? -58.98 -36.6 75.15 Favored 'General case' 0 N--CA 1.502 2.129 0 O-C-N 121.063 -1.257 . . . . 0.0 110.232 179.573 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 44' ' ' VAL . . . . . . . . . . . . . 93.9 t -85.05 -22.06 7.71 Favored 'Isoleucine or valine' 0 N--CA 1.498 1.961 0 O-C-N 121.499 -0.751 . . . . 0.0 109.911 179.335 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 45' ' ' MET . . . . . 0.4 ' HB2' ' O ' ' A' ' 42' ' ' GLY . 6.4 mmt -56.52 -36.9 69.73 Favored 'General case' 0 N--CA 1.499 2.02 0 O-C-N 121.262 -0.899 . . . . 0.0 110.326 179.35 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 46' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -62.21 -33.34 74.37 Favored 'General case' 0 N--CA 1.5 2.036 0 O-C-N 121.326 -0.858 . . . . 0.0 110.298 179.207 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 47' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -63.22 -32.28 73.64 Favored 'General case' 0 N--CA 1.501 2.102 0 O-C-N 121.342 -0.849 . . . . 0.0 110.141 179.332 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 48' ' ' LEU . . . . . . . . . . . . . 8.0 mt -93.2 -43.51 8.8 Favored 'General case' 0 N--CA 1.496 1.855 0 O-C-N 121.405 -0.81 . . . . 0.0 109.631 179.347 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 49' ' ' GLY . . . . . . . . . . . . . . . -143.73 -101.6 0.37 Allowed Glycine 0 N--CA 1.493 2.456 0 N-CA-C 109.082 -1.607 . . . . 0.0 109.082 179.557 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 50' ' ' GLN . . . . . . . . . . . . . 12.8 mt-30 -147.21 170.17 17.81 Favored 'General case' 0 N--CA 1.496 1.872 0 O-C-N 121.403 -1.057 . . . . 0.0 110.54 179.83 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 51' ' ' ASN . . . . . . . . . . . . . 44.7 t30 -138.79 104.76 7.49 Favored Pre-proline 0 N--CA 1.495 1.817 0 O-C-N 121.489 -0.757 . . . . 0.0 109.876 179.894 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 52' ' ' PRO . . . . . . . . . . . . . 48.9 Cg_endo -77.94 -50.74 0.08 OUTLIER 'Trans proline' 0 C--N 1.314 -1.267 0 O-C-N 123.771 1.406 . . . . 0.0 111.108 -179.614 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 53' ' ' THR . . . . . 0.487 ' OG1' ' HD2' ' A' ' 54' ' ' PRO . 0.1 OUTLIER -156.89 159.16 31.45 Favored Pre-proline 0 N--CA 1.498 1.931 0 O-C-N 121.142 -0.974 . . . . 0.0 110.739 -179.448 . . . . . . . . 3 3 . 1 . 005 nuclear orig core ' A' A ' 54' ' ' PRO . . . . . 0.487 ' HD2' ' OG1' ' A' ' 53' ' ' THR . 42.5 Cg_endo -67.12 -24.57 44.56 Favored 'Trans proline' 0 N--CA 1.49 1.296 0 O-C-N 123.932 1.49 . . . . 0.0 110.69 179.246 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 55' ' ' GLU . . . . . . . . . . . . . 0.9 OUTLIER -59.31 -36.5 75.74 Favored 'General case' 0 N--CA 1.498 1.958 0 O-C-N 121.319 -0.863 . . . . 0.0 109.971 179.178 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 1.2 mm-40 -59.85 -42.93 94.69 Favored 'General case' 0 N--CA 1.497 1.882 0 O-C-N 121.502 -0.749 . . . . 0.0 109.808 179.103 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 57' ' ' LEU . . . . . 0.469 ' HA ' ' HB2' ' A' ' 60' ' ' MET . 2.6 mm? -74.05 -28.89 61.63 Favored 'General case' 0 N--CA 1.494 1.761 0 O-C-N 121.367 -0.833 . . . . 0.0 109.769 178.988 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 58' ' ' GLN . . . . . 0.506 ' HG2' HG22 ' A' ' 38' ' ' THR . 0.0 OUTLIER -54.83 -53.36 56.24 Favored 'General case' 0 N--CA 1.5 2.027 0 O-C-N 121.28 -0.887 . . . . 0.0 109.056 179.127 . . . . . . . . 3 3 . 1 . 005 nuclear orig core ' A' A ' 59' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER -61.17 -33.71 73.87 Favored 'General case' 0 N--CA 1.495 1.804 0 N-CA-C 108.848 -0.797 . . . . 0.0 108.848 177.966 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 60' ' ' MET . . . . . 0.469 ' HB2' ' HA ' ' A' ' 57' ' ' LEU . 0.0 OUTLIER -64.65 -37.91 89.2 Favored 'General case' 0 N--CA 1.496 1.838 0 O-C-N 121.753 -0.592 . . . . 0.0 110.052 178.752 . . . . . . . . 3 3 . 1 . 005 nuclear orig core ' A' A ' 61' ' ' ILE . . . . . 0.502 HG13 HG22 ' A' ' 72' ' ' VAL . 1.0 OUTLIER -74.57 -43.84 47.79 Favored 'Isoleucine or valine' 0 N--CA 1.496 1.835 0 O-C-N 121.308 -0.87 . . . . 0.0 109.573 179.375 . . . . . . . . 3 3 . 1 . 005 nuclear orig core ' A' A ' 62' ' ' ASP . . . . . 0.411 ' N ' ' CG2' ' A' ' 61' ' ' ILE . 2.6 m-20 -55.6 -31.67 62.44 Favored 'General case' 0 N--CA 1.5 2.06 0 O-C-N 121.262 -0.899 . . . . 0.0 109.902 178.874 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 63' ' ' GLU . . . . . . . . . . . . . 7.4 tt0 -59.74 -35.07 73.82 Favored 'General case' 0 N--CA 1.497 1.92 0 O-C-N 121.737 -0.602 . . . . 0.0 110.672 179.226 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 64' ' ' VAL . . . . . . . . . . . . . 9.9 p -124.11 23.38 3.87 Favored 'Isoleucine or valine' 0 N--CA 1.497 1.885 0 O-C-N 121.216 -0.927 . . . . 0.0 110.842 -179.75 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 65' ' ' ASP . . . . . . . . . . . . . 8.5 t70 -131.36 -82.44 0.52 Allowed 'General case' 0 N--CA 1.497 1.909 0 O-C-N 121.172 -0.955 . . . . 0.0 109.654 -179.918 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 66' ' ' GLU . . . . . . . . . . . . . 0.3 OUTLIER 40.81 48.46 2.71 Favored 'General case' 0 N--CA 1.505 2.315 0 O-C-N 121.42 -0.8 . . . . 0.0 112.366 178.734 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 67' ' ' ASP . . . . . . . . . . . . . 4.3 p-10 -117.46 7.39 12.73 Favored 'General case' 0 N--CA 1.501 2.08 0 O-C-N 120.982 -1.074 . . . . 0.0 111.079 179.532 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 68' ' ' GLY . . . . . . . . . . . . . . . 96.3 -5.46 65.35 Favored Glycine 0 N--CA 1.497 2.764 0 N-CA-C 110.521 -1.032 . . . . 0.0 110.521 -179.856 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 69' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -106.07 -43.82 4.74 Favored 'General case' 0 N--CA 1.496 1.838 0 O-C-N 121.049 -1.265 . . . . 0.0 110.496 -179.825 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 70' ' ' GLY . . . . . . . . . . . . . . . 78.78 19.84 72.25 Favored Glycine 0 N--CA 1.497 2.758 0 N-CA-C 109.527 -1.429 . . . . 0.0 109.527 -179.472 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 71' ' ' THR . . . . . . . . . . . . . 0.1 OUTLIER -132.22 124.01 28.11 Favored 'General case' 0 N--CA 1.492 1.643 0 O-C-N 121.601 -0.941 . . . . 0.0 108.652 -179.761 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 72' ' ' VAL . . . . . 0.502 HG22 HG13 ' A' ' 61' ' ' ILE . 4.9 t -75.59 124.54 33.79 Favored 'Isoleucine or valine' 0 N--CA 1.496 1.844 0 O-C-N 121.448 -0.783 . . . . 0.0 111.008 -178.68 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 73' ' ' ASP . . . . . . . . . . . . . 18.0 t70 -95.6 -176.84 3.87 Favored 'General case' 0 N--CA 1.495 1.791 0 O-C-N 121.673 -0.642 . . . . 0.0 109.399 179.145 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 74' ' ' PHE . . . . . . . . . . . . . 28.6 t80 -60.07 -44.62 94.63 Favored 'General case' 0 N--CA 1.498 1.945 0 O-C-N 120.957 -1.09 . . . . 0.0 109.784 179.61 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 75' ' ' ASP . . . . . . . . . . . . . 31.4 t70 -62.71 -48.03 81.02 Favored 'General case' 0 N--CA 1.496 1.864 0 O-C-N 121.543 -0.723 . . . . 0.0 110.287 179.32 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 76' ' ' GLU . . . . . . . . . . . . . 54.0 mt-10 -66.92 -32.67 74.07 Favored 'General case' 0 N--CA 1.498 1.933 0 O-C-N 121.444 -0.785 . . . . 0.0 109.656 179.342 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 77' ' ' PHE . . . . . . . . . . . . . 68.3 t80 -60.74 -39.16 87.64 Favored 'General case' 0 N--CA 1.493 1.708 0 O-C-N 121.513 -0.742 . . . . 0.0 109.44 178.642 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 78' ' ' LEU . . . . . . . . . . . . . 88.9 mt -63.77 -37.94 89.26 Favored 'General case' 0 N--CA 1.498 1.942 0 O-C-N 121.432 -0.792 . . . . 0.0 109.46 178.736 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 79' ' ' VAL . . . . . 0.501 ' HA ' HG23 ' A' ' 9' ' ' VAL . 85.0 t -64.17 -34.74 70.81 Favored 'Isoleucine or valine' 0 N--CA 1.499 2.014 0 O-C-N 121.36 -0.838 . . . . 0.0 109.13 178.405 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 80' ' ' MET . . . . . . . . . . . . . 1.5 ttt -67.88 -39.48 83.69 Favored 'General case' 0 N--CA 1.496 1.842 0 O-C-N 121.552 -0.718 . . . . 0.0 109.53 178.835 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 81' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -65.95 -50.23 65.12 Favored 'General case' 0 N--CA 1.497 1.913 0 O-C-N 121.562 -0.711 . . . . 0.0 110.684 179.702 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 82' ' ' VAL . . . . . 0.495 ' HA ' ' HE1' ' A' ' 85' ' ' MET . 9.4 p -62.19 -30.02 47.9 Favored 'Isoleucine or valine' 0 N--CA 1.5 2.035 0 O-C-N 121.25 -0.906 . . . . 0.0 110.189 179.774 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 83' ' ' ARG . . . . . . . . . . . . . 3.2 mtp-105 -69.24 -46.48 67.21 Favored 'General case' 0 N--CA 1.495 1.78 0 O-C-N 121.354 -0.842 . . . . 0.0 109.392 178.724 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 84' ' ' CYS . . . . . . . . . . . . . 88.6 m -66.92 -32.78 74.27 Favored 'General case' 0 N--CA 1.497 1.906 0 O-C-N 121.61 -0.681 . . . . 0.0 110.155 179.254 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 85' ' ' MET . . . . . 0.495 ' HE1' ' HA ' ' A' ' 82' ' ' VAL . 32.2 mtm . . . . . 0 N--CA 1.5 2.033 0 O-C-N 121.453 -0.779 . . . . 0.0 110.249 179.216 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' B' B ' 149' ' ' SER . . . . . . . . . . . . . 27.5 m . . . . . 0 N--CA 1.498 1.965 0 CA-C-O 121.252 0.548 . . . . 0.0 110.772 . . . . . . . . . 0 0 . 1 . 005 nuclear orig core ' B' B ' 150' ' ' ALA . . . . . . . . . . . . . . . -60.47 -50.76 72.29 Favored 'General case' 0 N--CA 1.498 1.958 0 O-C-N 121.573 -0.704 . . . . 0.0 110.549 179.909 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' B' B ' 151' ' ' ASP . . . . . . . . . . . . . 7.5 p-10 -61.54 -34.79 76.16 Favored 'General case' 0 N--CA 1.5 2.029 0 O-C-N 121.453 -0.779 . . . . 0.0 110.68 179.771 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' B' B ' 152' ' ' ALA . . . . . . . . . . . . . . . -68.06 -54.4 18.55 Favored 'General case' 0 N--CA 1.497 1.878 0 O-C-N 121.316 -0.865 . . . . 0.0 110.44 179.995 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' B' B ' 153' ' ' MET . . . . . . . . . . . . . 1.1 tpt -66.16 -31.04 71.65 Favored 'General case' 0 N--CA 1.499 1.991 0 O-C-N 121.317 -0.865 . . . . 0.0 110.346 179.597 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' B' B ' 154' ' ' MET . . . . . 0.436 ' HE2' HD11 ' B' ' 158' ' ' LEU . 0.0 OUTLIER -64.12 -41.21 97.31 Favored 'General case' 0 N--CA 1.499 2.009 0 O-C-N 121.348 -0.845 . . . . 0.0 110.326 179.486 . . . . . . . . 3 3 . 1 . 005 nuclear orig core ' B' B ' 155' ' ' GLN . . . . . . . . . . . . . 33.6 mt-30 -77.94 -31.75 51.16 Favored 'General case' 0 N--CA 1.499 1.98 0 O-C-N 121.346 -0.846 . . . . 0.0 110.83 179.878 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' B' B ' 156' ' ' ALA . . . . . . . . . . . . . . . -54.93 -45.85 74.87 Favored 'General case' 0 N--CA 1.501 2.11 0 O-C-N 121.386 -0.821 . . . . 0.0 110.959 -179.683 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' B' B ' 157' ' ' LEU . . . . . 0.437 HD11 ' CD2' ' A' ' 27' ' ' PHE . 1.2 tp -80.35 -46.35 16.22 Favored 'General case' 0 N--CA 1.496 1.83 0 O-C-N 121.173 -0.955 . . . . 0.0 110.208 179.71 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' B' B ' 158' ' ' LEU . . . . . 0.436 HD11 ' HE2' ' B' ' 154' ' ' MET . 1.1 mp . . . . . 0 N--CA 1.495 1.816 0 O-C-N 121.34 -0.85 . . . . 0.0 109.308 179.207 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 4' ' ' ILE . . . . . . . . . . . . . 1.1 tp . . . . . 0 N--CA 1.499 2.023 0 CA-C-O 120.595 0.236 . . . . 0.0 111.107 . . . . . . . . . 0 0 . 1 . 006 nuclear orig core ' A' A ' 5' ' ' TYR . . . . . 0.535 ' CD2' ' HG2' ' A' ' 83' ' ' ARG . 27.2 m-85 -78.84 -34.03 45.47 Favored 'General case' 0 N--CA 1.497 1.885 0 O-C-N 121.037 -1.039 . . . . 0.0 109.781 179.615 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 11.7 ttpp -61.03 -43.54 98.73 Favored 'General case' 0 N--CA 1.493 1.722 0 O-C-N 121.564 -0.71 . . . . 0.0 109.929 179.159 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 7' ' ' ALA . . . . . . . . . . . . . . . -55.31 -38.94 69.33 Favored 'General case' 0 N--CA 1.5 2.075 0 O-C-N 121.47 -0.769 . . . . 0.0 110.083 179.325 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 8' ' ' ALA . . . . . . . . . . . . . . . -61.0 -39.1 88.42 Favored 'General case' 0 N--CA 1.497 1.915 0 O-C-N 121.481 -0.762 . . . . 0.0 109.614 178.91 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 9' ' ' VAL . . . . . 0.417 ' CG2' ' HA ' ' A' ' 79' ' ' VAL . 59.1 t -64.27 -39.11 84.35 Favored 'Isoleucine or valine' 0 N--CA 1.499 2.0 0 O-C-N 121.532 -0.73 . . . . 0.0 109.288 178.784 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 10' ' ' GLU . . . . . . . . . . . . . 3.4 mt-10 -64.98 -29.07 69.97 Favored 'General case' 0 N--CA 1.5 2.041 0 O-C-N 121.459 -0.776 . . . . 0.0 109.769 178.675 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 11' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -82.62 -19.05 39.09 Favored 'General case' 0 N--CA 1.498 1.972 0 O-C-N 121.445 -0.784 . . . . 0.0 110.69 179.417 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 12' ' ' LEU . . . . . 0.406 ' CD1' ' HA ' ' A' ' 9' ' ' VAL . 18.3 mt -62.99 116.14 5.05 Favored 'General case' 0 N--CA 1.497 1.887 0 O-C-N 121.255 -0.903 . . . . 0.0 110.057 179.857 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 13' ' ' THR . . . . . . . . . . . . . 71.3 p -74.62 167.49 21.66 Favored 'General case' 0 N--CA 1.497 1.902 0 O-C-N 121.297 -0.877 . . . . 0.0 109.888 179.75 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 14' ' ' GLU . . . . . . . . . . . . . 9.7 tp10 -58.23 -34.71 70.73 Favored 'General case' 0 N--CA 1.492 1.671 0 O-C-N 121.588 -0.695 . . . . 0.0 110.643 -179.421 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 17.9 tt0 -59.32 -46.39 88.7 Favored 'General case' 0 N--CA 1.498 1.968 0 O-C-N 121.338 -0.851 . . . . 0.0 109.44 178.981 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 16' ' ' GLN . . . . . . . . . . . . . 3.2 mt-30 -65.15 -37.58 87.87 Favored 'General case' 0 N--CA 1.498 1.949 0 O-C-N 121.531 -0.73 . . . . 0.0 109.871 178.826 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 17' ' ' LYS . . . . . . . . . . . . . 15.8 mtmt -60.58 -40.3 91.22 Favored 'General case' 0 N--CA 1.497 1.882 0 N-CA-C 109.163 -0.68 . . . . 0.0 109.163 178.795 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 18' ' ' ASN . . . . . 0.433 ' HA ' ' HB3' ' A' ' 21' ' ' LYS . 8.2 t30 -64.9 -39.32 93.34 Favored 'General case' 0 N--CA 1.497 1.884 0 O-C-N 121.588 -0.695 . . . . 0.0 109.894 179.107 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 14.9 mt-10 -57.49 -42.49 82.8 Favored 'General case' 0 N--CA 1.499 1.988 0 O-C-N 121.46 -0.775 . . . . 0.0 109.224 178.862 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 20' ' ' PHE . . . . . . . . . . . . . 3.8 m-85 -75.5 -30.11 59.74 Favored 'General case' 0 N--CA 1.494 1.76 0 O-C-N 121.581 -0.699 . . . . 0.0 109.49 178.543 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 21' ' ' LYS . . . . . 0.441 ' HG3' ' N ' ' A' ' 22' ' ' ALA . 0.0 OUTLIER -57.43 -32.55 67.01 Favored 'General case' 0 N--CA 1.498 1.965 0 O-C-N 121.58 -0.7 . . . . 0.0 109.638 179.042 . . . . . . . . 3 3 . 1 . 006 nuclear orig core ' A' A ' 22' ' ' ALA . . . . . 0.441 ' N ' ' HG3' ' A' ' 21' ' ' LYS . . . -58.3 -52.98 63.3 Favored 'General case' 0 N--CA 1.497 1.876 0 O-C-N 121.394 -0.816 . . . . 0.0 109.408 178.787 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 23' ' ' ALA . . . . . . . . . . . . . . . -68.89 -35.88 77.38 Favored 'General case' 0 N--CA 1.496 1.865 0 O-C-N 121.602 -0.687 . . . . 0.0 109.548 178.622 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 24' ' ' PHE . . . . . . . . . . . . . 70.8 t80 -61.58 -51.06 70.09 Favored 'General case' 0 N--CA 1.497 1.911 0 O-C-N 121.721 -0.612 . . . . 0.0 110.404 179.446 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 25' ' ' ASP . . . . . . . . . . . . . 0.7 OUTLIER -62.33 -44.91 95.4 Favored 'General case' 0 N--CA 1.498 1.964 0 O-C-N 121.562 -0.711 . . . . 0.0 110.241 179.812 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 26' ' ' ILE . . . . . 0.531 HG23 HD12 ' A' ' 29' ' ' LEU . 22.1 mt -65.84 -29.53 47.22 Favored 'Isoleucine or valine' 0 N--CA 1.498 1.947 0 O-C-N 121.268 -0.895 . . . . 0.0 109.68 179.009 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 27' ' ' PHE . . . . . 0.405 ' HZ ' ' SD ' ' B' ' 153' ' ' MET . 0.1 OUTLIER -62.14 -42.58 99.39 Favored 'General case' 0 N--CA 1.498 1.945 0 O-C-N 121.372 -0.83 . . . . 0.0 110.13 179.033 . . . . . . . . 3 3 . 1 . 006 nuclear orig core ' A' A ' 28' ' ' VAL . . . . . 0.452 ' HA ' ' HB2' ' A' ' 31' ' ' ALA . 34.0 m -88.24 37.01 0.07 OUTLIER 'Isoleucine or valine' 0 N--CA 1.5 2.046 0 O-C-N 121.29 -0.881 . . . . 0.0 111.137 -179.846 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 29' ' ' LEU . . . . . 0.531 HD12 HG23 ' A' ' 26' ' ' ILE . 2.7 mt -74.17 -44.89 51.77 Favored 'General case' 0 N--CA 1.498 1.957 0 O-C-N 120.954 -1.091 . . . . 0.0 109.58 178.944 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 30' ' ' GLY . . . . . . . . . . . . . . . -110.46 30.3 8.32 Favored Glycine 0 N--CA 1.494 2.533 0 N-CA-C 109.381 -1.488 . . . . 0.0 109.381 179.071 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 31' ' ' ALA . . . . . 0.452 ' HB2' ' HA ' ' A' ' 28' ' ' VAL . . . . . . . . 0 N--CA 1.497 1.901 0 O-C-N 121.363 -1.081 . . . . 0.0 110.585 -179.884 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 35' ' ' CYS . . . . . 0.403 ' SG ' ' HB ' ' A' ' 71' ' ' THR . 30.3 p . . . . . 0 N--CA 1.499 1.989 0 N-CA-C 109.807 -0.442 . . . . 0.0 109.807 . . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 36' ' ' ILE . . . . . 0.622 ' HA ' ' HG2' ' A' ' 40' ' ' GLU . 4.2 mt -81.15 104.07 9.13 Favored 'Isoleucine or valine' 0 N--CA 1.497 1.916 0 O-C-N 120.94 -1.1 . . . . 0.0 110.207 179.833 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 37' ' ' SER . . . . . . . . . . . . . 0.9 OUTLIER -107.95 -170.54 1.7 Allowed 'General case' 0 N--CA 1.494 1.752 0 O-C-N 121.644 -0.66 . . . . 0.0 110.014 179.758 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 38' ' ' THR . . . . . . . . . . . . . 23.9 p -63.45 -37.7 88.3 Favored 'General case' 0 N--CA 1.502 2.175 0 O-C-N 121.23 -0.919 . . . . 0.0 110.54 179.726 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 39' ' ' LYS . . . . . . . . . . . . . 9.8 mtmt -63.47 -47.39 82.01 Favored 'General case' 0 N--CA 1.5 2.032 0 O-C-N 121.557 -0.714 . . . . 0.0 111.173 -179.77 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 40' ' ' GLU . . . . . 0.622 ' HG2' ' HA ' ' A' ' 36' ' ' ILE . 0.0 OUTLIER -60.49 -33.66 72.93 Favored 'General case' 0 N--CA 1.502 2.133 0 O-C-N 121.391 -0.818 . . . . 0.0 111.529 -179.074 . . . . . . . . 3 3 . 1 . 006 nuclear orig core ' A' A ' 41' ' ' LEU . . . . . 0.678 HD13 ' HG ' ' A' ' 57' ' ' LEU . 3.1 tm? -69.36 -66.73 0.55 Allowed 'General case' 0 N--CA 1.495 1.782 0 O-C-N 121.32 -0.863 . . . . 0.0 110.18 -179.771 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 42' ' ' GLY . . . . . . . . . . . . . . . -44.84 -42.42 7.77 Favored Glycine 0 N--CA 1.5 2.934 0 N-CA-C 110.61 -0.996 . . . . 0.0 110.61 -179.729 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 43' ' ' LYS . . . . . . . . . . . . . 5.1 mttm -56.96 -49.9 74.28 Favored 'General case' 0 N--CA 1.501 2.077 0 O-C-N 121.476 -1.014 . . . . 0.0 110.348 179.617 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 44' ' ' VAL . . . . . . . . . . . . . 21.3 t -67.42 -36.32 76.11 Favored 'Isoleucine or valine' 0 N--CA 1.5 2.07 0 O-C-N 121.334 -0.854 . . . . 0.0 110.179 179.221 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 45' ' ' MET . . . . . 0.483 ' HG3' HD12 ' A' ' 41' ' ' LEU . 1.2 mtt -63.11 -32.34 73.7 Favored 'General case' 0 N--CA 1.499 2.006 0 O-C-N 121.472 -0.767 . . . . 0.0 111.21 -179.89 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 46' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -47.92 -41.64 25.14 Favored 'General case' 0 N--CA 1.503 2.179 0 O-C-N 121.212 -0.93 . . . . 0.0 111.365 -179.786 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 47' ' ' MET . . . . . . . . . . . . . 13.3 ptt? -90.66 -27.69 18.86 Favored 'General case' 0 N--CA 1.5 2.041 0 O-C-N 121.162 -0.961 . . . . 0.0 110.395 179.384 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 48' ' ' LEU . . . . . . . . . . . . . 14.6 tp -128.86 87.45 2.57 Favored 'General case' 0 N--CA 1.492 1.654 0 O-C-N 121.367 -0.833 . . . . 0.0 109.236 179.423 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 49' ' ' GLY . . . . . . . . . . . . . . . 93.53 70.34 1.12 Allowed Glycine 0 N--CA 1.497 2.758 0 N-CA-C 108.504 -1.838 . . . . 0.0 108.504 -178.767 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 50' ' ' GLN . . . . . . . . . . . . . 3.2 mm-40 -36.93 136.41 0.39 Allowed 'General case' 0 N--CA 1.504 2.272 0 CA-C-O 121.574 0.702 . . . . 0.0 112.865 -178.518 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 51' ' ' ASN . . . . . . . . . . . . . 37.2 t30 -100.75 116.28 64.34 Favored Pre-proline 0 N--CA 1.493 1.725 0 O-C-N 121.843 -0.536 . . . . 0.0 110.048 179.353 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 52' ' ' PRO . . . . . . . . . . . . . 42.8 Cg_endo -73.26 -64.31 0.03 OUTLIER 'Trans proline' 0 C--N 1.311 -1.407 0 O-C-N 123.928 1.488 . . . . 0.0 111.705 -179.829 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 53' ' ' THR . . . . . . . . . . . . . 1.0 OUTLIER -118.25 152.64 50.92 Favored Pre-proline 0 N--CA 1.498 1.964 0 O-C-N 121.111 -0.993 . . . . 0.0 110.942 -179.252 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 54' ' ' PRO . . . . . . . . . . . . . 45.0 Cg_endo -71.69 -37.2 5.51 Favored 'Trans proline' 0 N--CA 1.492 1.401 0 O-C-N 123.941 1.495 . . . . 0.0 111.267 179.983 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 55' ' ' GLU . . . . . . . . . . . . . 2.5 mp0 -62.8 -32.3 73.45 Favored 'General case' 0 N--CA 1.5 2.03 0 O-C-N 121.374 -0.829 . . . . 0.0 110.732 -179.895 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 2.5 tt0 -51.9 -40.25 60.38 Favored 'General case' 0 N--CA 1.499 2.023 0 O-C-N 121.604 -0.685 . . . . 0.0 111.117 -179.997 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 57' ' ' LEU . . . . . 0.678 ' HG ' HD13 ' A' ' 41' ' ' LEU . 0.4 OUTLIER -73.62 -31.51 63.58 Favored 'General case' 0 N--CA 1.499 2.016 0 O-C-N 121.082 -1.012 . . . . 0.0 110.153 179.778 . . . . . . . . 3 3 . 1 . 006 nuclear orig core ' A' A ' 58' ' ' GLN . . . . . 0.443 ' O ' HG23 ' A' ' 61' ' ' ILE . 0.0 OUTLIER -58.08 -44.19 87.43 Favored 'General case' 0 N--CA 1.496 1.842 0 O-C-N 121.191 -0.943 . . . . 0.0 108.465 178.951 . . . . . . . . 3 3 . 1 . 006 nuclear orig core ' A' A ' 59' ' ' GLU . . . . . . . . . . . . . 2.0 mp0 -61.12 -36.09 78.79 Favored 'General case' 0 N--CA 1.496 1.874 0 O-C-N 121.282 -0.887 . . . . 0.0 108.68 177.831 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 60' ' ' MET . . . . . . . . . . . . . 0.4 OUTLIER -62.61 -36.89 84.2 Favored 'General case' 0 N--CA 1.497 1.907 0 O-C-N 121.725 -0.609 . . . . 0.0 109.867 178.618 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 61' ' ' ILE . . . . . 0.443 HG23 ' O ' ' A' ' 58' ' ' GLN . 0.8 OUTLIER -83.77 -31.78 8.37 Favored 'Isoleucine or valine' 0 N--CA 1.498 1.946 0 O-C-N 121.41 -0.806 . . . . 0.0 111.039 -179.916 . . . . . . . . 3 3 . 1 . 006 nuclear orig core ' A' A ' 62' ' ' ASP . . . . . . . . . . . . . 2.7 m-20 -58.04 -47.57 82.72 Favored 'General case' 0 N--CA 1.5 2.065 0 O-C-N 121.289 -0.882 . . . . 0.0 111.233 -179.37 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 63' ' ' GLU . . . . . . . . . . . . . 0.9 OUTLIER -63.5 -36.21 83.02 Favored 'General case' 0 N--CA 1.5 2.028 0 O-C-N 121.274 -0.891 . . . . 0.0 110.799 -179.875 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 64' ' ' VAL . . . . . . . . . . . . . 84.4 t -84.36 -30.44 7.28 Favored 'Isoleucine or valine' 0 N--CA 1.498 1.944 0 O-C-N 121.33 -0.856 . . . . 0.0 111.465 -179.49 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 65' ' ' ASP . . . . . . . . . . . . . 16.9 t70 -133.72 137.78 45.44 Favored 'General case' 0 N--CA 1.497 1.885 0 O-C-N 121.006 -1.058 . . . . 0.0 111.76 -179.368 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 66' ' ' GLU . . . . . . . . . . . . . 0.3 OUTLIER -148.17 45.39 1.07 Allowed 'General case' 0 N--CA 1.495 1.796 0 CA-C-O 121.573 0.701 . . . . 0.0 109.245 178.694 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 67' ' ' ASP . . . . . . . . . . . . . 12.7 p-10 -102.78 13.18 35.03 Favored 'General case' 0 N--CA 1.499 1.992 0 O-C-N 121.448 -0.783 . . . . 0.0 111.567 -179.359 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 68' ' ' GLY . . . . . . . . . . . . . . . 107.79 -51.55 0.71 Allowed Glycine 0 N--CA 1.496 2.657 0 C-N-CA 120.039 -1.077 . . . . 0.0 110.497 179.422 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 69' ' ' SER . . . . . . . . . . . . . 82.3 p -64.07 -55.78 19.68 Favored 'General case' 0 N--CA 1.501 2.11 0 O-C-N 121.241 -1.152 . . . . 0.0 110.876 -179.418 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 70' ' ' GLY . . . . . . . . . . . . . . . 89.75 34.74 8.2 Favored Glycine 0 N--CA 1.495 2.595 0 N-CA-C 108.326 -1.91 . . . . 0.0 108.326 -179.283 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 71' ' ' THR . . . . . 0.419 ' HA ' HD12 ' A' ' 61' ' ' ILE . 3.1 p -131.0 143.03 50.41 Favored 'General case' 0 N--CA 1.489 1.49 0 O-C-N 122.029 -0.689 . . . . 0.0 109.694 -179.29 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 72' ' ' VAL . . . . . 0.503 HG13 ' HE3' ' A' ' 80' ' ' MET . 93.3 t -75.59 107.37 6.32 Favored 'Isoleucine or valine' 0 N--CA 1.496 1.87 0 O-C-N 121.545 -0.722 . . . . 0.0 110.598 -179.724 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 73' ' ' ASP . . . . . . . . . . . . . 1.1 m-20 -75.25 -175.34 2.66 Favored 'General case' 0 N--CA 1.497 1.913 0 O-C-N 121.415 -0.803 . . . . 0.0 110.244 179.601 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 74' ' ' PHE . . . . . . . . . . . . . 39.0 t80 -65.16 -58.09 6.88 Favored 'General case' 0 N--CA 1.499 2.002 0 O-C-N 121.194 -0.941 . . . . 0.0 109.779 179.951 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 75' ' ' ASP . . . . . 0.482 ' HA ' HD12 ' A' ' 78' ' ' LEU . 0.5 OUTLIER -65.79 -34.64 78.65 Favored 'General case' 0 N--CA 1.495 1.783 0 O-C-N 121.553 -0.717 . . . . 0.0 109.86 179.174 . . . . . . . . 3 3 . 1 . 006 nuclear orig core ' A' A ' 76' ' ' GLU . . . . . . . . . . . . . 19.3 mt-10 -63.67 -40.42 96.78 Favored 'General case' 0 N--CA 1.497 1.903 0 O-C-N 121.451 -0.78 . . . . 0.0 109.502 178.715 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 77' ' ' PHE . . . . . . . . . . . . . 57.6 t80 -56.86 -40.46 76.17 Favored 'General case' 0 N--CA 1.498 1.972 0 O-C-N 121.621 -0.674 . . . . 0.0 110.541 179.48 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 78' ' ' LEU . . . . . 0.482 HD12 ' HA ' ' A' ' 75' ' ' ASP . 27.2 mt -55.45 -40.5 71.65 Favored 'General case' 0 N--CA 1.502 2.16 0 O-C-N 121.463 -0.773 . . . . 0.0 110.63 179.831 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 79' ' ' VAL . . . . . 0.417 ' HA ' ' CG2' ' A' ' 9' ' ' VAL . 77.8 t -62.5 -34.85 67.0 Favored 'Isoleucine or valine' 0 N--CA 1.502 2.125 0 O-C-N 121.497 -0.752 . . . . 0.0 110.033 179.496 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 80' ' ' MET . . . . . 0.503 ' HE3' HG13 ' A' ' 72' ' ' VAL . 18.9 ttp -73.58 -35.27 65.4 Favored 'General case' 0 N--CA 1.494 1.732 0 O-C-N 121.342 -0.849 . . . . 0.0 110.305 179.539 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 81' ' ' MET . . . . . . . . . . . . . 12.0 mmm -66.62 -46.76 74.8 Favored 'General case' 0 N--CA 1.499 1.979 0 O-C-N 121.424 -0.798 . . . . 0.0 110.715 -179.719 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 82' ' ' VAL . . . . . . . . . . . . . 33.2 m -62.81 -32.64 56.5 Favored 'Isoleucine or valine' 0 N--CA 1.504 2.243 0 O-C-N 121.128 -0.983 . . . . 0.0 110.441 179.88 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 83' ' ' ARG . . . . . 0.535 ' HG2' ' CD2' ' A' ' 5' ' ' TYR . 69.8 mtt180 -66.84 -34.52 77.99 Favored 'General case' 0 N--CA 1.497 1.908 0 O-C-N 121.38 -0.825 . . . . 0.0 109.835 179.132 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 84' ' ' CYS . . . . . . . . . . . . . 79.5 m -77.41 -28.93 52.81 Favored 'General case' 0 N--CA 1.496 1.856 0 O-C-N 121.502 -0.749 . . . . 0.0 109.983 178.914 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 85' ' ' MET . . . . . . . . . . . . . 42.0 mtm . . . . . 0 N--CA 1.497 1.903 0 O-C-N 121.582 -0.699 . . . . 0.0 110.76 179.838 . . . . . . . . 0 0 . 1 . 006 nuclear orig core ' B' B ' 149' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER . . . . . 0 N--CA 1.505 2.315 0 CA-C-O 121.41 0.624 . . . . 0.0 111.154 . . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 150' ' ' ALA . . . . . . . . . . . . . . . -55.29 -42.76 74.08 Favored 'General case' 0 N--CA 1.501 2.118 0 O-C-N 121.412 -0.805 . . . . 0.0 110.824 179.955 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 151' ' ' ASP . . . . . . . . . . . . . 4.2 p-10 -53.92 -39.33 65.74 Favored 'General case' 0 N--CA 1.502 2.135 0 O-C-N 121.613 -0.679 . . . . 0.0 110.741 179.743 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 152' ' ' ALA . . . . . . . . . . . . . . . -87.14 -40.1 14.93 Favored 'General case' 0 N--CA 1.496 1.833 0 O-C-N 121.365 -0.834 . . . . 0.0 110.318 179.555 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 153' ' ' MET . . . . . 0.405 ' SD ' ' HZ ' ' A' ' 27' ' ' PHE . 5.7 ttt -60.09 -44.9 94.46 Favored 'General case' 0 N--CA 1.498 1.971 0 O-C-N 121.484 -0.76 . . . . 0.0 110.627 179.875 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' B' B ' 154' ' ' MET . . . . . . . . . . . . . 19.7 ttt -62.46 -43.63 98.34 Favored 'General case' 0 N--CA 1.497 1.917 0 O-C-N 121.474 -0.766 . . . . 0.0 110.428 179.773 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 155' ' ' GLN . . . . . . . . . . . . . 0.6 OUTLIER -65.42 -43.07 91.7 Favored 'General case' 0 N--CA 1.499 2.005 0 O-C-N 121.522 -0.737 . . . . 0.0 110.587 179.771 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' B' B ' 156' ' ' ALA . . . . . . . . . . . . . . . -63.43 -34.86 78.68 Favored 'General case' 0 N--CA 1.499 1.983 0 O-C-N 121.336 -0.853 . . . . 0.0 110.587 179.817 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 157' ' ' LEU . . . . . 0.463 HD22 HG21 ' A' ' 26' ' ' ILE . 24.8 tp -80.83 -49.46 11.05 Favored 'General case' 0 N--CA 1.495 1.809 0 O-C-N 121.301 -0.875 . . . . 0.0 110.611 179.849 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' B' B ' 158' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER . . . . . 0 N--CA 1.499 2.009 0 O-C-N 121.287 -0.883 . . . . 0.0 110.069 179.825 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 4' ' ' ILE . . . . . . . . . . . . . 5.3 mt . . . . . 0 N--CA 1.493 1.682 0 N-CA-C 109.294 -0.632 . . . . 0.0 109.294 . . . . . . . . . 0 0 . 1 . 007 nuclear orig core ' A' A ' 5' ' ' TYR . . . . . . . . . . . . . 39.7 m-85 -68.77 -36.53 78.44 Favored 'General case' 0 N--CA 1.494 1.758 0 O-C-N 121.605 -0.684 . . . . 0.0 109.454 178.896 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 6' ' ' LYS . . . . . 0.451 ' O ' ' HB ' ' A' ' 9' ' ' VAL . 0.3 OUTLIER -64.99 -42.7 94.28 Favored 'General case' 0 N--CA 1.496 1.846 0 O-C-N 121.451 -0.78 . . . . 0.0 109.031 178.483 . . . . . . . . 3 3 . 1 . 007 nuclear orig core ' A' A ' 7' ' ' ALA . . . . . . . . . . . . . . . -61.46 -35.99 79.18 Favored 'General case' 0 N--CA 1.496 1.868 0 O-C-N 121.464 -0.772 . . . . 0.0 109.338 178.306 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 8' ' ' ALA . . . . . . . . . . . . . . . -66.57 -26.39 67.1 Favored 'General case' 0 N--CA 1.498 1.938 0 O-C-N 121.497 -0.752 . . . . 0.0 110.232 179.03 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 9' ' ' VAL . . . . . 0.451 ' HB ' ' O ' ' A' ' 6' ' ' LYS . 57.1 t -59.51 -40.27 81.46 Favored 'Isoleucine or valine' 0 N--CA 1.498 1.963 0 O-C-N 121.301 -0.874 . . . . 0.0 109.416 179.036 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 10' ' ' GLU . . . . . . . . . . . . . 0.9 OUTLIER -61.69 -30.28 70.64 Favored 'General case' 0 N--CA 1.496 1.848 0 O-C-N 121.417 -0.802 . . . . 0.0 110.01 178.828 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 11' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -60.04 -33.81 72.55 Favored 'General case' 0 N--CA 1.5 2.035 0 O-C-N 121.407 -0.808 . . . . 0.0 109.388 178.406 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 12' ' ' LEU . . . . . 0.669 ' HB3' ' CB ' ' A' ' 16' ' ' GLN . 19.4 mt -67.62 -23.76 65.39 Favored 'General case' 0 N--CA 1.498 1.959 0 O-C-N 121.687 -0.633 . . . . 0.0 109.703 178.494 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 13' ' ' THR . . . . . . . . . . . . . 1.3 p 74.2 165.78 0.29 Allowed 'General case' 0 N--CA 1.51 2.555 0 C-N-CA 123.47 0.708 . . . . 0.0 110.86 -179.594 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 14' ' ' GLU . . . . . . . . . . . . . 1.1 tp10 -57.33 -30.63 64.96 Favored 'General case' 0 N--CA 1.494 1.751 0 O-C-N 121.645 -0.659 . . . . 0.0 110.779 -178.958 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER -57.53 -47.4 82.1 Favored 'General case' 0 N--CA 1.495 1.782 0 O-C-N 121.436 -0.79 . . . . 0.0 109.395 178.803 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 16' ' ' GLN . . . . . 0.669 ' CB ' ' HB3' ' A' ' 12' ' ' LEU . 27.3 mt-30 -72.79 -38.55 67.2 Favored 'General case' 0 N--CA 1.495 1.815 0 O-C-N 121.459 -0.776 . . . . 0.0 110.076 178.951 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 17' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -56.68 -45.99 81.39 Favored 'General case' 0 N--CA 1.498 1.943 0 N-CA-C 109.259 -0.645 . . . . 0.0 109.259 179.132 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 18' ' ' ASN . . . . . . . . . . . . . 21.2 m-80 -71.21 -36.48 71.91 Favored 'General case' 0 N--CA 1.494 1.766 0 O-C-N 121.603 -0.686 . . . . 0.0 109.249 178.281 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 15.2 mt-10 -62.24 -52.13 64.98 Favored 'General case' 0 N--CA 1.498 1.96 0 O-C-N 121.568 -0.707 . . . . 0.0 109.95 179.108 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 20' ' ' PHE . . . . . 0.463 ' CE1' ' HG2' ' A' ' 81' ' ' MET . 17.7 m-85 -62.51 -40.03 95.42 Favored 'General case' 0 N--CA 1.497 1.921 0 O-C-N 121.497 -0.752 . . . . 0.0 109.841 179.467 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 21' ' ' LYS . . . . . . . . . . . . . 13.8 tptt -59.1 -46.16 89.01 Favored 'General case' 0 N--CA 1.499 1.993 0 O-C-N 121.433 -0.792 . . . . 0.0 109.534 178.93 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 22' ' ' ALA . . . . . . . . . . . . . . . -68.74 -46.42 68.93 Favored 'General case' 0 N--CA 1.496 1.829 0 O-C-N 121.626 -0.671 . . . . 0.0 109.918 179.436 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 23' ' ' ALA . . . . . . . . . . . . . . . -62.53 -34.72 77.47 Favored 'General case' 0 N--CA 1.498 1.963 0 O-C-N 121.432 -0.792 . . . . 0.0 109.538 178.808 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 24' ' ' PHE . . . . . . . . . . . . . 65.5 t80 -60.39 -48.25 82.55 Favored 'General case' 0 N--CA 1.496 1.829 0 N-CA-C 109.138 -0.69 . . . . 0.0 109.138 178.839 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 25' ' ' ASP . . . . . . . . . . . . . 0.9 OUTLIER -64.36 -34.42 78.12 Favored 'General case' 0 N--CA 1.496 1.852 0 O-C-N 121.54 -0.725 . . . . 0.0 109.361 178.663 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 26' ' ' ILE . . . . . 0.466 HD13 ' CD1' ' A' ' 29' ' ' LEU . 15.9 mm -67.06 -34.69 71.4 Favored 'Isoleucine or valine' 0 N--CA 1.498 1.926 0 O-C-N 121.328 -0.857 . . . . 0.0 109.112 178.372 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 27' ' ' PHE . . . . . . . . . . . . . 0.2 OUTLIER -65.4 -34.52 78.5 Favored 'General case' 0 N--CA 1.498 1.966 0 O-C-N 121.569 -0.707 . . . . 0.0 110.587 179.366 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 28' ' ' VAL . . . . . 0.48 ' HA ' ' HB3' ' A' ' 31' ' ' ALA . 32.9 m -93.4 1.5 9.47 Favored 'Isoleucine or valine' 0 N--CA 1.502 2.142 0 O-C-N 121.283 -0.886 . . . . 0.0 112.064 -179.39 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 29' ' ' LEU . . . . . 0.466 ' CD1' HD13 ' A' ' 26' ' ' ILE . 2.3 mt -63.28 -45.92 89.19 Favored 'General case' 0 N--CA 1.501 2.089 0 O-C-N 120.821 -1.174 . . . . 0.0 109.688 179.33 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 30' ' ' GLY . . . . . . . . . . . . . . . -103.66 43.66 1.63 Allowed Glycine 0 N--CA 1.492 2.414 0 N-CA-C 108.561 -1.815 . . . . 0.0 108.561 178.643 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 31' ' ' ALA . . . . . 0.48 ' HB3' ' HA ' ' A' ' 28' ' ' VAL . . . . . . . . 0 N--CA 1.496 1.838 0 O-C-N 121.528 -0.984 . . . . 0.0 111.197 -179.18 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 35' ' ' CYS . . . . . . . . . . . . . 1.3 m . . . . . 0 N--CA 1.497 1.881 0 N-CA-C 109.965 -0.383 . . . . 0.0 109.965 . . . . . . . . . 0 0 . 1 . 007 nuclear orig core ' A' A ' 36' ' ' ILE . . . . . 0.446 HG13 ' CG1' ' A' ' 28' ' ' VAL . 96.6 mt -90.27 101.64 12.49 Favored 'Isoleucine or valine' 0 N--CA 1.496 1.829 0 O-C-N 121.117 -0.99 . . . . 0.0 110.57 -179.781 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 37' ' ' SER . . . . . . . . . . . . . 83.8 p -113.55 -179.36 3.62 Favored 'General case' 0 N--CA 1.494 1.733 0 N-CA-C 108.983 -0.747 . . . . 0.0 108.983 178.854 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 38' ' ' THR . . . . . 0.545 HG22 ' HG2' ' A' ' 58' ' ' GLN . 8.6 p -62.6 -41.18 98.82 Favored 'General case' 0 N--CA 1.5 2.041 0 O-C-N 120.963 -1.086 . . . . 0.0 110.056 179.515 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 39' ' ' LYS . . . . . 0.557 ' HA ' ' HB3' ' A' ' 54' ' ' PRO . 1.0 OUTLIER -60.94 -35.16 76.01 Favored 'General case' 0 N--CA 1.501 2.079 0 O-C-N 121.485 -0.759 . . . . 0.0 110.018 179.263 . . . . . . . . 3 3 . 1 . 007 nuclear orig core ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 1.1 tp10 -83.41 -39.2 20.93 Favored 'General case' 0 N--CA 1.493 1.709 0 O-C-N 121.507 -0.746 . . . . 0.0 109.636 179.041 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 41' ' ' LEU . . . . . 0.564 HD11 ' HG2' ' A' ' 45' ' ' MET . 9.1 tp -62.63 -49.0 76.91 Favored 'General case' 0 N--CA 1.498 1.957 0 O-C-N 121.623 -0.673 . . . . 0.0 110.588 179.72 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 42' ' ' GLY . . . . . 0.402 ' HA2' ' HB2' ' A' ' 45' ' ' MET . . . -54.36 -38.41 62.23 Favored Glycine 0 N--CA 1.494 2.549 0 N-CA-C 110.84 -0.904 . . . . 0.0 110.84 -179.038 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 43' ' ' LYS . . . . . . . . . . . . . 0.4 OUTLIER -54.49 -41.48 69.62 Favored 'General case' 0 N--CA 1.503 2.199 0 O-C-N 121.309 -1.112 . . . . 0.0 110.298 179.686 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 44' ' ' VAL . . . . . . . . . . . . . 44.0 t -83.08 -36.65 13.09 Favored 'Isoleucine or valine' 0 N--CA 1.499 2.014 0 O-C-N 121.349 -0.844 . . . . 0.0 109.876 179.21 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 45' ' ' MET . . . . . 0.663 ' HB3' ' HB2' ' A' ' 51' ' ' ASN . 69.4 mmm -61.91 -41.22 97.67 Favored 'General case' 0 N--CA 1.501 2.098 0 O-C-N 121.527 -0.733 . . . . 0.0 110.47 179.815 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 46' ' ' ARG . . . . . . . . . . . . . 8.9 tpt180 -67.34 -36.98 82.52 Favored 'General case' 0 N--CA 1.497 1.885 0 O-C-N 121.304 -0.872 . . . . 0.0 109.592 179.153 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 47' ' ' MET . . . . . . . . . . . . . 43.2 ttp -75.59 -1.97 26.99 Favored 'General case' 0 N--CA 1.499 1.977 0 O-C-N 121.559 -0.713 . . . . 0.0 110.46 178.704 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 48' ' ' LEU . . . . . . . . . . . . . 4.2 tp -119.66 -54.74 2.15 Favored 'General case' 0 N--CA 1.493 1.702 0 O-C-N 121.024 -1.048 . . . . 0.0 109.728 179.95 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 49' ' ' GLY . . . . . . . . . . . . . . . -114.04 -116.62 3.25 Favored Glycine 0 N--CA 1.494 2.515 0 N-CA-C 109.221 -1.552 . . . . 0.0 109.221 179.426 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 50' ' ' GLN . . . . . 0.499 ' O ' ' HD3' ' A' ' 52' ' ' PRO . 0.8 OUTLIER -139.11 13.68 2.63 Favored 'General case' 0 N--CA 1.5 2.067 0 O-C-N 121.375 -1.074 . . . . 0.0 111.933 -179.866 . . . . . . . . 3 3 . 1 . 007 nuclear orig core ' A' A ' 51' ' ' ASN . . . . . 0.663 ' HB2' ' HB3' ' A' ' 45' ' ' MET . 8.2 m120 -78.0 108.88 8.35 Favored Pre-proline 0 N--CA 1.505 2.291 0 O-C-N 121.02 -1.05 . . . . 0.0 109.633 179.897 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 52' ' ' PRO . . . . . 0.499 ' HD3' ' O ' ' A' ' 50' ' ' GLN . 45.2 Cg_endo -93.15 -73.6 0.0 OUTLIER 'Trans proline' 0 C--N 1.313 -1.292 0 C-N-CA 121.728 1.619 . . . . 0.0 112.627 -177.983 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 53' ' ' THR . . . . . . . . . . . . . 11.7 p -67.9 142.55 95.61 Favored Pre-proline 0 N--CA 1.499 1.986 0 O-C-N 121.311 -0.868 . . . . 0.0 111.599 -178.298 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 54' ' ' PRO . . . . . 0.557 ' HB3' ' HA ' ' A' ' 39' ' ' LYS . 43.4 Cg_endo -67.41 -32.81 31.38 Favored 'Trans proline' 0 N--CA 1.491 1.359 0 O-C-N 124.285 1.676 . . . . 0.0 110.893 179.577 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 55' ' ' GLU . . . . . . . . . . . . . 1.6 mp0 -57.92 -31.95 67.29 Favored 'General case' 0 N--CA 1.502 2.144 0 O-C-N 121.4 -0.813 . . . . 0.0 109.988 179.508 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 1.0 OUTLIER -62.8 -38.48 90.86 Favored 'General case' 0 N--CA 1.496 1.874 0 O-C-N 121.543 -0.723 . . . . 0.0 110.13 179.408 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 57' ' ' LEU . . . . . 0.403 HD13 ' CE ' ' A' ' 60' ' ' MET . 0.5 OUTLIER -87.5 -12.55 45.6 Favored 'General case' 0 N--CA 1.495 1.801 0 O-C-N 121.291 -0.88 . . . . 0.0 110.66 179.624 . . . . . . . . 3 3 . 1 . 007 nuclear orig core ' A' A ' 58' ' ' GLN . . . . . 0.561 ' O ' HG23 ' A' ' 61' ' ' ILE . 0.0 OUTLIER -56.27 -38.09 70.68 Favored 'General case' 0 N--CA 1.502 2.154 0 O-C-N 121.218 -0.926 . . . . 0.0 110.55 179.838 . . . . . . . . 3 3 . 1 . 007 nuclear orig core ' A' A ' 59' ' ' GLU . . . . . . . . . . . . . 0.9 OUTLIER -58.95 -32.16 69.36 Favored 'General case' 0 N--CA 1.498 1.951 0 O-C-N 121.018 -1.052 . . . . 0.0 109.439 178.82 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 60' ' ' MET . . . . . 0.403 ' CE ' HD13 ' A' ' 57' ' ' LEU . 40.7 mtm -78.41 -47.47 17.51 Favored 'General case' 0 N--CA 1.495 1.786 0 O-C-N 121.586 -0.696 . . . . 0.0 110.244 179.03 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 61' ' ' ILE . . . . . 0.561 HG23 ' O ' ' A' ' 58' ' ' GLN . 11.0 tt -62.36 -41.57 92.21 Favored 'Isoleucine or valine' 0 N--CA 1.501 2.108 0 O-C-N 121.219 -0.926 . . . . 0.0 110.39 179.812 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 62' ' ' ASP . . . . . . . . . . . . . 0.8 OUTLIER -64.77 -36.3 83.88 Favored 'General case' 0 N--CA 1.499 2.015 0 O-C-N 121.249 -0.907 . . . . 0.0 110.159 179.286 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 63' ' ' GLU . . . . . . . . . . . . . 3.1 tt0 -63.0 -28.56 70.18 Favored 'General case' 0 N--CA 1.498 1.954 0 O-C-N 121.48 -0.762 . . . . 0.0 110.435 179.196 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 64' ' ' VAL . . . . . . . . . . . . . 4.0 t -114.95 25.85 4.03 Favored 'Isoleucine or valine' 0 N--CA 1.498 1.971 0 O-C-N 121.203 -0.936 . . . . 0.0 110.567 179.838 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 65' ' ' ASP . . . . . 0.476 ' HB2' ' O ' ' A' ' 61' ' ' ILE . 16.9 t70 -110.64 -73.9 0.67 Allowed 'General case' 0 N--CA 1.5 2.03 0 O-C-N 120.966 -1.084 . . . . 0.0 110.551 179.973 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 66' ' ' GLU . . . . . . . . . . . . . 7.7 tt0 57.92 23.31 9.67 Favored 'General case' 0 N--CA 1.501 2.109 0 O-C-N 121.607 -0.683 . . . . 0.0 110.86 -179.396 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 67' ' ' ASP . . . . . . . . . . . . . 64.9 m-20 -111.85 5.29 18.9 Favored 'General case' 0 N--CA 1.496 1.853 0 O-C-N 121.257 -0.902 . . . . 0.0 110.948 179.669 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 68' ' ' GLY . . . . . . . . . . . . . . . 63.49 38.06 95.74 Favored Glycine 0 N--CA 1.495 2.599 0 N-CA-C 108.703 -1.759 . . . . 0.0 108.703 -178.931 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 69' ' ' SER . . . . . . . . . . . . . 71.0 p -139.11 -53.53 0.57 Allowed 'General case' 0 N--CA 1.495 1.8 0 O-C-N 121.626 -0.926 . . . . 0.0 110.73 -179.1 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 70' ' ' GLY . . . . . . . . . . . . . . . 90.25 45.35 4.43 Favored Glycine 0 N--CA 1.497 2.738 0 N-CA-C 108.639 -1.785 . . . . 0.0 108.639 -179.308 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 71' ' ' THR . . . . . . . . . . . . . 0.9 OUTLIER -140.44 126.1 19.17 Favored 'General case' 0 N--CA 1.493 1.72 0 O-C-N 121.861 -0.788 . . . . 0.0 109.993 -179.154 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 72' ' ' VAL . . . . . 0.449 ' CG2' HG13 ' A' ' 61' ' ' ILE . 53.9 t -80.66 105.88 11.06 Favored 'Isoleucine or valine' 0 N--CA 1.497 1.879 0 O-C-N 121.535 -0.728 . . . . 0.0 110.567 -179.98 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 73' ' ' ASP . . . . . . . . . . . . . 1.1 t70 -85.29 -162.9 0.76 Allowed 'General case' 0 N--CA 1.495 1.799 0 O-C-N 121.366 -0.834 . . . . 0.0 109.854 179.287 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 74' ' ' PHE . . . . . . . . . . . . . 25.7 t80 -64.91 -50.86 64.84 Favored 'General case' 0 N--CA 1.499 1.988 0 O-C-N 121.085 -1.009 . . . . 0.0 110.278 -179.917 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 75' ' ' ASP . . . . . . . . . . . . . 25.0 t70 -60.19 -49.61 76.93 Favored 'General case' 0 N--CA 1.497 1.902 0 O-C-N 121.543 -0.723 . . . . 0.0 109.947 179.31 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 76' ' ' GLU . . . . . . . . . . . . . 30.5 mt-10 -60.73 -37.93 83.42 Favored 'General case' 0 N--CA 1.498 1.929 0 O-C-N 121.473 -0.767 . . . . 0.0 110.468 179.633 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 77' ' ' PHE . . . . . . . . . . . . . 42.6 t80 -59.63 -48.29 82.24 Favored 'General case' 0 N--CA 1.498 1.973 0 O-C-N 121.317 -0.864 . . . . 0.0 110.142 179.445 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 78' ' ' LEU . . . . . . . . . . . . . 16.2 mt -66.84 -37.88 85.32 Favored 'General case' 0 N--CA 1.501 2.09 0 O-C-N 121.41 -0.806 . . . . 0.0 110.023 179.579 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 79' ' ' VAL . . . . . . . . . . . . . 39.2 t -59.71 -36.7 67.27 Favored 'Isoleucine or valine' 0 N--CA 1.499 2.025 0 O-C-N 121.49 -0.756 . . . . 0.0 110.012 179.192 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 80' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -69.99 -40.34 75.35 Favored 'General case' 0 N--CA 1.496 1.849 0 O-C-N 121.359 -0.838 . . . . 0.0 109.868 179.332 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 81' ' ' MET . . . . . 0.463 ' HG2' ' CE1' ' A' ' 20' ' ' PHE . 0.0 OUTLIER -62.53 -48.4 79.71 Favored 'General case' 0 N--CA 1.496 1.848 0 O-C-N 121.557 -0.714 . . . . 0.0 109.976 179.515 . . . . . . . . 3 3 . 1 . 007 nuclear orig core ' A' A ' 82' ' ' VAL . . . . . . . . . . . . . 34.3 m -67.44 -28.18 41.27 Favored 'Isoleucine or valine' 0 N--CA 1.499 2.018 0 O-C-N 121.251 -0.905 . . . . 0.0 109.805 179.016 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 83' ' ' ARG . . . . . . . . . . . . . 7.2 mtt85 -61.58 -39.97 93.08 Favored 'General case' 0 N--CA 1.497 1.91 0 O-C-N 121.348 -0.845 . . . . 0.0 109.518 178.779 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 84' ' ' CYS . . . . . . . . . . . . . 5.2 t -62.49 -35.57 79.77 Favored 'General case' 0 N--CA 1.498 1.95 0 O-C-N 121.542 -0.724 . . . . 0.0 110.002 178.882 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 85' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.499 1.982 0 O-C-N 121.408 -0.807 . . . . 0.0 110.353 179.341 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' B' B ' 149' ' ' SER . . . . . . . . . . . . . 34.8 p . . . . . 0 N--CA 1.497 1.91 0 CA-C-O 121.383 0.611 . . . . 0.0 110.957 . . . . . . . . . 0 0 . 1 . 007 nuclear orig core ' B' B ' 150' ' ' ALA . . . . . . . . . . . . . . . -67.94 -28.5 67.53 Favored 'General case' 0 N--CA 1.494 1.761 0 O-C-N 121.568 -0.707 . . . . 0.0 110.438 179.482 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' B' B ' 151' ' ' ASP . . . . . . . . . . . . . 22.9 t70 -75.27 -39.43 59.75 Favored 'General case' 0 N--CA 1.499 2.005 0 O-C-N 121.32 -0.863 . . . . 0.0 110.563 179.561 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' B' B ' 152' ' ' ALA . . . . . . . . . . . . . . . -52.47 -36.71 55.48 Favored 'General case' 0 N--CA 1.501 2.117 0 O-C-N 121.508 -0.745 . . . . 0.0 110.992 -179.871 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' B' B ' 153' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -77.47 -35.77 53.45 Favored 'General case' 0 N--CA 1.495 1.815 0 O-C-N 121.17 -0.956 . . . . 0.0 110.477 179.712 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' B' B ' 154' ' ' MET . . . . . . . . . . . . . 0.7 OUTLIER -62.91 -53.4 54.65 Favored 'General case' 0 N--CA 1.5 2.034 0 O-C-N 121.264 -0.898 . . . . 0.0 110.095 179.685 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' B' B ' 155' ' ' GLN . . . . . . . . . . . . . 2.1 pp0? -62.81 -22.15 66.43 Favored 'General case' 0 N--CA 1.5 2.075 0 O-C-N 121.187 -0.945 . . . . 0.0 110.379 179.101 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' B' B ' 156' ' ' ALA . . . . . . . . . . . . . . . -82.58 -40.96 20.17 Favored 'General case' 0 N--CA 1.495 1.79 0 O-C-N 121.235 -0.916 . . . . 0.0 110.448 179.266 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' B' B ' 157' ' ' LEU . . . . . . . . . . . . . 2.0 mt -91.69 -59.11 2.21 Favored 'General case' 0 N--CA 1.499 2.008 0 O-C-N 121.29 -0.882 . . . . 0.0 110.408 179.996 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' B' B ' 158' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER . . . . . 0 N--CA 1.499 2.014 0 O-C-N 121.305 -0.872 . . . . 0.0 110.46 179.745 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 4' ' ' ILE . . . . . . . . . . . . . 1.7 tt . . . . . 0 N--CA 1.501 2.108 0 N-CA-C 111.615 0.228 . . . . 0.0 111.615 . . . . . . . . . 0 0 . 1 . 008 nuclear orig core ' A' A ' 5' ' ' TYR . . . . . 0.489 ' CG ' ' HG2' ' A' ' 83' ' ' ARG . 57.5 m-85 -76.75 -38.8 53.52 Favored 'General case' 0 N--CA 1.5 2.026 0 O-C-N 121.098 -1.001 . . . . 0.0 110.156 179.989 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 6' ' ' LYS . . . . . 0.425 ' HG2' ' CD ' ' A' ' 10' ' ' GLU . 12.3 ttpp -66.37 -37.81 86.14 Favored 'General case' 0 N--CA 1.494 1.771 0 O-C-N 121.411 -0.806 . . . . 0.0 109.456 178.9 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 7' ' ' ALA . . . . . . . . . . . . . . . -56.17 -43.64 78.56 Favored 'General case' 0 N--CA 1.498 1.971 0 O-C-N 121.534 -0.729 . . . . 0.0 110.209 179.313 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 8' ' ' ALA . . . . . . . . . . . . . . . -61.09 -39.85 91.48 Favored 'General case' 0 N--CA 1.499 2.018 0 O-C-N 121.437 -0.789 . . . . 0.0 109.977 179.149 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 9' ' ' VAL . . . . . 0.532 HG21 ' C ' ' A' ' 78' ' ' LEU . 53.0 t -75.36 -43.65 42.8 Favored 'Isoleucine or valine' 0 N--CA 1.496 1.864 0 O-C-N 121.483 -0.761 . . . . 0.0 110.32 179.587 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 10' ' ' GLU . . . . . 0.425 ' CD ' ' HG2' ' A' ' 6' ' ' LYS . 58.6 mt-10 -57.8 -36.73 72.6 Favored 'General case' 0 N--CA 1.498 1.935 0 O-C-N 121.437 -0.789 . . . . 0.0 109.701 179.383 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 11' ' ' GLN . . . . . . . . . . . . . 0.2 OUTLIER -108.19 47.83 0.88 Allowed 'General case' 0 N--CA 1.482 1.152 0 O-C-N 121.417 -0.802 . . . . 0.0 109.704 179.363 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 12' ' ' LEU . . . . . . . . . . . . . 1.5 mt -82.03 150.68 27.47 Favored 'General case' 0 N--CA 1.497 1.911 0 O-C-N 121.304 -0.873 . . . . 0.0 110.714 -179.748 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 13' ' ' THR . . . . . . . . . . . . . 45.4 p -83.12 152.69 25.19 Favored 'General case' 0 N--CA 1.498 1.956 0 O-C-N 121.462 -0.774 . . . . 0.0 109.922 179.396 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 14' ' ' GLU . . . . . 0.611 ' HA ' ' HD3' ' A' ' 17' ' ' LYS . 5.0 tp10 -56.71 -32.2 65.26 Favored 'General case' 0 N--CA 1.492 1.666 0 O-C-N 121.554 -0.716 . . . . 0.0 110.767 -179.415 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 1.5 mp0 -60.58 -47.85 84.38 Favored 'General case' 0 N--CA 1.497 1.889 0 O-C-N 121.355 -0.84 . . . . 0.0 109.805 179.351 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 16' ' ' GLN . . . . . . . . . . . . . 5.4 mt-30 -77.45 -27.89 52.28 Favored 'General case' 0 N--CA 1.496 1.832 0 O-C-N 121.259 -0.9 . . . . 0.0 110.607 179.347 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 17' ' ' LYS . . . . . 0.611 ' HD3' ' HA ' ' A' ' 14' ' ' GLU . 0.2 OUTLIER -60.53 -46.67 89.31 Favored 'General case' 0 N--CA 1.498 1.965 0 O-C-N 121.513 -0.742 . . . . 0.0 109.547 179.138 . . . . . . . . 3 3 . 1 . 008 nuclear orig core ' A' A ' 18' ' ' ASN . . . . . . . . . . . . . 50.5 t30 -72.77 -34.26 66.84 Favored 'General case' 0 N--CA 1.496 1.863 0 O-C-N 121.581 -0.699 . . . . 0.0 109.926 179.061 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 3.6 tt0 -60.47 -49.15 78.72 Favored 'General case' 0 N--CA 1.497 1.903 0 O-C-N 121.477 -0.764 . . . . 0.0 109.578 179.265 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 20' ' ' PHE . . . . . . . . . . . . . 16.9 m-85 -68.1 -32.36 72.61 Favored 'General case' 0 N--CA 1.499 2.0 0 O-C-N 121.316 -0.865 . . . . 0.0 110.092 179.123 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 21' ' ' LYS . . . . . . . . . . . . . 13.9 tptp -58.42 -45.44 88.46 Favored 'General case' 0 N--CA 1.495 1.822 0 O-C-N 121.604 -0.685 . . . . 0.0 109.611 179.43 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 22' ' ' ALA . . . . . . . . . . . . . . . -59.43 -44.23 92.95 Favored 'General case' 0 N--CA 1.496 1.847 0 O-C-N 121.514 -0.742 . . . . 0.0 110.271 179.373 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 23' ' ' ALA . . . . . . . . . . . . . . . -64.87 -44.48 89.54 Favored 'General case' 0 N--CA 1.501 2.088 0 O-C-N 121.283 -0.886 . . . . 0.0 109.926 179.209 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 24' ' ' PHE . . . . . 0.521 ' CD2' HD11 ' A' ' 36' ' ' ILE . 40.8 t80 -66.75 -38.73 87.22 Favored 'General case' 0 N--CA 1.496 1.835 0 O-C-N 121.609 -0.682 . . . . 0.0 110.303 179.505 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 25' ' ' ASP . . . . . . . . . . . . . 9.1 t70 -54.73 -52.36 62.73 Favored 'General case' 0 N--CA 1.501 2.115 0 O-C-N 121.606 -0.684 . . . . 0.0 111.012 -179.805 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 26' ' ' ILE . . . . . . . . . . . . . 19.7 mt -69.8 -27.8 34.61 Favored 'Isoleucine or valine' 0 N--CA 1.498 1.959 0 O-C-N 121.145 -0.972 . . . . 0.0 110.266 179.856 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 27' ' ' PHE . . . . . . . . . . . . . 0.3 OUTLIER -65.23 -32.75 74.58 Favored 'General case' 0 N--CA 1.498 1.956 0 O-C-N 121.244 -0.91 . . . . 0.0 111.05 179.81 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 28' ' ' VAL . . . . . . . . . . . . . 33.0 m -91.75 34.02 0.11 Allowed 'Isoleucine or valine' 0 N--CA 1.501 2.12 0 O-C-N 121.121 -0.987 . . . . 0.0 110.816 179.945 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 29' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -67.02 -42.18 85.37 Favored 'General case' 0 N--CA 1.498 1.945 0 O-C-N 121.111 -0.993 . . . . 0.0 110.176 179.459 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 30' ' ' GLY . . . . . . . . . . . . . . . -105.92 40.2 2.58 Favored Glycine 0 N--CA 1.495 2.578 0 N-CA-C 109.488 -1.445 . . . . 0.0 109.488 179.475 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 31' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.496 1.849 0 O-C-N 121.364 -1.08 . . . . 0.0 110.203 -179.982 . . . . . . . . 0 0 . 1 . 008 nuclear orig core ' A' A ' 35' ' ' CYS . . . . . . . . . . . . . 58.2 m . . . . . 0 N--CA 1.497 1.889 0 CA-C-O 121.096 0.474 . . . . 0.0 110.339 . . . . . . . . . 0 0 . 1 . 008 nuclear orig core ' A' A ' 36' ' ' ILE . . . . . 0.521 HD11 ' CD2' ' A' ' 24' ' ' PHE . 25.9 mt -102.13 129.26 53.79 Favored 'Isoleucine or valine' 0 N--CA 1.496 1.863 0 O-C-N 121.168 -0.957 . . . . 0.0 110.425 -179.685 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 37' ' ' SER . . . . . . . . . . . . . 3.4 t -107.17 163.68 12.8 Favored 'General case' 0 N--CA 1.495 1.795 0 O-C-N 121.484 -0.76 . . . . 0.0 109.722 179.133 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 38' ' ' THR . . . . . 0.455 HG21 HD13 ' A' ' 61' ' ' ILE . 77.1 p -63.05 -30.38 71.55 Favored 'General case' 0 N--CA 1.501 2.105 0 O-C-N 121.294 -0.879 . . . . 0.0 110.27 179.64 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 39' ' ' LYS . . . . . . . . . . . . . 1.6 mptp? -58.93 -42.96 91.02 Favored 'General case' 0 N--CA 1.497 1.912 0 O-C-N 121.535 -0.728 . . . . 0.0 109.837 179.343 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 1.6 mp0 -74.25 -37.22 63.84 Favored 'General case' 0 N--CA 1.498 1.942 0 O-C-N 121.463 -0.773 . . . . 0.0 109.942 179.442 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 41' ' ' LEU . . . . . . . . . . . . . 6.2 tp -60.69 -47.56 85.7 Favored 'General case' 0 N--CA 1.495 1.789 0 O-C-N 121.499 -0.751 . . . . 0.0 109.807 179.499 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 42' ' ' GLY . . . . . . . . . . . . . . . -54.62 -39.84 68.22 Favored Glycine 0 N--CA 1.494 2.536 0 N-CA-C 109.887 -1.285 . . . . 0.0 109.887 179.688 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 43' ' ' LYS . . . . . . . . . . . . . 16.0 mttp -58.34 -40.19 81.49 Favored 'General case' 0 N--CA 1.501 2.084 0 O-C-N 121.34 -1.094 . . . . 0.0 110.033 179.171 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 44' ' ' VAL . . . . . . . . . . . . . 45.0 t -75.25 -38.45 41.11 Favored 'Isoleucine or valine' 0 N--CA 1.497 1.901 0 O-C-N 121.36 -0.838 . . . . 0.0 109.39 179.108 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 45' ' ' MET . . . . . . . . . . . . . 1.6 mmt -57.14 -43.29 82.28 Favored 'General case' 0 N--CA 1.498 1.936 0 O-C-N 121.713 -0.617 . . . . 0.0 110.031 179.343 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 46' ' ' ARG . . . . . . . . . . . . . 0.4 OUTLIER -63.12 -39.9 96.04 Favored 'General case' 0 N--CA 1.496 1.853 0 O-C-N 121.571 -0.706 . . . . 0.0 109.783 179.234 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 47' ' ' MET . . . . . . . . . . . . . 6.0 ttp -63.54 -29.35 70.63 Favored 'General case' 0 N--CA 1.497 1.875 0 O-C-N 121.569 -0.707 . . . . 0.0 110.188 179.036 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 48' ' ' LEU . . . . . . . . . . . . . 1.9 tt -72.13 -39.64 68.66 Favored 'General case' 0 N--CA 1.495 1.823 0 O-C-N 121.391 -0.818 . . . . 0.0 110.65 179.618 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 49' ' ' GLY . . . . . . . . . . . . . . . 144.29 -29.85 1.9 Allowed Glycine 0 N--CA 1.499 2.859 0 C-N-CA 120.113 -1.041 . . . . 0.0 110.627 179.982 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 50' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -127.07 129.8 48.69 Favored 'General case' 0 N--CA 1.501 2.082 0 O-C-N 121.21 -1.171 . . . . 0.0 111.166 -179.628 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 51' ' ' ASN . . . . . . . . . . . . . 43.3 t30 -172.15 104.87 0.35 Allowed Pre-proline 0 N--CA 1.496 1.845 0 O-C-N 121.549 -0.719 . . . . 0.0 110.363 179.319 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 52' ' ' PRO . . . . . . . . . . . . . 43.3 Cg_endo -76.95 -71.8 0.01 OUTLIER 'Trans proline' 0 C--N 1.311 -1.396 0 O-C-N 123.859 1.452 . . . . 0.0 110.565 179.562 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 53' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -139.96 150.77 63.47 Favored Pre-proline 0 N--CA 1.501 2.079 0 O-C-N 121.172 -0.955 . . . . 0.0 109.812 179.641 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 54' ' ' PRO . . . . . 0.452 ' O ' ' HB ' ' A' ' 38' ' ' THR . 45.3 Cg_endo -70.4 -48.17 0.63 Allowed 'Trans proline' 0 N--CA 1.491 1.368 0 O-C-N 123.837 1.44 . . . . 0.0 111.208 -179.483 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 55' ' ' GLU . . . . . 0.482 ' O ' ' HB2' ' A' ' 58' ' ' GLN . 11.3 mm-40 -66.63 -20.01 65.9 Favored 'General case' 0 N--CA 1.499 2.013 0 O-C-N 121.19 -0.944 . . . . 0.0 110.855 -179.983 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 7.6 tt0 -61.3 -25.41 67.1 Favored 'General case' 0 N--CA 1.499 1.976 0 O-C-N 121.149 -0.97 . . . . 0.0 110.321 178.981 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 57' ' ' LEU . . . . . . . . . . . . . 4.6 mt -85.78 -9.21 57.44 Favored 'General case' 0 N--CA 1.498 1.939 0 O-C-N 121.39 -0.819 . . . . 0.0 111.672 -179.875 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 58' ' ' GLN . . . . . 0.482 ' HB2' ' O ' ' A' ' 55' ' ' GLU . 1.7 mm100 -48.69 -53.86 17.1 Favored 'General case' 0 N--CA 1.505 2.302 0 O-C-N 121.136 -0.978 . . . . 0.0 111.38 -179.362 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 59' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -51.27 -33.91 30.55 Favored 'General case' 0 N--CA 1.502 2.153 0 O-C-N 121.299 -0.876 . . . . 0.0 110.881 179.868 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 60' ' ' MET . . . . . . . . . . . . . 1.5 ttp -75.31 -35.36 61.26 Favored 'General case' 0 N--CA 1.496 1.871 0 O-C-N 121.294 -0.879 . . . . 0.0 110.646 179.406 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 61' ' ' ILE . . . . . 0.521 HG13 ' CG2' ' A' ' 72' ' ' VAL . 8.6 tt -65.22 -31.75 55.26 Favored 'Isoleucine or valine' 0 N--CA 1.501 2.083 0 O-C-N 121.021 -1.049 . . . . 0.0 110.276 179.62 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 62' ' ' ASP . . . . . 0.507 ' N ' HG22 ' A' ' 61' ' ' ILE . 22.6 m-20 -76.99 -28.86 55.23 Favored 'General case' 0 N--CA 1.496 1.873 0 O-C-N 121.268 -0.895 . . . . 0.0 109.955 179.066 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 63' ' ' GLU . . . . . . . . . . . . . 6.6 mt-10 -59.11 -49.58 77.33 Favored 'General case' 0 N--CA 1.5 2.063 0 O-C-N 121.518 -0.739 . . . . 0.0 110.411 179.37 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 64' ' ' VAL . . . . . . . . . . . . . 14.6 p -84.33 -10.79 11.67 Favored 'Isoleucine or valine' 0 N--CA 1.497 1.9 0 O-C-N 121.661 -0.65 . . . . 0.0 111.122 -179.679 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 65' ' ' ASP . . . . . . . . . . . . . 24.9 t70 -69.13 133.72 48.39 Favored 'General case' 0 N--CA 1.497 1.887 0 O-C-N 120.945 -1.097 . . . . 0.0 110.032 179.553 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 66' ' ' GLU . . . . . . . . . . . . . 25.4 mt-10 -128.73 25.89 5.63 Favored 'General case' 0 N--CA 1.495 1.823 0 O-C-N 121.322 -0.861 . . . . 0.0 111.219 -179.493 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 67' ' ' ASP . . . . . . . . . . . . . 1.6 p-10 -124.97 -21.2 4.75 Favored 'General case' 0 N--CA 1.498 1.967 0 O-C-N 120.822 -1.174 . . . . 0.0 112.162 -179.878 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 68' ' ' GLY . . . . . . . . . . . . . . . 114.91 -37.13 3.62 Favored Glycine 0 N--CA 1.497 2.762 0 O-C-N 120.825 -1.172 . . . . 0.0 110.466 179.665 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 69' ' ' SER . . . . . . . . . . . . . 38.9 p -58.87 -32.0 69.08 Favored 'General case' 0 N--CA 1.502 2.162 0 O-C-N 121.361 -1.082 . . . . 0.0 110.996 -179.883 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 70' ' ' GLY . . . . . . . . . . . . . . . 93.27 -40.1 2.86 Favored Glycine 0 N--CA 1.499 2.845 0 N-CA-C 110.185 -1.166 . . . . 0.0 110.185 -179.824 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 71' ' ' THR . . . . . . . . . . . . . 14.0 m -64.34 144.69 56.97 Favored 'General case' 0 N--CA 1.501 2.113 0 O-C-N 121.262 -1.14 . . . . 0.0 110.273 -179.841 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 72' ' ' VAL . . . . . 0.521 ' CG2' HG13 ' A' ' 61' ' ' ILE . 2.1 t -77.62 119.36 26.16 Favored 'Isoleucine or valine' 0 N--CA 1.497 1.901 0 O-C-N 121.377 -0.827 . . . . 0.0 110.105 179.867 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 73' ' ' ASP . . . . . . . . . . . . . 45.6 m-20 -92.78 -173.31 3.28 Favored 'General case' 0 N--CA 1.496 1.831 0 O-C-N 121.616 -0.678 . . . . 0.0 109.887 179.839 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 74' ' ' PHE . . . . . . . . . . . . . 26.0 t80 -64.97 -48.45 73.99 Favored 'General case' 0 N--CA 1.495 1.821 0 O-C-N 121.195 -0.94 . . . . 0.0 110.052 179.602 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 75' ' ' ASP . . . . . 0.446 ' HA ' HD12 ' A' ' 78' ' ' LEU . 29.0 t70 -60.45 -49.82 76.02 Favored 'General case' 0 N--CA 1.498 1.927 0 O-C-N 121.579 -0.701 . . . . 0.0 109.97 179.323 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 76' ' ' GLU . . . . . . . . . . . . . 43.8 mt-10 -60.77 -41.6 95.82 Favored 'General case' 0 N--CA 1.498 1.973 0 O-C-N 121.592 -0.693 . . . . 0.0 109.8 179.135 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 77' ' ' PHE . . . . . . . . . . . . . 43.9 t80 -58.99 -45.57 90.31 Favored 'General case' 0 N--CA 1.498 1.945 0 O-C-N 121.575 -0.703 . . . . 0.0 109.528 178.888 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 78' ' ' LEU . . . . . 0.532 ' C ' HG21 ' A' ' 9' ' ' VAL . 14.2 mt -56.92 -46.47 82.0 Favored 'General case' 0 N--CA 1.498 1.945 0 O-C-N 121.678 -0.639 . . . . 0.0 110.083 179.438 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 79' ' ' VAL . . . . . 0.465 ' HA ' HG22 ' A' ' 9' ' ' VAL . 86.3 t -61.7 -35.16 65.77 Favored 'Isoleucine or valine' 0 N--CA 1.501 2.119 0 O-C-N 121.463 -0.773 . . . . 0.0 109.835 179.453 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 80' ' ' MET . . . . . . . . . . . . . 12.4 ttp -70.66 -37.61 73.7 Favored 'General case' 0 N--CA 1.494 1.738 0 O-C-N 121.507 -0.745 . . . . 0.0 110.532 179.566 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 81' ' ' MET . . . . . . . . . . . . . 68.4 mmm -62.77 -53.03 60.63 Favored 'General case' 0 N--CA 1.499 1.982 0 O-C-N 121.253 -0.904 . . . . 0.0 110.336 179.929 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 82' ' ' VAL . . . . . . . . . . . . . 13.4 p -63.26 -29.78 48.1 Favored 'Isoleucine or valine' 0 N--CA 1.501 2.113 0 O-C-N 121.302 -0.874 . . . . 0.0 110.132 179.333 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 83' ' ' ARG . . . . . 0.489 ' HG2' ' CG ' ' A' ' 5' ' ' TYR . 0.0 OUTLIER -62.24 -52.13 64.98 Favored 'General case' 0 N--CA 1.498 1.937 0 O-C-N 121.299 -0.876 . . . . 0.0 110.293 179.32 . . . . . . . . 3 3 . 1 . 008 nuclear orig core ' A' A ' 84' ' ' CYS . . . . . . . . . . . . . 0.1 OUTLIER -77.33 -22.79 51.33 Favored 'General case' 0 N--CA 1.498 1.956 0 O-C-N 121.495 -0.753 . . . . 0.0 110.88 179.928 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 85' ' ' MET . . . . . 0.456 ' HB2' ' HB2' ' B' ' 150' ' ' ALA . 22.9 ttp . . . . . 0 N--CA 1.496 1.861 0 O-C-N 121.35 -0.844 . . . . 0.0 110.138 179.665 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B ' 149' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER . . . . . 0 N--CA 1.501 2.112 0 CA-C-O 121.322 0.582 . . . . 0.0 111.188 . . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B ' 150' ' ' ALA . . . . . 0.456 ' HB2' ' HB2' ' A' ' 85' ' ' MET . . . -108.68 -59.73 1.84 Allowed 'General case' 0 N--CA 1.495 1.809 0 O-C-N 121.299 -0.876 . . . . 0.0 110.162 179.898 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' B' B ' 151' ' ' ASP . . . . . . . . . . . . . 6.4 p-10 -58.34 -30.9 67.08 Favored 'General case' 0 N--CA 1.5 2.059 0 O-C-N 121.491 -0.755 . . . . 0.0 110.805 179.59 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B ' 152' ' ' ALA . . . . . . . . . . . . . . . -71.81 -47.5 52.84 Favored 'General case' 0 N--CA 1.496 1.845 0 O-C-N 121.343 -0.848 . . . . 0.0 110.169 179.708 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B ' 153' ' ' MET . . . . . . . . . . . . . 7.1 mmt -68.31 -37.43 80.6 Favored 'General case' 0 N--CA 1.499 1.988 0 O-C-N 121.333 -0.854 . . . . 0.0 110.482 179.679 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B ' 154' ' ' MET . . . . . . . . . . . . . 39.7 mtp -58.68 -45.02 90.33 Favored 'General case' 0 N--CA 1.499 2.009 0 O-C-N 121.401 -0.812 . . . . 0.0 110.513 179.836 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B ' 155' ' ' GLN . . . . . . . . . . . . . 6.7 tp-100 -60.37 -42.22 95.34 Favored 'General case' 0 N--CA 1.5 2.068 0 O-C-N 121.422 -0.799 . . . . 0.0 110.503 179.895 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B ' 156' ' ' ALA . . . . . . . . . . . . . . . -66.68 -39.3 88.06 Favored 'General case' 0 N--CA 1.499 1.997 0 O-C-N 121.428 -0.795 . . . . 0.0 110.34 179.608 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B ' 157' ' ' LEU . . . . . 0.405 ' HA ' HD23 ' B' ' 157' ' ' LEU . 0.2 OUTLIER -67.86 -35.93 79.41 Favored 'General case' 0 N--CA 1.499 2.013 0 O-C-N 121.449 -0.782 . . . . 0.0 110.782 179.872 . . . . . . . . 3 3 . 1 . 008 nuclear orig core ' B' B ' 158' ' ' LEU . . . . . . . . . . . . . 12.0 mt . . . . . 0 N--CA 1.498 1.97 0 O-C-N 121.326 -0.859 . . . . 0.0 110.777 -179.862 . . . . . . . . 0 0 . 1 . 009 nuclear orig core ' A' A ' 4' ' ' ILE . . . . . . . . . . . . . 11.7 mt . . . . . 0 N--CA 1.5 2.035 0 CA-C-O 120.939 0.399 . . . . 0.0 110.147 . . . . . . . . . 0 0 . 1 . 009 nuclear orig core ' A' A ' 5' ' ' TYR . . . . . . . . . . . . . 13.0 m-85 -60.21 -36.4 77.58 Favored 'General case' 0 N--CA 1.499 2.007 0 O-C-N 121.248 -0.907 . . . . 0.0 110.668 179.778 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 6' ' ' LYS . . . . . 0.458 ' HB3' ' HE3' ' A' ' 6' ' ' LYS . 26.1 ttpp -79.77 -46.46 16.95 Favored 'General case' 0 N--CA 1.494 1.774 0 O-C-N 121.201 -0.937 . . . . 0.0 110.415 179.718 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 7' ' ' ALA . . . . . . . . . . . . . . . -56.55 -46.67 80.58 Favored 'General case' 0 N--CA 1.498 1.937 0 O-C-N 121.45 -0.781 . . . . 0.0 110.309 179.858 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 8' ' ' ALA . . . . . 0.469 ' O ' ' HG ' ' A' ' 12' ' ' LEU . . . -58.33 -44.27 88.59 Favored 'General case' 0 N--CA 1.498 1.959 0 O-C-N 121.286 -0.884 . . . . 0.0 109.532 179.1 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 9' ' ' VAL . . . . . 0.44 HG21 HG23 ' A' ' 79' ' ' VAL . 10.9 t -67.19 -40.91 86.12 Favored 'Isoleucine or valine' 0 N--CA 1.497 1.891 0 O-C-N 121.657 -0.652 . . . . 0.0 110.512 179.446 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 10' ' ' GLU . . . . . . . . . . . . . 55.2 mt-10 -67.85 -43.51 79.32 Favored 'General case' 0 N--CA 1.5 2.056 0 O-C-N 121.416 -0.802 . . . . 0.0 111.588 -179.348 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 11' ' ' GLN . . . . . . . . . . . . . 3.1 mp0 -86.24 -80.16 0.24 Allowed 'General case' 0 N--CA 1.496 1.844 0 O-C-N 121.308 -0.87 . . . . 0.0 111.091 -178.786 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 12' ' ' LEU . . . . . 0.469 ' HG ' ' O ' ' A' ' 8' ' ' ALA . 4.8 mt 57.33 -168.45 0.12 Allowed 'General case' 0 N--CA 1.504 2.271 0 O-C-N 121.476 -0.765 . . . . 0.0 109.981 -179.076 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 13' ' ' THR . . . . . 0.442 ' OG1' ' HB2' ' A' ' 16' ' ' GLN . 76.0 p -120.49 159.58 24.89 Favored 'General case' 0 N--CA 1.499 1.995 0 O-C-N 120.867 -1.146 . . . . 0.0 110.078 179.406 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 14' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -53.15 -43.08 66.71 Favored 'General case' 0 N--CA 1.493 1.703 0 C-N-CA 120.278 -0.569 . . . . 0.0 110.441 -179.632 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 1.2 mp0 -65.38 -59.23 4.24 Favored 'General case' 0 N--CA 1.496 1.83 0 O-C-N 121.56 -0.713 . . . . 0.0 110.31 -179.956 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 16' ' ' GLN . . . . . 0.442 ' HB2' ' OG1' ' A' ' 13' ' ' THR . 0.9 OUTLIER -50.65 -52.73 36.95 Favored 'General case' 0 N--CA 1.501 2.098 0 O-C-N 121.352 -0.843 . . . . 0.0 111.257 -179.728 . . . . . . . . 3 3 . 1 . 009 nuclear orig core ' A' A ' 17' ' ' LYS . . . . . 0.425 ' O ' ' HB3' ' A' ' 21' ' ' LYS . 3.2 tttp -57.92 -41.25 82.3 Favored 'General case' 0 N--CA 1.501 2.09 0 O-C-N 121.827 -0.546 . . . . 0.0 110.7 179.847 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 18' ' ' ASN . . . . . . . . . . . . . 12.8 m-20 -70.95 -48.45 53.36 Favored 'General case' 0 N--CA 1.501 2.079 0 O-C-N 121.259 -0.9 . . . . 0.0 110.207 179.592 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 0.5 OUTLIER -59.12 -46.14 89.09 Favored 'General case' 0 N--CA 1.495 1.8 0 O-C-N 121.611 -0.68 . . . . 0.0 110.436 179.933 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 20' ' ' PHE . . . . . 0.477 ' CE1' ' HG2' ' A' ' 81' ' ' MET . 19.6 m-30 -64.54 -38.0 89.49 Favored 'General case' 0 N--CA 1.498 1.965 0 O-C-N 121.29 -0.881 . . . . 0.0 110.004 179.562 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 21' ' ' LYS . . . . . 0.514 ' HG3' ' N ' ' A' ' 22' ' ' ALA . 0.0 OUTLIER -62.9 -36.68 84.14 Favored 'General case' 0 N--CA 1.5 2.05 0 O-C-N 121.38 -0.825 . . . . 0.0 109.242 178.725 . . . . . . . . 3 3 . 1 . 009 nuclear orig core ' A' A ' 22' ' ' ALA . . . . . 0.514 ' N ' ' HG3' ' A' ' 21' ' ' LYS . . . -70.03 -49.39 51.77 Favored 'General case' 0 N--CA 1.494 1.736 0 O-C-N 121.47 -0.769 . . . . 0.0 109.382 178.841 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 23' ' ' ALA . . . . . . . . . . . . . . . -61.74 -41.59 97.86 Favored 'General case' 0 N--CA 1.496 1.835 0 O-C-N 121.685 -0.635 . . . . 0.0 109.848 179.087 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 24' ' ' PHE . . . . . 0.504 ' CE1' ' HA ' ' A' ' 74' ' ' PHE . 82.7 t80 -61.33 -45.65 93.53 Favored 'General case' 0 N--CA 1.498 1.941 0 O-C-N 121.69 -0.631 . . . . 0.0 110.257 179.582 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 25' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -53.73 -51.47 63.21 Favored 'General case' 0 N--CA 1.498 1.973 0 O-C-N 121.661 -0.649 . . . . 0.0 110.504 179.87 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 26' ' ' ILE . . . . . 0.465 HD13 HD13 ' B' ' 157' ' ' LEU . 2.8 mt -69.07 -31.63 51.03 Favored 'Isoleucine or valine' 0 N--CA 1.498 1.975 0 O-C-N 121.221 -0.924 . . . . 0.0 110.148 179.532 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 27' ' ' PHE . . . . . . . . . . . . . 0.2 OUTLIER -67.15 -43.2 82.92 Favored 'General case' 0 N--CA 1.497 1.898 0 O-C-N 121.126 -0.984 . . . . 0.0 110.259 179.505 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 28' ' ' VAL . . . . . . . . . . . . . 12.8 m -81.72 -16.69 11.99 Favored 'Isoleucine or valine' 0 N--CA 1.502 2.14 0 O-C-N 121.182 -0.948 . . . . 0.0 110.397 179.322 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 29' ' ' LEU . . . . . . . . . . . . . 1.5 tp -61.13 118.52 6.91 Favored 'General case' 0 N--CA 1.49 1.528 0 N-CA-C 108.354 -0.98 . . . . 0.0 108.354 178.979 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 30' ' ' GLY . . . . . . . . . . . . . . . 99.68 22.97 11.38 Favored Glycine 0 N--CA 1.496 2.683 0 N-CA-C 109.678 -1.369 . . . . 0.0 109.678 -178.206 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 31' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.496 1.857 0 O-C-N 121.349 -1.089 . . . . 0.0 109.516 179.596 . . . . . . . . 0 0 . 1 . 009 nuclear orig core ' A' A ' 35' ' ' CYS . . . . . . . . . . . . . 59.1 m . . . . . 0 N--CA 1.504 2.274 0 CA-C-O 120.546 0.212 . . . . 0.0 111.131 . . . . . . . . . 0 0 . 1 . 009 nuclear orig core ' A' A ' 36' ' ' ILE . . . . . . . . . . . . . 69.1 mt -129.31 92.52 1.82 Allowed 'Isoleucine or valine' 0 N--CA 1.495 1.804 0 O-C-N 120.99 -1.069 . . . . 0.0 109.987 179.478 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 37' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -95.08 -173.77 3.05 Favored 'General case' 0 N--CA 1.495 1.794 0 O-C-N 121.277 -0.889 . . . . 0.0 109.345 179.283 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 38' ' ' THR . . . . . . . . . . . . . 1.6 p -59.72 -33.52 71.73 Favored 'General case' 0 N--CA 1.499 2.001 0 O-C-N 121.062 -1.024 . . . . 0.0 109.792 179.376 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 39' ' ' LYS . . . . . . . . . . . . . 23.5 ttpp -62.69 -38.6 91.02 Favored 'General case' 0 N--CA 1.499 1.981 0 O-C-N 121.526 -0.734 . . . . 0.0 109.708 178.755 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 0.6 OUTLIER -66.7 -33.6 75.99 Favored 'General case' 0 N--CA 1.498 1.929 0 O-C-N 121.661 -0.65 . . . . 0.0 109.839 179.355 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 41' ' ' LEU . . . . . 0.595 HD13 ' SD ' ' A' ' 45' ' ' MET . 2.8 tm? -66.21 -63.73 1.01 Allowed 'General case' 0 N--CA 1.497 1.875 0 O-C-N 121.385 -0.822 . . . . 0.0 108.946 178.464 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 42' ' ' GLY . . . . . 0.575 ' HA2' ' HB2' ' A' ' 45' ' ' MET . . . -46.96 -28.03 3.73 Favored Glycine 0 N--CA 1.499 2.876 0 N-CA-C 111.08 -0.808 . . . . 0.0 111.08 179.911 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 43' ' ' LYS . . . . . 0.437 ' HA ' ' HD2' ' A' ' 46' ' ' ARG . 0.0 OUTLIER -49.96 -50.93 45.06 Favored 'General case' 0 N--CA 1.501 2.115 0 O-C-N 121.364 -1.08 . . . . 0.0 110.389 179.733 . . . . . . . . 3 3 . 1 . 009 nuclear orig core ' A' A ' 44' ' ' VAL . . . . . 0.566 HG22 ' SD ' ' A' ' 45' ' ' MET . 13.6 m -75.68 -35.89 32.39 Favored 'Isoleucine or valine' 0 N--CA 1.502 2.129 0 O-C-N 121.376 -0.828 . . . . 0.0 109.732 179.106 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 45' ' ' MET . . . . . 0.595 ' SD ' HD13 ' A' ' 41' ' ' LEU . 0.0 OUTLIER -57.27 -30.23 64.51 Favored 'General case' 0 N--CA 1.498 1.927 0 O-C-N 121.215 -0.928 . . . . 0.0 110.757 178.679 . . . . . . . . 3 3 . 1 . 009 nuclear orig core ' A' A ' 46' ' ' ARG . . . . . 0.437 ' HD2' ' HA ' ' A' ' 43' ' ' LYS . 43.5 mtt85 -58.46 -47.56 83.61 Favored 'General case' 0 N--CA 1.501 2.107 0 O-C-N 121.276 -0.89 . . . . 0.0 109.547 179.135 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 47' ' ' MET . . . . . . . . . . . . . 45.7 mtm -66.05 -30.42 70.94 Favored 'General case' 0 N--CA 1.499 2.014 0 O-C-N 121.59 -0.694 . . . . 0.0 109.687 178.866 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 48' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -71.63 -46.63 58.52 Favored 'General case' 0 N--CA 1.497 1.887 0 O-C-N 121.538 -0.726 . . . . 0.0 110.186 179.334 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 49' ' ' GLY . . . . . . . . . . . . . . . 117.05 -17.14 12.91 Favored Glycine 0 N--CA 1.497 2.765 0 C-N-CA 120.51 -0.852 . . . . 0.0 111.176 179.543 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 50' ' ' GLN . . . . . . . . . . . . . 2.3 mt-30 -109.83 104.38 13.32 Favored 'General case' 0 N--CA 1.499 2.016 0 O-C-N 120.886 -1.361 . . . . 0.0 111.122 -179.427 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 51' ' ' ASN . . . . . . . . . . . . . 31.7 t30 -154.92 101.58 2.32 Favored Pre-proline 0 N--CA 1.496 1.873 0 O-C-N 121.465 -0.772 . . . . 0.0 110.003 179.283 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 52' ' ' PRO . . . . . . . . . . . . . 50.5 Cg_endo -77.1 -91.46 0.0 OUTLIER 'Trans proline' 0 C--N 1.315 -1.207 0 O-C-N 123.787 1.414 . . . . 0.0 111.268 -179.411 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 53' ' ' THR . . . . . . . . . . . . . 3.1 p -130.91 163.67 47.31 Favored Pre-proline 0 N--CA 1.493 1.691 0 O-C-N 120.93 -1.106 . . . . 0.0 110.774 -179.228 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 54' ' ' PRO . . . . . . . . . . . . . 43.0 Cg_endo -72.48 -33.76 8.31 Favored 'Trans proline' 0 C--N 1.314 -1.28 0 O-C-N 123.955 1.503 . . . . 0.0 110.266 179.487 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 55' ' ' GLU . . . . . . . . . . . . . 3.5 mp0 -61.68 -30.46 70.76 Favored 'General case' 0 N--CA 1.497 1.886 0 O-C-N 121.564 -0.71 . . . . 0.0 110.653 179.751 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 3.0 tt0 -61.17 -39.52 90.45 Favored 'General case' 0 N--CA 1.498 1.941 0 O-C-N 121.384 -0.823 . . . . 0.0 110.639 179.559 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 57' ' ' LEU . . . . . 0.479 HD21 ' HG ' ' A' ' 41' ' ' LEU . 1.1 mt -90.25 -9.68 47.1 Favored 'General case' 0 N--CA 1.497 1.911 0 O-C-N 121.249 -0.907 . . . . 0.0 111.379 -179.878 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 58' ' ' GLN . . . . . 0.464 ' O ' HG21 ' A' ' 61' ' ' ILE . 9.8 mm-40 -59.43 -47.06 86.91 Favored 'General case' 0 N--CA 1.501 2.107 0 O-C-N 120.999 -1.063 . . . . 0.0 110.056 179.665 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 59' ' ' GLU . . . . . . . . . . . . . 0.5 OUTLIER -63.95 -32.84 74.52 Favored 'General case' 0 N--CA 1.502 2.157 0 O-C-N 121.07 -1.019 . . . . 0.0 109.89 178.912 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 60' ' ' MET . . . . . . . . . . . . . 4.2 tmm? -65.92 -35.96 82.05 Favored 'General case' 0 N--CA 1.496 1.862 0 O-C-N 121.424 -0.798 . . . . 0.0 110.32 179.428 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 61' ' ' ILE . . . . . 0.533 HG13 ' CG2' ' A' ' 72' ' ' VAL . 1.1 tt -63.26 -29.12 46.44 Favored 'Isoleucine or valine' 0 N--CA 1.499 1.992 0 O-C-N 121.326 -0.859 . . . . 0.0 110.708 179.645 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 62' ' ' ASP . . . . . 0.459 ' N ' HG21 ' A' ' 61' ' ' ILE . 3.7 m-20 -62.21 -45.25 94.18 Favored 'General case' 0 N--CA 1.498 1.933 0 O-C-N 121.185 -0.947 . . . . 0.0 110.145 179.644 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 63' ' ' GLU . . . . . . . . . . . . . 4.0 tm-20 -69.51 -42.61 74.48 Favored 'General case' 0 N--CA 1.498 1.956 0 O-C-N 121.537 -0.727 . . . . 0.0 110.247 179.431 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 64' ' ' VAL . . . . . . . . . . . . . 77.0 t -72.19 -23.96 22.02 Favored 'Isoleucine or valine' 0 N--CA 1.498 1.952 0 O-C-N 121.383 -0.823 . . . . 0.0 110.901 -179.947 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 65' ' ' ASP . . . . . 0.469 ' O ' ' HG2' ' A' ' 66' ' ' GLU . 17.1 t70 -86.93 -68.17 0.77 Allowed 'General case' 0 N--CA 1.497 1.882 0 O-C-N 121.079 -1.013 . . . . 0.0 110.298 -179.878 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 66' ' ' GLU . . . . . 0.469 ' HG2' ' O ' ' A' ' 65' ' ' ASP . 0.4 OUTLIER 44.02 28.76 0.28 Allowed 'General case' 0 N--CA 1.507 2.414 0 N-CA-C 112.615 0.598 . . . . 0.0 112.615 179.903 . . . . . . . . 3 3 . 1 . 009 nuclear orig core ' A' A ' 67' ' ' ASP . . . . . . . . . . . . . 0.0 OUTLIER -110.57 -23.53 11.06 Favored 'General case' 0 N--CA 1.498 1.932 0 O-C-N 120.723 -1.236 . . . . 0.0 111.236 179.623 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 68' ' ' GLY . . . . . . . . . . . . . . . 131.22 -50.19 0.9 Allowed Glycine 0 N--CA 1.495 2.59 0 N-CA-C 110.255 -1.138 . . . . 0.0 110.255 -179.981 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 69' ' ' SER . . . . . . . . . . . . . 5.4 p -66.84 -37.2 84.02 Favored 'General case' 0 N--CA 1.499 1.979 0 O-C-N 121.392 -1.063 . . . . 0.0 111.192 -179.491 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 70' ' ' GLY . . . . . . . . . . . . . . . 99.42 -43.73 1.78 Allowed Glycine 0 N--CA 1.496 2.691 0 N-CA-C 110.365 -1.094 . . . . 0.0 110.365 179.781 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 71' ' ' THR . . . . . . . . . . . . . 0.6 OUTLIER -71.82 139.3 48.88 Favored 'General case' 0 N--CA 1.503 2.205 0 O-C-N 121.197 -1.178 . . . . 0.0 110.443 -179.63 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 72' ' ' VAL . . . . . 0.533 ' CG2' HG13 ' A' ' 61' ' ' ILE . 6.6 t -75.88 131.34 35.11 Favored 'Isoleucine or valine' 0 N--CA 1.498 1.964 0 O-C-N 121.543 -0.723 . . . . 0.0 110.395 179.844 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 73' ' ' ASP . . . . . . . . . . . . . 29.5 m-20 -117.29 -164.11 0.97 Allowed 'General case' 0 N--CA 1.5 2.03 0 O-C-N 121.373 -0.83 . . . . 0.0 110.55 -179.935 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 74' ' ' PHE . . . . . 0.504 ' HA ' ' CE1' ' A' ' 24' ' ' PHE . 87.9 t80 -66.2 -45.83 79.41 Favored 'General case' 0 N--CA 1.502 2.156 0 O-C-N 121.38 -0.825 . . . . 0.0 110.305 179.849 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 75' ' ' ASP . . . . . . . . . . . . . 1.1 m-20 -58.56 -47.8 83.01 Favored 'General case' 0 N--CA 1.497 1.887 0 O-C-N 121.58 -0.7 . . . . 0.0 109.886 179.441 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 76' ' ' GLU . . . . . . . . . . . . . 2.1 mt-10 -67.65 -33.96 76.0 Favored 'General case' 0 N--CA 1.496 1.844 0 O-C-N 121.501 -0.749 . . . . 0.0 109.821 179.044 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 77' ' ' PHE . . . . . . . . . . . . . 47.9 t80 -56.82 -40.27 75.71 Favored 'General case' 0 N--CA 1.5 2.071 0 O-C-N 121.409 -0.807 . . . . 0.0 108.915 178.324 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 78' ' ' LEU . . . . . . . . . . . . . 66.6 mt -69.36 -42.88 74.65 Favored 'General case' 0 N--CA 1.495 1.779 0 N-CA-C 109.041 -0.725 . . . . 0.0 109.041 178.21 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 79' ' ' VAL . . . . . 0.446 ' O ' HG12 ' A' ' 82' ' ' VAL . 71.9 t -63.71 -34.97 71.18 Favored 'Isoleucine or valine' 0 N--CA 1.501 2.085 0 O-C-N 121.588 -0.695 . . . . 0.0 109.924 178.984 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 80' ' ' MET . . . . . . . . . . . . . 0.5 OUTLIER -69.07 -43.07 75.33 Favored 'General case' 0 N--CA 1.495 1.807 0 O-C-N 121.344 -0.848 . . . . 0.0 109.685 179.223 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 81' ' ' MET . . . . . 0.477 ' HG2' ' CE1' ' A' ' 20' ' ' PHE . 12.9 tpp -65.09 -49.39 70.17 Favored 'General case' 0 N--CA 1.497 1.919 0 O-C-N 121.556 -0.715 . . . . 0.0 109.949 179.556 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 82' ' ' VAL . . . . . 0.446 HG12 ' O ' ' A' ' 79' ' ' VAL . 7.2 p -61.57 -27.95 43.08 Favored 'Isoleucine or valine' 0 N--CA 1.501 2.115 0 O-C-N 121.256 -0.902 . . . . 0.0 109.492 178.549 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 83' ' ' ARG . . . . . . . . . . . . . 1.6 mtt180 -71.65 -39.63 70.2 Favored 'General case' 0 N--CA 1.499 1.989 0 O-C-N 121.427 -0.796 . . . . 0.0 109.54 178.466 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 84' ' ' CYS . . . . . . . . . . . . . 0.0 OUTLIER -69.08 -50.69 46.06 Favored 'General case' 0 N--CA 1.5 2.053 0 O-C-N 121.499 -0.751 . . . . 0.0 110.47 179.872 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 85' ' ' MET . . . . . . . . . . . . . 2.5 ptt? . . . . . 0 N--CA 1.499 2.025 0 O-C-N 121.259 -0.901 . . . . 0.0 111.202 179.85 . . . . . . . . 0 0 . 1 . 009 nuclear orig core ' B' B ' 149' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER . . . . . 0 N--CA 1.496 1.867 0 CA-C-O 121.112 0.482 . . . . 0.0 109.994 . . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' B' B ' 150' ' ' ALA . . . . . . . . . . . . . . . -58.58 -41.01 84.76 Favored 'General case' 0 N--CA 1.499 1.977 0 O-C-N 121.603 -0.686 . . . . 0.0 110.749 -179.644 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' B' B ' 151' ' ' ASP . . . . . . . . . . . . . 7.2 p-10 -64.3 -38.1 89.84 Favored 'General case' 0 N--CA 1.5 2.03 0 O-C-N 121.46 -0.775 . . . . 0.0 110.599 179.574 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' B' B ' 152' ' ' ALA . . . . . . . . . . . . . . . -78.06 -46.78 19.93 Favored 'General case' 0 N--CA 1.496 1.852 0 O-C-N 121.368 -0.833 . . . . 0.0 110.295 179.742 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' B' B ' 153' ' ' MET . . . . . . . . . . . . . 8.5 tpp -56.69 -43.7 80.75 Favored 'General case' 0 N--CA 1.499 1.992 0 O-C-N 121.494 -0.754 . . . . 0.0 110.332 179.728 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' B' B ' 154' ' ' MET . . . . . 0.514 ' O ' ' HB2' ' B' ' 158' ' ' LEU . 9.0 mmm -58.01 -52.75 64.21 Favored 'General case' 0 N--CA 1.498 1.946 0 O-C-N 121.442 -0.786 . . . . 0.0 110.448 179.88 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' B' B ' 155' ' ' GLN . . . . . . . . . . . . . 0.9 OUTLIER -62.44 -32.64 73.53 Favored 'General case' 0 N--CA 1.499 1.993 0 O-C-N 121.434 -0.791 . . . . 0.0 111.001 -179.959 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' B' B ' 156' ' ' ALA . . . . . . . . . . . . . . . -55.52 -34.92 65.08 Favored 'General case' 0 N--CA 1.501 2.094 0 O-C-N 121.38 -0.825 . . . . 0.0 111.095 179.954 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' B' B ' 157' ' ' LEU . . . . . 0.465 HD13 HD13 ' A' ' 26' ' ' ILE . 1.6 pp -112.43 8.22 19.37 Favored 'General case' 0 N--CA 1.5 2.054 0 O-C-N 121.17 -0.956 . . . . 0.0 111.796 -179.709 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' B' B ' 158' ' ' LEU . . . . . 0.514 ' HB2' ' O ' ' B' ' 154' ' ' MET . 0.0 OUTLIER . . . . . 0 N--CA 1.498 1.968 0 O-C-N 120.922 -1.111 . . . . 0.0 110.682 179.682 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 4' ' ' ILE . . . . . . . . . . . . . 23.6 mm . . . . . 0 N--CA 1.497 1.882 0 N-CA-C 109.661 -0.496 . . . . 0.0 109.661 . . . . . . . . . 0 0 . 1 . 010 nuclear orig core ' A' A ' 5' ' ' TYR . . . . . . . . . . . . . 1.2 m-85 -96.14 -36.85 10.82 Favored 'General case' 0 N--CA 1.494 1.773 0 O-C-N 121.473 -0.767 . . . . 0.0 109.471 179.124 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 2.0 tmmt? -63.22 -28.36 69.98 Favored 'General case' 0 N--CA 1.497 1.893 0 O-C-N 121.433 -0.792 . . . . 0.0 109.819 178.664 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 7' ' ' ALA . . . . . . . . . . . . . . . -53.58 -44.83 69.66 Favored 'General case' 0 N--CA 1.497 1.923 0 O-C-N 121.609 -0.682 . . . . 0.0 109.287 178.948 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 8' ' ' ALA . . . . . . . . . . . . . . . -67.29 -43.65 81.23 Favored 'General case' 0 N--CA 1.495 1.802 0 O-C-N 121.533 -0.729 . . . . 0.0 109.256 178.331 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 9' ' ' VAL . . . . . 0.518 HG21 ' HA ' ' A' ' 79' ' ' VAL . 53.0 t -56.62 -40.42 69.07 Favored 'Isoleucine or valine' 0 N--CA 1.5 2.075 0 O-C-N 121.8 -0.563 . . . . 0.0 110.404 179.585 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 10' ' ' GLU . . . . . . . . . . . . . 0.7 OUTLIER -63.77 -44.41 93.47 Favored 'General case' 0 N--CA 1.496 1.853 0 O-C-N 121.437 -0.789 . . . . 0.0 111.333 -179.604 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 11' ' ' GLN . . . . . . . . . . . . . 4.3 mt-30 -139.69 82.84 1.9 Allowed 'General case' 0 N--CA 1.496 1.839 0 O-C-N 121.138 -0.976 . . . . 0.0 111.184 -179.704 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 12' ' ' LEU . . . . . . . . . . . . . 36.1 mt -70.79 -74.23 0.15 Allowed 'General case' 0 N--CA 1.498 1.956 0 O-C-N 121.197 -0.94 . . . . 0.0 108.792 178.703 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 13' ' ' THR . . . . . 0.483 ' HB ' ' HB2' ' A' ' 16' ' ' GLN . 2.1 m -157.21 156.55 32.75 Favored 'General case' 0 N--CA 1.494 1.731 0 N-CA-C 108.657 -0.868 . . . . 0.0 108.657 178.55 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 14' ' ' GLU . . . . . . . . . . . . . 2.7 tp10 -53.97 -33.06 55.92 Favored 'General case' 0 N--CA 1.494 1.741 0 O-C-N 121.531 -0.73 . . . . 0.0 110.825 -179.394 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 1.7 mp0 -90.72 -44.37 9.52 Favored 'General case' 0 N--CA 1.495 1.78 0 O-C-N 121.316 -0.865 . . . . 0.0 110.649 179.973 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 16' ' ' GLN . . . . . 0.483 ' HB2' ' HB ' ' A' ' 13' ' ' THR . 0.8 OUTLIER -48.24 -59.89 3.07 Favored 'General case' 0 N--CA 1.503 2.194 0 O-C-N 121.503 -0.748 . . . . 0.0 111.123 -179.408 . . . . . . . . 3 3 . 1 . 010 nuclear orig core ' A' A ' 17' ' ' LYS . . . . . . . . . . . . . 1.0 OUTLIER -56.91 -39.73 74.99 Favored 'General case' 0 N--CA 1.498 1.962 0 O-C-N 121.891 -0.506 . . . . 0.0 110.375 179.898 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 18' ' ' ASN . . . . . . . . . . . . . 2.1 t-20 -66.56 -39.63 88.6 Favored 'General case' 0 N--CA 1.499 2.022 0 O-C-N 121.302 -0.874 . . . . 0.0 110.129 179.26 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 17.0 mt-10 -62.23 -40.41 96.04 Favored 'General case' 0 N--CA 1.497 1.916 0 O-C-N 121.327 -0.858 . . . . 0.0 109.673 179.078 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 20' ' ' PHE . . . . . . . . . . . . . 33.9 m-85 -66.35 -31.53 72.37 Favored 'General case' 0 N--CA 1.498 1.936 0 O-C-N 121.482 -0.761 . . . . 0.0 109.559 178.728 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 21' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -60.22 -43.69 95.79 Favored 'General case' 0 N--CA 1.497 1.92 0 O-C-N 121.438 -0.789 . . . . 0.0 109.05 178.836 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 22' ' ' ALA . . . . . . . . . . . . . . . -72.18 -39.91 68.31 Favored 'General case' 0 N--CA 1.495 1.804 0 O-C-N 121.637 -0.664 . . . . 0.0 109.394 178.681 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 23' ' ' ALA . . . . . 0.41 ' HB3' ' CD1' ' B' ' 158' ' ' LEU . . . -65.7 -28.67 69.24 Favored 'General case' 0 N--CA 1.498 1.971 0 O-C-N 121.345 -0.847 . . . . 0.0 109.778 178.821 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 24' ' ' PHE . . . . . . . . . . . . . 23.7 t80 -69.53 -34.03 73.65 Favored 'General case' 0 N--CA 1.495 1.787 0 O-C-N 121.581 -0.7 . . . . 0.0 110.188 179.514 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 25' ' ' ASP . . . . . . . . . . . . . 21.5 m-20 -52.26 -53.11 47.99 Favored 'General case' 0 N--CA 1.501 2.12 0 O-C-N 121.367 -0.833 . . . . 0.0 111.024 179.875 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 26' ' ' ILE . . . . . 0.498 ' HA ' HD22 ' A' ' 29' ' ' LEU . 1.1 pt -75.01 -20.46 16.48 Favored 'Isoleucine or valine' 0 N--CA 1.503 2.179 0 O-C-N 121.256 -0.902 . . . . 0.0 111.077 -179.866 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 27' ' ' PHE . . . . . 0.415 ' CZ ' HG23 ' A' ' 44' ' ' VAL . 0.1 OUTLIER -75.83 -17.5 59.81 Favored 'General case' 0 N--CA 1.496 1.848 0 O-C-N 120.933 -1.104 . . . . 0.0 110.196 179.169 . . . . . . . . 3 3 . 1 . 010 nuclear orig core ' A' A ' 28' ' ' VAL . . . . . . . . . . . . . 20.6 m -129.25 26.27 1.92 Allowed 'Isoleucine or valine' 0 N--CA 1.499 1.997 0 O-C-N 121.305 -0.872 . . . . 0.0 110.74 179.93 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 29' ' ' LEU . . . . . 0.498 HD22 ' HA ' ' A' ' 26' ' ' ILE . 3.5 pp -74.29 -27.32 60.67 Favored 'General case' 0 N--CA 1.501 2.094 0 O-C-N 120.996 -1.065 . . . . 0.0 111.068 -179.854 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 30' ' ' GLY . . . . . . . . . . . . . . . -105.72 42.27 1.95 Allowed Glycine 0 N--CA 1.495 2.607 0 N-CA-C 109.784 -1.326 . . . . 0.0 109.784 179.866 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 31' ' ' ALA . . . . . 0.435 ' HB3' ' HG3' ' A' ' 40' ' ' GLU . . . . . . . . 0 N--CA 1.494 1.756 0 O-C-N 121.395 -1.062 . . . . 0.0 110.426 -179.847 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 35' ' ' CYS . . . . . . . . . . . . . 64.2 m . . . . . 0 N--CA 1.495 1.818 0 CA-C-O 121.135 0.493 . . . . 0.0 110.116 . . . . . . . . . 0 0 . 1 . 010 nuclear orig core ' A' A ' 36' ' ' ILE . . . . . 0.457 HG21 HD21 ' A' ' 41' ' ' LEU . 78.7 mt -81.34 105.07 10.81 Favored 'Isoleucine or valine' 0 N--CA 1.498 1.946 0 O-C-N 121.142 -0.974 . . . . 0.0 110.21 -179.907 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 37' ' ' SER . . . . . . . . . . . . . 89.2 p -96.14 -177.24 3.92 Favored 'General case' 0 N--CA 1.495 1.809 0 O-C-N 121.502 -0.749 . . . . 0.0 110.237 179.773 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 38' ' ' THR . . . . . 0.442 ' HB ' ' O ' ' A' ' 54' ' ' PRO . 1.8 p -59.38 -43.94 92.83 Favored 'General case' 0 N--CA 1.502 2.129 0 O-C-N 121.438 -0.789 . . . . 0.0 110.459 179.789 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 39' ' ' LYS . . . . . 0.565 ' HA ' ' HB3' ' A' ' 54' ' ' PRO . 0.0 OUTLIER -62.98 -45.52 92.02 Favored 'General case' 0 N--CA 1.496 1.85 0 O-C-N 121.57 -0.706 . . . . 0.0 110.092 179.527 . . . . . . . . 3 3 . 1 . 010 nuclear orig core ' A' A ' 40' ' ' GLU . . . . . 0.435 ' HG3' ' HB3' ' A' ' 31' ' ' ALA . 19.0 mm-40 -69.42 -29.03 66.66 Favored 'General case' 0 N--CA 1.498 1.947 0 O-C-N 121.414 -0.804 . . . . 0.0 110.39 179.647 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 41' ' ' LEU . . . . . 0.457 HD21 HG21 ' A' ' 36' ' ' ILE . 0.1 OUTLIER -73.32 -61.29 1.88 Allowed 'General case' 0 N--CA 1.497 1.904 0 O-C-N 121.253 -0.904 . . . . 0.0 108.833 178.603 . . . . . . . . 3 3 . 1 . 010 nuclear orig core ' A' A ' 42' ' ' GLY . . . . . 0.543 ' HA2' ' HB2' ' A' ' 45' ' ' MET . . . -49.53 -30.96 13.75 Favored Glycine 0 N--CA 1.499 2.856 0 N-CA-C 109.933 -1.267 . . . . 0.0 109.933 179.112 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 43' ' ' LYS . . . . . 0.43 ' HB3' ' O ' ' A' ' 40' ' ' GLU . 0.9 OUTLIER -48.98 -48.87 42.9 Favored 'General case' 0 N--CA 1.502 2.145 0 O-C-N 121.623 -0.928 . . . . 0.0 110.653 179.344 . . . . . . . . 3 3 . 1 . 010 nuclear orig core ' A' A ' 44' ' ' VAL . . . . . 0.415 HG23 ' CZ ' ' A' ' 27' ' ' PHE . 28.5 m -82.87 -23.86 8.54 Favored 'Isoleucine or valine' 0 N--CA 1.501 2.092 0 O-C-N 121.373 -0.83 . . . . 0.0 110.461 179.563 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 45' ' ' MET . . . . . 0.543 ' HB2' ' HA2' ' A' ' 42' ' ' GLY . 0.0 OUTLIER -65.43 -38.27 89.4 Favored 'General case' 0 N--CA 1.499 1.997 0 O-C-N 121.337 -0.852 . . . . 0.0 110.321 179.404 . . . . . . . . 3 3 . 1 . 010 nuclear orig core ' A' A ' 46' ' ' ARG . . . . . 0.435 ' CB ' ' HB3' ' A' ' 51' ' ' ASN . 13.2 ttt180 -62.19 -51.58 67.23 Favored 'General case' 0 N--CA 1.5 2.039 0 O-C-N 121.626 -0.671 . . . . 0.0 110.962 -179.746 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 47' ' ' MET . . . . . . . . . . . . . 4.9 ptm -67.25 -28.23 67.88 Favored 'General case' 0 N--CA 1.498 1.971 0 O-C-N 121.296 -0.877 . . . . 0.0 111.186 -179.661 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 48' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -79.83 -46.01 17.69 Favored 'General case' 0 N--CA 1.497 1.879 0 O-C-N 121.051 -1.031 . . . . 0.0 110.708 179.932 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 49' ' ' GLY . . . . . . . . . . . . . . . -147.21 -77.83 0.02 OUTLIER Glycine 0 N--CA 1.496 2.679 0 N-CA-C 110.107 -1.197 . . . . 0.0 110.107 -179.875 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 50' ' ' GLN . . . . . . . . . . . . . 2.4 pp0? -147.98 160.72 42.53 Favored 'General case' 0 N--CA 1.498 1.946 0 O-C-N 121.306 -1.114 . . . . 0.0 111.083 -179.822 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 51' ' ' ASN . . . . . 0.435 ' HB3' ' CB ' ' A' ' 46' ' ' ARG . 24.7 t30 -175.0 93.44 0.29 Allowed Pre-proline 0 N--CA 1.494 1.764 0 O-C-N 121.779 -0.576 . . . . 0.0 109.641 179.467 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 52' ' ' PRO . . . . . . . . . . . . . 42.1 Cg_endo -73.17 -65.95 0.03 OUTLIER 'Trans proline' 0 C--N 1.312 -1.387 0 O-C-N 123.658 1.346 . . . . 0.0 110.187 -179.943 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 53' ' ' THR . . . . . . . . . . . . . 1.8 p -129.94 155.76 80.1 Favored Pre-proline 0 N--CA 1.489 1.512 0 O-C-N 121.4 -0.813 . . . . 0.0 109.579 179.29 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 54' ' ' PRO . . . . . 0.565 ' HB3' ' HA ' ' A' ' 39' ' ' LYS . 40.4 Cg_endo -66.29 -28.3 47.43 Favored 'Trans proline' 0 C--N 1.31 -1.475 0 O-C-N 123.742 1.39 . . . . 0.0 111.071 -179.982 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 55' ' ' GLU . . . . . . . . . . . . . 1.1 mp0 -60.03 -34.85 73.94 Favored 'General case' 0 N--CA 1.501 2.117 0 O-C-N 121.218 -0.926 . . . . 0.0 110.684 179.559 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 27.1 tt0 -62.52 -21.75 65.77 Favored 'General case' 0 N--CA 1.5 2.059 0 O-C-N 121.404 -0.81 . . . . 0.0 111.529 -179.886 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 57' ' ' LEU . . . . . 0.447 ' N ' ' CD2' ' A' ' 57' ' ' LEU . 3.4 mm? -79.44 -12.51 59.89 Favored 'General case' 0 N--CA 1.499 2.018 0 O-C-N 121.022 -1.049 . . . . 0.0 111.115 -179.916 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 58' ' ' GLN . . . . . 0.431 ' O ' HG22 ' A' ' 61' ' ' ILE . 5.0 pt20 -52.65 -35.36 54.75 Favored 'General case' 0 N--CA 1.5 2.041 0 O-C-N 121.072 -1.018 . . . . 0.0 110.445 -179.712 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 59' ' ' GLU . . . . . . . . . . . . . 6.8 mm-40 -56.22 -34.4 66.27 Favored 'General case' 0 N--CA 1.5 2.038 0 O-C-N 121.02 -1.05 . . . . 0.0 109.891 178.834 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 60' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -82.22 -33.17 29.44 Favored 'General case' 0 N--CA 1.495 1.813 0 O-C-N 121.68 -0.637 . . . . 0.0 110.625 179.522 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 61' ' ' ILE . . . . . 0.468 HG13 HG21 ' A' ' 72' ' ' VAL . 3.4 tt -81.4 -31.69 11.57 Favored 'Isoleucine or valine' 0 N--CA 1.498 1.955 0 O-C-N 121.17 -0.956 . . . . 0.0 111.044 -179.505 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 62' ' ' ASP . . . . . 0.417 ' N ' HG22 ' A' ' 61' ' ' ILE . 6.7 m-20 -69.44 -44.85 70.45 Favored 'General case' 0 N--CA 1.496 1.849 0 O-C-N 121.125 -0.984 . . . . 0.0 111.032 -179.679 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 63' ' ' GLU . . . . . 0.443 ' HG3' ' N ' ' A' ' 64' ' ' VAL . 0.6 OUTLIER -62.47 -23.49 66.94 Favored 'General case' 0 N--CA 1.501 2.076 0 O-C-N 121.333 -0.854 . . . . 0.0 111.714 -179.43 . . . . . . . . 3 3 . 1 . 010 nuclear orig core ' A' A ' 64' ' ' VAL . . . . . 0.443 ' N ' ' HG3' ' A' ' 63' ' ' GLU . 44.2 t -107.85 -24.9 3.83 Favored 'Isoleucine or valine' 0 N--CA 1.501 2.096 0 O-C-N 121.014 -1.054 . . . . 0.0 111.648 -179.235 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 65' ' ' ASP . . . . . . . . . . . . . 22.4 t70 -75.91 -91.39 0.03 OUTLIER 'General case' 0 N--CA 1.5 2.028 0 O-C-N 120.949 -1.094 . . . . 0.0 110.456 -179.627 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 66' ' ' GLU . . . . . . . . . . . . . 3.6 mm-40 49.28 33.37 5.14 Favored 'General case' 0 N--CA 1.502 2.174 0 O-C-N 121.333 -0.854 . . . . 0.0 111.544 179.958 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 67' ' ' ASP . . . . . . . . . . . . . 1.9 p-10 -115.24 -22.7 9.3 Favored 'General case' 0 N--CA 1.499 2.018 0 O-C-N 120.968 -1.082 . . . . 0.0 111.475 -179.932 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 68' ' ' GLY . . . . . . . . . . . . . . . 127.68 -30.78 3.91 Favored Glycine 0 N--CA 1.495 2.592 0 N-CA-C 110.074 -1.21 . . . . 0.0 110.074 -179.849 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 69' ' ' SER . . . . . . . . . . . . . 0.9 OUTLIER -78.24 -35.36 48.38 Favored 'General case' 0 N--CA 1.497 1.916 0 O-C-N 121.289 -1.124 . . . . 0.0 111.033 -179.786 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 70' ' ' GLY . . . . . . . . . . . . . . . 91.26 -50.49 3.04 Favored Glycine 0 N--CA 1.499 2.883 0 N-CA-C 110.197 -1.161 . . . . 0.0 110.197 179.89 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 71' ' ' THR . . . . . . . . . . . . . 54.9 m -79.13 154.58 29.23 Favored 'General case' 0 N--CA 1.502 2.13 0 O-C-N 121.298 -1.119 . . . . 0.0 110.977 -179.417 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 72' ' ' VAL . . . . . 0.468 HG21 HG13 ' A' ' 61' ' ' ILE . 2.4 t -81.57 128.82 38.39 Favored 'Isoleucine or valine' 0 N--CA 1.498 1.974 0 O-C-N 121.727 -0.608 . . . . 0.0 110.453 179.728 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 73' ' ' ASP . . . . . . . . . . . . . 1.4 p30 -102.44 -161.07 0.82 Allowed 'General case' 0 N--CA 1.498 1.927 0 O-C-N 121.574 -0.704 . . . . 0.0 109.881 179.263 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 74' ' ' PHE . . . . . . . . . . . . . 45.5 t80 -67.99 -53.06 28.84 Favored 'General case' 0 N--CA 1.499 1.983 0 O-C-N 121.129 -0.982 . . . . 0.0 110.69 -179.577 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 75' ' ' ASP . . . . . . . . . . . . . 1.0 OUTLIER -59.5 -43.01 93.44 Favored 'General case' 0 N--CA 1.498 1.927 0 O-C-N 121.498 -0.751 . . . . 0.0 110.473 179.91 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 76' ' ' GLU . . . . . 0.426 ' HG2' HG13 ' A' ' 64' ' ' VAL . 1.5 mt-10 -65.13 -42.2 94.08 Favored 'General case' 0 N--CA 1.497 1.917 0 O-C-N 121.498 -0.751 . . . . 0.0 109.961 179.335 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 77' ' ' PHE . . . . . . . . . . . . . 25.4 t80 -59.26 -37.34 77.38 Favored 'General case' 0 N--CA 1.497 1.886 0 O-C-N 121.483 -0.761 . . . . 0.0 109.658 179.155 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 78' ' ' LEU . . . . . . . . . . . . . 41.4 mt -66.36 -34.18 77.39 Favored 'General case' 0 N--CA 1.497 1.893 0 O-C-N 121.411 -0.806 . . . . 0.0 109.914 178.987 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 79' ' ' VAL . . . . . 0.518 ' HA ' HG21 ' A' ' 9' ' ' VAL . 55.3 t -64.25 -42.93 96.96 Favored 'Isoleucine or valine' 0 N--CA 1.498 1.955 0 O-C-N 121.359 -0.838 . . . . 0.0 109.699 179.056 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 80' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -60.48 -34.14 73.62 Favored 'General case' 0 N--CA 1.498 1.937 0 O-C-N 121.4 -0.813 . . . . 0.0 110.034 179.318 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 81' ' ' MET . . . . . . . . . . . . . 8.9 mmt -62.92 -53.44 53.98 Favored 'General case' 0 N--CA 1.498 1.955 0 O-C-N 121.459 -0.776 . . . . 0.0 110.34 179.732 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 82' ' ' VAL . . . . . . . . . . . . . 0.6 OUTLIER -66.7 -24.55 33.01 Favored 'Isoleucine or valine' 0 N--CA 1.503 2.189 0 O-C-N 121.165 -0.959 . . . . 0.0 110.035 179.236 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 83' ' ' ARG . . . . . . . . . . . . . 0.6 OUTLIER -78.38 -35.18 47.64 Favored 'General case' 0 N--CA 1.497 1.921 0 O-C-N 121.248 -0.907 . . . . 0.0 109.613 178.829 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 84' ' ' CYS . . . . . . . . . . . . . 1.0 OUTLIER -70.03 -28.91 65.87 Favored 'General case' 0 N--CA 1.498 1.942 0 O-C-N 121.504 -0.747 . . . . 0.0 110.645 179.531 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 85' ' ' MET . . . . . . . . . . . . . 34.0 mtt . . . . . 0 N--CA 1.502 2.158 0 O-C-N 121.68 -0.637 . . . . 0.0 110.759 179.867 . . . . . . . . 0 0 . 1 . 010 nuclear orig core ' B' B ' 149' ' ' SER . . . . . . . . . . . . . 6.5 t . . . . . 0 N--CA 1.498 1.97 0 CA-C-O 121.132 0.491 . . . . 0.0 110.728 . . . . . . . . . 0 0 . 1 . 010 nuclear orig core ' B' B ' 150' ' ' ALA . . . . . . . . . . . . . . . -56.35 -43.15 78.82 Favored 'General case' 0 N--CA 1.498 1.944 0 O-C-N 121.494 -0.754 . . . . 0.0 110.543 179.767 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' B' B ' 151' ' ' ASP . . . . . . . . . . . . . 4.8 m-20 -71.11 -48.11 54.15 Favored 'General case' 0 N--CA 1.498 1.95 0 O-C-N 121.406 -0.809 . . . . 0.0 110.28 179.786 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' B' B ' 152' ' ' ALA . . . . . . . . . . . . . . . -60.53 -48.3 82.38 Favored 'General case' 0 N--CA 1.498 1.949 0 O-C-N 121.544 -0.723 . . . . 0.0 110.648 179.88 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' B' B ' 153' ' ' MET . . . . . . . . . . . . . 0.5 OUTLIER -63.25 -37.72 88.35 Favored 'General case' 0 N--CA 1.499 1.985 0 O-C-N 121.364 -0.835 . . . . 0.0 110.195 179.693 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' B' B ' 154' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -65.47 -42.76 91.89 Favored 'General case' 0 N--CA 1.497 1.922 0 O-C-N 121.285 -0.884 . . . . 0.0 110.144 179.461 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' B' B ' 155' ' ' GLN . . . . . . . . . . . . . 14.3 mt-30 -62.92 -42.0 99.65 Favored 'General case' 0 N--CA 1.5 2.053 0 O-C-N 121.54 -0.725 . . . . 0.0 110.32 179.424 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' B' B ' 156' ' ' ALA . . . . . . . . . . . . . . . -70.0 -36.26 75.0 Favored 'General case' 0 N--CA 1.496 1.858 0 O-C-N 121.438 -0.789 . . . . 0.0 110.171 179.73 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' B' B ' 157' ' ' LEU . . . . . . . . . . . . . 4.1 mp -71.05 -61.74 1.65 Allowed 'General case' 0 N--CA 1.496 1.841 0 O-C-N 121.645 -0.659 . . . . 0.0 110.351 -179.967 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' B' B ' 158' ' ' LEU . . . . . 0.41 ' CD1' ' HB3' ' A' ' 23' ' ' ALA . 17.5 mt . . . . . 0 N--CA 1.497 1.918 0 O-C-N 121.261 -0.899 . . . . 0.0 109.971 179.821 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 4' ' ' ILE . . . . . . . . . . . . . 11.6 mt . . . . . 0 N--CA 1.503 2.219 0 CA-C-O 120.798 0.333 . . . . 0.0 110.267 . . . . . . . . . 0 0 . 1 . 011 nuclear orig core ' A' A ' 5' ' ' TYR . . . . . . . . . . . . . 6.8 m-85 -73.52 -34.31 65.18 Favored 'General case' 0 N--CA 1.5 2.051 0 O-C-N 121.288 -0.883 . . . . 0.0 109.967 179.155 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 6' ' ' LYS . . . . . 0.462 ' O ' HG11 ' A' ' 9' ' ' VAL . 0.0 OUTLIER -59.78 -32.34 70.51 Favored 'General case' 0 N--CA 1.497 1.924 0 O-C-N 121.44 -0.787 . . . . 0.0 110.214 179.576 . . . . . . . . 3 3 . 1 . 011 nuclear orig core ' A' A ' 7' ' ' ALA . . . . . . . . . . . . . . . -55.88 -34.32 65.39 Favored 'General case' 0 N--CA 1.497 1.912 0 O-C-N 121.282 -0.886 . . . . 0.0 109.693 178.865 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 8' ' ' ALA . . . . . . . . . . . . . . . -71.72 -45.42 61.84 Favored 'General case' 0 N--CA 1.497 1.892 0 O-C-N 121.523 -0.736 . . . . 0.0 110.331 179.375 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 9' ' ' VAL . . . . . 0.514 ' HA ' HD11 ' A' ' 12' ' ' LEU . 0.3 OUTLIER -63.66 -28.98 46.1 Favored 'Isoleucine or valine' 0 N--CA 1.5 2.064 0 O-C-N 121.152 -0.967 . . . . 0.0 109.999 179.398 . . . . . . . . 3 3 . 1 . 011 nuclear orig core ' A' A ' 10' ' ' GLU . . . . . . . . . . . . . 1.1 tt0 -73.26 -31.98 64.41 Favored 'General case' 0 N--CA 1.493 1.677 0 O-C-N 121.606 -0.684 . . . . 0.0 110.366 179.299 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 11' ' ' GLN . . . . . . . . . . . . . 27.4 mt-30 -85.22 2.81 42.2 Favored 'General case' 0 N--CA 1.499 2.008 0 O-C-N 121.331 -0.856 . . . . 0.0 111.577 -179.84 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 12' ' ' LEU . . . . . 0.514 HD11 ' HA ' ' A' ' 9' ' ' VAL . 4.5 mt -73.2 136.83 44.75 Favored 'General case' 0 N--CA 1.5 2.033 0 O-C-N 120.877 -1.14 . . . . 0.0 110.197 179.823 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 13' ' ' THR . . . . . . . . . . . . . 3.2 m -92.26 157.6 16.58 Favored 'General case' 0 N--CA 1.503 2.196 0 O-C-N 121.323 -0.861 . . . . 0.0 111.008 -179.602 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 14' ' ' GLU . . . . . . . . . . . . . 8.5 tp10 -51.96 -41.75 62.35 Favored 'General case' 0 N--CA 1.496 1.847 0 O-C-N 121.809 -0.557 . . . . 0.0 110.607 -179.918 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 23.5 mt-10 -58.5 -43.78 89.22 Favored 'General case' 0 N--CA 1.498 1.967 0 O-C-N 121.544 -0.723 . . . . 0.0 110.512 179.56 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 16' ' ' GLN . . . . . . . . . . . . . 0.8 OUTLIER -70.5 -37.07 74.11 Favored 'General case' 0 N--CA 1.498 1.931 0 O-C-N 121.491 -0.755 . . . . 0.0 110.284 179.745 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 17' ' ' LYS . . . . . . . . . . . . . 2.6 tptt -62.98 -45.68 91.28 Favored 'General case' 0 N--CA 1.496 1.873 0 N-CA-C 109.083 -0.71 . . . . 0.0 109.083 178.756 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 18' ' ' ASN . . . . . . . . . . . . . 15.7 m-80 -70.07 -27.98 65.06 Favored 'General case' 0 N--CA 1.497 1.901 0 O-C-N 121.439 -0.788 . . . . 0.0 109.757 178.642 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 7.3 tt0 -67.33 -51.42 52.56 Favored 'General case' 0 N--CA 1.495 1.776 0 O-C-N 121.445 -0.784 . . . . 0.0 109.247 178.967 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 20' ' ' PHE . . . . . . . . . . . . . 30.6 m-85 -67.19 -27.4 67.23 Favored 'General case' 0 N--CA 1.497 1.877 0 O-C-N 121.328 -0.858 . . . . 0.0 109.798 178.936 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 21' ' ' LYS . . . . . . . . . . . . . 3.1 tptt -58.04 -46.82 84.73 Favored 'General case' 0 N--CA 1.499 1.995 0 O-C-N 121.377 -0.827 . . . . 0.0 109.62 178.885 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 22' ' ' ALA . . . . . . . . . . . . . . . -63.27 -46.67 85.71 Favored 'General case' 0 N--CA 1.496 1.832 0 O-C-N 121.541 -0.725 . . . . 0.0 109.745 179.235 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 23' ' ' ALA . . . . . . . . . . . . . . . -60.65 -42.88 97.87 Favored 'General case' 0 N--CA 1.498 1.962 0 O-C-N 121.516 -0.74 . . . . 0.0 109.625 178.946 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 24' ' ' PHE . . . . . . . . . . . . . 59.4 t80 -59.38 -47.92 83.6 Favored 'General case' 0 N--CA 1.494 1.766 0 O-C-N 121.567 -0.708 . . . . 0.0 109.666 179.139 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 25' ' ' ASP . . . . . . . . . . . . . 1.1 m-20 -56.39 -41.41 76.21 Favored 'General case' 0 N--CA 1.498 1.955 0 O-C-N 121.692 -0.63 . . . . 0.0 110.393 179.475 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 26' ' ' ILE . . . . . 0.525 HG21 ' HG ' ' B' ' 157' ' ' LEU . 38.1 mm -64.87 -30.12 49.39 Favored 'Isoleucine or valine' 0 N--CA 1.501 2.109 0 O-C-N 121.389 -0.819 . . . . 0.0 110.047 179.262 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 27' ' ' PHE . . . . . 0.451 ' CE1' ' HB ' ' A' ' 44' ' ' VAL . 0.1 OUTLIER -75.38 -28.98 59.71 Favored 'General case' 0 N--CA 1.496 1.833 0 O-C-N 121.435 -0.791 . . . . 0.0 111.115 -179.954 . . . . . . . . 3 3 . 1 . 011 nuclear orig core ' A' A ' 28' ' ' VAL . . . . . 0.402 HG12 ' HG3' ' A' ' 40' ' ' GLU . 0.0 OUTLIER -113.75 -79.17 0.38 Allowed 'Isoleucine or valine' 0 N--CA 1.498 1.95 0 O-C-N 121.138 -0.976 . . . . 0.0 110.748 179.859 . . . . . . . . 3 3 . 1 . 011 nuclear orig core ' A' A ' 29' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER 67.19 -68.89 0.14 Allowed 'General case' 0 N--CA 1.504 2.262 0 O-C-N 121.644 -0.66 . . . . 0.0 110.407 -179.615 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 30' ' ' GLY . . . . . . . . . . . . . . . -98.36 40.84 2.37 Favored Glycine 0 N--CA 1.494 2.545 0 N-CA-C 109.538 -1.425 . . . . 0.0 109.538 179.138 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 31' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.499 2.017 0 O-C-N 121.306 -1.114 . . . . 0.0 110.681 -179.892 . . . . . . . . 0 0 . 1 . 011 nuclear orig core ' A' A ' 35' ' ' CYS . . . . . . . . . . . . . 12.9 p . . . . . 0 N--CA 1.496 1.835 0 CA-C-O 121.111 0.481 . . . . 0.0 110.4 . . . . . . . . . 0 0 . 1 . 011 nuclear orig core ' A' A ' 36' ' ' ILE . . . . . . . . . . . . . 69.5 mt -78.05 96.42 1.85 Allowed 'Isoleucine or valine' 0 N--CA 1.496 1.86 0 O-C-N 121.416 -0.802 . . . . 0.0 110.059 -179.988 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 37' ' ' SER . . . . . . . . . . . . . 91.5 p -87.92 -176.79 5.6 Favored 'General case' 0 N--CA 1.496 1.833 0 O-C-N 121.407 -0.808 . . . . 0.0 109.766 179.452 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 38' ' ' THR . . . . . . . . . . . . . 7.3 p -55.45 -36.98 67.14 Favored 'General case' 0 N--CA 1.5 2.032 0 O-C-N 121.361 -0.837 . . . . 0.0 110.487 179.819 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 39' ' ' LYS . . . . . . . . . . . . . 4.2 mtmp? -71.23 -44.92 64.41 Favored 'General case' 0 N--CA 1.499 1.983 0 O-C-N 121.416 -0.802 . . . . 0.0 110.583 179.818 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 40' ' ' GLU . . . . . 0.402 ' HG3' HG12 ' A' ' 28' ' ' VAL . 9.9 mm-40 -63.61 -38.61 91.76 Favored 'General case' 0 N--CA 1.501 2.094 0 O-C-N 121.393 -0.817 . . . . 0.0 110.647 -179.811 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 41' ' ' LEU . . . . . 0.538 HD12 ' CD1' ' A' ' 57' ' ' LEU . 1.8 tm? -66.14 -66.39 0.56 Allowed 'General case' 0 N--CA 1.499 2.0 0 O-C-N 121.297 -0.877 . . . . 0.0 109.346 179.124 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 42' ' ' GLY . . . . . 0.6 ' HA2' ' HB2' ' A' ' 45' ' ' MET . . . -48.03 -33.28 10.08 Favored Glycine 0 N--CA 1.501 3.011 0 N-CA-C 110.873 -0.891 . . . . 0.0 110.873 179.881 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 43' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -52.52 -46.24 66.61 Favored 'General case' 0 N--CA 1.503 2.178 0 O-C-N 121.383 -1.069 . . . . 0.0 110.566 179.54 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 44' ' ' VAL . . . . . 0.451 ' HB ' ' CE1' ' A' ' 27' ' ' PHE . 60.4 t -87.99 -21.61 7.02 Favored 'Isoleucine or valine' 0 N--CA 1.499 1.992 0 O-C-N 121.446 -0.784 . . . . 0.0 110.673 179.828 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 45' ' ' MET . . . . . 0.6 ' HB2' ' HA2' ' A' ' 42' ' ' GLY . 0.2 OUTLIER -57.44 -24.91 58.41 Favored 'General case' 0 N--CA 1.502 2.165 0 O-C-N 121.214 -0.929 . . . . 0.0 111.55 -179.957 . . . . . . . . 3 3 . 1 . 011 nuclear orig core ' A' A ' 46' ' ' ARG . . . . . 0.453 ' HA ' ' HG3' ' A' ' 50' ' ' GLN . 4.9 mtm180 -50.33 -36.06 30.39 Favored 'General case' 0 N--CA 1.502 2.13 0 O-C-N 121.321 -0.862 . . . . 0.0 111.119 179.989 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 47' ' ' MET . . . . . . . . . . . . . 20.3 mtm -80.15 -30.86 38.99 Favored 'General case' 0 N--CA 1.497 1.899 0 O-C-N 121.359 -0.838 . . . . 0.0 110.889 -179.96 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 48' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -134.47 84.43 2.11 Favored 'General case' 0 N--CA 1.485 1.287 0 O-C-N 121.211 -0.93 . . . . 0.0 110.872 -179.457 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 49' ' ' GLY . . . . . . . . . . . . . . . 81.02 89.95 0.55 Allowed Glycine 0 N--CA 1.495 2.614 0 N-CA-C 109.828 -1.309 . . . . 0.0 109.828 179.722 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 50' ' ' GLN . . . . . 0.453 ' HG3' ' HA ' ' A' ' 46' ' ' ARG . 7.9 mp0 -65.83 152.49 44.29 Favored 'General case' 0 N--CA 1.498 1.953 0 O-C-N 121.525 -0.985 . . . . 0.0 110.661 -179.943 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 51' ' ' ASN . . . . . . . . . . . . . 16.3 p-10 -97.41 110.84 56.47 Favored Pre-proline 0 N--CA 1.494 1.76 0 O-C-N 121.535 -0.728 . . . . 0.0 110.125 179.551 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 52' ' ' PRO . . . . . . . . . . . . . 41.7 Cg_endo -69.21 -43.33 3.19 Favored 'Trans proline' 0 C--N 1.312 -1.343 0 O-C-N 123.676 1.356 . . . . 0.0 110.832 -179.885 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 53' ' ' THR . . . . . . . . . . . . . 0.6 OUTLIER -126.93 146.78 58.78 Favored Pre-proline 0 N--CA 1.495 1.824 0 O-C-N 121.336 -0.853 . . . . 0.0 110.282 -179.991 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 54' ' ' PRO . . . . . . . . . . . . . 40.9 Cg_endo -67.37 -36.96 18.91 Favored 'Trans proline' 0 N--CA 1.491 1.371 0 O-C-N 123.729 1.384 . . . . 0.0 110.781 179.811 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 55' ' ' GLU . . . . . 0.476 ' HG2' ' N ' ' A' ' 56' ' ' GLU . 3.1 pm0 -64.29 -24.6 67.72 Favored 'General case' 0 N--CA 1.498 1.965 0 O-C-N 121.365 -0.834 . . . . 0.0 110.748 179.432 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 56' ' ' GLU . . . . . 0.476 ' N ' ' HG2' ' A' ' 55' ' ' GLU . 27.0 tt0 -65.35 -25.41 67.57 Favored 'General case' 0 N--CA 1.498 1.951 0 O-C-N 121.174 -0.954 . . . . 0.0 110.401 179.399 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 57' ' ' LEU . . . . . 0.538 ' CD1' HD12 ' A' ' 41' ' ' LEU . 4.7 mt -94.13 -18.79 21.41 Favored 'General case' 0 N--CA 1.496 1.85 0 O-C-N 121.155 -0.966 . . . . 0.0 110.189 179.362 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 58' ' ' GLN . . . . . . . . . . . . . 4.0 mm100 -59.78 -39.84 86.27 Favored 'General case' 0 N--CA 1.499 2.016 0 O-C-N 121.059 -1.026 . . . . 0.0 109.966 179.638 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 59' ' ' GLU . . . . . 0.518 ' O ' ' HB2' ' A' ' 63' ' ' GLU . 0.0 OUTLIER -59.82 -29.39 68.21 Favored 'General case' 0 N--CA 1.5 2.052 0 O-C-N 121.359 -0.838 . . . . 0.0 109.392 178.576 . . . . . . . . 3 3 . 1 . 011 nuclear orig core ' A' A ' 60' ' ' MET . . . . . 0.425 ' HB2' ' O ' ' A' ' 57' ' ' LEU . 0.0 OUTLIER -72.87 -20.69 61.05 Favored 'General case' 0 N--CA 1.493 1.716 0 O-C-N 121.586 -0.696 . . . . 0.0 109.596 178.207 . . . . . . . . 3 3 . 1 . 011 nuclear orig core ' A' A ' 61' ' ' ILE . . . . . 0.453 ' HA ' HG23 ' A' ' 72' ' ' VAL . 28.9 mm -85.14 -59.21 2.89 Favored 'Isoleucine or valine' 0 N--CA 1.496 1.874 0 O-C-N 121.514 -0.741 . . . . 0.0 110.468 179.941 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 62' ' ' ASP . . . . . . . . . . . . . 25.2 m-20 -60.16 -33.44 72.19 Favored 'General case' 0 N--CA 1.501 2.11 0 O-C-N 121.736 -0.602 . . . . 0.0 112.115 -178.58 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 63' ' ' GLU . . . . . 0.518 ' HB2' ' O ' ' A' ' 59' ' ' GLU . 0.6 OUTLIER -56.35 -42.36 77.63 Favored 'General case' 0 N--CA 1.504 2.266 0 O-C-N 121.169 -0.957 . . . . 0.0 110.939 -179.492 . . . . . . . . 3 3 . 1 . 011 nuclear orig core ' A' A ' 64' ' ' VAL . . . . . 0.463 HG11 ' HB3' ' A' ' 80' ' ' MET . 34.5 m -99.79 -18.0 6.49 Favored 'Isoleucine or valine' 0 N--CA 1.501 2.094 0 O-C-N 121.308 -0.87 . . . . 0.0 111.224 179.872 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 65' ' ' ASP . . . . . 0.463 ' HA ' ' CD ' ' A' ' 76' ' ' GLU . 23.6 t70 -68.37 -87.12 0.02 OUTLIER 'General case' 0 N--CA 1.496 1.831 0 O-C-N 121.371 -0.831 . . . . 0.0 110.521 -179.596 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 66' ' ' GLU . . . . . . . . . . . . . 7.6 mm-40 48.51 33.28 3.91 Favored 'General case' 0 N--CA 1.502 2.135 0 O-C-N 121.35 -0.843 . . . . 0.0 111.171 -179.971 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 67' ' ' ASP . . . . . . . . . . . . . 0.7 OUTLIER -116.88 -18.29 10.21 Favored 'General case' 0 N--CA 1.499 1.995 0 O-C-N 121.104 -0.998 . . . . 0.0 111.601 -179.633 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 68' ' ' GLY . . . . . . . . . . . . . . . 123.05 -30.07 5.14 Favored Glycine 0 N--CA 1.498 2.804 0 N-CA-C 110.42 -1.072 . . . . 0.0 110.42 179.782 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 69' ' ' SER . . . . . . . . . . . . . 1.0 OUTLIER -78.93 -35.58 43.08 Favored 'General case' 0 N--CA 1.499 2.001 0 O-C-N 121.23 -1.159 . . . . 0.0 110.891 -179.635 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 70' ' ' GLY . . . . . . . . . . . . . . . 76.39 28.02 60.57 Favored Glycine 0 N--CA 1.498 2.8 0 N-CA-C 110.391 -1.084 . . . . 0.0 110.391 179.951 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 71' ' ' THR . . . . . . . . . . . . . 2.3 m -144.18 140.67 29.48 Favored 'General case' 0 N--CA 1.499 2.008 0 O-C-N 121.24 -1.153 . . . . 0.0 109.45 179.448 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 72' ' ' VAL . . . . . 0.453 HG23 ' HA ' ' A' ' 61' ' ' ILE . 24.7 t -75.69 124.49 33.82 Favored 'Isoleucine or valine' 0 N--CA 1.497 1.909 0 O-C-N 121.58 -0.7 . . . . 0.0 110.734 -179.586 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 73' ' ' ASP . . . . . . . . . . . . . 1.1 p30 -111.45 -161.38 0.75 Allowed 'General case' 0 N--CA 1.498 1.949 0 O-C-N 121.539 -0.726 . . . . 0.0 110.037 179.258 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 74' ' ' PHE . . . . . . . . . . . . . 16.9 t80 -66.72 -47.99 70.6 Favored 'General case' 0 N--CA 1.5 2.063 0 O-C-N 121.063 -1.023 . . . . 0.0 111.328 -178.91 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 75' ' ' ASP . . . . . 0.414 ' HA ' HD13 ' A' ' 78' ' ' LEU . 0.4 OUTLIER -68.25 -42.65 79.34 Favored 'General case' 0 N--CA 1.496 1.828 0 O-C-N 121.136 -0.978 . . . . 0.0 110.632 -179.621 . . . . . . . . 3 3 . 1 . 011 nuclear orig core ' A' A ' 76' ' ' GLU . . . . . 0.463 ' CD ' ' HA ' ' A' ' 65' ' ' ASP . 2.6 mt-10 -64.86 -30.45 71.45 Favored 'General case' 0 N--CA 1.498 1.935 0 O-C-N 121.207 -0.933 . . . . 0.0 109.742 178.767 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 77' ' ' PHE . . . . . 0.506 ' HA ' ' SD ' ' A' ' 80' ' ' MET . 67.4 t80 -58.96 -28.1 65.98 Favored 'General case' 0 N--CA 1.5 2.056 0 O-C-N 121.539 -0.725 . . . . 0.0 109.835 178.575 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 78' ' ' LEU . . . . . 0.414 HD13 ' HA ' ' A' ' 75' ' ' ASP . 20.0 mt -77.31 -35.36 54.98 Favored 'General case' 0 N--CA 1.495 1.797 0 O-C-N 121.352 -0.843 . . . . 0.0 110.257 179.297 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 79' ' ' VAL . . . . . . . . . . . . . 61.8 t -56.67 -57.21 10.21 Favored 'Isoleucine or valine' 0 N--CA 1.502 2.151 0 O-C-N 121.395 -0.816 . . . . 0.0 110.253 179.795 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 80' ' ' MET . . . . . 0.506 ' SD ' ' HA ' ' A' ' 77' ' ' PHE . 0.0 OUTLIER -57.17 -34.92 68.96 Favored 'General case' 0 N--CA 1.502 2.135 0 O-C-N 121.425 -0.797 . . . . 0.0 110.402 179.626 . . . . . . . . 3 3 . 1 . 011 nuclear orig core ' A' A ' 81' ' ' MET . . . . . . . . . . . . . 12.3 mmt -65.58 -43.87 88.44 Favored 'General case' 0 N--CA 1.498 1.967 0 O-C-N 121.365 -0.834 . . . . 0.0 110.063 179.129 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 82' ' ' VAL . . . . . . . . . . . . . 55.0 t -63.96 -34.62 69.58 Favored 'Isoleucine or valine' 0 N--CA 1.503 2.184 0 O-C-N 121.425 -0.797 . . . . 0.0 110.146 179.317 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 83' ' ' ARG . . . . . . . . . . . . . 31.7 mtt180 -66.5 -44.39 82.72 Favored 'General case' 0 N--CA 1.497 1.915 0 O-C-N 121.548 -0.72 . . . . 0.0 110.381 179.864 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 84' ' ' CYS . . . . . . . . . . . . . 84.1 m -71.95 -39.31 69.47 Favored 'General case' 0 N--CA 1.498 1.953 0 O-C-N 121.434 -0.791 . . . . 0.0 110.003 179.439 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 85' ' ' MET . . . . . . . . . . . . . 38.1 ttp . . . . . 0 N--CA 1.497 1.925 0 O-C-N 121.502 -0.749 . . . . 0.0 110.797 179.527 . . . . . . . . 0 0 . 1 . 011 nuclear orig core ' B' B ' 149' ' ' SER . . . . . . . . . . . . . 78.9 p . . . . . 0 N--CA 1.497 1.9 0 CA-C-O 121.208 0.528 . . . . 0.0 110.449 . . . . . . . . . 0 0 . 1 . 011 nuclear orig core ' B' B ' 150' ' ' ALA . . . . . . . . . . . . . . . -88.75 -45.46 9.77 Favored 'General case' 0 N--CA 1.498 1.944 0 O-C-N 121.258 -0.901 . . . . 0.0 110.523 -179.955 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' B' B ' 151' ' ' ASP . . . . . . . . . . . . . 8.0 p-10 -56.8 -41.64 78.1 Favored 'General case' 0 N--CA 1.503 2.188 0 O-C-N 121.537 -0.727 . . . . 0.0 111.076 -179.977 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' B' B ' 152' ' ' ALA . . . . . . . . . . . . . . . -66.35 -43.09 87.05 Favored 'General case' 0 N--CA 1.498 1.94 0 O-C-N 121.293 -0.879 . . . . 0.0 110.286 179.78 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' B' B ' 153' ' ' MET . . . . . . . . . . . . . 7.3 mmt -63.17 -48.32 78.9 Favored 'General case' 0 N--CA 1.496 1.867 0 O-C-N 121.553 -0.717 . . . . 0.0 109.968 179.516 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' B' B ' 154' ' ' MET . . . . . . . . . . . . . 22.9 mmm -59.99 -37.57 80.05 Favored 'General case' 0 N--CA 1.498 1.957 0 O-C-N 121.566 -0.709 . . . . 0.0 110.092 179.309 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' B' B ' 155' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -69.47 -38.91 77.94 Favored 'General case' 0 N--CA 1.499 2.021 0 O-C-N 121.537 -0.727 . . . . 0.0 110.938 179.696 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' B' B ' 156' ' ' ALA . . . . . . . . . . . . . . . -75.91 -45.34 35.81 Favored 'General case' 0 N--CA 1.498 1.945 0 O-C-N 121.249 -0.907 . . . . 0.0 110.777 -179.507 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' B' B ' 157' ' ' LEU . . . . . 0.525 ' HG ' HG21 ' A' ' 26' ' ' ILE . 1.4 mp -60.08 -37.08 78.84 Favored 'General case' 0 N--CA 1.499 2.024 0 O-C-N 121.469 -0.77 . . . . 0.0 111.142 -179.737 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' B' B ' 158' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER . . . . . 0 N--CA 1.496 1.829 0 O-C-N 121.254 -0.904 . . . . 0.0 110.297 -179.886 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 4' ' ' ILE . . . . . . . . . . . . . 2.0 mp . . . . . 0 N--CA 1.501 2.099 0 CA-C-O 120.666 0.269 . . . . 0.0 110.316 . . . . . . . . . 0 0 . 1 . 012 nuclear orig core ' A' A ' 5' ' ' TYR . . . . . . . . . . . . . 0.4 OUTLIER -55.88 -31.5 62.87 Favored 'General case' 0 N--CA 1.502 2.135 0 O-C-N 121.333 -0.854 . . . . 0.0 110.181 179.448 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -58.02 -38.35 76.02 Favored 'General case' 0 N--CA 1.497 1.886 0 O-C-N 121.602 -0.686 . . . . 0.0 110.589 179.408 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 7' ' ' ALA . . . . . . . . . . . . . . . -61.42 -44.16 97.62 Favored 'General case' 0 N--CA 1.499 2.024 0 O-C-N 121.396 -0.815 . . . . 0.0 110.643 179.644 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 8' ' ' ALA . . . . . . . . . . . . . . . -74.73 -12.26 60.37 Favored 'General case' 0 N--CA 1.499 2.018 0 O-C-N 121.302 -0.874 . . . . 0.0 111.371 179.988 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 9' ' ' VAL . . . . . . . . . . . . . 48.1 t -101.58 -52.68 8.23 Favored 'Isoleucine or valine' 0 N--CA 1.498 1.961 0 O-C-N 121.142 -0.974 . . . . 0.0 110.601 -179.684 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 10' ' ' GLU . . . . . . . . . . . . . 21.9 mm-40 -86.77 -18.62 30.65 Favored 'General case' 0 N--CA 1.494 1.765 0 O-C-N 121.303 -0.873 . . . . 0.0 111.163 -179.544 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 11' ' ' GLN . . . . . . . . . . . . . 0.6 OUTLIER -120.27 59.29 0.9 Allowed 'General case' 0 N--CA 1.496 1.86 0 O-C-N 120.974 -1.078 . . . . 0.0 111.088 -179.933 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 12' ' ' LEU . . . . . 0.481 HD12 ' HB3' ' A' ' 16' ' ' GLN . 0.0 OUTLIER -92.99 -73.14 0.57 Allowed 'General case' 0 N--CA 1.501 2.121 0 O-C-N 120.988 -1.07 . . . . 0.0 108.721 178.33 . . . . . . . . 3 3 . 1 . 012 nuclear orig core ' A' A ' 13' ' ' THR . . . . . 0.462 ' HB ' ' HB2' ' A' ' 16' ' ' GLN . 1.6 m -152.23 147.53 26.49 Favored 'General case' 0 N--CA 1.498 1.945 0 O-C-N 121.528 -0.732 . . . . 0.0 109.346 179.034 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 14' ' ' GLU . . . . . . . . . . . . . 0.3 OUTLIER -54.07 -46.24 71.95 Favored 'General case' 0 N--CA 1.494 1.728 0 O-C-N 121.714 -0.616 . . . . 0.0 111.013 -179.238 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 7.0 tp10 -76.87 -26.72 54.54 Favored 'General case' 0 N--CA 1.496 1.839 0 O-C-N 121.297 -0.877 . . . . 0.0 111.048 179.96 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 16' ' ' GLN . . . . . 0.481 ' HB3' HD12 ' A' ' 12' ' ' LEU . 2.5 mt-30 -56.23 -42.44 77.3 Favored 'General case' 0 N--CA 1.503 2.191 0 O-C-N 121.156 -0.965 . . . . 0.0 110.711 -179.897 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 17' ' ' LYS . . . . . . . . . . . . . 6.7 mttm -65.95 -45.7 80.83 Favored 'General case' 0 N--CA 1.496 1.863 0 N-CA-C 109.245 -0.65 . . . . 0.0 109.245 179.145 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 18' ' ' ASN . . . . . . . . . . . . . 61.9 t30 -64.07 -37.28 86.88 Favored 'General case' 0 N--CA 1.497 1.906 0 O-C-N 121.779 -0.576 . . . . 0.0 109.628 178.736 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 5.6 tt0 -67.07 -52.62 39.87 Favored 'General case' 0 N--CA 1.495 1.799 0 O-C-N 121.543 -0.723 . . . . 0.0 109.363 179.108 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 20' ' ' PHE . . . . . . . . . . . . . 4.0 m-85 -58.58 -34.16 70.78 Favored 'General case' 0 N--CA 1.499 2.012 0 O-C-N 121.419 -0.801 . . . . 0.0 109.699 179.121 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 21' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -61.43 -46.51 89.8 Favored 'General case' 0 N--CA 1.498 1.925 0 O-C-N 121.439 -0.788 . . . . 0.0 109.19 178.852 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 22' ' ' ALA . . . . . . . . . . . . . . . -59.77 -47.9 83.82 Favored 'General case' 0 N--CA 1.499 1.978 0 O-C-N 121.387 -0.82 . . . . 0.0 109.532 179.107 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 23' ' ' ALA . . . . . . . . . . . . . . . -61.02 -41.02 95.75 Favored 'General case' 0 N--CA 1.497 1.919 0 O-C-N 121.455 -0.778 . . . . 0.0 109.412 178.563 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 24' ' ' PHE . . . . . 0.405 ' O ' HG23 ' A' ' 28' ' ' VAL . 37.7 t80 -67.12 -45.98 75.53 Favored 'General case' 0 N--CA 1.497 1.891 0 O-C-N 121.767 -0.583 . . . . 0.0 110.112 179.339 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 25' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER -53.38 -46.38 69.6 Favored 'General case' 0 N--CA 1.5 2.071 0 O-C-N 121.606 -0.684 . . . . 0.0 110.26 179.72 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 26' ' ' ILE . . . . . 0.485 ' HB ' HD21 ' B' ' 157' ' ' LEU . 51.0 mt -72.45 -30.27 34.05 Favored 'Isoleucine or valine' 0 N--CA 1.497 1.909 0 O-C-N 121.465 -0.772 . . . . 0.0 109.68 179.171 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 27' ' ' PHE . . . . . . . . . . . . . 0.8 OUTLIER -63.52 -38.82 92.59 Favored 'General case' 0 N--CA 1.498 1.932 0 O-C-N 121.434 -0.791 . . . . 0.0 110.299 179.363 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 28' ' ' VAL . . . . . 0.405 HG23 ' O ' ' A' ' 24' ' ' PHE . 34.9 m -93.78 36.68 0.1 Allowed 'Isoleucine or valine' 0 N--CA 1.501 2.11 0 O-C-N 121.265 -0.897 . . . . 0.0 110.811 179.838 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 29' ' ' LEU . . . . . . . . . . . . . 0.9 OUTLIER -70.22 106.45 3.32 Favored 'General case' 0 N--CA 1.499 1.996 0 O-C-N 121.012 -1.055 . . . . 0.0 109.816 179.476 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 30' ' ' GLY . . . . . . . . . . . . . . . 109.9 -30.87 7.97 Favored Glycine 0 N--CA 1.494 2.556 0 N-CA-C 109.352 -1.499 . . . . 0.0 109.352 -179.228 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 31' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.495 1.779 0 O-C-N 121.411 -1.052 . . . . 0.0 109.642 179.549 . . . . . . . . 0 0 . 1 . 012 nuclear orig core ' A' A ' 35' ' ' CYS . . . . . . . . . . . . . 56.3 m . . . . . 0 N--CA 1.496 1.848 0 CA-C-O 121.41 0.624 . . . . 0.0 110.656 . . . . . . . . . 0 0 . 1 . 012 nuclear orig core ' A' A ' 36' ' ' ILE . . . . . . . . . . . . . 0.5 OUTLIER -102.28 112.58 36.02 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.613 0 CA-C-O 121.44 0.638 . . . . 0.0 109.361 179.596 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 37' ' ' SER . . . . . . . . . . . . . 0.2 OUTLIER -108.57 -173.18 2.21 Favored 'General case' 0 N--CA 1.494 1.728 0 O-C-N 121.413 -0.805 . . . . 0.0 110.628 -179.417 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 38' ' ' THR . . . . . . . . . . . . . 57.2 p -66.21 -42.17 89.12 Favored 'General case' 0 N--CA 1.499 1.99 0 O-C-N 121.486 -0.759 . . . . 0.0 110.911 -179.73 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 39' ' ' LYS . . . . . . . . . . . . . 47.9 mtmt -58.43 -45.57 88.21 Favored 'General case' 0 N--CA 1.502 2.13 0 O-C-N 121.45 -0.781 . . . . 0.0 110.731 -179.87 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 1.1 mp0 -71.86 -27.94 63.21 Favored 'General case' 0 N--CA 1.499 2.005 0 O-C-N 121.551 -0.718 . . . . 0.0 110.522 -179.855 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 41' ' ' LEU . . . . . 0.461 HD23 ' HB3' ' A' ' 57' ' ' LEU . 6.9 tp -72.58 -53.48 11.82 Favored 'General case' 0 N--CA 1.497 1.894 0 O-C-N 121.208 -0.932 . . . . 0.0 110.452 179.72 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 42' ' ' GLY . . . . . . . . . . . . . . . -56.44 -35.89 67.98 Favored Glycine 0 N--CA 1.496 2.666 0 N-CA-C 110.4 -1.08 . . . . 0.0 110.4 -179.406 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 43' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -56.56 -37.16 70.17 Favored 'General case' 0 N--CA 1.5 2.052 0 O-C-N 121.345 -1.091 . . . . 0.0 109.907 179.218 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 44' ' ' VAL . . . . . . . . . . . . . 88.6 t -85.18 -31.8 7.06 Favored 'Isoleucine or valine' 0 N--CA 1.497 1.917 0 O-C-N 121.483 -0.76 . . . . 0.0 109.761 178.837 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 45' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -58.52 -53.33 59.5 Favored 'General case' 0 N--CA 1.5 2.034 0 O-C-N 121.398 -0.814 . . . . 0.0 109.96 179.496 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 46' ' ' ARG . . . . . 0.519 ' HA ' ' HB2' ' A' ' 51' ' ' ASN . 1.9 ppt_? -64.25 -28.72 69.93 Favored 'General case' 0 N--CA 1.499 2.011 0 O-C-N 121.377 -0.827 . . . . 0.0 109.938 179.125 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 47' ' ' MET . . . . . . . . . . . . . 13.9 ttp -66.95 -36.22 81.72 Favored 'General case' 0 N--CA 1.495 1.824 0 O-C-N 121.455 -0.778 . . . . 0.0 109.501 178.856 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 48' ' ' LEU . . . . . . . . . . . . . 28.5 mt -75.28 -40.35 58.77 Favored 'General case' 0 N--CA 1.498 1.959 0 O-C-N 121.516 -0.74 . . . . 0.0 110.0 179.151 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 49' ' ' GLY . . . . . . . . . . . . . . . 139.02 -50.81 0.78 Allowed Glycine 0 N--CA 1.495 2.575 0 N-CA-C 109.96 -1.256 . . . . 0.0 109.96 -179.773 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 50' ' ' GLN . . . . . . . . . . . . . 0.6 OUTLIER -84.89 99.69 11.11 Favored 'General case' 0 N--CA 1.498 1.939 0 O-C-N 121.331 -1.1 . . . . 0.0 110.739 -179.662 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 51' ' ' ASN . . . . . 0.519 ' HB2' ' HA ' ' A' ' 46' ' ' ARG . 14.2 t30 -129.69 101.08 18.84 Favored Pre-proline 0 N--CA 1.496 1.856 0 O-C-N 121.473 -0.767 . . . . 0.0 109.992 179.723 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 52' ' ' PRO . . . . . . . . . . . . . 46.1 Cg_endo -73.56 -92.3 0.01 OUTLIER 'Trans proline' 0 C--N 1.314 -1.252 0 O-C-N 123.821 1.432 . . . . 0.0 111.23 -179.569 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 53' ' ' THR . . . . . . . . . . . . . 0.1 OUTLIER -139.54 151.1 65.77 Favored Pre-proline 0 N--CA 1.502 2.164 0 O-C-N 120.918 -1.114 . . . . 0.0 110.432 -179.375 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 54' ' ' PRO . . . . . . . . . . . . . 41.8 Cg_endo -69.21 -40.31 6.37 Favored 'Trans proline' 0 N--CA 1.489 1.247 0 O-C-N 123.841 1.443 . . . . 0.0 110.667 179.807 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 55' ' ' GLU . . . . . . . . . . . . . 3.6 mp0 -66.48 -31.14 71.69 Favored 'General case' 0 N--CA 1.496 1.832 0 O-C-N 121.449 -0.782 . . . . 0.0 109.869 179.375 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 16.0 tt0 -63.7 -34.62 78.28 Favored 'General case' 0 N--CA 1.496 1.838 0 O-C-N 121.528 -0.733 . . . . 0.0 110.231 179.291 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 57' ' ' LEU . . . . . 0.461 ' HB3' HD23 ' A' ' 41' ' ' LEU . 56.7 mt -67.25 -25.63 66.17 Favored 'General case' 0 N--CA 1.496 1.853 0 O-C-N 121.186 -0.946 . . . . 0.0 110.273 179.491 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 58' ' ' GLN . . . . . 0.551 ' O ' HG23 ' A' ' 61' ' ' ILE . 0.0 OUTLIER -64.31 -29.77 70.84 Favored 'General case' 0 N--CA 1.498 1.958 0 O-C-N 121.064 -1.022 . . . . 0.0 108.969 178.793 . . . . . . . . 3 3 . 1 . 012 nuclear orig core ' A' A ' 59' ' ' GLU . . . . . 0.503 ' N ' ' HG3' ' A' ' 58' ' ' GLN . 17.8 mm-40 -81.28 -32.22 33.29 Favored 'General case' 0 N--CA 1.492 1.632 0 N-CA-C 107.89 -1.152 . . . . 0.0 107.89 177.415 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 60' ' ' MET . . . . . 0.422 ' HE1' HD23 ' A' ' 57' ' ' LEU . 0.3 OUTLIER -68.86 -44.4 73.41 Favored 'General case' 0 N--CA 1.495 1.793 0 O-C-N 121.91 -0.494 . . . . 0.0 109.953 178.799 . . . . . . . . 3 3 . 1 . 012 nuclear orig core ' A' A ' 61' ' ' ILE . . . . . 0.551 HG23 ' O ' ' A' ' 58' ' ' GLN . 12.6 tt -62.71 -31.34 51.84 Favored 'Isoleucine or valine' 0 N--CA 1.497 1.915 0 O-C-N 121.493 -0.754 . . . . 0.0 110.201 179.631 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 62' ' ' ASP . . . . . 0.519 ' HA ' ' HB3' ' A' ' 65' ' ' ASP . 17.6 t70 -64.41 -35.47 81.01 Favored 'General case' 0 N--CA 1.499 1.987 0 O-C-N 121.459 -0.776 . . . . 0.0 110.838 179.675 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 63' ' ' GLU . . . . . . . . . . . . . 5.1 tt0 -51.31 -38.51 53.34 Favored 'General case' 0 N--CA 1.503 2.225 0 O-C-N 121.399 -0.813 . . . . 0.0 110.291 179.571 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 64' ' ' VAL . . . . . . . . . . . . . 65.0 t -100.3 -24.67 4.06 Favored 'Isoleucine or valine' 0 N--CA 1.497 1.883 0 O-C-N 121.516 -0.74 . . . . 0.0 109.966 179.015 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 65' ' ' ASP . . . . . 0.519 ' HB3' ' HA ' ' A' ' 62' ' ' ASP . 18.4 t70 -79.57 -93.03 0.04 OUTLIER 'General case' 0 N--CA 1.494 1.728 0 O-C-N 121.529 -0.732 . . . . 0.0 110.58 -179.595 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 66' ' ' GLU . . . . . . . . . . . . . 0.5 OUTLIER 47.05 32.31 1.89 Allowed 'General case' 0 N--CA 1.501 2.12 0 O-C-N 121.389 -0.819 . . . . 0.0 111.073 -179.592 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 67' ' ' ASP . . . . . . . . . . . . . 4.9 p-10 -118.31 1.63 11.85 Favored 'General case' 0 N--CA 1.498 1.926 0 O-C-N 121.135 -0.978 . . . . 0.0 111.695 -179.559 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 68' ' ' GLY . . . . . . . . . . . . . . . 106.13 -41.33 2.2 Favored Glycine 0 N--CA 1.495 2.605 0 N-CA-C 109.908 -1.277 . . . . 0.0 109.908 179.949 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 69' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -60.9 -51.24 70.11 Favored 'General case' 0 N--CA 1.501 2.095 0 O-C-N 121.482 -1.01 . . . . 0.0 110.778 -179.732 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 70' ' ' GLY . . . . . . . . . . . . . . . 100.06 -28.04 17.54 Favored Glycine 0 N--CA 1.498 2.783 0 C-N-CA 120.152 -1.023 . . . . 0.0 110.959 179.535 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 71' ' ' THR . . . . . . . . . . . . . 11.7 t -104.89 159.89 15.44 Favored 'General case' 0 N--CA 1.5 2.025 0 O-C-N 120.997 -1.296 . . . . 0.0 111.389 -179.533 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 72' ' ' VAL . . . . . 0.467 HG21 HG13 ' A' ' 61' ' ' ILE . 2.5 t -94.35 118.44 40.35 Favored 'Isoleucine or valine' 0 N--CA 1.497 1.884 0 O-C-N 121.751 -0.593 . . . . 0.0 110.239 179.922 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 73' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -91.8 -166.76 1.63 Allowed 'General case' 0 N--CA 1.495 1.809 0 O-C-N 121.165 -0.96 . . . . 0.0 110.012 179.519 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 74' ' ' PHE . . . . . . . . . . . . . 77.3 t80 -61.57 -45.23 95.03 Favored 'General case' 0 N--CA 1.499 2.02 0 O-C-N 121.17 -0.956 . . . . 0.0 110.558 179.827 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 75' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -62.88 -46.2 88.96 Favored 'General case' 0 N--CA 1.499 1.989 0 O-C-N 121.432 -0.793 . . . . 0.0 110.536 179.819 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 76' ' ' GLU . . . . . . . . . . . . . 27.3 mt-10 -63.98 -36.97 85.72 Favored 'General case' 0 N--CA 1.501 2.084 0 O-C-N 121.441 -0.787 . . . . 0.0 109.807 179.35 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 77' ' ' PHE . . . . . . . . . . . . . 5.9 t80 -55.67 -43.43 76.35 Favored 'General case' 0 N--CA 1.494 1.772 0 O-C-N 121.759 -0.588 . . . . 0.0 109.818 179.266 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 78' ' ' LEU . . . . . . . . . . . . . 35.0 mt -70.41 -45.05 66.71 Favored 'General case' 0 N--CA 1.497 1.881 0 O-C-N 121.467 -0.771 . . . . 0.0 110.491 179.553 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 79' ' ' VAL . . . . . . . . . . . . . 24.1 t -58.59 -34.13 50.45 Favored 'Isoleucine or valine' 0 N--CA 1.502 2.138 0 O-C-N 121.335 -0.853 . . . . 0.0 109.202 178.968 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 80' ' ' MET . . . . . . . . . . . . . 0.8 OUTLIER -73.77 -42.27 61.28 Favored 'General case' 0 N--CA 1.493 1.693 0 O-C-N 121.526 -0.734 . . . . 0.0 109.238 178.489 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 81' ' ' MET . . . . . 0.51 ' HG3' ' CB ' ' B' ' 150' ' ' ALA . 0.0 OUTLIER -55.11 -51.25 67.0 Favored 'General case' 0 N--CA 1.499 2.014 0 O-C-N 121.76 -0.588 . . . . 0.0 110.559 179.576 . . . . . . . . 3 3 . 1 . 012 nuclear orig core ' A' A ' 82' ' ' VAL . . . . . 0.462 HG21 ' N ' ' A' ' 83' ' ' ARG . 33.7 m -65.99 -29.07 45.68 Favored 'Isoleucine or valine' 0 N--CA 1.502 2.156 0 O-C-N 121.453 -0.779 . . . . 0.0 110.671 179.931 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 83' ' ' ARG . . . . . 0.462 ' N ' HG21 ' A' ' 82' ' ' VAL . 2.1 mtt180 -64.95 -43.0 94.15 Favored 'General case' 0 N--CA 1.496 1.827 0 O-C-N 121.255 -0.903 . . . . 0.0 109.395 179.237 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 84' ' ' CYS . . . . . . . . . . . . . 0.0 OUTLIER -72.05 -42.63 66.05 Favored 'General case' 0 N--CA 1.495 1.777 0 O-C-N 121.549 -0.719 . . . . 0.0 110.123 179.17 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 85' ' ' MET . . . . . . . . . . . . . 70.7 mtm . . . . . 0 N--CA 1.499 2.019 0 O-C-N 121.473 -0.767 . . . . 0.0 111.225 179.834 . . . . . . . . 0 0 . 1 . 012 nuclear orig core ' B' B ' 149' ' ' SER . . . . . . . . . . . . . 6.8 t . . . . . 0 N--CA 1.496 1.874 0 CA-C-O 121.608 0.718 . . . . 0.0 111.246 . . . . . . . . . 0 0 . 1 . 012 nuclear orig core ' B' B ' 150' ' ' ALA . . . . . 0.51 ' CB ' ' HG3' ' A' ' 81' ' ' MET . . . -61.54 -51.67 67.64 Favored 'General case' 0 N--CA 1.497 1.901 0 O-C-N 121.73 -0.606 . . . . 0.0 110.509 179.732 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' B' B ' 151' ' ' ASP . . . . . . . . . . . . . 6.8 p-10 -61.57 -31.92 71.98 Favored 'General case' 0 N--CA 1.499 2.018 0 O-C-N 121.627 -0.671 . . . . 0.0 110.717 179.685 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' B' B ' 152' ' ' ALA . . . . . . . . . . . . . . . -70.16 -46.52 64.5 Favored 'General case' 0 N--CA 1.497 1.902 0 O-C-N 121.21 -0.931 . . . . 0.0 110.545 179.987 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' B' B ' 153' ' ' MET . . . . . . . . . . . . . 1.5 tpt -75.2 -37.65 61.08 Favored 'General case' 0 N--CA 1.498 1.947 0 O-C-N 121.287 -0.883 . . . . 0.0 110.848 -179.99 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' B' B ' 154' ' ' MET . . . . . . . . . . . . . 2.7 ttp -70.6 -50.54 36.05 Favored 'General case' 0 N--CA 1.498 1.938 0 O-C-N 121.302 -0.874 . . . . 0.0 110.918 -179.652 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' B' B ' 155' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -64.39 -35.77 81.98 Favored 'General case' 0 N--CA 1.5 2.052 0 O-C-N 121.273 -0.892 . . . . 0.0 110.801 -179.752 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' B' B ' 156' ' ' ALA . . . . . . . . . . . . . . . -59.31 -46.91 87.3 Favored 'General case' 0 N--CA 1.498 1.933 0 O-C-N 121.303 -0.873 . . . . 0.0 110.112 179.604 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' B' B ' 157' ' ' LEU . . . . . 0.485 HD21 ' HB ' ' A' ' 26' ' ' ILE . 14.8 tp -61.22 -53.79 52.38 Favored 'General case' 0 N--CA 1.496 1.859 0 O-C-N 121.586 -0.696 . . . . 0.0 110.4 179.653 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' B' B ' 158' ' ' LEU . . . . . . . . . . . . . 1.6 mt . . . . . 0 N--CA 1.495 1.79 0 O-C-N 121.451 -0.781 . . . . 0.0 109.792 179.624 . . . . . . . . 0 0 . 1 . 013 nuclear orig core ' A' A ' 4' ' ' ILE . . . . . . . . . . . . . 7.8 mt . . . . . 0 N--CA 1.493 1.72 0 N-CA-C 108.975 -0.75 . . . . 0.0 108.975 . . . . . . . . . 0 0 . 1 . 013 nuclear orig core ' A' A ' 5' ' ' TYR . . . . . 0.407 ' CD2' ' HA ' ' A' ' 83' ' ' ARG . 47.8 m-85 -73.56 -30.61 63.16 Favored 'General case' 0 N--CA 1.496 1.853 0 O-C-N 121.644 -0.66 . . . . 0.0 109.92 179.124 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 6' ' ' LYS . . . . . 0.486 ' HA ' HG22 ' A' ' 79' ' ' VAL . 0.3 OUTLIER -56.67 -34.24 67.18 Favored 'General case' 0 N--CA 1.498 1.939 0 O-C-N 121.613 -0.679 . . . . 0.0 109.855 179.041 . . . . . . . . 3 3 . 1 . 013 nuclear orig core ' A' A ' 7' ' ' ALA . . . . . . . . . . . . . . . -61.76 -43.05 99.61 Favored 'General case' 0 N--CA 1.496 1.859 0 O-C-N 121.519 -0.738 . . . . 0.0 109.965 179.187 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 8' ' ' ALA . . . . . . . . . . . . . . . -60.66 -34.01 73.67 Favored 'General case' 0 N--CA 1.501 2.081 0 O-C-N 121.438 -0.789 . . . . 0.0 110.829 179.521 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 9' ' ' VAL . . . . . 0.434 ' CG2' ' HA ' ' A' ' 79' ' ' VAL . 72.9 t -58.73 -43.84 88.73 Favored 'Isoleucine or valine' 0 N--CA 1.501 2.09 0 O-C-N 121.437 -0.79 . . . . 0.0 111.064 -179.92 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 10' ' ' GLU . . . . . . . . . . . . . 12.0 mm-40 -89.76 -1.9 58.11 Favored 'General case' 0 N--CA 1.496 1.842 0 O-C-N 121.257 -0.902 . . . . 0.0 111.166 -179.949 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 11' ' ' GLN . . . . . . . . . . . . . 4.1 mt-30 -99.63 -22.76 15.29 Favored 'General case' 0 N--CA 1.496 1.839 0 O-C-N 121.086 -1.009 . . . . 0.0 110.978 179.78 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 12' ' ' LEU . . . . . 0.448 ' HB2' ' HG2' ' A' ' 16' ' ' GLN . 4.6 pp -67.2 171.9 5.28 Favored 'General case' 0 N--CA 1.505 2.287 0 O-C-N 121.069 -1.019 . . . . 0.0 110.998 -179.811 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 13' ' ' THR . . . . . . . . . . . . . 76.4 p -92.84 159.97 15.14 Favored 'General case' 0 N--CA 1.501 2.092 0 O-C-N 121.332 -0.855 . . . . 0.0 110.854 -179.572 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 14' ' ' GLU . . . . . . . . . . . . . 0.8 OUTLIER -56.77 -28.76 61.78 Favored 'General case' 0 N--CA 1.493 1.716 0 O-C-N 121.643 -0.661 . . . . 0.0 110.653 -179.967 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 1.3 mp0 -60.6 -41.33 94.53 Favored 'General case' 0 N--CA 1.498 1.973 0 O-C-N 121.439 -0.788 . . . . 0.0 110.167 179.419 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 16' ' ' GLN . . . . . 0.448 ' HG2' ' HB2' ' A' ' 12' ' ' LEU . 0.0 OUTLIER -80.24 -33.59 37.85 Favored 'General case' 0 N--CA 1.491 1.591 0 O-C-N 121.423 -0.798 . . . . 0.0 110.087 179.539 . . . . . . . . 3 3 . 1 . 013 nuclear orig core ' A' A ' 17' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -70.78 -40.11 72.79 Favored 'General case' 0 N--CA 1.498 1.961 0 O-C-N 121.552 -0.718 . . . . 0.0 110.054 179.305 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 18' ' ' ASN . . . . . . . . . . . . . 3.9 t30 -61.24 -34.6 75.41 Favored 'General case' 0 N--CA 1.497 1.878 0 O-C-N 121.513 -0.742 . . . . 0.0 109.995 179.331 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -62.98 -49.2 75.62 Favored 'General case' 0 N--CA 1.498 1.966 0 O-C-N 121.497 -0.752 . . . . 0.0 109.809 179.295 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 20' ' ' PHE . . . . . . . . . . . . . 12.9 m-85 -64.55 -34.64 78.71 Favored 'General case' 0 N--CA 1.5 2.055 0 O-C-N 121.419 -0.8 . . . . 0.0 110.005 179.098 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 21' ' ' LYS . . . . . . . . . . . . . 1.6 tptp -55.23 -47.35 75.48 Favored 'General case' 0 N--CA 1.498 1.956 0 O-C-N 121.566 -0.709 . . . . 0.0 110.201 179.591 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 22' ' ' ALA . . . . . . . . . . . . . . . -56.07 -44.87 79.33 Favored 'General case' 0 N--CA 1.499 1.996 0 O-C-N 121.598 -0.689 . . . . 0.0 110.082 179.575 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 23' ' ' ALA . . . . . . . . . . . . . . . -66.99 -35.89 80.95 Favored 'General case' 0 N--CA 1.497 1.887 0 O-C-N 121.353 -0.842 . . . . 0.0 109.66 178.726 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 24' ' ' PHE . . . . . . . . . . . . . 76.9 t80 -65.69 -37.85 87.62 Favored 'General case' 0 N--CA 1.497 1.917 0 O-C-N 121.582 -0.699 . . . . 0.0 110.223 179.309 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 25' ' ' ASP . . . . . . . . . . . . . 51.5 m-20 -56.18 -39.72 72.82 Favored 'General case' 0 N--CA 1.501 2.083 0 O-C-N 121.549 -0.719 . . . . 0.0 110.733 179.903 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 26' ' ' ILE . . . . . 0.48 ' HA ' HD11 ' A' ' 29' ' ' LEU . 6.7 mt -71.02 -31.68 45.87 Favored 'Isoleucine or valine' 0 N--CA 1.499 1.986 0 O-C-N 121.174 -0.954 . . . . 0.0 109.846 179.379 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 27' ' ' PHE . . . . . . . . . . . . . 0.2 OUTLIER -71.09 -39.68 71.97 Favored 'General case' 0 N--CA 1.496 1.846 0 O-C-N 121.359 -0.838 . . . . 0.0 110.291 179.522 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 28' ' ' VAL . . . . . 0.46 HG13 HG13 ' A' ' 36' ' ' ILE . 23.5 m -87.99 9.07 2.27 Favored 'Isoleucine or valine' 0 N--CA 1.501 2.086 0 O-C-N 121.365 -0.834 . . . . 0.0 111.281 179.862 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 29' ' ' LEU . . . . . 0.48 HD11 ' HA ' ' A' ' 26' ' ' ILE . 0.7 OUTLIER -61.08 105.82 0.53 Allowed 'General case' 0 N--CA 1.497 1.907 0 O-C-N 121.022 -1.049 . . . . 0.0 110.058 -179.936 . . . . . . . . 3 3 . 1 . 013 nuclear orig core ' A' A ' 30' ' ' GLY . . . . . . . . . . . . . . . 96.09 16.62 37.58 Favored Glycine 0 N--CA 1.495 2.623 0 N-CA-C 110.366 -1.094 . . . . 0.0 110.366 -179.577 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 31' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.493 1.719 0 O-C-N 121.024 -1.28 . . . . 0.0 109.959 179.768 . . . . . . . . 0 0 . 1 . 013 nuclear orig core ' A' A ' 35' ' ' CYS . . . . . . . . . . . . . 25.8 p . . . . . 0 N--CA 1.499 1.99 0 CA-C-O 121.095 0.474 . . . . 0.0 110.359 . . . . . . . . . 0 0 . 1 . 013 nuclear orig core ' A' A ' 36' ' ' ILE . . . . . 0.529 ' HB ' ' HB ' ' A' ' 72' ' ' VAL . 31.0 mt -123.85 130.35 73.97 Favored 'Isoleucine or valine' 0 N--CA 1.497 1.888 0 O-C-N 121.369 -0.832 . . . . 0.0 110.618 -179.826 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 37' ' ' SER . . . . . . . . . . . . . 1.7 t -122.51 -176.49 3.39 Favored 'General case' 0 N--CA 1.496 1.871 0 O-C-N 121.64 -0.662 . . . . 0.0 109.877 179.307 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 38' ' ' THR . . . . . 0.493 ' HB ' ' HA ' ' A' ' 54' ' ' PRO . 54.7 p -65.12 -36.45 84.31 Favored 'General case' 0 N--CA 1.503 2.216 0 O-C-N 121.329 -0.857 . . . . 0.0 110.617 179.891 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 39' ' ' LYS . . . . . . . . . . . . . 7.1 mttm -66.73 -44.47 81.46 Favored 'General case' 0 N--CA 1.498 1.95 0 O-C-N 121.39 -0.818 . . . . 0.0 110.476 179.761 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 1.2 mp0 -71.81 -23.3 61.53 Favored 'General case' 0 N--CA 1.497 1.916 0 O-C-N 121.494 -0.754 . . . . 0.0 110.935 -179.864 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 41' ' ' LEU . . . . . 0.416 HD21 ' CD1' ' A' ' 57' ' ' LEU . 5.4 tp -63.2 -47.51 82.26 Favored 'General case' 0 N--CA 1.498 1.944 0 O-C-N 121.079 -1.013 . . . . 0.0 110.157 179.774 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 42' ' ' GLY . . . . . 0.494 ' HA2' ' HB2' ' A' ' 45' ' ' MET . . . -55.94 -28.81 54.06 Favored Glycine 0 N--CA 1.495 2.614 0 N-CA-C 110.478 -1.049 . . . . 0.0 110.478 -179.951 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 43' ' ' LYS . . . . . . . . . . . . . 13.5 ttmt -50.99 -47.89 61.42 Favored 'General case' 0 N--CA 1.501 2.079 0 O-C-N 121.374 -1.074 . . . . 0.0 109.984 179.039 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 44' ' ' VAL . . . . . . . . . . . . . 38.1 t -80.5 -29.14 11.93 Favored 'Isoleucine or valine' 0 N--CA 1.498 1.954 0 O-C-N 121.557 -0.714 . . . . 0.0 110.03 179.053 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 45' ' ' MET . . . . . 0.494 ' HB2' ' HA2' ' A' ' 42' ' ' GLY . 5.1 mmt -57.09 -40.63 77.34 Favored 'General case' 0 N--CA 1.501 2.093 0 O-C-N 121.345 -0.847 . . . . 0.0 110.268 179.654 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 46' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -59.32 -40.61 86.84 Favored 'General case' 0 N--CA 1.501 2.109 0 O-C-N 121.411 -0.805 . . . . 0.0 110.224 179.383 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 47' ' ' MET . . . . . . . . . . . . . 0.2 OUTLIER -59.76 -43.09 94.48 Favored 'General case' 0 N--CA 1.499 1.981 0 O-C-N 121.493 -0.755 . . . . 0.0 110.185 179.552 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 48' ' ' LEU . . . . . . . . . . . . . 83.9 mt -78.21 -37.49 45.33 Favored 'General case' 0 N--CA 1.498 1.931 0 O-C-N 121.443 -0.785 . . . . 0.0 109.875 179.153 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 49' ' ' GLY . . . . . . . . . . . . . . . 115.92 50.56 0.43 Allowed Glycine 0 N--CA 1.495 2.629 0 N-CA-C 109.582 -1.407 . . . . 0.0 109.582 179.792 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 50' ' ' GLN . . . . . . . . . . . . . 25.1 mt-30 -132.6 145.59 51.22 Favored 'General case' 0 N--CA 1.497 1.923 0 O-C-N 121.408 -1.054 . . . . 0.0 110.111 -179.829 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 51' ' ' ASN . . . . . . . . . . . . . 1.2 t30 -132.36 62.56 63.86 Favored Pre-proline 0 N--CA 1.497 1.919 0 O-C-N 121.273 -0.892 . . . . 0.0 110.959 -179.887 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 52' ' ' PRO . . . . . 0.534 ' HG2' HD12 ' A' ' 57' ' ' LEU . 51.3 Cg_endo -78.16 157.43 30.06 Favored 'Trans proline' 0 C--N 1.314 -1.255 0 O-C-N 123.656 1.345 . . . . 0.0 110.624 179.569 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 53' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -85.14 153.82 59.92 Favored Pre-proline 0 N--CA 1.499 1.98 0 O-C-N 121.235 -0.916 . . . . 0.0 110.191 179.728 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 54' ' ' PRO . . . . . 0.493 ' HA ' ' HB ' ' A' ' 38' ' ' THR . 39.9 Cg_endo -66.15 -47.44 3.43 Favored 'Trans proline' 0 C--N 1.313 -1.303 0 O-C-N 123.686 1.361 . . . . 0.0 110.623 -179.693 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 55' ' ' GLU . . . . . . . . . . . . . 1.3 tt0 -61.45 -30.49 70.62 Favored 'General case' 0 N--CA 1.498 1.95 0 O-C-N 121.307 -0.87 . . . . 0.0 109.834 178.917 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 1.7 tm-20 -73.6 -45.8 50.96 Favored 'General case' 0 N--CA 1.495 1.781 0 O-C-N 121.461 -0.774 . . . . 0.0 110.029 179.252 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 57' ' ' LEU . . . . . 0.534 HD12 ' HG2' ' A' ' 52' ' ' PRO . 15.6 mt -69.63 -18.16 63.57 Favored 'General case' 0 N--CA 1.497 1.898 0 O-C-N 121.246 -0.908 . . . . 0.0 110.813 179.736 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 58' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -52.68 -51.23 61.16 Favored 'General case' 0 N--CA 1.497 1.921 0 O-C-N 121.084 -1.01 . . . . 0.0 110.538 179.723 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 59' ' ' GLU . . . . . . . . . . . . . 6.8 mm-40 -56.86 -32.23 65.61 Favored 'General case' 0 N--CA 1.499 1.987 0 O-C-N 121.603 -0.686 . . . . 0.0 110.138 179.386 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 60' ' ' MET . . . . . . . . . . . . . 11.5 tpp -59.14 -38.56 79.97 Favored 'General case' 0 N--CA 1.497 1.894 0 O-C-N 121.386 -0.821 . . . . 0.0 109.685 178.863 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 61' ' ' ILE . . . . . 0.533 HG21 HG22 ' A' ' 72' ' ' VAL . 15.9 mt -70.73 -41.65 77.59 Favored 'Isoleucine or valine' 0 N--CA 1.497 1.885 0 O-C-N 121.433 -0.792 . . . . 0.0 109.353 178.862 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 62' ' ' ASP . . . . . 0.473 ' HA ' ' HB3' ' A' ' 65' ' ' ASP . 17.8 m-20 -54.84 -32.37 60.51 Favored 'General case' 0 N--CA 1.5 2.036 0 O-C-N 121.596 -0.69 . . . . 0.0 110.719 179.522 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 63' ' ' GLU . . . . . . . . . . . . . 1.4 tm-20 -50.27 -43.35 53.28 Favored 'General case' 0 N--CA 1.5 2.072 0 O-C-N 121.641 -0.662 . . . . 0.0 110.878 179.914 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 64' ' ' VAL . . . . . . . . . . . . . 27.2 m -113.08 0.2 9.08 Favored 'Isoleucine or valine' 0 N--CA 1.501 2.092 0 O-C-N 121.265 -0.897 . . . . 0.0 111.219 179.631 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 65' ' ' ASP . . . . . 0.473 ' HB3' ' HA ' ' A' ' 62' ' ' ASP . 19.7 t70 -86.32 -95.18 0.08 Allowed 'General case' 0 N--CA 1.498 1.949 0 O-C-N 121.211 -0.931 . . . . 0.0 110.37 179.927 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 66' ' ' GLU . . . . . . . . . . . . . 2.3 tp10 50.89 35.21 11.86 Favored 'General case' 0 N--CA 1.502 2.161 0 O-C-N 121.214 -0.929 . . . . 0.0 111.253 -179.759 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 67' ' ' ASP . . . . . . . . . . . . . 3.8 p-10 -117.2 -5.45 11.35 Favored 'General case' 0 N--CA 1.501 2.084 0 O-C-N 121.1 -1.0 . . . . 0.0 111.673 -179.946 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 68' ' ' GLY . . . . . . . . . . . . . . . 109.66 -26.46 14.37 Favored Glycine 0 N--CA 1.496 2.64 0 N-CA-C 110.239 -1.145 . . . . 0.0 110.239 179.822 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 69' ' ' SER . . . . . . . . . . . . . 0.5 OUTLIER -79.68 -41.22 27.29 Favored 'General case' 0 N--CA 1.498 1.955 0 O-C-N 121.227 -1.161 . . . . 0.0 110.731 -179.769 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 70' ' ' GLY . . . . . . . . . . . . . . . 74.0 26.57 68.51 Favored Glycine 0 N--CA 1.497 2.756 0 N-CA-C 109.643 -1.383 . . . . 0.0 109.643 -179.578 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 71' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -140.11 148.29 41.49 Favored 'General case' 0 N--CA 1.497 1.879 0 O-C-N 121.527 -0.984 . . . . 0.0 109.193 179.931 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 72' ' ' VAL . . . . . 0.533 HG22 HG21 ' A' ' 61' ' ' ILE . 59.4 t -75.34 114.78 15.83 Favored 'Isoleucine or valine' 0 N--CA 1.498 1.957 0 O-C-N 121.367 -0.833 . . . . 0.0 110.539 -179.553 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 73' ' ' ASP . . . . . . . . . . . . . 4.6 m-20 -86.23 -166.32 1.51 Allowed 'General case' 0 N--CA 1.498 1.973 0 O-C-N 121.331 -0.856 . . . . 0.0 109.242 179.263 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 74' ' ' PHE . . . . . . . . . . . . . 53.4 t80 -74.25 -58.38 3.33 Favored 'General case' 0 N--CA 1.498 1.964 0 O-C-N 120.841 -1.162 . . . . 0.0 109.714 179.328 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 75' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -63.84 -33.82 76.54 Favored 'General case' 0 N--CA 1.496 1.864 0 O-C-N 121.452 -0.78 . . . . 0.0 110.162 179.552 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 76' ' ' GLU . . . . . . . . . . . . . 6.1 tt0 -62.16 -38.67 89.93 Favored 'General case' 0 N--CA 1.497 1.893 0 O-C-N 121.23 -0.918 . . . . 0.0 108.884 178.507 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 77' ' ' PHE . . . . . . . . . . . . . 65.2 t80 -62.72 -38.63 91.22 Favored 'General case' 0 N--CA 1.494 1.753 0 O-C-N 121.69 -0.631 . . . . 0.0 109.355 178.347 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 78' ' ' LEU . . . . . 0.419 ' HB3' HG13 ' A' ' 9' ' ' VAL . 14.3 mt -60.86 -36.59 79.54 Favored 'General case' 0 N--CA 1.498 1.967 0 O-C-N 121.475 -0.765 . . . . 0.0 110.049 178.899 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 79' ' ' VAL . . . . . 0.486 HG22 ' HA ' ' A' ' 6' ' ' LYS . 45.0 t -62.67 -43.56 98.7 Favored 'Isoleucine or valine' 0 N--CA 1.501 2.099 0 O-C-N 121.43 -0.794 . . . . 0.0 109.067 179.205 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 80' ' ' MET . . . . . . . . . . . . . 13.6 ttm -65.58 -36.11 82.79 Favored 'General case' 0 N--CA 1.494 1.753 0 O-C-N 121.542 -0.724 . . . . 0.0 109.355 178.593 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 81' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -58.43 -53.11 61.98 Favored 'General case' 0 N--CA 1.497 1.899 0 O-C-N 121.531 -0.731 . . . . 0.0 110.115 179.403 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 82' ' ' VAL . . . . . 0.424 HG13 ' N ' ' A' ' 83' ' ' ARG . 14.2 p -69.88 -26.51 30.37 Favored 'Isoleucine or valine' 0 N--CA 1.499 2.002 0 O-C-N 121.242 -0.911 . . . . 0.0 110.289 179.213 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 83' ' ' ARG . . . . . 0.424 ' N ' HG13 ' A' ' 82' ' ' VAL . 27.2 mtt-85 -69.41 -45.18 69.82 Favored 'General case' 0 N--CA 1.498 1.967 0 O-C-N 121.282 -0.886 . . . . 0.0 110.111 179.387 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 84' ' ' CYS . . . . . 0.457 ' HB3' ' HA ' ' B' ' 149' ' ' SER . 86.3 m -98.69 27.08 5.09 Favored 'General case' 0 N--CA 1.498 1.928 0 O-C-N 121.392 -0.818 . . . . 0.0 110.584 179.593 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 85' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.498 1.939 0 O-C-N 121.252 -0.905 . . . . 0.0 110.59 179.646 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' B' B ' 149' ' ' SER . . . . . 0.457 ' HA ' ' HB3' ' A' ' 84' ' ' CYS . 86.3 p . . . . . 0 N--CA 1.496 1.86 0 CA-C-O 121.097 0.475 . . . . 0.0 110.096 . . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' B' B ' 150' ' ' ALA . . . . . . . . . . . . . . . -74.65 -42.3 58.77 Favored 'General case' 0 N--CA 1.497 1.907 0 O-C-N 121.302 -0.874 . . . . 0.0 110.871 -179.731 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' B' B ' 151' ' ' ASP . . . . . . . . . . . . . 31.2 t70 -61.39 -52.62 63.86 Favored 'General case' 0 N--CA 1.498 1.97 0 O-C-N 121.462 -0.773 . . . . 0.0 110.882 -179.732 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' B' B ' 152' ' ' ALA . . . . . . . . . . . . . . . -52.33 -45.22 65.56 Favored 'General case' 0 N--CA 1.504 2.232 0 O-C-N 121.3 -0.875 . . . . 0.0 111.047 -179.918 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' B' B ' 153' ' ' MET . . . . . 0.56 ' HG2' HD13 ' B' ' 157' ' ' LEU . 1.3 ttt -73.16 -44.05 60.59 Favored 'General case' 0 N--CA 1.499 1.985 0 O-C-N 121.281 -0.887 . . . . 0.0 110.655 179.984 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' B' B ' 154' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -59.4 -37.97 79.36 Favored 'General case' 0 N--CA 1.501 2.113 0 O-C-N 121.467 -0.771 . . . . 0.0 110.457 179.792 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' B' B ' 155' ' ' GLN . . . . . . . . . . . . . 47.5 mt-30 -67.11 -38.4 85.57 Favored 'General case' 0 N--CA 1.499 1.998 0 O-C-N 121.539 -0.726 . . . . 0.0 110.908 179.859 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' B' B ' 156' ' ' ALA . . . . . . . . . . . . . . . -79.03 -34.39 43.94 Favored 'General case' 0 N--CA 1.498 1.951 0 O-C-N 121.321 -0.862 . . . . 0.0 110.971 -179.713 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' B' B ' 157' ' ' LEU . . . . . 0.56 HD13 ' HG2' ' B' ' 153' ' ' MET . 17.6 mt -75.27 -42.03 55.88 Favored 'General case' 0 N--CA 1.499 1.978 0 O-C-N 121.244 -0.91 . . . . 0.0 111.211 -179.497 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' B' B ' 158' ' ' LEU . . . . . . . . . . . . . 95.9 mt . . . . . 0 N--CA 1.499 2.005 0 O-C-N 121.137 -0.977 . . . . 0.0 110.941 -179.366 . . . . . . . . 0 0 . 1 . 014 nuclear orig core ' A' A ' 4' ' ' ILE . . . . . . . . . . . . . 4.9 mt . . . . . 0 N--CA 1.499 1.988 0 CA-C-O 120.78 0.324 . . . . 0.0 110.589 . . . . . . . . . 0 0 . 1 . 014 nuclear orig core ' A' A ' 5' ' ' TYR . . . . . . . . . . . . . 1.6 m-85 -63.93 -29.78 70.92 Favored 'General case' 0 N--CA 1.502 2.142 0 O-C-N 121.26 -0.9 . . . . 0.0 110.703 179.691 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 27.7 ttpt -65.11 -36.86 85.63 Favored 'General case' 0 N--CA 1.497 1.907 0 O-C-N 121.24 -0.913 . . . . 0.0 110.057 179.182 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 7' ' ' ALA . . . . . . . . . . . . . . . -58.13 -38.66 76.96 Favored 'General case' 0 N--CA 1.497 1.882 0 O-C-N 121.6 -0.688 . . . . 0.0 110.13 179.505 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 8' ' ' ALA . . . . . . . . . . . . . . . -66.42 -44.03 84.07 Favored 'General case' 0 N--CA 1.497 1.906 0 O-C-N 121.507 -0.746 . . . . 0.0 110.182 179.454 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 9' ' ' VAL . . . . . . . . . . . . . 19.6 t -64.89 -44.01 96.25 Favored 'Isoleucine or valine' 0 N--CA 1.5 2.051 0 O-C-N 121.352 -0.843 . . . . 0.0 110.015 179.362 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 10' ' ' GLU . . . . . . . . . . . . . 31.1 mm-40 -74.09 -19.66 60.52 Favored 'General case' 0 N--CA 1.496 1.849 0 O-C-N 121.346 -0.846 . . . . 0.0 110.356 179.42 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 11' ' ' GLN . . . . . . . . . . . . . 0.2 OUTLIER -58.98 -49.38 78.12 Favored 'General case' 0 N--CA 1.498 1.947 0 O-C-N 121.412 -0.805 . . . . 0.0 109.906 179.425 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 12' ' ' LEU . . . . . 0.426 HD13 ' HG3' ' A' ' 17' ' ' LYS . 0.9 OUTLIER -72.18 134.45 45.69 Favored 'General case' 0 N--CA 1.495 1.812 0 O-C-N 121.314 -0.866 . . . . 0.0 109.003 178.953 . . . . . . . . 3 3 . 1 . 014 nuclear orig core ' A' A ' 13' ' ' THR . . . . . 0.601 HG23 ' HB2' ' A' ' 15' ' ' GLU . 13.3 t -60.76 166.16 3.5 Favored 'General case' 0 N--CA 1.501 2.116 0 O-C-N 121.277 -0.889 . . . . 0.0 112.12 -178.009 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 14' ' ' GLU . . . . . 0.547 ' HA ' ' HD3' ' A' ' 17' ' ' LYS . 4.5 tp10 -61.51 -26.21 67.77 Favored 'General case' 0 N--CA 1.493 1.695 0 CA-C-N 116.213 -0.449 . . . . 0.0 110.921 -179.538 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 15' ' ' GLU . . . . . 0.601 ' HB2' HG23 ' A' ' 13' ' ' THR . 1.4 mp0 -57.54 -44.06 84.86 Favored 'General case' 0 N--CA 1.498 1.973 0 O-C-N 121.279 -0.888 . . . . 0.0 109.068 179.049 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 16' ' ' GLN . . . . . . . . . . . . . 44.1 mt-30 -68.82 -38.46 79.88 Favored 'General case' 0 N--CA 1.497 1.889 0 CA-C-O 121.743 0.782 . . . . 0.0 109.033 178.168 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 17' ' ' LYS . . . . . 0.547 ' HD3' ' HA ' ' A' ' 14' ' ' GLU . 0.0 OUTLIER -61.84 -29.54 70.24 Favored 'General case' 0 N--CA 1.497 1.898 0 N-CA-C 109.608 -0.516 . . . . 0.0 109.608 178.734 . . . . . . . . 3 3 . 1 . 014 nuclear orig core ' A' A ' 18' ' ' ASN . . . . . . . . . . . . . 4.6 t-20 -59.45 -43.34 93.19 Favored 'General case' 0 N--CA 1.499 1.976 0 O-C-N 121.592 -0.693 . . . . 0.0 110.154 179.357 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 19' ' ' GLU . . . . . 0.521 ' HB3' ' HE3' ' B' ' 154' ' ' MET . 1.2 mp0 -56.82 -41.86 78.56 Favored 'General case' 0 N--CA 1.497 1.911 0 O-C-N 121.381 -0.825 . . . . 0.0 109.499 179.138 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 20' ' ' PHE . . . . . . . . . . . . . 14.9 m-85 -70.19 -37.4 75.11 Favored 'General case' 0 N--CA 1.494 1.757 0 O-C-N 121.445 -0.784 . . . . 0.0 109.32 178.413 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 21' ' ' LYS . . . . . 0.546 ' HG3' ' N ' ' A' ' 22' ' ' ALA . 0.0 OUTLIER -63.82 -31.7 72.97 Favored 'General case' 0 N--CA 1.495 1.806 0 O-C-N 121.489 -0.757 . . . . 0.0 109.188 178.677 . . . . . . . . 3 3 . 1 . 014 nuclear orig core ' A' A ' 22' ' ' ALA . . . . . 0.546 ' N ' ' HG3' ' A' ' 21' ' ' LYS . . . -69.13 -43.58 74.1 Favored 'General case' 0 N--CA 1.495 1.778 0 O-C-N 121.402 -0.811 . . . . 0.0 109.007 178.154 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 23' ' ' ALA . . . . . . . . . . . . . . . -68.84 -43.45 75.45 Favored 'General case' 0 N--CA 1.497 1.885 0 O-C-N 121.558 -0.714 . . . . 0.0 109.369 178.672 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 24' ' ' PHE . . . . . . . . . . . . . 20.1 t80 -60.53 -37.63 81.82 Favored 'General case' 0 N--CA 1.497 1.876 0 O-C-N 121.64 -0.662 . . . . 0.0 109.851 179.027 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 25' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -54.1 -45.59 71.86 Favored 'General case' 0 N--CA 1.5 2.038 0 O-C-N 121.675 -0.641 . . . . 0.0 110.769 179.547 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 26' ' ' ILE . . . . . . . . . . . . . 2.3 mt -87.07 -9.84 11.07 Favored 'Isoleucine or valine' 0 N--CA 1.499 2.01 0 O-C-N 121.304 -0.872 . . . . 0.0 110.485 179.844 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 27' ' ' PHE . . . . . . . . . . . . . 0.1 OUTLIER -73.83 -32.24 63.59 Favored 'General case' 0 N--CA 1.496 1.857 0 O-C-N 121.145 -0.972 . . . . 0.0 109.994 179.386 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 28' ' ' VAL . . . . . . . . . . . . . 15.7 m -100.23 48.56 0.12 Allowed 'Isoleucine or valine' 0 N--CA 1.499 1.989 0 O-C-N 121.52 -0.738 . . . . 0.0 110.246 179.55 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 29' ' ' LEU . . . . . . . . . . . . . 7.0 mt -67.1 -48.51 67.94 Favored 'General case' 0 N--CA 1.5 2.069 0 O-C-N 121.287 -0.883 . . . . 0.0 109.911 179.653 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 30' ' ' GLY . . . . . . . . . . . . . . . -109.24 28.63 10.69 Favored Glycine 0 N--CA 1.495 2.578 0 N-CA-C 109.392 -1.483 . . . . 0.0 109.392 179.117 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 31' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.493 1.723 0 O-C-N 121.308 -1.113 . . . . 0.0 110.053 179.953 . . . . . . . . 0 0 . 1 . 014 nuclear orig core ' A' A ' 35' ' ' CYS . . . . . 0.494 ' HB3' ' HA ' ' A' ' 73' ' ' ASP . 0.1 OUTLIER . . . . . 0 N--CA 1.498 1.931 0 CA-C-O 121.081 0.467 . . . . 0.0 110.426 . . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 36' ' ' ILE . . . . . . . . . . . . . 38.2 mt -75.87 122.49 29.98 Favored 'Isoleucine or valine' 0 N--CA 1.497 1.922 0 O-C-N 121.115 -0.99 . . . . 0.0 110.537 -179.478 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 37' ' ' SER . . . . . . . . . . . . . 41.6 t -92.5 159.84 15.33 Favored 'General case' 0 N--CA 1.495 1.787 0 O-C-N 121.58 -0.7 . . . . 0.0 110.041 179.516 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 38' ' ' THR . . . . . 0.507 HG22 ' HA ' ' A' ' 58' ' ' GLN . 11.4 p -63.2 -37.21 86.32 Favored 'General case' 0 N--CA 1.501 2.106 0 O-C-N 121.337 -0.852 . . . . 0.0 110.556 179.954 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 39' ' ' LYS . . . . . . . . . . . . . 2.4 tttp -59.35 -42.79 92.35 Favored 'General case' 0 N--CA 1.498 1.969 0 O-C-N 121.357 -0.839 . . . . 0.0 109.903 179.322 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 1.6 mm-40 -69.1 -42.88 75.52 Favored 'General case' 0 N--CA 1.497 1.913 0 O-C-N 121.525 -0.735 . . . . 0.0 109.92 179.28 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 41' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -60.34 -63.94 1.13 Allowed 'General case' 0 N--CA 1.499 1.997 0 O-C-N 121.655 -0.653 . . . . 0.0 110.23 179.647 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 42' ' ' GLY . . . . . . . . . . . . . . . -48.02 -42.11 22.72 Favored Glycine 0 N--CA 1.502 3.098 0 N-CA-C 110.098 -1.201 . . . . 0.0 110.098 179.655 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 43' ' ' LYS . . . . . . . . . . . . . 66.3 tttt -62.93 -38.05 89.49 Favored 'General case' 0 N--CA 1.501 2.103 0 O-C-N 121.301 -1.117 . . . . 0.0 110.356 179.184 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 44' ' ' VAL . . . . . . . . . . . . . 5.3 t -66.91 -26.62 37.33 Favored 'Isoleucine or valine' 0 N--CA 1.502 2.127 0 O-C-N 121.469 -0.769 . . . . 0.0 110.752 179.589 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 45' ' ' MET . . . . . . . . . . . . . 4.9 mmt -58.79 -29.52 66.9 Favored 'General case' 0 N--CA 1.503 2.222 0 O-C-N 121.192 -0.942 . . . . 0.0 111.455 -179.82 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 46' ' ' ARG . . . . . . . . . . . . . 18.0 ttp180 -56.01 -38.24 70.24 Favored 'General case' 0 N--CA 1.503 2.181 0 O-C-N 121.212 -0.93 . . . . 0.0 110.931 -179.91 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 47' ' ' MET . . . . . . . . . . . . . 14.5 ttp -89.13 4.76 47.41 Favored 'General case' 0 N--CA 1.501 2.087 0 O-C-N 121.27 -0.894 . . . . 0.0 111.148 179.716 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 48' ' ' LEU . . . . . 0.42 HD12 ' HB3' ' B' ' 152' ' ' ALA . 11.9 tp -117.14 -53.73 2.45 Favored 'General case' 0 N--CA 1.494 1.768 0 O-C-N 120.978 -1.076 . . . . 0.0 110.33 -179.824 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 49' ' ' GLY . . . . . 0.453 ' O ' ' HB2' ' A' ' 50' ' ' GLN . . . 170.51 119.4 0.5 Allowed Glycine 0 N--CA 1.493 2.466 0 N-CA-C 109.69 -1.364 . . . . 0.0 109.69 -179.976 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 50' ' ' GLN . . . . . 0.453 ' HB2' ' O ' ' A' ' 49' ' ' GLY . 64.3 mt-30 60.29 -177.7 0.1 Allowed 'General case' 0 N--CA 1.505 2.292 0 O-C-N 121.913 -0.757 . . . . 0.0 111.251 -179.97 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 51' ' ' ASN . . . . . . . . . . . . . 8.7 t-20 -159.35 105.37 1.51 Allowed Pre-proline 0 N--CA 1.496 1.858 0 O-C-N 121.231 -0.918 . . . . 0.0 110.274 -179.769 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 52' ' ' PRO . . . . . 0.493 ' HG2' HD12 ' A' ' 57' ' ' LEU . 52.6 Cg_endo -78.57 165.8 24.63 Favored 'Trans proline' 0 C--N 1.314 -1.252 0 O-C-N 123.819 1.431 . . . . 0.0 110.287 179.98 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 53' ' ' THR . . . . . 0.551 ' HB ' ' HD2' ' A' ' 54' ' ' PRO . 41.5 p -73.76 166.78 41.2 Favored Pre-proline 0 N--CA 1.5 2.042 0 O-C-N 121.103 -0.998 . . . . 0.0 110.448 179.938 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 54' ' ' PRO . . . . . 0.551 ' HD2' ' HB ' ' A' ' 53' ' ' THR . 39.6 Cg_endo -65.52 -40.87 16.8 Favored 'Trans proline' 0 N--CA 1.493 1.452 0 O-C-N 123.707 1.372 . . . . 0.0 111.051 -179.78 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 55' ' ' GLU . . . . . . . . . . . . . 27.3 mm-40 -69.43 -30.3 68.2 Favored 'General case' 0 N--CA 1.496 1.846 0 O-C-N 121.393 -0.817 . . . . 0.0 110.075 179.41 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 56' ' ' GLU . . . . . 0.4 ' HB2' ' OG1' ' A' ' 53' ' ' THR . 1.4 tt0 -54.86 -50.45 68.65 Favored 'General case' 0 N--CA 1.498 1.957 0 O-C-N 121.455 -0.778 . . . . 0.0 110.248 179.643 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 57' ' ' LEU . . . . . 0.493 HD12 ' HG2' ' A' ' 52' ' ' PRO . 1.2 mt -77.58 -22.66 50.6 Favored 'General case' 0 N--CA 1.495 1.796 0 O-C-N 121.36 -0.838 . . . . 0.0 110.825 179.754 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 58' ' ' GLN . . . . . 0.551 ' HG3' ' N ' ' A' ' 59' ' ' GLU . 0.0 OUTLIER -60.61 -34.62 74.5 Favored 'General case' 0 N--CA 1.499 2.008 0 O-C-N 120.978 -1.076 . . . . 0.0 109.297 179.289 . . . . . . . . 3 3 . 1 . 014 nuclear orig core ' A' A ' 59' ' ' GLU . . . . . 0.551 ' N ' ' HG3' ' A' ' 58' ' ' GLN . 12.9 mm-40 -79.77 -33.76 40.36 Favored 'General case' 0 N--CA 1.493 1.695 0 O-C-N 121.289 -0.882 . . . . 0.0 108.697 177.91 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 60' ' ' MET . . . . . . . . . . . . . 16.3 ttm -67.91 -41.42 82.69 Favored 'General case' 0 N--CA 1.495 1.808 0 O-C-N 121.714 -0.616 . . . . 0.0 109.836 178.681 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 61' ' ' ILE . . . . . 0.518 HD11 ' HA ' ' A' ' 71' ' ' THR . 3.2 tt -68.04 -36.96 77.39 Favored 'Isoleucine or valine' 0 N--CA 1.495 1.824 0 O-C-N 121.561 -0.712 . . . . 0.0 109.839 179.53 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 62' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -68.68 -32.34 72.1 Favored 'General case' 0 N--CA 1.498 1.934 0 O-C-N 121.374 -0.829 . . . . 0.0 110.233 179.009 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 63' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER -59.88 -44.27 94.3 Favored 'General case' 0 N--CA 1.498 1.962 0 O-C-N 121.363 -0.836 . . . . 0.0 110.16 179.534 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 64' ' ' VAL . . . . . 0.467 HG21 ' HD2' ' A' ' 83' ' ' ARG . 11.9 p -103.86 24.32 1.83 Allowed 'Isoleucine or valine' 0 N--CA 1.496 1.846 0 O-C-N 121.432 -0.793 . . . . 0.0 110.768 179.839 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 65' ' ' ASP . . . . . . . . . . . . . 2.7 t70 -84.41 153.62 23.3 Favored 'General case' 0 N--CA 1.495 1.803 0 O-C-N 120.971 -1.081 . . . . 0.0 110.256 179.756 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 66' ' ' GLU . . . . . . . . . . . . . 32.4 mt-10 -121.11 11.15 10.86 Favored 'General case' 0 N--CA 1.495 1.787 0 O-C-N 121.423 -0.798 . . . . 0.0 111.828 -179.263 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 67' ' ' ASP . . . . . . . . . . . . . 1.1 p30 -146.84 0.51 0.75 Allowed 'General case' 0 N--CA 1.502 2.16 0 O-C-N 120.753 -1.217 . . . . 0.0 113.205 -179.692 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 68' ' ' GLY . . . . . . . . . . . . . . . 89.02 -24.63 12.29 Favored Glycine 0 N--CA 1.497 2.702 0 O-C-N 120.576 -1.328 . . . . 0.0 111.1 179.14 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 69' ' ' SER . . . . . . . . . . . . . 4.2 p -54.45 -29.75 50.66 Favored 'General case' 0 N--CA 1.503 2.181 0 O-C-N 121.107 -1.231 . . . . 0.0 110.403 179.943 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 70' ' ' GLY . . . . . . . . . . . . . . . 71.32 41.89 58.16 Favored Glycine 0 N--CA 1.497 2.712 0 N-CA-C 109.419 -1.472 . . . . 0.0 109.419 -179.761 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 71' ' ' THR . . . . . 0.518 ' HA ' HD11 ' A' ' 61' ' ' ILE . 0.2 OUTLIER -142.67 139.04 31.04 Favored 'General case' 0 N--CA 1.498 1.932 0 O-C-N 121.513 -0.992 . . . . 0.0 109.017 179.85 . . . . . . . . 3 3 . 1 . 014 nuclear orig core ' A' A ' 72' ' ' VAL . . . . . 0.409 HG22 HG13 ' A' ' 61' ' ' ILE . 38.5 t -75.41 111.44 11.71 Favored 'Isoleucine or valine' 0 N--CA 1.499 1.991 0 O-C-N 121.337 -0.852 . . . . 0.0 111.178 -178.899 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 73' ' ' ASP . . . . . 0.494 ' HA ' ' HB3' ' A' ' 35' ' ' CYS . 8.6 m-20 -87.53 -173.01 4.15 Favored 'General case' 0 N--CA 1.494 1.728 0 O-C-N 121.711 -0.618 . . . . 0.0 109.405 178.941 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 74' ' ' PHE . . . . . . . . . . . . . 87.2 t80 -61.95 -48.47 80.26 Favored 'General case' 0 N--CA 1.5 2.054 0 O-C-N 121.071 -1.018 . . . . 0.0 110.237 179.804 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 75' ' ' ASP . . . . . . . . . . . . . 0.1 OUTLIER -69.36 -45.11 70.15 Favored 'General case' 0 N--CA 1.496 1.852 0 O-C-N 121.457 -0.777 . . . . 0.0 110.355 179.786 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 76' ' ' GLU . . . . . . . . . . . . . 3.2 mt-10 -59.6 -34.73 73.12 Favored 'General case' 0 N--CA 1.499 1.998 0 O-C-N 121.433 -0.792 . . . . 0.0 110.073 179.38 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 77' ' ' PHE . . . . . 0.459 ' CZ ' ' HE3' ' A' ' 81' ' ' MET . 48.2 t80 -62.25 -43.96 97.63 Favored 'General case' 0 N--CA 1.496 1.86 0 O-C-N 121.48 -0.763 . . . . 0.0 109.644 178.866 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 78' ' ' LEU . . . . . . . . . . . . . 67.5 mt -66.39 -40.94 89.96 Favored 'General case' 0 N--CA 1.499 1.986 0 O-C-N 121.516 -0.74 . . . . 0.0 109.742 179.11 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 79' ' ' VAL . . . . . . . . . . . . . 5.2 t -62.98 -35.0 69.58 Favored 'Isoleucine or valine' 0 N--CA 1.501 2.082 0 O-C-N 121.502 -0.749 . . . . 0.0 110.11 179.355 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 80' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -73.58 -31.85 63.82 Favored 'General case' 0 N--CA 1.497 1.891 0 O-C-N 121.308 -0.87 . . . . 0.0 110.341 179.647 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 81' ' ' MET . . . . . 0.459 ' HE3' ' CZ ' ' A' ' 77' ' ' PHE . 12.0 mmt -63.54 -50.5 69.32 Favored 'General case' 0 N--CA 1.498 1.965 0 O-C-N 121.419 -0.801 . . . . 0.0 110.465 179.857 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 82' ' ' VAL . . . . . . . . . . . . . 10.9 p -66.87 -29.14 45.33 Favored 'Isoleucine or valine' 0 N--CA 1.498 1.953 0 O-C-N 121.368 -0.833 . . . . 0.0 110.29 179.606 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 83' ' ' ARG . . . . . 0.467 ' HD2' HG21 ' A' ' 64' ' ' VAL . 3.0 mtt85 -56.92 -41.16 77.68 Favored 'General case' 0 N--CA 1.501 2.103 0 O-C-N 121.307 -0.87 . . . . 0.0 109.777 178.99 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 84' ' ' CYS . . . . . . . . . . . . . 84.4 m -85.45 -33.9 21.78 Favored 'General case' 0 N--CA 1.497 1.893 0 O-C-N 121.477 -0.764 . . . . 0.0 109.584 178.857 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 85' ' ' MET . . . . . . . . . . . . . 36.2 ttp . . . . . 0 N--CA 1.496 1.864 0 O-C-N 121.46 -0.775 . . . . 0.0 109.88 179.403 . . . . . . . . 0 0 . 1 . 014 nuclear orig core ' B' B ' 149' ' ' SER . . . . . . . . . . . . . 8.8 t . . . . . 0 N--CA 1.502 2.159 0 CA-C-O 121.093 0.473 . . . . 0.0 110.766 . . . . . . . . . 0 0 . 1 . 014 nuclear orig core ' B' B ' 150' ' ' ALA . . . . . . . . . . . . . . . -111.36 -43.64 3.67 Favored 'General case' 0 N--CA 1.496 1.84 0 O-C-N 121.259 -0.9 . . . . 0.0 110.403 -179.974 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' B' B ' 151' ' ' ASP . . . . . . . . . . . . . 8.0 p-10 -58.09 -42.87 86.57 Favored 'General case' 0 N--CA 1.499 1.993 0 O-C-N 121.541 -0.725 . . . . 0.0 111.287 -179.771 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' B' B ' 152' ' ' ALA . . . . . 0.42 ' HB3' HD12 ' A' ' 48' ' ' LEU . . . -58.49 -50.02 75.25 Favored 'General case' 0 N--CA 1.499 2.009 0 O-C-N 121.149 -0.969 . . . . 0.0 110.239 179.8 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' B' B ' 153' ' ' MET . . . . . . . . . . . . . 1.5 ttt -68.33 -36.58 79.49 Favored 'General case' 0 N--CA 1.497 1.905 0 O-C-N 121.431 -0.793 . . . . 0.0 109.908 179.233 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' B' B ' 154' ' ' MET . . . . . 0.521 ' HE3' ' HB3' ' A' ' 19' ' ' GLU . 4.1 mtt -61.5 -47.83 83.83 Favored 'General case' 0 N--CA 1.497 1.912 0 O-C-N 121.501 -0.75 . . . . 0.0 110.063 179.523 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' B' B ' 155' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -63.33 -28.51 70.06 Favored 'General case' 0 N--CA 1.499 1.99 0 O-C-N 121.462 -0.774 . . . . 0.0 110.962 179.739 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' B' B ' 156' ' ' ALA . . . . . . . . . . . . . . . -89.66 -22.23 22.37 Favored 'General case' 0 N--CA 1.501 2.078 0 O-C-N 121.236 -0.915 . . . . 0.0 111.724 -179.439 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' B' B ' 157' ' ' LEU . . . . . . . . . . . . . 9.3 mt -99.12 -43.56 6.6 Favored 'General case' 0 N--CA 1.499 2.012 0 O-C-N 120.893 -1.129 . . . . 0.0 111.203 -179.486 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' B' B ' 158' ' ' LEU . . . . . . . . . . . . . 5.9 mp . . . . . 0 N--CA 1.499 1.999 0 O-C-N 121.201 -0.937 . . . . 0.0 110.49 -179.66 . . . . . . . . 0 0 . 1 . 015 nuclear orig core ' A' A ' 4' ' ' ILE . . . . . . . . . . . . . 2.7 mp . . . . . 0 N--CA 1.497 1.919 0 CA-C-O 120.734 0.302 . . . . 0.0 110.417 . . . . . . . . . 0 0 . 1 . 015 nuclear orig core ' A' A ' 5' ' ' TYR . . . . . . . . . . . . . 12.2 m-85 -62.3 -40.56 96.69 Favored 'General case' 0 N--CA 1.499 2.013 0 O-C-N 121.303 -0.873 . . . . 0.0 110.306 179.842 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 9.7 ttmt -69.95 -37.59 75.88 Favored 'General case' 0 N--CA 1.496 1.846 0 O-C-N 121.4 -0.813 . . . . 0.0 110.061 179.326 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 7' ' ' ALA . . . . . . . . . . . . . . . -51.81 -49.57 62.52 Favored 'General case' 0 N--CA 1.5 2.049 0 O-C-N 121.577 -0.702 . . . . 0.0 110.258 179.632 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 8' ' ' ALA . . . . . . . . . . . . . . . -61.0 -42.89 99.3 Favored 'General case' 0 N--CA 1.497 1.92 0 O-C-N 121.501 -0.749 . . . . 0.0 109.977 179.23 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 9' ' ' VAL . . . . . 0.439 ' HA ' HD11 ' A' ' 12' ' ' LEU . 38.3 t -60.07 -38.19 75.89 Favored 'Isoleucine or valine' 0 N--CA 1.501 2.123 0 O-C-N 121.48 -0.763 . . . . 0.0 110.135 179.414 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 10' ' ' GLU . . . . . . . . . . . . . 36.8 mt-10 -81.57 -31.66 32.51 Favored 'General case' 0 N--CA 1.497 1.877 0 O-C-N 121.51 -0.744 . . . . 0.0 110.192 179.633 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 11' ' ' GLN . . . . . . . . . . . . . 41.0 mt-30 -63.04 -32.03 73.3 Favored 'General case' 0 N--CA 1.5 2.063 0 O-C-N 121.588 -0.695 . . . . 0.0 111.027 179.923 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 12' ' ' LEU . . . . . 0.439 HD11 ' HA ' ' A' ' 9' ' ' VAL . 30.5 mt -54.54 139.49 37.8 Favored 'General case' 0 N--CA 1.501 2.112 0 O-C-N 121.292 -0.88 . . . . 0.0 110.397 179.85 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 13' ' ' THR . . . . . . . . . . . . . 72.1 p -77.55 165.01 24.86 Favored 'General case' 0 N--CA 1.499 1.979 0 O-C-N 121.216 -0.927 . . . . 0.0 110.025 179.643 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 14' ' ' GLU . . . . . 0.509 ' HA ' ' HD3' ' A' ' 17' ' ' LYS . 0.5 OUTLIER -55.22 -27.51 46.62 Favored 'General case' 0 N--CA 1.493 1.697 0 O-C-N 121.507 -0.746 . . . . 0.0 110.788 -179.6 . . . . . . . . 3 3 . 1 . 015 nuclear orig core ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 1.5 mp0 -61.31 -47.49 85.69 Favored 'General case' 0 N--CA 1.496 1.848 0 O-C-N 121.351 -0.843 . . . . 0.0 109.329 178.828 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 16' ' ' GLN . . . . . . . . . . . . . 1.2 mt-30 -67.02 -41.65 86.26 Favored 'General case' 0 N--CA 1.498 1.953 0 CA-C-O 121.581 0.705 . . . . 0.0 109.614 178.784 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 17' ' ' LYS . . . . . 0.509 ' HD3' ' HA ' ' A' ' 14' ' ' GLU . 0.2 OUTLIER -59.42 -45.14 92.37 Favored 'General case' 0 N--CA 1.499 1.999 0 CA-C-O 121.119 0.485 . . . . 0.0 109.786 179.202 . . . . . . . . 3 3 . 1 . 015 nuclear orig core ' A' A ' 18' ' ' ASN . . . . . . . . . . . . . 0.8 OUTLIER -69.35 -41.08 77.08 Favored 'General case' 0 N--CA 1.496 1.863 0 O-C-N 121.593 -0.692 . . . . 0.0 109.945 179.316 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 0.3 OUTLIER -60.39 -45.49 93.37 Favored 'General case' 0 N--CA 1.5 2.036 0 O-C-N 121.416 -0.802 . . . . 0.0 109.694 179.083 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 20' ' ' PHE . . . . . 0.436 ' CE1' ' HG2' ' A' ' 81' ' ' MET . 8.4 m-85 -64.73 -35.29 80.59 Favored 'General case' 0 N--CA 1.497 1.882 0 O-C-N 121.531 -0.731 . . . . 0.0 109.77 178.94 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 21' ' ' LYS . . . . . 0.474 ' HG3' ' N ' ' A' ' 22' ' ' ALA . 0.0 OUTLIER -60.82 -39.89 90.69 Favored 'General case' 0 N--CA 1.497 1.885 0 O-C-N 121.439 -0.788 . . . . 0.0 109.6 179.173 . . . . . . . . 3 3 . 1 . 015 nuclear orig core ' A' A ' 22' ' ' ALA . . . . . 0.474 ' N ' ' HG3' ' A' ' 21' ' ' LYS . . . -62.99 -46.84 85.78 Favored 'General case' 0 N--CA 1.498 1.943 0 O-C-N 121.386 -0.821 . . . . 0.0 109.816 179.136 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 23' ' ' ALA . . . . . . . . . . . . . . . -66.81 -39.3 87.66 Favored 'General case' 0 N--CA 1.497 1.891 0 O-C-N 121.497 -0.752 . . . . 0.0 110.145 179.259 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 24' ' ' PHE . . . . . . . . . . . . . 73.1 t80 -68.41 -39.83 81.49 Favored 'General case' 0 N--CA 1.498 1.941 0 O-C-N 121.516 -0.74 . . . . 0.0 110.297 179.607 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 25' ' ' ASP . . . . . . . . . . . . . 0.9 OUTLIER -54.24 -43.51 70.95 Favored 'General case' 0 N--CA 1.498 1.974 0 O-C-N 121.5 -0.75 . . . . 0.0 110.047 179.733 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 26' ' ' ILE . . . . . . . . . . . . . 12.9 mt -74.57 -28.07 21.75 Favored 'Isoleucine or valine' 0 N--CA 1.498 1.929 0 O-C-N 121.424 -0.797 . . . . 0.0 109.478 178.564 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 27' ' ' PHE . . . . . . . . . . . . . 0.2 OUTLIER -73.36 -10.54 59.85 Favored 'General case' 0 N--CA 1.498 1.953 0 O-C-N 121.285 -0.884 . . . . 0.0 111.239 179.452 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 28' ' ' VAL . . . . . . . . . . . . . 21.2 m -125.26 3.17 4.57 Favored 'Isoleucine or valine' 0 N--CA 1.501 2.103 0 O-C-N 121.036 -1.04 . . . . 0.0 111.25 179.841 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 29' ' ' LEU . . . . . . . . . . . . . 2.1 pp -65.64 -32.49 74.09 Favored 'General case' 0 N--CA 1.5 2.033 0 O-C-N 120.913 -1.117 . . . . 0.0 110.154 179.666 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 30' ' ' GLY . . . . . . . . . . . . . . . -114.58 28.05 8.44 Favored Glycine 0 N--CA 1.495 2.628 0 N-CA-C 109.283 -1.527 . . . . 0.0 109.283 178.939 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 31' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.493 1.725 0 O-C-N 121.516 -0.99 . . . . 0.0 109.668 -179.994 . . . . . . . . 0 0 . 1 . 015 nuclear orig core ' A' A ' 35' ' ' CYS . . . . . . . . . . . . . 1.1 m . . . . . 0 N--CA 1.497 1.895 0 CA-C-O 121.163 0.506 . . . . 0.0 110.777 . . . . . . . . . 0 0 . 1 . 015 nuclear orig core ' A' A ' 36' ' ' ILE . . . . . . . . . . . . . 4.1 mt -129.12 126.12 63.72 Favored 'Isoleucine or valine' 0 N--CA 1.498 1.954 0 O-C-N 121.506 -0.746 . . . . 0.0 110.33 -179.983 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 37' ' ' SER . . . . . . . . . . . . . 1.1 t -125.1 66.33 1.12 Allowed 'General case' 0 N--CA 1.496 1.867 0 O-C-N 121.406 -0.809 . . . . 0.0 110.265 179.755 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 38' ' ' THR . . . . . 0.404 ' HA ' ' HB3' ' A' ' 41' ' ' LEU . 1.2 p 66.25 -43.59 0.4 Allowed 'General case' 0 N--CA 1.518 2.958 0 N-CA-C 112.866 0.691 . . . . 0.0 112.866 179.69 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 39' ' ' LYS . . . . . . . . . . . . . 3.7 ttpp -46.59 -64.84 0.66 Allowed 'General case' 0 N--CA 1.505 2.31 0 O-C-N 121.045 -1.035 . . . . 0.0 111.826 -178.941 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER -71.44 -32.0 67.84 Favored 'General case' 0 N--CA 1.5 2.033 0 O-C-N 121.076 -1.015 . . . . 0.0 110.245 179.916 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 41' ' ' LEU . . . . . 0.451 HD23 ' HB3' ' A' ' 57' ' ' LEU . 4.8 tp -59.08 -50.95 72.13 Favored 'General case' 0 N--CA 1.497 1.919 0 O-C-N 121.5 -0.75 . . . . 0.0 110.377 179.737 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 42' ' ' GLY . . . . . . . . . . . . . . . -59.93 -38.06 93.56 Favored Glycine 0 N--CA 1.493 2.475 0 N-CA-C 110.033 -1.227 . . . . 0.0 110.033 -179.922 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 43' ' ' LYS . . . . . . . . . . . . . 1.9 ttpt -54.23 -44.32 71.61 Favored 'General case' 0 N--CA 1.5 2.036 0 O-C-N 121.439 -1.036 . . . . 0.0 109.832 179.251 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 44' ' ' VAL . . . . . . . . . . . . . 92.7 t -76.31 -39.46 34.58 Favored 'Isoleucine or valine' 0 N--CA 1.496 1.851 0 O-C-N 121.521 -0.737 . . . . 0.0 109.788 179.153 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 45' ' ' MET . . . . . 0.406 ' HE3' HD11 ' A' ' 41' ' ' LEU . 8.7 mmt -61.3 -36.74 80.91 Favored 'General case' 0 N--CA 1.501 2.089 0 O-C-N 121.393 -0.817 . . . . 0.0 109.944 179.222 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 46' ' ' ARG . . . . . . . . . . . . . 0.9 OUTLIER -64.02 -34.44 78.01 Favored 'General case' 0 N--CA 1.5 2.037 0 O-C-N 121.487 -0.758 . . . . 0.0 109.949 179.122 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 47' ' ' MET . . . . . . . . . . . . . 3.1 ttp -77.48 -35.16 53.95 Favored 'General case' 0 N--CA 1.496 1.852 0 O-C-N 121.484 -0.76 . . . . 0.0 109.777 179.401 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 48' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -136.04 89.89 2.53 Favored 'General case' 0 N--CA 1.495 1.794 0 O-C-N 121.407 -0.808 . . . . 0.0 109.57 179.295 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 49' ' ' GLY . . . . . 0.451 ' C ' ' HG3' ' A' ' 50' ' ' GLN . . . 147.36 -114.63 0.72 Allowed Glycine 0 N--CA 1.497 2.701 0 N-CA-C 109.617 -1.393 . . . . 0.0 109.617 -179.503 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 50' ' ' GLN . . . . . 0.451 ' HG3' ' C ' ' A' ' 49' ' ' GLY . 0.0 OUTLIER -149.21 -52.93 0.16 Allowed 'General case' 0 N--CA 1.502 2.163 0 O-C-N 121.575 -0.956 . . . . 0.0 109.818 179.914 . . . . . . . . 3 3 . 1 . 015 nuclear orig core ' A' A ' 51' ' ' ASN . . . . . . . . . . . . . 45.3 t30 54.72 78.75 0.37 Allowed Pre-proline 0 N--CA 1.502 2.134 0 O-C-N 121.8 -0.562 . . . . 0.0 112.11 179.317 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 52' ' ' PRO . . . . . . . . . . . . . 44.8 Cg_endo -78.64 -61.55 0.03 OUTLIER 'Trans proline' 0 C--N 1.315 -1.224 0 O-C-N 123.601 1.316 . . . . 0.0 110.0 178.573 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 53' ' ' THR . . . . . . . . . . . . . 3.3 p -134.67 162.29 58.58 Favored Pre-proline 0 N--CA 1.492 1.639 0 O-C-N 121.297 -0.877 . . . . 0.0 109.623 179.611 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 54' ' ' PRO . . . . . . . . . . . . . 43.4 Cg_endo -68.42 -31.06 28.59 Favored 'Trans proline' 0 N--CA 1.491 1.381 0 O-C-N 123.498 1.262 . . . . 0.0 110.515 179.555 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 55' ' ' GLU . . . . . . . . . . . . . 28.9 mp0 -67.39 -29.4 68.9 Favored 'General case' 0 N--CA 1.496 1.853 0 O-C-N 121.548 -0.72 . . . . 0.0 110.227 179.381 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -60.57 -32.74 71.82 Favored 'General case' 0 N--CA 1.499 2.015 0 O-C-N 121.519 -0.738 . . . . 0.0 111.45 -179.754 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 57' ' ' LEU . . . . . 0.451 ' HB3' HD23 ' A' ' 41' ' ' LEU . 9.0 mt -89.17 -12.65 40.36 Favored 'General case' 0 N--CA 1.496 1.85 0 O-C-N 121.043 -1.036 . . . . 0.0 111.413 -179.408 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 58' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -66.3 -47.95 71.94 Favored 'General case' 0 N--CA 1.492 1.662 0 O-C-N 120.912 -1.118 . . . . 0.0 108.69 179.234 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 59' ' ' GLU . . . . . . . . . . . . . 8.5 pt-20 -61.15 -31.38 71.1 Favored 'General case' 0 N--CA 1.495 1.819 0 O-C-N 121.548 -0.72 . . . . 0.0 109.601 178.69 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 60' ' ' MET . . . . . 0.423 ' HB2' ' O ' ' A' ' 57' ' ' LEU . 1.9 mmm -61.08 -42.14 97.95 Favored 'General case' 0 N--CA 1.497 1.878 0 O-C-N 121.5 -0.75 . . . . 0.0 109.663 178.811 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 61' ' ' ILE . . . . . 0.527 HG12 HG22 ' A' ' 72' ' ' VAL . 10.9 mt -72.75 -45.42 57.01 Favored 'Isoleucine or valine' 0 N--CA 1.497 1.89 0 O-C-N 121.355 -0.841 . . . . 0.0 109.658 178.982 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 62' ' ' ASP . . . . . . . . . . . . . 10.4 m-20 -54.11 -35.09 61.77 Favored 'General case' 0 N--CA 1.499 1.989 0 O-C-N 121.675 -0.641 . . . . 0.0 111.064 -179.735 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 63' ' ' GLU . . . . . . . . . . . . . 3.5 tm-20 -58.47 -39.93 81.3 Favored 'General case' 0 N--CA 1.501 2.089 0 O-C-N 121.217 -0.927 . . . . 0.0 110.068 179.459 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 64' ' ' VAL . . . . . 0.408 HG23 ' HB3' ' A' ' 80' ' ' MET . 23.1 m -107.23 23.81 3.04 Favored 'Isoleucine or valine' 0 N--CA 1.497 1.913 0 O-C-N 121.404 -0.81 . . . . 0.0 110.709 179.5 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 65' ' ' ASP . . . . . . . . . . . . . 11.3 t0 -98.2 97.15 8.6 Favored 'General case' 0 N--CA 1.495 1.806 0 O-C-N 121.104 -0.998 . . . . 0.0 110.074 179.648 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 66' ' ' GLU . . . . . . . . . . . . . 3.3 mp0 -91.88 28.67 1.75 Allowed 'General case' 0 N--CA 1.495 1.803 0 O-C-N 121.416 -0.802 . . . . 0.0 109.264 178.818 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 67' ' ' ASP . . . . . . . . . . . . . 1.0 OUTLIER -107.61 -29.58 9.09 Favored 'General case' 0 N--CA 1.492 1.65 0 O-C-N 121.593 -0.692 . . . . 0.0 110.361 -179.477 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 68' ' ' GLY . . . . . . . . . . . . . . . 80.08 19.39 69.91 Favored Glycine 0 N--CA 1.492 2.398 0 N-CA-C 108.215 -1.954 . . . . 0.0 108.215 -177.548 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 69' ' ' SER . . . . . . . . . . . . . 59.9 p -109.81 -44.9 3.73 Favored 'General case' 0 N--CA 1.493 1.704 0 O-C-N 121.609 -0.936 . . . . 0.0 110.393 -179.592 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 70' ' ' GLY . . . . . . . . . . . . . . . 118.06 -40.21 2.38 Favored Glycine 0 N--CA 1.499 2.89 0 C-N-CA 119.927 -1.13 . . . . 0.0 110.881 179.518 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 71' ' ' THR . . . . . . . . . . . . . 4.7 m -76.45 144.21 40.05 Favored 'General case' 0 N--CA 1.505 2.276 0 O-C-N 121.002 -1.293 . . . . 0.0 110.342 -179.686 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 72' ' ' VAL . . . . . 0.527 HG22 HG12 ' A' ' 61' ' ' ILE . 0.7 OUTLIER -98.69 136.93 27.76 Favored 'Isoleucine or valine' 0 N--CA 1.497 1.888 0 O-C-N 121.496 -0.753 . . . . 0.0 110.373 179.919 . . . . . . . . 3 3 . 1 . 015 nuclear orig core ' A' A ' 73' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER -113.81 -165.37 1.0 Allowed 'General case' 0 N--CA 1.496 1.874 0 O-C-N 121.371 -0.831 . . . . 0.0 110.05 179.814 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 74' ' ' PHE . . . . . . . . . . . . . 23.6 t80 -64.37 -44.85 90.09 Favored 'General case' 0 N--CA 1.499 1.984 0 O-C-N 121.174 -0.953 . . . . 0.0 110.475 179.893 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 75' ' ' ASP . . . . . . . . . . . . . 30.2 t70 -57.72 -51.9 67.64 Favored 'General case' 0 N--CA 1.497 1.909 0 O-C-N 121.412 -0.805 . . . . 0.0 109.881 179.447 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 76' ' ' GLU . . . . . . . . . . . . . 35.0 mt-10 -60.49 -37.09 79.95 Favored 'General case' 0 N--CA 1.499 1.989 0 O-C-N 121.576 -0.702 . . . . 0.0 109.771 178.9 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 77' ' ' PHE . . . . . 0.497 ' HA ' ' CE ' ' A' ' 80' ' ' MET . 2.4 t80 -57.63 -36.64 72.08 Favored 'General case' 0 N--CA 1.496 1.849 0 O-C-N 121.691 -0.63 . . . . 0.0 110.279 179.362 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 78' ' ' LEU . . . . . . . . . . . . . 12.5 mt -75.29 -37.12 61.04 Favored 'General case' 0 N--CA 1.496 1.84 0 O-C-N 121.512 -0.742 . . . . 0.0 110.943 -179.945 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 79' ' ' VAL . . . . . 0.443 ' O ' HG21 ' A' ' 82' ' ' VAL . 66.1 t -62.11 -49.26 84.81 Favored 'Isoleucine or valine' 0 N--CA 1.503 2.196 0 O-C-N 121.23 -0.919 . . . . 0.0 111.21 -179.504 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 80' ' ' MET . . . . . 0.497 ' CE ' ' HA ' ' A' ' 77' ' ' PHE . 16.2 ptt? -69.67 -24.27 63.58 Favored 'General case' 0 N--CA 1.502 2.147 0 O-C-N 120.872 -1.143 . . . . 0.0 110.727 -179.806 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 81' ' ' MET . . . . . 0.436 ' HG2' ' CE1' ' A' ' 20' ' ' PHE . 24.9 tpp -73.89 -50.46 20.12 Favored 'General case' 0 N--CA 1.494 1.757 0 O-C-N 121.098 -1.002 . . . . 0.0 109.825 179.2 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 82' ' ' VAL . . . . . 0.443 HG21 ' O ' ' A' ' 79' ' ' VAL . 30.1 m -62.25 -26.08 39.33 Favored 'Isoleucine or valine' 0 N--CA 1.503 2.19 0 O-C-N 121.174 -0.954 . . . . 0.0 109.846 178.905 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 83' ' ' ARG . . . . . 0.459 ' HD2' ' HA ' ' A' ' 80' ' ' MET . 19.6 mtt180 -66.1 -52.32 49.72 Favored 'General case' 0 N--CA 1.496 1.858 0 O-C-N 121.283 -0.886 . . . . 0.0 108.936 178.601 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 84' ' ' CYS . . . . . . . . . . . . . 37.7 t -64.74 -23.36 67.22 Favored 'General case' 0 N--CA 1.499 2.009 0 O-C-N 121.648 -0.658 . . . . 0.0 110.397 178.964 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 85' ' ' MET . . . . . 0.417 ' HE1' ' HG3' ' A' ' 81' ' ' MET . 9.5 mtt . . . . . 0 N--CA 1.499 1.991 0 O-C-N 121.301 -0.874 . . . . 0.0 110.647 179.257 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' B' B ' 149' ' ' SER . . . . . . . . . . . . . 30.1 t . . . . . 0 N--CA 1.499 1.994 0 CA-C-O 121.09 0.472 . . . . 0.0 110.477 . . . . . . . . . 0 0 . 1 . 015 nuclear orig core ' B' B ' 150' ' ' ALA . . . . . . . . . . . . . . . -58.24 -41.86 85.08 Favored 'General case' 0 N--CA 1.499 2.002 0 O-C-N 121.556 -0.715 . . . . 0.0 110.582 179.765 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' B' B ' 151' ' ' ASP . . . . . . . . . . . . . 20.7 t70 -67.16 -47.14 71.89 Favored 'General case' 0 N--CA 1.497 1.909 0 O-C-N 121.317 -0.864 . . . . 0.0 110.308 179.677 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' B' B ' 152' ' ' ALA . . . . . . . . . . . . . . . -60.01 -47.36 86.17 Favored 'General case' 0 N--CA 1.499 1.978 0 O-C-N 121.511 -0.743 . . . . 0.0 110.731 -179.94 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' B' B ' 153' ' ' MET . . . . . . . . . . . . . 0.1 OUTLIER -64.74 -40.05 94.65 Favored 'General case' 0 N--CA 1.498 1.932 0 O-C-N 121.328 -0.858 . . . . 0.0 110.239 179.769 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' B' B ' 154' ' ' MET . . . . . . . . . . . . . 3.1 tpp -63.18 -47.69 81.55 Favored 'General case' 0 N--CA 1.499 1.976 0 O-C-N 121.434 -0.791 . . . . 0.0 110.16 179.501 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' B' B ' 155' ' ' GLN . . . . . . . . . . . . . 0.8 OUTLIER -68.7 -36.95 79.14 Favored 'General case' 0 N--CA 1.5 2.032 0 O-C-N 121.388 -0.82 . . . . 0.0 110.494 179.573 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' B' B ' 156' ' ' ALA . . . . . . . . . . . . . . . -69.65 -29.79 67.34 Favored 'General case' 0 N--CA 1.499 2.005 0 O-C-N 121.306 -0.871 . . . . 0.0 110.934 179.881 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' B' B ' 157' ' ' LEU . . . . . . . . . . . . . 4.8 tp -84.9 -33.99 22.65 Favored 'General case' 0 N--CA 1.497 1.877 0 O-C-N 121.319 -0.863 . . . . 0.0 110.501 179.981 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' B' B ' 158' ' ' LEU . . . . . 0.448 ' N ' HD23 ' B' ' 158' ' ' LEU . 4.2 mm? . . . . . 0 N--CA 1.496 1.862 0 O-C-N 121.297 -0.877 . . . . 0.0 110.308 -179.748 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 4' ' ' ILE . . . . . . . . . . . . . 9.5 mt . . . . . 0 N--CA 1.499 1.977 0 CA-C-O 121.033 0.444 . . . . 0.0 109.945 . . . . . . . . . 0 0 . 1 . 016 nuclear orig core ' A' A ' 5' ' ' TYR . . . . . 0.405 ' HB3' ' CG2' ' A' ' 79' ' ' VAL . 0.9 OUTLIER -66.92 -39.54 87.4 Favored 'General case' 0 N--CA 1.496 1.831 0 O-C-N 121.369 -0.832 . . . . 0.0 109.563 179.125 . . . . . . . . 3 3 . 1 . 016 nuclear orig core ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 0.4 OUTLIER -68.07 -32.73 73.27 Favored 'General case' 0 N--CA 1.495 1.818 0 O-C-N 121.562 -0.712 . . . . 0.0 109.81 178.946 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 7' ' ' ALA . . . . . . . . . . . . . . . -63.4 -34.65 78.2 Favored 'General case' 0 N--CA 1.499 1.975 0 O-C-N 121.233 -0.917 . . . . 0.0 109.483 178.728 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 8' ' ' ALA . . . . . . . . . . . . . . . -66.02 -28.05 68.58 Favored 'General case' 0 N--CA 1.495 1.808 0 O-C-N 121.496 -0.753 . . . . 0.0 110.229 178.892 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 9' ' ' VAL . . . . . . . . . . . . . 68.6 t -64.52 -32.75 59.09 Favored 'Isoleucine or valine' 0 N--CA 1.5 2.069 0 O-C-N 121.318 -0.864 . . . . 0.0 110.338 179.475 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 10' ' ' GLU . . . . . . . . . . . . . 15.4 mt-10 -65.58 -25.45 67.41 Favored 'General case' 0 N--CA 1.499 2.01 0 O-C-N 121.301 -0.874 . . . . 0.0 110.665 179.871 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 11' ' ' GLN . . . . . . . . . . . . . 0.3 OUTLIER -65.45 -24.47 67.18 Favored 'General case' 0 N--CA 1.5 2.065 0 O-C-N 121.407 -0.808 . . . . 0.0 110.991 179.635 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 12' ' ' LEU . . . . . . . . . . . . . 10.2 mt -61.47 135.83 57.81 Favored 'General case' 0 N--CA 1.499 2.023 0 O-C-N 121.256 -0.902 . . . . 0.0 110.45 -179.935 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 13' ' ' THR . . . . . . . . . . . . . 27.9 p -77.97 165.02 24.57 Favored 'General case' 0 N--CA 1.498 1.966 0 O-C-N 121.275 -0.891 . . . . 0.0 110.357 179.623 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 14' ' ' GLU . . . . . . . . . . . . . 0.6 OUTLIER -56.52 -31.49 64.17 Favored 'General case' 0 N--CA 1.494 1.739 0 O-C-N 121.678 -0.639 . . . . 0.0 110.407 -179.879 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 1.4 mp0 -62.07 -52.79 62.47 Favored 'General case' 0 N--CA 1.498 1.933 0 O-C-N 121.467 -0.771 . . . . 0.0 109.761 179.306 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 16' ' ' GLN . . . . . . . . . . . . . 38.9 mt-30 -65.02 -33.18 75.44 Favored 'General case' 0 N--CA 1.497 1.888 0 O-C-N 121.627 -0.671 . . . . 0.0 110.111 179.448 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 17' ' ' LYS . . . . . . . . . . . . . 15.4 mttp -63.56 -49.0 75.15 Favored 'General case' 0 N--CA 1.497 1.904 0 N-CA-C 109.47 -0.567 . . . . 0.0 109.47 179.009 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 18' ' ' ASN . . . . . 0.494 ' HA ' ' HG2' ' A' ' 21' ' ' LYS . 41.7 t30 -71.47 -32.21 68.02 Favored 'General case' 0 N--CA 1.497 1.894 0 O-C-N 121.537 -0.727 . . . . 0.0 109.225 178.398 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 2.4 tt0 -66.73 -41.78 87.33 Favored 'General case' 0 N--CA 1.496 1.848 0 O-C-N 121.539 -0.726 . . . . 0.0 109.425 178.925 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 20' ' ' PHE . . . . . . . . . . . . . 3.0 m-85 -70.68 -34.72 72.3 Favored 'General case' 0 N--CA 1.497 1.877 0 O-C-N 121.497 -0.752 . . . . 0.0 110.301 179.477 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 21' ' ' LYS . . . . . 0.581 ' HG3' ' N ' ' A' ' 22' ' ' ALA . 0.0 OUTLIER -64.47 -28.03 69.39 Favored 'General case' 0 N--CA 1.497 1.921 0 O-C-N 121.33 -0.856 . . . . 0.0 110.158 179.524 . . . . . . . . 3 3 . 1 . 016 nuclear orig core ' A' A ' 22' ' ' ALA . . . . . 0.581 ' N ' ' HG3' ' A' ' 21' ' ' LYS . . . -65.44 -44.49 87.13 Favored 'General case' 0 N--CA 1.498 1.963 0 O-C-N 121.143 -0.973 . . . . 0.0 108.96 178.401 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 23' ' ' ALA . . . . . . . . . . . . . . . -71.71 -40.44 69.48 Favored 'General case' 0 N--CA 1.493 1.7 0 N-CA-C 109.086 -0.709 . . . . 0.0 109.086 178.33 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 24' ' ' PHE . . . . . . . . . . . . . 65.2 t80 -59.37 -43.63 92.83 Favored 'General case' 0 N--CA 1.499 1.999 0 O-C-N 121.65 -0.656 . . . . 0.0 110.511 179.448 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 25' ' ' ASP . . . . . . . . . . . . . 16.3 m-20 -61.15 -45.51 94.34 Favored 'General case' 0 N--CA 1.499 2.004 0 O-C-N 121.4 -0.813 . . . . 0.0 110.67 179.997 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 26' ' ' ILE . . . . . . . . . . . . . 54.4 mt -73.56 -21.25 18.46 Favored 'Isoleucine or valine' 0 N--CA 1.501 2.081 0 O-C-N 121.419 -0.801 . . . . 0.0 110.96 179.971 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 27' ' ' PHE . . . . . . . . . . . . . 0.2 OUTLIER -70.29 -11.24 60.77 Favored 'General case' 0 N--CA 1.502 2.15 0 O-C-N 120.991 -1.068 . . . . 0.0 111.878 -179.691 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 28' ' ' VAL . . . . . . . . . . . . . 6.8 m -127.63 -46.83 1.2 Allowed 'Isoleucine or valine' 0 N--CA 1.499 1.984 0 O-C-N 120.949 -1.094 . . . . 0.0 111.049 179.859 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 29' ' ' LEU . . . . . . . . . . . . . 12.7 mt 47.78 39.53 10.63 Favored 'General case' 0 N--CA 1.504 2.238 0 O-C-N 121.364 -0.835 . . . . 0.0 110.629 -179.7 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 30' ' ' GLY . . . . . . . . . . . . . . . 85.13 39.96 8.24 Favored Glycine 0 N--CA 1.494 2.535 0 N-CA-C 109.588 -1.405 . . . . 0.0 109.588 -179.322 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 31' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.501 2.107 0 O-C-N 121.535 -0.979 . . . . 0.0 110.456 -179.881 . . . . . . . . 0 0 . 1 . 016 nuclear orig core ' A' A ' 35' ' ' CYS . . . . . 0.407 ' HB2' HG21 ' A' ' 71' ' ' THR . 68.1 m . . . . . 0 N--CA 1.497 1.875 0 CA-C-O 121.048 0.451 . . . . 0.0 110.514 . . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 36' ' ' ILE . . . . . . . . . . . . . 55.7 mt -97.16 135.31 31.8 Favored 'Isoleucine or valine' 0 N--CA 1.498 1.931 0 O-C-N 121.374 -0.829 . . . . 0.0 109.869 179.502 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 37' ' ' SER . . . . . . . . . . . . . 7.5 p -115.12 -177.77 3.21 Favored 'General case' 0 N--CA 1.496 1.857 0 O-C-N 121.288 -0.883 . . . . 0.0 110.442 179.821 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 38' ' ' THR . . . . . . . . . . . . . 42.9 p -65.38 -37.45 87.03 Favored 'General case' 0 N--CA 1.502 2.125 0 O-C-N 121.498 -0.752 . . . . 0.0 110.463 179.754 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 39' ' ' LYS . . . . . . . . . . . . . 2.6 mtmp? -63.0 -36.95 85.28 Favored 'General case' 0 N--CA 1.501 2.082 0 O-C-N 121.521 -0.737 . . . . 0.0 110.055 179.598 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 1.1 mp0 -76.45 -26.82 55.84 Favored 'General case' 0 N--CA 1.496 1.845 0 O-C-N 121.545 -0.722 . . . . 0.0 110.664 -179.902 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 41' ' ' LEU . . . . . 0.4 HD21 ' CD2' ' A' ' 57' ' ' LEU . 4.9 tp -69.56 -49.94 49.49 Favored 'General case' 0 N--CA 1.498 1.972 0 O-C-N 121.1 -1.0 . . . . 0.0 110.135 179.591 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 42' ' ' GLY . . . . . 0.554 ' HA2' ' HB2' ' A' ' 45' ' ' MET . . . -55.02 -32.53 56.63 Favored Glycine 0 N--CA 1.497 2.734 0 N-CA-C 110.798 -0.921 . . . . 0.0 110.798 -179.423 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 43' ' ' LYS . . . . . . . . . . . . . 5.4 mttt -54.27 -47.96 71.73 Favored 'General case' 0 N--CA 1.501 2.081 0 O-C-N 121.419 -1.047 . . . . 0.0 110.378 179.822 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 44' ' ' VAL . . . . . . . . . . . . . 61.9 t -82.26 -28.26 9.13 Favored 'Isoleucine or valine' 0 N--CA 1.5 2.04 0 O-C-N 121.287 -0.883 . . . . 0.0 110.064 179.367 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 45' ' ' MET . . . . . 0.554 ' HB2' ' HA2' ' A' ' 42' ' ' GLY . 0.5 OUTLIER -56.95 -31.05 64.59 Favored 'General case' 0 N--CA 1.502 2.156 0 O-C-N 121.308 -0.87 . . . . 0.0 110.991 179.612 . . . . . . . . 3 3 . 1 . 016 nuclear orig core ' A' A ' 46' ' ' ARG . . . . . 0.564 ' HA ' ' HG3' ' A' ' 50' ' ' GLN . 7.0 mmm180 -53.5 -27.47 25.67 Favored 'General case' 0 N--CA 1.505 2.296 0 O-C-N 121.35 -0.844 . . . . 0.0 111.729 -179.586 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 47' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -81.6 -39.73 24.07 Favored 'General case' 0 N--CA 1.496 1.871 0 O-C-N 121.101 -0.999 . . . . 0.0 110.812 -179.825 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 48' ' ' LEU . . . . . . . . . . . . . 1.1 mt -153.31 104.8 2.81 Favored 'General case' 0 N--CA 1.491 1.613 0 O-C-N 121.264 -0.897 . . . . 0.0 110.17 -179.83 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 49' ' ' GLY . . . . . 0.493 ' O ' ' HB2' ' A' ' 50' ' ' GLN . . . 124.48 -67.13 0.52 Allowed Glycine 0 N--CA 1.498 2.833 0 N-CA-C 109.677 -1.369 . . . . 0.0 109.677 -179.996 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 50' ' ' GLN . . . . . 0.564 ' HG3' ' HA ' ' A' ' 46' ' ' ARG . 0.5 OUTLIER 66.53 131.56 0.02 OUTLIER 'General case' 0 N--CA 1.504 2.244 0 CA-C-O 121.582 0.706 . . . . 0.0 111.186 179.935 . . . . . . . . 3 3 . 1 . 016 nuclear orig core ' A' A ' 51' ' ' ASN . . . . . . . . . . . . . 14.6 p-10 -97.82 114.82 65.52 Favored Pre-proline 0 N--CA 1.493 1.719 0 O-C-N 121.279 -0.888 . . . . 0.0 109.653 179.367 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 52' ' ' PRO . . . . . . . . . . . . . 43.0 Cg_endo -69.29 -39.16 7.78 Favored 'Trans proline' 0 C--N 1.313 -1.334 0 O-C-N 123.613 1.323 . . . . 0.0 111.084 -179.419 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 53' ' ' THR . . . . . 0.423 ' CG2' ' HD2' ' A' ' 54' ' ' PRO . 0.2 OUTLIER -126.37 152.88 74.61 Favored Pre-proline 0 N--CA 1.497 1.92 0 O-C-N 121.406 -0.808 . . . . 0.0 109.956 -179.962 . . . . . . . . 3 3 . 1 . 016 nuclear orig core ' A' A ' 54' ' ' PRO . . . . . 0.423 ' HD2' ' CG2' ' A' ' 53' ' ' THR . 42.6 Cg_endo -70.82 -44.85 1.18 Allowed 'Trans proline' 0 C--N 1.314 -1.262 0 O-C-N 123.793 1.417 . . . . 0.0 110.392 179.761 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 55' ' ' GLU . . . . . . . . . . . . . 0.9 OUTLIER -68.98 -19.85 64.16 Favored 'General case' 0 N--CA 1.497 1.881 0 O-C-N 121.441 -0.787 . . . . 0.0 110.33 179.151 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 0.6 OUTLIER -56.99 -41.61 78.73 Favored 'General case' 0 N--CA 1.498 1.939 0 O-C-N 121.361 -0.837 . . . . 0.0 110.269 179.592 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 57' ' ' LEU . . . . . 0.4 ' CD2' HD21 ' A' ' 41' ' ' LEU . 19.7 mt -78.49 -23.54 46.33 Favored 'General case' 0 N--CA 1.495 1.816 0 O-C-N 121.444 -0.785 . . . . 0.0 110.183 179.51 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 58' ' ' GLN . . . . . 0.54 ' HG3' ' N ' ' A' ' 59' ' ' GLU . 0.0 OUTLIER -59.41 -31.82 69.61 Favored 'General case' 0 N--CA 1.497 1.914 0 O-C-N 121.193 -0.942 . . . . 0.0 109.165 179.13 . . . . . . . . 3 3 . 1 . 016 nuclear orig core ' A' A ' 59' ' ' GLU . . . . . 0.54 ' N ' ' HG3' ' A' ' 58' ' ' GLN . 0.8 OUTLIER -72.62 -41.71 65.26 Favored 'General case' 0 N--CA 1.491 1.603 0 N-CA-C 108.508 -0.923 . . . . 0.0 108.508 177.85 . . . . . . . . 3 3 . 1 . 016 nuclear orig core ' A' A ' 60' ' ' MET . . . . . . . . . . . . . 2.3 mtp -60.57 -38.56 84.98 Favored 'General case' 0 N--CA 1.495 1.806 0 O-C-N 121.77 -0.581 . . . . 0.0 109.853 178.513 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 61' ' ' ILE . . . . . 0.567 HG13 HG21 ' A' ' 72' ' ' VAL . 3.5 tt -73.17 -33.13 41.01 Favored 'Isoleucine or valine' 0 N--CA 1.497 1.921 0 O-C-N 121.397 -0.814 . . . . 0.0 110.492 179.659 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 62' ' ' ASP . . . . . 0.514 ' N ' HG23 ' A' ' 61' ' ' ILE . 0.3 OUTLIER -74.9 -29.86 61.11 Favored 'General case' 0 N--CA 1.498 1.941 0 O-C-N 121.334 -0.854 . . . . 0.0 110.501 179.552 . . . . . . . . 3 3 . 1 . 016 nuclear orig core ' A' A ' 63' ' ' GLU . . . . . . . . . . . . . 26.7 mt-10 -61.14 -26.23 67.55 Favored 'General case' 0 N--CA 1.502 2.155 0 O-C-N 121.381 -0.824 . . . . 0.0 110.939 179.72 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 64' ' ' VAL . . . . . 0.437 HG11 ' HA ' ' A' ' 80' ' ' MET . 14.0 m -112.35 -12.55 11.61 Favored 'Isoleucine or valine' 0 N--CA 1.501 2.078 0 O-C-N 121.42 -0.8 . . . . 0.0 111.195 -179.665 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 65' ' ' ASP . . . . . . . . . . . . . 22.3 t70 -60.17 150.69 29.09 Favored 'General case' 0 N--CA 1.498 1.946 0 O-C-N 121.362 -0.836 . . . . 0.0 110.701 -179.8 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 66' ' ' GLU . . . . . . . . . . . . . 2.1 tt0 -140.07 18.12 2.45 Favored 'General case' 0 N--CA 1.494 1.772 0 O-C-N 121.45 -0.782 . . . . 0.0 111.522 -179.482 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 67' ' ' ASP . . . . . . . . . . . . . 5.9 p30 -140.17 1.22 1.8 Allowed 'General case' 0 N--CA 1.503 2.178 0 O-C-N 120.776 -1.202 . . . . 0.0 112.546 -179.787 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 68' ' ' GLY . . . . . . . . . . . . . . . 86.04 -16.04 45.12 Favored Glycine 0 N--CA 1.496 2.644 0 O-C-N 120.649 -1.282 . . . . 0.0 110.657 179.956 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 69' ' ' SER . . . . . . . . . . . . . 1.1 p -66.96 -27.29 67.33 Favored 'General case' 0 N--CA 1.498 1.934 0 O-C-N 121.013 -1.287 . . . . 0.0 110.224 179.693 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 70' ' ' GLY . . . . . . . . . . . . . . . 87.17 -57.73 4.56 Favored Glycine 0 N--CA 1.499 2.834 0 N-CA-C 110.289 -1.124 . . . . 0.0 110.289 179.441 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 71' ' ' THR . . . . . 0.407 HG21 ' HB2' ' A' ' 35' ' ' CYS . 1.0 OUTLIER -47.99 137.94 9.63 Favored 'General case' 0 N--CA 1.506 2.339 0 O-C-N 121.585 -0.95 . . . . 0.0 110.506 -179.7 . . . . . . . . 3 3 . 1 . 016 nuclear orig core ' A' A ' 72' ' ' VAL . . . . . 0.567 HG21 HG13 ' A' ' 61' ' ' ILE . 0.9 OUTLIER -75.91 125.55 35.7 Favored 'Isoleucine or valine' 0 N--CA 1.499 2.0 0 CA-C-O 121.7 0.762 . . . . 0.0 111.631 -178.787 . . . . . . . . 3 3 . 1 . 016 nuclear orig core ' A' A ' 73' ' ' ASP . . . . . . . . . . . . . 1.0 OUTLIER -97.1 -170.55 2.05 Favored 'General case' 0 N--CA 1.495 1.797 0 N-CA-C 109.172 -0.677 . . . . 0.0 109.172 178.724 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 74' ' ' PHE . . . . . . . . . . . . . 28.3 t80 -67.0 -47.72 70.64 Favored 'General case' 0 N--CA 1.499 2.024 0 O-C-N 120.826 -1.171 . . . . 0.0 110.263 179.64 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 75' ' ' ASP . . . . . . . . . . . . . 10.6 t70 -63.64 -44.5 93.68 Favored 'General case' 0 N--CA 1.498 1.967 0 O-C-N 121.412 -0.805 . . . . 0.0 110.146 179.406 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 76' ' ' GLU . . . . . 0.539 ' HA ' HG11 ' A' ' 79' ' ' VAL . 95.5 mt-10 -65.77 -35.12 79.82 Favored 'General case' 0 N--CA 1.498 1.929 0 O-C-N 121.464 -0.772 . . . . 0.0 110.277 179.843 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 77' ' ' PHE . . . . . . . . . . . . . 71.2 t80 -67.19 -38.55 85.57 Favored 'General case' 0 N--CA 1.494 1.755 0 O-C-N 121.112 -0.993 . . . . 0.0 109.496 178.978 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 78' ' ' LEU . . . . . . . . . . . . . 41.3 mt -66.29 -43.82 85.27 Favored 'General case' 0 N--CA 1.498 1.955 0 O-C-N 121.542 -0.724 . . . . 0.0 110.38 179.46 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 79' ' ' VAL . . . . . 0.539 HG11 ' HA ' ' A' ' 76' ' ' GLU . 7.6 p -69.34 -15.64 19.78 Favored 'Isoleucine or valine' 0 N--CA 1.502 2.165 0 O-C-N 121.185 -0.947 . . . . 0.0 110.314 179.119 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 80' ' ' MET . . . . . 0.437 ' HA ' HG11 ' A' ' 64' ' ' VAL . 15.8 ttp -76.73 -37.43 56.01 Favored 'General case' 0 N--CA 1.493 1.71 0 O-C-N 121.116 -0.99 . . . . 0.0 109.383 178.849 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 81' ' ' MET . . . . . . . . . . . . . 3.8 mmm -69.23 -45.44 69.77 Favored 'General case' 0 N--CA 1.499 2.008 0 O-C-N 121.473 -0.767 . . . . 0.0 110.343 179.696 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 82' ' ' VAL . . . . . 0.47 ' HA ' ' HE3' ' A' ' 85' ' ' MET . 35.6 m -59.51 -28.72 40.66 Favored 'Isoleucine or valine' 0 N--CA 1.505 2.316 0 O-C-N 121.388 -0.82 . . . . 0.0 110.844 -179.985 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 83' ' ' ARG . . . . . . . . . . . . . 4.0 mtp-105 -57.86 -37.07 73.24 Favored 'General case' 0 N--CA 1.502 2.132 0 O-C-N 121.131 -0.981 . . . . 0.0 109.61 178.817 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 84' ' ' CYS . . . . . . . . . . . . . 9.9 t -83.25 -28.54 29.11 Favored 'General case' 0 N--CA 1.495 1.783 0 O-C-N 121.625 -0.672 . . . . 0.0 109.833 178.868 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 85' ' ' MET . . . . . 0.47 ' HE3' ' HA ' ' A' ' 82' ' ' VAL . 66.9 mtm . . . . . 0 N--CA 1.497 1.887 0 O-C-N 121.431 -0.793 . . . . 0.0 110.876 179.887 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' B' B ' 149' ' ' SER . . . . . . . . . . . . . 20.1 t . . . . . 0 N--CA 1.505 2.324 0 CA-C-O 121.477 0.656 . . . . 0.0 110.934 . . . . . . . . . 0 0 . 1 . 016 nuclear orig core ' B' B ' 150' ' ' ALA . . . . . . . . . . . . . . . -57.57 -42.71 83.65 Favored 'General case' 0 N--CA 1.5 2.045 0 O-C-N 121.5 -0.75 . . . . 0.0 110.93 179.952 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' B' B ' 151' ' ' ASP . . . . . . . . . . . . . 5.4 m-20 -62.73 -49.81 73.58 Favored 'General case' 0 N--CA 1.5 2.041 0 O-C-N 121.4 -0.812 . . . . 0.0 110.644 -179.973 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' B' B ' 152' ' ' ALA . . . . . . . . . . . . . . . -63.35 -44.93 93.44 Favored 'General case' 0 N--CA 1.497 1.918 0 O-C-N 121.379 -0.826 . . . . 0.0 110.149 179.631 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' B' B ' 153' ' ' MET . . . . . . . . . . . . . 0.2 OUTLIER -63.62 -44.66 93.29 Favored 'General case' 0 N--CA 1.497 1.877 0 O-C-N 121.512 -0.743 . . . . 0.0 109.991 179.361 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' B' B ' 154' ' ' MET . . . . . 0.432 ' HG2' HD13 ' B' ' 158' ' ' LEU . 3.8 ttm -60.25 -44.26 95.42 Favored 'General case' 0 N--CA 1.497 1.916 0 O-C-N 121.419 -0.801 . . . . 0.0 110.014 179.308 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' B' B ' 155' ' ' GLN . . . . . . . . . . . . . 1.0 OUTLIER -62.5 -33.14 74.29 Favored 'General case' 0 N--CA 1.498 1.975 0 O-C-N 121.511 -0.743 . . . . 0.0 110.221 179.299 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' B' B ' 156' ' ' ALA . . . . . . . . . . . . . . . -71.78 -26.68 62.52 Favored 'General case' 0 N--CA 1.497 1.889 0 O-C-N 121.523 -0.736 . . . . 0.0 110.723 179.511 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' B' B ' 157' ' ' LEU . . . . . . . . . . . . . 13.9 mt -92.87 -41.97 9.77 Favored 'General case' 0 N--CA 1.495 1.82 0 O-C-N 121.273 -0.892 . . . . 0.0 111.326 -179.338 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' B' B ' 158' ' ' LEU . . . . . 0.432 HD13 ' HG2' ' B' ' 154' ' ' MET . 66.0 mt . . . . . 0 N--CA 1.5 2.06 0 O-C-N 121.198 -0.939 . . . . 0.0 111.597 -179.393 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 4' ' ' ILE . . . . . . . . . . . . . 15.4 mt . . . . . 0 N--CA 1.501 2.095 0 CA-C-O 120.965 0.412 . . . . 0.0 110.51 . . . . . . . . . 0 0 . 1 . 017 nuclear orig core ' A' A ' 5' ' ' TYR . . . . . 0.544 ' CE1' ' HG2' ' A' ' 83' ' ' ARG . 6.3 m-85 -70.86 -34.76 71.97 Favored 'General case' 0 N--CA 1.498 1.932 0 O-C-N 121.351 -0.843 . . . . 0.0 110.686 -179.987 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -68.57 -30.41 69.18 Favored 'General case' 0 N--CA 1.498 1.969 0 O-C-N 121.251 -0.906 . . . . 0.0 110.53 179.614 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 7' ' ' ALA . . . . . . . . . . . . . . . -55.12 -36.27 65.55 Favored 'General case' 0 N--CA 1.5 2.033 0 O-C-N 121.236 -0.915 . . . . 0.0 109.784 179.146 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 8' ' ' ALA . . . . . . . . . . . . . . . -65.24 -35.3 80.62 Favored 'General case' 0 N--CA 1.496 1.842 0 O-C-N 121.586 -0.697 . . . . 0.0 109.778 178.768 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 9' ' ' VAL . . . . . . . . . . . . . 43.7 t -62.62 -32.96 57.23 Favored 'Isoleucine or valine' 0 N--CA 1.502 2.128 0 O-C-N 121.456 -0.777 . . . . 0.0 109.523 178.827 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 10' ' ' GLU . . . . . . . . . . . . . 9.3 mt-10 -88.57 -5.84 57.93 Favored 'General case' 0 N--CA 1.498 1.943 0 O-C-N 121.408 -0.808 . . . . 0.0 110.732 179.273 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 11' ' ' GLN . . . . . . . . . . . . . 1.4 mt-30 -87.97 -29.6 20.66 Favored 'General case' 0 N--CA 1.496 1.865 0 O-C-N 121.105 -0.997 . . . . 0.0 111.063 -179.809 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 12' ' ' LEU . . . . . 0.401 ' HB2' ' CB ' ' A' ' 16' ' ' GLN . 3.7 pp -66.98 153.11 44.43 Favored 'General case' 0 N--CA 1.5 2.065 0 O-C-N 121.104 -0.997 . . . . 0.0 110.739 -179.71 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 13' ' ' THR . . . . . . . . . . . . . 22.2 p -99.48 -177.55 3.62 Favored 'General case' 0 N--CA 1.501 2.105 0 O-C-N 121.416 -0.803 . . . . 0.0 111.368 -179.147 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 14' ' ' GLU . . . . . 0.418 ' O ' ' HB2' ' A' ' 18' ' ' ASN . 12.8 tp10 -53.86 -39.32 65.56 Favored 'General case' 0 N--CA 1.492 1.669 0 O-C-N 121.912 -0.492 . . . . 0.0 110.697 -179.683 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 1.5 mp0 -54.53 -36.95 64.82 Favored 'General case' 0 N--CA 1.5 2.055 0 O-C-N 121.463 -0.773 . . . . 0.0 110.783 179.766 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 16' ' ' GLN . . . . . 0.401 ' CB ' ' HB2' ' A' ' 12' ' ' LEU . 0.8 OUTLIER -72.18 -63.84 1.06 Allowed 'General case' 0 N--CA 1.497 1.897 0 O-C-N 121.292 -0.88 . . . . 0.0 111.146 -179.716 . . . . . . . . 3 3 . 1 . 017 nuclear orig core ' A' A ' 17' ' ' LYS . . . . . 0.405 ' HG3' ' O ' ' A' ' 14' ' ' GLU . 5.3 ptmt -54.81 -32.54 60.47 Favored 'General case' 0 N--CA 1.503 2.194 0 O-C-N 121.839 -0.538 . . . . 0.0 111.347 -179.456 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 18' ' ' ASN . . . . . 0.418 ' HB2' ' O ' ' A' ' 14' ' ' GLU . 7.6 t-20 -70.02 -49.45 51.19 Favored 'General case' 0 N--CA 1.494 1.775 0 O-C-N 121.269 -0.894 . . . . 0.0 110.308 179.999 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 0.3 OUTLIER -62.91 -43.48 98.69 Favored 'General case' 0 N--CA 1.497 1.922 0 O-C-N 121.3 -0.875 . . . . 0.0 109.545 179.187 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 20' ' ' PHE . . . . . . . . . . . . . 12.7 m-85 -59.41 -33.79 71.66 Favored 'General case' 0 N--CA 1.497 1.918 0 O-C-N 121.447 -0.783 . . . . 0.0 109.769 178.941 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 21' ' ' LYS . . . . . 0.511 ' HG3' ' N ' ' A' ' 22' ' ' ALA . 0.0 OUTLIER -65.65 -41.78 92.16 Favored 'General case' 0 N--CA 1.496 1.832 0 O-C-N 121.538 -0.726 . . . . 0.0 109.233 178.629 . . . . . . . . 3 3 . 1 . 017 nuclear orig core ' A' A ' 22' ' ' ALA . . . . . 0.511 ' N ' ' HG3' ' A' ' 21' ' ' LYS . . . -69.69 -45.45 68.27 Favored 'General case' 0 N--CA 1.496 1.828 0 O-C-N 121.286 -0.884 . . . . 0.0 109.589 179.181 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 23' ' ' ALA . . . . . . . . . . . . . . . -63.35 -49.73 72.74 Favored 'General case' 0 N--CA 1.497 1.897 0 O-C-N 121.648 -0.658 . . . . 0.0 110.455 179.412 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 24' ' ' PHE . . . . . 0.422 ' CD2' HD12 ' A' ' 36' ' ' ILE . 27.4 t80 -55.92 -43.55 77.45 Favored 'General case' 0 N--CA 1.5 2.069 0 O-C-N 121.507 -0.746 . . . . 0.0 110.47 179.724 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 25' ' ' ASP . . . . . . . . . . . . . 20.2 t70 -62.79 -52.14 64.36 Favored 'General case' 0 N--CA 1.496 1.841 0 O-C-N 121.625 -0.672 . . . . 0.0 110.387 179.815 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 26' ' ' ILE . . . . . . . . . . . . . 1.9 mt -64.55 -28.29 44.52 Favored 'Isoleucine or valine' 0 N--CA 1.498 1.963 0 O-C-N 121.334 -0.854 . . . . 0.0 110.495 179.584 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 27' ' ' PHE . . . . . . . . . . . . . 0.1 OUTLIER -63.9 -42.86 97.32 Favored 'General case' 0 N--CA 1.498 1.947 0 O-C-N 121.194 -0.942 . . . . 0.0 110.511 179.68 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 28' ' ' VAL . . . . . . . . . . . . . 19.5 m -91.38 -35.7 7.32 Favored 'Isoleucine or valine' 0 N--CA 1.499 2.004 0 O-C-N 121.317 -0.864 . . . . 0.0 110.772 -179.975 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 29' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER 57.24 -87.64 0.02 OUTLIER 'General case' 0 N--CA 1.501 2.082 0 O-C-N 121.672 -0.643 . . . . 0.0 110.631 -179.63 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 30' ' ' GLY . . . . . . . . . . . . . . . -89.73 -16.99 55.68 Favored Glycine 0 N--CA 1.496 2.656 0 N-CA-C 110.14 -1.184 . . . . 0.0 110.14 179.421 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 31' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.499 1.984 0 O-C-N 121.095 -1.238 . . . . 0.0 110.322 179.747 . . . . . . . . 0 0 . 1 . 017 nuclear orig core ' A' A ' 35' ' ' CYS . . . . . . . . . . . . . 12.7 m . . . . . 0 N--CA 1.502 2.139 0 CA-C-O 121.213 0.53 . . . . 0.0 111.08 . . . . . . . . . 0 0 . 1 . 017 nuclear orig core ' A' A ' 36' ' ' ILE . . . . . 0.422 HD12 ' CD2' ' A' ' 24' ' ' PHE . 65.2 mt -79.36 123.26 36.05 Favored 'Isoleucine or valine' 0 N--CA 1.499 2.009 0 O-C-N 121.191 -0.943 . . . . 0.0 111.059 -179.175 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 37' ' ' SER . . . . . . . . . . . . . 18.3 t -125.08 -178.84 4.32 Favored 'General case' 0 N--CA 1.494 1.762 0 O-C-N 121.632 -0.667 . . . . 0.0 109.613 178.948 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 38' ' ' THR . . . . . . . . . . . . . 3.2 p -61.55 -36.34 80.34 Favored 'General case' 0 N--CA 1.501 2.117 0 O-C-N 121.324 -0.86 . . . . 0.0 110.597 179.709 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 39' ' ' LYS . . . . . . . . . . . . . 4.1 tptt -68.3 -34.28 75.86 Favored 'General case' 0 N--CA 1.498 1.951 0 O-C-N 121.529 -0.732 . . . . 0.0 110.804 179.843 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 40' ' ' GLU . . . . . 0.551 ' HA ' ' HD2' ' A' ' 43' ' ' LYS . 25.7 mm-40 -83.58 -24.14 31.65 Favored 'General case' 0 N--CA 1.499 1.978 0 O-C-N 121.299 -0.876 . . . . 0.0 111.083 -179.643 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 41' ' ' LEU . . . . . 0.437 ' C ' ' CD1' ' A' ' 41' ' ' LEU . 3.4 tm? -70.22 -64.66 0.85 Allowed 'General case' 0 N--CA 1.499 1.99 0 O-C-N 121.135 -0.978 . . . . 0.0 109.711 179.519 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 42' ' ' GLY . . . . . . . . . . . . . . . -47.59 -31.85 7.44 Favored Glycine 0 N--CA 1.501 3.025 0 N-CA-C 110.621 -0.992 . . . . 0.0 110.621 179.836 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 43' ' ' LYS . . . . . 0.551 ' HD2' ' HA ' ' A' ' 40' ' ' GLU . 11.1 mttp -49.22 -49.29 43.73 Favored 'General case' 0 N--CA 1.503 2.187 0 O-C-N 121.572 -0.958 . . . . 0.0 110.91 179.602 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 44' ' ' VAL . . . . . . . . . . . . . 33.6 m -81.76 -22.02 10.16 Favored 'Isoleucine or valine' 0 N--CA 1.503 2.204 0 O-C-N 121.322 -0.862 . . . . 0.0 111.204 -179.878 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 45' ' ' MET . . . . . . . . . . . . . 19.6 mmt -59.27 -38.74 80.87 Favored 'General case' 0 N--CA 1.502 2.13 0 O-C-N 121.121 -0.987 . . . . 0.0 110.258 179.672 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 46' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -57.7 -41.91 82.65 Favored 'General case' 0 N--CA 1.498 1.939 0 O-C-N 121.572 -0.705 . . . . 0.0 110.454 179.704 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 47' ' ' MET . . . . . . . . . . . . . 29.9 ttp -68.23 -36.05 78.88 Favored 'General case' 0 N--CA 1.498 1.937 0 O-C-N 121.494 -0.754 . . . . 0.0 110.562 179.693 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 48' ' ' LEU . . . . . . . . . . . . . 6.2 tp -75.02 -44.74 46.29 Favored 'General case' 0 N--CA 1.492 1.669 0 O-C-N 121.357 -0.839 . . . . 0.0 110.298 179.951 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 49' ' ' GLY . . . . . . . . . . . . . . . -155.28 -76.77 0.02 OUTLIER Glycine 0 N--CA 1.495 2.613 0 N-CA-C 110.024 -1.23 . . . . 0.0 110.024 179.918 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 50' ' ' GLN . . . . . . . . . . . . . 36.9 mt-30 -137.54 171.63 14.17 Favored 'General case' 0 N--CA 1.499 1.975 0 O-C-N 121.409 -1.053 . . . . 0.0 110.584 -179.833 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 51' ' ' ASN . . . . . . . . . . . . . 1.3 t30 -106.66 105.74 55.76 Favored Pre-proline 0 N--CA 1.499 1.993 0 O-C-N 121.225 -0.922 . . . . 0.0 111.266 -179.556 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 52' ' ' PRO . . . . . 0.554 ' HG2' HD11 ' A' ' 57' ' ' LEU . 46.8 Cg_endo -77.34 166.23 26.44 Favored 'Trans proline' 0 C--N 1.315 -1.225 0 O-C-N 123.668 1.352 . . . . 0.0 110.242 178.799 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 53' ' ' THR . . . . . . . . . . . . . 65.4 p -79.16 159.23 73.38 Favored Pre-proline 0 N--CA 1.5 2.044 0 O-C-N 121.198 -0.939 . . . . 0.0 110.833 -179.527 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 54' ' ' PRO . . . . . . . . . . . . . 41.6 Cg_endo -67.18 -38.7 15.0 Favored 'Trans proline' 0 N--CA 1.49 1.287 0 O-C-N 123.818 1.43 . . . . 0.0 110.817 179.793 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 55' ' ' GLU . . . . . 0.408 ' O ' ' HB2' ' A' ' 58' ' ' GLN . 0.1 OUTLIER -58.88 -39.61 81.91 Favored 'General case' 0 N--CA 1.498 1.933 0 O-C-N 121.394 -0.816 . . . . 0.0 110.107 179.505 . . . . . . . . 3 3 . 1 . 017 nuclear orig core ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 5.8 mt-10 -66.58 -37.94 86.0 Favored 'General case' 0 N--CA 1.497 1.876 0 O-C-N 121.38 -0.825 . . . . 0.0 110.302 179.307 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 57' ' ' LEU . . . . . 0.554 HD11 ' HG2' ' A' ' 52' ' ' PRO . 9.0 mt -81.51 -9.79 59.62 Favored 'General case' 0 N--CA 1.499 1.993 0 O-C-N 121.332 -0.855 . . . . 0.0 111.25 179.958 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 58' ' ' GLN . . . . . 0.408 ' HB2' ' O ' ' A' ' 55' ' ' GLU . 9.7 mm100 -57.36 -52.1 66.7 Favored 'General case' 0 N--CA 1.5 2.062 0 O-C-N 120.997 -1.064 . . . . 0.0 110.113 -179.892 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 59' ' ' GLU . . . . . . . . . . . . . 10.9 tp10 -53.07 -40.11 63.79 Favored 'General case' 0 N--CA 1.498 1.936 0 O-C-N 121.623 -0.673 . . . . 0.0 110.362 179.461 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 60' ' ' MET . . . . . 0.401 ' HE1' HD23 ' A' ' 57' ' ' LEU . 0.4 OUTLIER -53.37 -34.44 57.64 Favored 'General case' 0 N--CA 1.501 2.082 0 O-C-N 121.415 -0.803 . . . . 0.0 110.376 179.389 . . . . . . . . 3 3 . 1 . 017 nuclear orig core ' A' A ' 61' ' ' ILE . . . . . 0.617 HG22 HG22 ' A' ' 72' ' ' VAL . 15.1 mt -91.97 -44.27 14.19 Favored 'Isoleucine or valine' 0 N--CA 1.497 1.921 0 O-C-N 121.407 -0.808 . . . . 0.0 110.124 179.196 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 62' ' ' ASP . . . . . . . . . . . . . 71.8 m-20 -57.12 -33.17 67.07 Favored 'General case' 0 N--CA 1.5 2.026 0 O-C-N 121.465 -0.772 . . . . 0.0 111.04 -179.607 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 63' ' ' GLU . . . . . . . . . . . . . 1.9 tt0 -66.91 -26.85 67.06 Favored 'General case' 0 N--CA 1.5 2.044 0 O-C-N 121.186 -0.946 . . . . 0.0 111.035 179.809 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 64' ' ' VAL . . . . . . . . . . . . . 24.5 m -117.14 9.96 7.22 Favored 'Isoleucine or valine' 0 N--CA 1.503 2.178 0 O-C-N 121.148 -0.97 . . . . 0.0 111.481 -179.882 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 65' ' ' ASP . . . . . . . . . . . . . 19.0 t70 -80.3 138.23 36.72 Favored 'General case' 0 N--CA 1.498 1.935 0 O-C-N 120.897 -1.127 . . . . 0.0 110.154 179.897 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 66' ' ' GLU . . . . . . . . . . . . . 21.2 mt-10 -128.77 24.07 5.74 Favored 'General case' 0 N--CA 1.497 1.914 0 O-C-N 121.376 -0.827 . . . . 0.0 111.642 -179.132 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 67' ' ' ASP . . . . . . . . . . . . . 42.6 p-10 -141.22 -0.3 1.45 Allowed 'General case' 0 N--CA 1.501 2.109 0 O-C-N 120.767 -1.208 . . . . 0.0 112.865 -179.91 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 68' ' ' GLY . . . . . . . . . . . . . . . 86.97 -21.27 20.68 Favored Glycine 0 N--CA 1.496 2.698 0 O-C-N 120.705 -1.247 . . . . 0.0 110.687 179.653 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 69' ' ' SER . . . . . . . . . . . . . 1.7 p -59.52 -27.99 66.68 Favored 'General case' 0 N--CA 1.499 1.987 0 O-C-N 121.253 -1.145 . . . . 0.0 110.482 179.83 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 70' ' ' GLY . . . . . . . . . . . . . . . 71.44 30.21 67.12 Favored Glycine 0 N--CA 1.498 2.817 0 N-CA-C 110.195 -1.162 . . . . 0.0 110.195 -179.981 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 71' ' ' THR . . . . . . . . . . . . . 5.3 m -134.54 142.93 47.14 Favored 'General case' 0 N--CA 1.499 1.999 0 O-C-N 121.407 -1.055 . . . . 0.0 108.929 179.489 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 72' ' ' VAL . . . . . 0.617 HG22 HG22 ' A' ' 61' ' ' ILE . 17.0 t -75.92 113.49 14.91 Favored 'Isoleucine or valine' 0 N--CA 1.498 1.944 0 O-C-N 121.192 -0.943 . . . . 0.0 111.198 -179.002 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 73' ' ' ASP . . . . . . . . . . . . . 17.0 m-20 -88.48 -178.69 5.91 Favored 'General case' 0 N--CA 1.494 1.772 0 N-CA-C 108.7 -0.852 . . . . 0.0 108.7 178.409 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 74' ' ' PHE . . . . . . . . . . . . . 49.1 t80 -63.91 -42.18 97.47 Favored 'General case' 0 N--CA 1.499 2.015 0 O-C-N 120.905 -1.122 . . . . 0.0 109.828 179.266 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 75' ' ' ASP . . . . . . . . . . . . . 1.0 OUTLIER -66.54 -47.13 73.83 Favored 'General case' 0 N--CA 1.496 1.862 0 O-C-N 121.511 -0.743 . . . . 0.0 110.228 179.435 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 76' ' ' GLU . . . . . . . . . . . . . 72.4 mt-10 -63.95 -38.01 89.53 Favored 'General case' 0 N--CA 1.499 1.986 0 O-C-N 121.453 -0.779 . . . . 0.0 109.755 179.238 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 77' ' ' PHE . . . . . . . . . . . . . 75.7 t80 -57.11 -40.6 77.39 Favored 'General case' 0 N--CA 1.495 1.785 0 O-C-N 121.673 -0.642 . . . . 0.0 109.628 179.118 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 78' ' ' LEU . . . . . . . . . . . . . 43.2 mt -63.15 -43.68 97.64 Favored 'General case' 0 N--CA 1.498 1.945 0 O-C-N 121.396 -0.815 . . . . 0.0 109.476 178.802 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 79' ' ' VAL . . . . . . . . . . . . . 73.2 t -61.27 -39.53 82.93 Favored 'Isoleucine or valine' 0 N--CA 1.501 2.101 0 O-C-N 121.616 -0.677 . . . . 0.0 109.473 178.948 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 80' ' ' MET . . . . . . . . . . . . . 11.8 ttp -67.16 -35.19 79.16 Favored 'General case' 0 N--CA 1.496 1.866 0 O-C-N 121.486 -0.759 . . . . 0.0 110.096 179.168 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 81' ' ' MET . . . . . . . . . . . . . 11.3 mmt -70.49 -51.78 26.64 Favored 'General case' 0 N--CA 1.497 1.892 0 O-C-N 121.486 -0.758 . . . . 0.0 110.767 -179.915 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 82' ' ' VAL . . . . . 0.409 HG21 ' N ' ' A' ' 83' ' ' ARG . 34.2 m -62.61 -24.53 35.65 Favored 'Isoleucine or valine' 0 N--CA 1.501 2.1 0 O-C-N 121.141 -0.975 . . . . 0.0 110.655 -179.982 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 83' ' ' ARG . . . . . 0.544 ' HG2' ' CE1' ' A' ' 5' ' ' TYR . 11.3 mtt180 -62.45 -31.48 72.2 Favored 'General case' 0 N--CA 1.499 1.99 0 O-C-N 121.232 -0.917 . . . . 0.0 110.206 179.145 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 84' ' ' CYS . . . . . . . . . . . . . 3.3 t -86.58 -30.88 21.52 Favored 'General case' 0 N--CA 1.494 1.765 0 O-C-N 121.479 -0.763 . . . . 0.0 109.474 178.651 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 85' ' ' MET . . . . . . . . . . . . . 30.9 mtm . . . . . 0 N--CA 1.499 2.001 0 O-C-N 121.486 -0.759 . . . . 0.0 111.247 -179.96 . . . . . . . . 0 0 . 1 . 017 nuclear orig core ' B' B ' 149' ' ' SER . . . . . . . . . . . . . 45.5 t . . . . . 0 N--CA 1.493 1.692 0 CA-C-O 121.191 0.519 . . . . 0.0 110.227 . . . . . . . . . 0 0 . 1 . 017 nuclear orig core ' B' B ' 150' ' ' ALA . . . . . . . . . . . . . . . -55.67 -38.37 69.52 Favored 'General case' 0 N--CA 1.497 1.906 0 O-C-N 121.678 -0.638 . . . . 0.0 110.591 179.836 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' B' B ' 151' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -65.35 -46.28 80.83 Favored 'General case' 0 N--CA 1.497 1.908 0 O-C-N 121.329 -0.857 . . . . 0.0 110.445 179.695 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' B' B ' 152' ' ' ALA . . . . . . . . . . . . . . . -51.0 -48.32 61.42 Favored 'General case' 0 N--CA 1.501 2.081 0 O-C-N 121.486 -0.759 . . . . 0.0 110.644 179.943 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' B' B ' 153' ' ' MET . . . . . . . . . . . . . 11.6 mmt -63.17 -42.9 99.49 Favored 'General case' 0 N--CA 1.498 1.973 0 O-C-N 121.357 -0.839 . . . . 0.0 110.099 179.468 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' B' B ' 154' ' ' MET . . . . . . . . . . . . . 13.2 mtt -64.55 -37.04 86.17 Favored 'General case' 0 N--CA 1.498 1.959 0 O-C-N 121.493 -0.755 . . . . 0.0 110.499 179.586 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' B' B ' 155' ' ' GLN . . . . . . . . . . . . . 0.3 OUTLIER -58.02 -33.98 69.55 Favored 'General case' 0 N--CA 1.502 2.166 0 O-C-N 121.419 -0.801 . . . . 0.0 111.533 -179.67 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' B' B ' 156' ' ' ALA . . . . . . . . . . . . . . . -100.8 -44.23 5.85 Favored 'General case' 0 N--CA 1.501 2.094 0 O-C-N 121.159 -0.963 . . . . 0.0 111.162 -179.598 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' B' B ' 157' ' ' LEU . . . . . . . . . . . . . 10.0 mt -75.78 -37.88 58.79 Favored 'General case' 0 N--CA 1.501 2.101 0 O-C-N 121.27 -0.894 . . . . 0.0 111.018 -179.493 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' B' B ' 158' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER . . . . . 0 N--CA 1.498 1.929 0 O-C-N 121.257 -0.902 . . . . 0.0 110.375 179.877 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 4' ' ' ILE . . . . . . . . . . . . . 2.7 mp . . . . . 0 N--CA 1.496 1.86 0 N-CA-C 110.02 -0.363 . . . . 0.0 110.02 . . . . . . . . . 0 0 . 1 . 018 nuclear orig core ' A' A ' 5' ' ' TYR . . . . . . . . . . . . . 5.8 m-85 -57.63 -30.01 65.03 Favored 'General case' 0 N--CA 1.5 2.048 0 O-C-N 121.306 -0.872 . . . . 0.0 110.082 179.384 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 6' ' ' LYS . . . . . 0.456 ' O ' HG12 ' A' ' 9' ' ' VAL . 14.8 mttt -61.15 -43.53 98.74 Favored 'General case' 0 N--CA 1.499 1.997 0 O-C-N 121.385 -0.822 . . . . 0.0 109.716 178.986 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 7' ' ' ALA . . . . . . . . . . . . . . . -55.32 -32.67 62.66 Favored 'General case' 0 N--CA 1.499 2.007 0 O-C-N 121.342 -0.849 . . . . 0.0 110.238 179.099 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 8' ' ' ALA . . . . . . . . . . . . . . . -71.32 -37.52 71.75 Favored 'General case' 0 N--CA 1.499 1.985 0 O-C-N 121.433 -0.792 . . . . 0.0 110.424 179.39 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 9' ' ' VAL . . . . . 0.564 HG22 ' HB ' ' A' ' 79' ' ' VAL . 0.3 OUTLIER -77.4 -23.1 14.37 Favored 'Isoleucine or valine' 0 N--CA 1.499 2.008 0 O-C-N 121.503 -0.748 . . . . 0.0 111.169 -179.66 . . . . . . . . 3 3 . 1 . 018 nuclear orig core ' A' A ' 10' ' ' GLU . . . . . . . . . . . . . 28.1 mt-10 -92.89 -26.26 17.7 Favored 'General case' 0 N--CA 1.495 1.811 0 O-C-N 121.238 -0.914 . . . . 0.0 111.918 -179.233 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 11' ' ' GLN . . . . . . . . . . . . . 2.8 mt-30 -119.35 64.06 0.79 Allowed 'General case' 0 N--CA 1.499 2.009 0 O-C-N 120.825 -1.172 . . . . 0.0 112.239 -178.825 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 12' ' ' LEU . . . . . 0.542 HD11 ' HA ' ' A' ' 9' ' ' VAL . 0.5 OUTLIER -90.36 164.15 14.44 Favored 'General case' 0 N--CA 1.501 2.11 0 O-C-N 120.933 -1.105 . . . . 0.0 109.796 178.422 . . . . . . . . 3 3 . 1 . 018 nuclear orig core ' A' A ' 13' ' ' THR . . . . . . . . . . . . . 39.4 p -79.47 162.46 25.43 Favored 'General case' 0 N--CA 1.499 1.999 0 O-C-N 121.005 -1.06 . . . . 0.0 109.379 178.658 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 14' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER -55.92 -33.21 64.47 Favored 'General case' 0 N--CA 1.493 1.693 0 O-C-N 121.389 -0.819 . . . . 0.0 110.709 -179.349 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 1.8 mp0 -73.71 -55.81 5.79 Favored 'General case' 0 N--CA 1.498 1.961 0 O-C-N 121.29 -0.881 . . . . 0.0 109.935 179.349 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 16' ' ' GLN . . . . . . . . . . . . . 2.1 mp0 -57.03 -53.59 56.33 Favored 'General case' 0 N--CA 1.503 2.177 0 O-C-N 121.425 -0.797 . . . . 0.0 110.891 -179.827 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 17' ' ' LYS . . . . . 0.489 ' HD3' ' HB2' ' A' ' 12' ' ' LEU . 2.6 ttpm? -57.65 -42.73 84.07 Favored 'General case' 0 N--CA 1.499 2.021 0 CA-C-N 116.228 -0.442 . . . . 0.0 110.96 -179.95 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 18' ' ' ASN . . . . . . . . . . . . . 14.7 t30 -70.62 -42.51 70.81 Favored 'General case' 0 N--CA 1.497 1.921 0 O-C-N 121.288 -0.882 . . . . 0.0 110.66 -179.993 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -56.96 -47.55 80.45 Favored 'General case' 0 N--CA 1.499 2.018 0 O-C-N 121.369 -0.832 . . . . 0.0 110.608 -179.657 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 20' ' ' PHE . . . . . . . . . . . . . 23.3 m-85 -64.7 -37.82 88.88 Favored 'General case' 0 N--CA 1.501 2.095 0 O-C-N 121.051 -1.03 . . . . 0.0 109.863 179.363 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 21' ' ' LYS . . . . . . . . . . . . . 17.3 tptp -62.7 -41.74 99.28 Favored 'General case' 0 N--CA 1.499 1.993 0 O-C-N 121.525 -0.734 . . . . 0.0 109.908 179.228 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 22' ' ' ALA . . . . . . . . . . . . . . . -77.73 -42.62 33.66 Favored 'General case' 0 N--CA 1.496 1.863 0 O-C-N 121.488 -0.757 . . . . 0.0 110.084 179.506 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 23' ' ' ALA . . . . . . . . . . . . . . . -62.71 -42.86 99.86 Favored 'General case' 0 N--CA 1.497 1.903 0 O-C-N 121.463 -0.773 . . . . 0.0 110.461 179.717 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 24' ' ' PHE . . . . . 0.463 ' CE1' HG13 ' A' ' 36' ' ' ILE . 79.7 t80 -62.96 -42.82 99.93 Favored 'General case' 0 N--CA 1.496 1.865 0 O-C-N 121.393 -0.817 . . . . 0.0 110.476 179.854 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 25' ' ' ASP . . . . . . . . . . . . . 0.7 OUTLIER -58.14 -45.38 87.48 Favored 'General case' 0 N--CA 1.499 2.02 0 O-C-N 121.44 -0.787 . . . . 0.0 110.253 179.784 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 26' ' ' ILE . . . . . . . . . . . . . 21.1 mt -68.19 -28.39 40.68 Favored 'Isoleucine or valine' 0 N--CA 1.497 1.912 0 O-C-N 121.42 -0.8 . . . . 0.0 109.611 178.956 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 27' ' ' PHE . . . . . . . . . . . . . 0.1 OUTLIER -73.11 -42.56 62.81 Favored 'General case' 0 N--CA 1.498 1.95 0 O-C-N 121.405 -0.809 . . . . 0.0 111.108 179.871 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 28' ' ' VAL . . . . . 0.405 ' CG1' HG13 ' A' ' 36' ' ' ILE . 18.7 m -92.26 38.33 0.09 OUTLIER 'Isoleucine or valine' 0 N--CA 1.506 2.337 0 O-C-N 121.238 -0.914 . . . . 0.0 111.503 -179.471 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 29' ' ' LEU . . . . . . . . . . . . . 4.7 mt -69.3 -36.75 77.34 Favored 'General case' 0 N--CA 1.498 1.932 0 O-C-N 120.954 -1.091 . . . . 0.0 109.878 179.042 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 30' ' ' GLY . . . . . . . . . . . . . . . -102.67 38.32 3.26 Favored Glycine 0 N--CA 1.494 2.514 0 N-CA-C 109.372 -1.491 . . . . 0.0 109.372 179.018 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 31' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.496 1.853 0 O-C-N 121.575 -0.956 . . . . 0.0 110.371 -179.992 . . . . . . . . 0 0 . 1 . 018 nuclear orig core ' A' A ' 35' ' ' CYS . . . . . . . . . . . . . 3.3 t . . . . . 0 N--CA 1.497 1.906 0 CA-C-O 121.042 0.449 . . . . 0.0 110.093 . . . . . . . . . 0 0 . 1 . 018 nuclear orig core ' A' A ' 36' ' ' ILE . . . . . 0.463 HG13 ' CE1' ' A' ' 24' ' ' PHE . 14.8 mt -76.51 132.37 33.11 Favored 'Isoleucine or valine' 0 N--CA 1.5 2.048 0 O-C-N 121.235 -0.916 . . . . 0.0 110.367 -179.775 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 37' ' ' SER . . . . . . . . . . . . . 22.9 t -117.14 173.36 6.71 Favored 'General case' 0 N--CA 1.496 1.848 0 O-C-N 121.601 -0.687 . . . . 0.0 109.804 179.126 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 38' ' ' THR . . . . . 0.495 ' HB ' ' O ' ' A' ' 54' ' ' PRO . 23.3 p -61.04 -45.8 93.31 Favored 'General case' 0 N--CA 1.502 2.153 0 O-C-N 121.215 -0.928 . . . . 0.0 110.613 -180.0 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 39' ' ' LYS . . . . . . . . . . . . . 9.6 tmtt? -59.64 -35.18 73.89 Favored 'General case' 0 N--CA 1.499 1.976 0 O-C-N 121.596 -0.69 . . . . 0.0 110.557 179.728 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 9.3 mm-40 -69.58 -36.68 76.48 Favored 'General case' 0 N--CA 1.497 1.899 0 O-C-N 121.363 -0.836 . . . . 0.0 110.579 -179.968 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 41' ' ' LEU . . . . . 0.491 HD13 ' HG3' ' A' ' 45' ' ' MET . 6.8 tp -67.59 -45.16 76.32 Favored 'General case' 0 N--CA 1.497 1.922 0 O-C-N 121.028 -1.045 . . . . 0.0 109.053 178.748 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 42' ' ' GLY . . . . . . . . . . . . . . . -57.73 -34.3 70.21 Favored Glycine 0 N--CA 1.491 2.316 0 N-CA-C 110.073 -1.211 . . . . 0.0 110.073 179.862 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 43' ' ' LYS . . . . . . . . . . . . . 15.2 ttpt -54.0 -37.96 64.57 Favored 'General case' 0 N--CA 1.501 2.11 0 O-C-N 121.472 -1.017 . . . . 0.0 109.773 179.057 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 44' ' ' VAL . . . . . . . . . . . . . 98.0 t -84.55 -41.24 15.92 Favored 'Isoleucine or valine' 0 N--CA 1.499 2.017 0 O-C-N 121.395 -0.816 . . . . 0.0 109.699 179.097 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 45' ' ' MET . . . . . 0.491 ' HG3' HD13 ' A' ' 41' ' ' LEU . 2.6 mtt -64.31 -22.67 67.03 Favored 'General case' 0 N--CA 1.502 2.149 0 O-C-N 121.485 -0.759 . . . . 0.0 110.992 179.564 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 46' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -49.6 -40.96 40.75 Favored 'General case' 0 N--CA 1.501 2.079 0 O-C-N 121.364 -0.835 . . . . 0.0 111.555 -179.642 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 47' ' ' MET . . . . . . . . . . . . . 2.7 ptt? -94.39 4.23 54.13 Favored 'General case' 0 N--CA 1.5 2.037 0 O-C-N 121.26 -0.9 . . . . 0.0 111.741 -179.646 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 48' ' ' LEU . . . . . . . . . . . . . 43.0 tp -132.84 -64.07 0.76 Allowed 'General case' 0 N--CA 1.493 1.723 0 O-C-N 120.803 -1.185 . . . . 0.0 111.045 -179.466 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 49' ' ' GLY . . . . . 0.468 ' O ' ' HB2' ' A' ' 50' ' ' GLN . . . -96.96 19.24 55.58 Favored Glycine 0 N--CA 1.498 2.772 0 C-N-CA 120.405 -0.903 . . . . 0.0 111.115 -179.464 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 50' ' ' GLN . . . . . 0.468 ' HB2' ' O ' ' A' ' 49' ' ' GLY . 36.1 mt-30 65.19 -68.4 0.11 Allowed 'General case' 0 N--CA 1.507 2.407 0 CA-C-N 118.254 1.027 . . . . 0.0 111.469 179.661 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 51' ' ' ASN . . . . . 0.425 ' OD1' HD23 ' A' ' 57' ' ' LEU . 0.9 OUTLIER 63.49 94.28 0.05 OUTLIER Pre-proline 0 N--CA 1.504 2.227 0 O-C-N 121.492 -0.755 . . . . 0.0 110.956 -179.759 . . . . . . . . 3 3 . 1 . 018 nuclear orig core ' A' A ' 52' ' ' PRO . . . . . . . . . . . . . 49.2 Cg_endo -75.41 -42.96 0.4 Allowed 'Trans proline' 0 N--CA 1.49 1.274 0 O-C-N 123.747 1.393 . . . . 0.0 111.212 179.819 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 53' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -143.54 153.94 59.23 Favored Pre-proline 0 N--CA 1.501 2.086 0 O-C-N 121.198 -0.939 . . . . 0.0 110.622 -179.875 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 54' ' ' PRO . . . . . 0.495 ' O ' ' HB ' ' A' ' 38' ' ' THR . 44.2 Cg_endo -69.9 -42.08 3.56 Favored 'Trans proline' 0 C--N 1.312 -1.382 0 O-C-N 124.111 1.585 . . . . 0.0 110.774 179.431 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 55' ' ' GLU . . . . . . . . . . . . . 3.0 mp0 -55.04 -28.6 53.43 Favored 'General case' 0 N--CA 1.504 2.24 0 O-C-N 121.312 -0.867 . . . . 0.0 111.045 179.997 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 22.5 tt0 -65.74 -29.96 70.55 Favored 'General case' 0 N--CA 1.496 1.836 0 O-C-N 121.317 -0.865 . . . . 0.0 111.206 179.91 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 57' ' ' LEU . . . . . 0.456 ' CD2' ' N ' ' A' ' 57' ' ' LEU . 3.1 mm? -84.51 -12.95 53.26 Favored 'General case' 0 N--CA 1.5 2.035 0 O-C-N 120.949 -1.095 . . . . 0.0 111.58 -179.459 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 58' ' ' GLN . . . . . 0.549 ' O ' HG21 ' A' ' 61' ' ' ILE . 0.0 OUTLIER -57.2 -30.57 64.67 Favored 'General case' 0 N--CA 1.502 2.132 0 O-C-N 121.126 -0.984 . . . . 0.0 109.525 179.545 . . . . . . . . 3 3 . 1 . 018 nuclear orig core ' A' A ' 59' ' ' GLU . . . . . . . . . . . . . 0.7 OUTLIER -61.9 -37.46 84.69 Favored 'General case' 0 N--CA 1.498 1.966 0 O-C-N 121.058 -1.027 . . . . 0.0 109.013 178.214 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 60' ' ' MET . . . . . . . . . . . . . 0.7 OUTLIER -72.55 -40.54 66.63 Favored 'General case' 0 N--CA 1.495 1.786 0 O-C-N 121.798 -0.564 . . . . 0.0 110.509 179.49 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 61' ' ' ILE . . . . . 0.565 HG13 HG22 ' A' ' 72' ' ' VAL . 15.2 tt -76.23 -38.32 33.63 Favored 'Isoleucine or valine' 0 N--CA 1.498 1.954 0 O-C-N 121.245 -0.909 . . . . 0.0 111.019 -179.75 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 62' ' ' ASP . . . . . . . . . . . . . 0.7 OUTLIER -66.84 -35.23 79.58 Favored 'General case' 0 N--CA 1.499 2.023 0 O-C-N 121.148 -0.97 . . . . 0.0 110.433 179.928 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 63' ' ' GLU . . . . . . . . . . . . . 1.2 tt0 -56.84 -34.27 67.59 Favored 'General case' 0 N--CA 1.499 1.982 0 O-C-N 121.535 -0.728 . . . . 0.0 110.452 179.412 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 64' ' ' VAL . . . . . . . . . . . . . 27.5 t -101.63 -20.64 5.47 Favored 'Isoleucine or valine' 0 N--CA 1.496 1.872 0 O-C-N 121.311 -0.868 . . . . 0.0 110.651 179.632 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 65' ' ' ASP . . . . . . . . . . . . . 30.0 t70 -58.55 -70.93 0.13 Allowed 'General case' 0 N--CA 1.5 2.071 0 O-C-N 121.359 -0.838 . . . . 0.0 110.778 -179.641 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 66' ' ' GLU . . . . . . . . . . . . . 15.8 mm-40 49.18 30.61 3.12 Favored 'General case' 0 N--CA 1.504 2.23 0 O-C-N 121.489 -0.757 . . . . 0.0 110.293 -179.209 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 67' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -105.05 -29.15 10.61 Favored 'General case' 0 N--CA 1.492 1.633 0 O-C-N 121.604 -0.685 . . . . 0.0 110.549 -179.45 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 68' ' ' GLY . . . . . . . . . . . . . . . 110.92 -11.68 29.56 Favored Glycine 0 N--CA 1.495 2.569 0 N-CA-C 109.406 -1.477 . . . . 0.0 109.406 -178.729 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 69' ' ' SER . . . . . . . . . . . . . 89.7 p -102.32 -42.89 5.85 Favored 'General case' 0 N--CA 1.495 1.818 0 O-C-N 121.468 -1.019 . . . . 0.0 111.015 -179.847 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 70' ' ' GLY . . . . . . . . . . . . . . . 95.31 38.14 4.88 Favored Glycine 0 N--CA 1.496 2.657 0 N-CA-C 108.417 -1.873 . . . . 0.0 108.417 -178.954 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 71' ' ' THR . . . . . . . . . . . . . 8.1 p -142.6 134.31 26.77 Favored 'General case' 0 N--CA 1.492 1.648 0 O-C-N 121.763 -0.845 . . . . 0.0 109.954 -179.086 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 72' ' ' VAL . . . . . 0.565 HG22 HG13 ' A' ' 61' ' ' ILE . 2.9 t -103.05 113.56 40.16 Favored 'Isoleucine or valine' 0 N--CA 1.494 1.733 0 O-C-N 121.386 -0.821 . . . . 0.0 110.59 -179.859 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 73' ' ' ASP . . . . . . . . . . . . . 1.6 p-10 -87.15 -159.32 0.5 Allowed 'General case' 0 N--CA 1.496 1.83 0 O-C-N 121.493 -0.754 . . . . 0.0 110.042 179.581 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 74' ' ' PHE . . . . . . . . . . . . . 46.7 t80 -61.67 -51.87 66.64 Favored 'General case' 0 N--CA 1.496 1.866 0 O-C-N 121.303 -0.873 . . . . 0.0 110.323 179.812 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 75' ' ' ASP . . . . . 0.419 ' HA ' HD22 ' A' ' 78' ' ' LEU . 0.3 OUTLIER -61.61 -47.31 86.01 Favored 'General case' 0 N--CA 1.496 1.87 0 O-C-N 121.518 -0.738 . . . . 0.0 110.675 -179.935 . . . . . . . . 3 3 . 1 . 018 nuclear orig core ' A' A ' 76' ' ' GLU . . . . . . . . . . . . . 14.2 mt-10 -63.58 -33.53 75.81 Favored 'General case' 0 N--CA 1.499 2.004 0 O-C-N 121.327 -0.858 . . . . 0.0 110.433 179.586 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 77' ' ' PHE . . . . . . . . . . . . . 33.6 t80 -76.68 -46.2 26.59 Favored 'General case' 0 N--CA 1.497 1.886 0 O-C-N 121.173 -0.954 . . . . 0.0 110.033 179.358 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 78' ' ' LEU . . . . . 0.483 ' HG ' ' N ' ' A' ' 79' ' ' VAL . 0.1 OUTLIER -66.44 -36.14 82.05 Favored 'General case' 0 N--CA 1.498 1.946 0 O-C-N 121.429 -0.794 . . . . 0.0 110.429 -179.791 . . . . . . . . 3 3 . 1 . 018 nuclear orig core ' A' A ' 79' ' ' VAL . . . . . 0.564 ' HB ' HG22 ' A' ' 9' ' ' VAL . 4.3 p -71.78 -33.91 49.97 Favored 'Isoleucine or valine' 0 N--CA 1.499 2.015 0 O-C-N 120.951 -1.093 . . . . 0.0 109.206 178.684 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 80' ' ' MET . . . . . . . . . . . . . 56.2 ttp -61.24 -33.53 73.67 Favored 'General case' 0 N--CA 1.496 1.829 0 O-C-N 121.545 -0.722 . . . . 0.0 109.198 178.415 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 81' ' ' MET . . . . . . . . . . . . . 9.1 mmt -62.96 -42.85 99.95 Favored 'General case' 0 N--CA 1.494 1.763 0 O-C-N 121.667 -0.646 . . . . 0.0 109.544 178.881 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 82' ' ' VAL . . . . . . . . . . . . . 71.9 t -60.69 -38.85 79.76 Favored 'Isoleucine or valine' 0 N--CA 1.5 2.06 0 O-C-N 121.478 -0.764 . . . . 0.0 109.363 178.832 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 83' ' ' ARG . . . . . . . . . . . . . 20.1 mtp180 -62.79 -37.06 85.18 Favored 'General case' 0 N--CA 1.498 1.965 0 O-C-N 121.372 -0.83 . . . . 0.0 109.383 178.62 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 84' ' ' CYS . . . . . . . . . . . . . 66.7 m -78.86 -24.88 44.04 Favored 'General case' 0 N--CA 1.496 1.863 0 O-C-N 121.577 -0.702 . . . . 0.0 110.311 179.226 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 85' ' ' MET . . . . . . . . . . . . . 2.5 mtp . . . . . 0 N--CA 1.499 2.012 0 O-C-N 121.28 -0.888 . . . . 0.0 109.7 179.156 . . . . . . . . 0 0 . 1 . 018 nuclear orig core ' B' B ' 149' ' ' SER . . . . . . . . . . . . . 40.8 t . . . . . 0 N--CA 1.5 2.042 0 CA-C-O 121.325 0.583 . . . . 0.0 111.163 . . . . . . . . . 0 0 . 1 . 018 nuclear orig core ' B' B ' 150' ' ' ALA . . . . . . . . . . . . . . . -55.75 -50.58 70.0 Favored 'General case' 0 N--CA 1.499 2.019 0 O-C-N 121.72 -0.612 . . . . 0.0 111.084 -179.792 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' B' B ' 151' ' ' ASP . . . . . . . . . . . . . 4.7 p-10 -56.97 -37.28 71.39 Favored 'General case' 0 N--CA 1.501 2.083 0 O-C-N 121.392 -0.817 . . . . 0.0 110.696 179.893 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' B' B ' 152' ' ' ALA . . . . . . . . . . . . . . . -70.44 -45.29 66.12 Favored 'General case' 0 N--CA 1.495 1.803 0 O-C-N 121.321 -0.862 . . . . 0.0 109.636 179.304 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' B' B ' 153' ' ' MET . . . . . . . . . . . . . 1.1 mmt -62.74 -40.95 98.83 Favored 'General case' 0 N--CA 1.496 1.86 0 O-C-N 121.613 -0.68 . . . . 0.0 110.137 179.364 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' B' B ' 154' ' ' MET . . . . . . . . . . . . . 9.9 mmt -61.86 -47.94 82.77 Favored 'General case' 0 N--CA 1.499 1.993 0 O-C-N 121.358 -0.839 . . . . 0.0 109.956 179.458 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' B' B ' 155' ' ' GLN . . . . . . . . . . . . . 13.9 mt-30 -68.72 -29.69 68.16 Favored 'General case' 0 N--CA 1.498 1.973 0 O-C-N 121.338 -0.851 . . . . 0.0 110.505 179.334 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' B' B ' 156' ' ' ALA . . . . . . . . . . . . . . . -80.39 -20.32 44.28 Favored 'General case' 0 N--CA 1.498 1.973 0 O-C-N 121.243 -0.911 . . . . 0.0 111.082 179.867 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' B' B ' 157' ' ' LEU . . . . . . . . . . . . . 13.6 tp -96.59 -49.18 5.22 Favored 'General case' 0 N--CA 1.497 1.907 0 O-C-N 121.041 -1.037 . . . . 0.0 111.017 -179.685 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' B' B ' 158' ' ' LEU . . . . . . . . . . . . . 19.0 mt . . . . . 0 N--CA 1.5 2.069 0 O-C-N 121.15 -0.969 . . . . 0.0 111.587 -179.24 . . . . . . . . 0 0 . 1 . 019 nuclear orig core ' A' A ' 4' ' ' ILE . . . . . . . . . . . . . 72.3 mt . . . . . 0 N--CA 1.502 2.17 0 CA-C-O 120.859 0.362 . . . . 0.0 110.371 . . . . . . . . . 0 0 . 1 . 019 nuclear orig core ' A' A ' 5' ' ' TYR . . . . . . . . . . . . . 44.1 m-85 -66.26 -42.22 88.81 Favored 'General case' 0 N--CA 1.501 2.122 0 O-C-N 121.244 -0.91 . . . . 0.0 110.525 179.931 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 6' ' ' LYS . . . . . 0.493 ' HB3' ' HE3' ' A' ' 6' ' ' LYS . 15.9 mtpp -65.3 -32.18 73.7 Favored 'General case' 0 N--CA 1.493 1.683 0 O-C-N 121.332 -0.855 . . . . 0.0 110.415 179.99 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 7' ' ' ALA . . . . . . . . . . . . . . . -51.65 -42.91 62.42 Favored 'General case' 0 N--CA 1.498 1.954 0 O-C-N 121.253 -0.904 . . . . 0.0 109.306 178.803 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 8' ' ' ALA . . . . . 0.446 ' HB2' HG22 ' A' ' 82' ' ' VAL . . . -70.23 -42.24 72.5 Favored 'General case' 0 N--CA 1.495 1.812 0 O-C-N 121.503 -0.748 . . . . 0.0 109.158 178.218 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 9' ' ' VAL . . . . . . . . . . . . . 69.7 t -61.52 -40.53 86.79 Favored 'Isoleucine or valine' 0 N--CA 1.5 2.034 0 O-C-N 121.704 -0.623 . . . . 0.0 110.103 179.15 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 10' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER -69.16 -28.83 66.77 Favored 'General case' 0 N--CA 1.497 1.912 0 O-C-N 121.512 -0.743 . . . . 0.0 110.587 179.7 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 11' ' ' GLN . . . . . . . . . . . . . 0.1 OUTLIER -92.42 41.61 1.08 Allowed 'General case' 0 N--CA 1.496 1.836 0 O-C-N 121.279 -0.888 . . . . 0.0 110.946 -179.754 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 12' ' ' LEU . . . . . . . . . . . . . 10.7 mt -106.8 123.82 48.71 Favored 'General case' 0 N--CA 1.497 1.904 0 O-C-N 121.134 -0.979 . . . . 0.0 110.177 179.516 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 13' ' ' THR . . . . . . . . . . . . . 0.3 OUTLIER -79.69 164.49 23.7 Favored 'General case' 0 N--CA 1.498 1.927 0 O-C-N 121.193 -0.942 . . . . 0.0 110.07 179.621 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 14' ' ' GLU . . . . . . . . . . . . . 0.2 OUTLIER -52.54 -30.75 32.2 Favored 'General case' 0 N--CA 1.497 1.879 0 O-C-N 121.625 -0.672 . . . . 0.0 111.196 -179.281 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 1.5 mp0 -59.65 -51.23 70.71 Favored 'General case' 0 N--CA 1.497 1.892 0 O-C-N 121.449 -0.782 . . . . 0.0 109.838 179.483 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 16' ' ' GLN . . . . . . . . . . . . . 3.0 mp0 -79.99 -26.79 39.77 Favored 'General case' 0 N--CA 1.5 2.03 0 O-C-N 121.452 -0.78 . . . . 0.0 110.12 179.148 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 17' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -69.15 -42.57 75.76 Favored 'General case' 0 N--CA 1.496 1.867 0 O-C-N 121.628 -0.67 . . . . 0.0 110.097 179.707 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 18' ' ' ASN . . . . . 0.457 ' HA ' ' HG2' ' A' ' 21' ' ' LYS . 12.2 t30 -56.9 -39.69 74.89 Favored 'General case' 0 N--CA 1.499 2.002 0 O-C-N 121.6 -0.688 . . . . 0.0 110.761 179.923 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 4.4 mt-10 -54.88 -48.51 72.9 Favored 'General case' 0 N--CA 1.499 2.011 0 O-C-N 121.33 -0.856 . . . . 0.0 109.987 179.553 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 20' ' ' PHE . . . . . . . . . . . . . 43.9 m-85 -77.65 -33.58 53.41 Favored 'General case' 0 N--CA 1.497 1.919 0 O-C-N 121.436 -0.79 . . . . 0.0 110.282 179.516 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 21' ' ' LYS . . . . . 0.519 ' HE3' ' HA ' ' A' ' 22' ' ' ALA . 0.0 OUTLIER -64.21 -34.31 77.79 Favored 'General case' 0 N--CA 1.496 1.858 0 O-C-N 121.183 -0.948 . . . . 0.0 109.508 179.02 . . . . . . . . 3 3 . 1 . 019 nuclear orig core ' A' A ' 22' ' ' ALA . . . . . 0.519 ' HA ' ' HE3' ' A' ' 21' ' ' LYS . . . -76.02 -41.52 50.74 Favored 'General case' 0 N--CA 1.496 1.873 0 O-C-N 121.556 -0.715 . . . . 0.0 109.153 178.434 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 23' ' ' ALA . . . . . 0.477 ' O ' ' HB2' ' A' ' 27' ' ' PHE . . . -73.3 -7.27 50.83 Favored 'General case' 0 N--CA 1.494 1.732 0 O-C-N 121.679 -0.638 . . . . 0.0 110.75 178.975 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 24' ' ' PHE . . . . . . . . . . . . . 38.5 t80 -107.92 -49.32 3.23 Favored 'General case' 0 N--CA 1.495 1.793 0 O-C-N 121.181 -0.949 . . . . 0.0 110.795 -179.574 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 25' ' ' ASP . . . . . . . . . . . . . 0.1 OUTLIER -61.38 -41.84 97.75 Favored 'General case' 0 N--CA 1.5 2.065 0 O-C-N 121.307 -0.871 . . . . 0.0 110.891 -179.389 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 26' ' ' ILE . . . . . . . . . . . . . 37.4 mt -76.62 -27.05 16.83 Favored 'Isoleucine or valine' 0 N--CA 1.499 1.977 0 O-C-N 121.152 -0.968 . . . . 0.0 109.798 179.037 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 27' ' ' PHE . . . . . 0.568 ' HA ' HD22 ' B' ' 157' ' ' LEU . 1.7 t80 -59.08 -50.6 73.45 Favored 'General case' 0 N--CA 1.497 1.894 0 O-C-N 121.638 -0.664 . . . . 0.0 110.421 179.484 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 28' ' ' VAL . . . . . . . . . . . . . 18.6 m -91.04 -35.4 7.12 Favored 'Isoleucine or valine' 0 N--CA 1.497 1.906 0 O-C-N 121.555 -0.716 . . . . 0.0 111.254 -179.288 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 29' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER 46.48 43.66 12.31 Favored 'General case' 0 N--CA 1.497 1.919 0 O-C-N 121.45 -0.781 . . . . 0.0 110.218 -179.654 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 30' ' ' GLY . . . . . . . . . . . . . . . 106.06 -62.04 0.33 Allowed Glycine 0 N--CA 1.494 2.503 0 N-CA-C 108.794 -1.722 . . . . 0.0 108.794 -178.768 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 31' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.501 2.121 0 O-C-N 121.81 -0.817 . . . . 0.0 111.13 179.531 . . . . . . . . 0 0 . 1 . 019 nuclear orig core ' A' A ' 35' ' ' CYS . . . . . . . . . . . . . 96.7 m . . . . . 0 N--CA 1.508 2.456 0 CA-C-O 120.758 0.313 . . . . 0.0 111.302 . . . . . . . . . 0 0 . 1 . 019 nuclear orig core ' A' A ' 36' ' ' ILE . . . . . . . . . . . . . 30.5 mt -80.95 105.56 11.0 Favored 'Isoleucine or valine' 0 N--CA 1.5 2.054 0 O-C-N 120.792 -1.193 . . . . 0.0 110.141 -179.893 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 37' ' ' SER . . . . . . . . . . . . . 5.7 t -100.57 175.71 5.58 Favored 'General case' 0 N--CA 1.496 1.835 0 O-C-N 121.429 -0.794 . . . . 0.0 110.098 179.595 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 38' ' ' THR . . . . . . . . . . . . . 33.6 p -61.81 -38.8 89.49 Favored 'General case' 0 N--CA 1.501 2.1 0 O-C-N 121.231 -0.918 . . . . 0.0 110.041 179.553 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 39' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -65.64 -40.29 92.36 Favored 'General case' 0 N--CA 1.499 2.005 0 O-C-N 121.674 -0.641 . . . . 0.0 110.379 179.535 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 2.3 mp0 -65.42 -48.8 71.57 Favored 'General case' 0 N--CA 1.499 2.014 0 O-C-N 121.434 -0.791 . . . . 0.0 110.399 179.896 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 41' ' ' LEU . . . . . 0.4 HD11 ' HE2' ' A' ' 45' ' ' MET . 7.7 tp -61.69 -47.44 85.31 Favored 'General case' 0 N--CA 1.499 1.983 0 O-C-N 121.481 -0.762 . . . . 0.0 110.323 179.898 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 42' ' ' GLY . . . . . . . . . . . . . . . -58.16 -40.06 93.16 Favored Glycine 0 N--CA 1.493 2.472 0 N-CA-C 110.155 -1.178 . . . . 0.0 110.155 -179.712 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 43' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -56.42 -45.21 80.82 Favored 'General case' 0 N--CA 1.5 2.066 0 O-C-N 121.439 -1.036 . . . . 0.0 109.97 179.426 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 44' ' ' VAL . . . . . . . . . . . . . 72.1 t -67.84 -42.69 86.14 Favored 'Isoleucine or valine' 0 N--CA 1.498 1.94 0 O-C-N 121.42 -0.8 . . . . 0.0 109.557 179.154 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 45' ' ' MET . . . . . 0.4 ' HE2' HD11 ' A' ' 41' ' ' LEU . 0.9 OUTLIER -60.04 -39.27 85.35 Favored 'General case' 0 N--CA 1.499 2.012 0 O-C-N 121.431 -0.793 . . . . 0.0 109.59 178.805 . . . . . . . . 3 3 . 1 . 019 nuclear orig core ' A' A ' 46' ' ' ARG . . . . . . . . . . . . . 0.3 OUTLIER -61.49 -37.49 83.87 Favored 'General case' 0 N--CA 1.496 1.832 0 O-C-N 121.65 -0.656 . . . . 0.0 109.706 178.859 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 47' ' ' MET . . . . . . . . . . . . . 18.1 ttp -67.02 -38.65 86.33 Favored 'General case' 0 N--CA 1.496 1.863 0 O-C-N 121.711 -0.618 . . . . 0.0 110.032 179.153 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 48' ' ' LEU . . . . . . . . . . . . . 5.9 tp -68.9 -36.79 78.45 Favored 'General case' 0 N--CA 1.493 1.677 0 O-C-N 121.4 -0.812 . . . . 0.0 110.307 179.691 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 49' ' ' GLY . . . . . . . . . . . . . . . 131.98 -39.61 1.74 Allowed Glycine 0 N--CA 1.494 2.561 0 N-CA-C 110.023 -1.231 . . . . 0.0 110.023 179.925 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 50' ' ' GLN . . . . . . . . . . . . . 7.8 mt-30 -88.16 107.51 18.81 Favored 'General case' 0 N--CA 1.497 1.922 0 O-C-N 121.274 -1.133 . . . . 0.0 110.626 -179.741 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 51' ' ' ASN . . . . . . . . . . . . . 24.4 t-20 -156.79 100.76 1.99 Allowed Pre-proline 0 N--CA 1.499 1.999 0 O-C-N 121.412 -0.805 . . . . 0.0 110.196 179.81 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 52' ' ' PRO . . . . . . . . . . . . . 49.0 Cg_endo -79.53 -89.2 0.0 OUTLIER 'Trans proline' 0 C--N 1.317 -1.131 0 O-C-N 123.839 1.441 . . . . 0.0 111.178 -179.999 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 53' ' ' THR . . . . . . . . . . . . . 4.6 p -127.95 165.83 27.77 Favored Pre-proline 0 N--CA 1.496 1.846 0 O-C-N 120.945 -1.097 . . . . 0.0 110.791 -179.233 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 54' ' ' PRO . . . . . . . . . . . . . 42.7 Cg_endo -68.79 -31.76 24.64 Favored 'Trans proline' 0 N--CA 1.491 1.335 0 O-C-N 123.704 1.371 . . . . 0.0 110.939 179.495 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 55' ' ' GLU . . . . . . . . . . . . . 1.9 mp0 -67.4 -29.45 68.97 Favored 'General case' 0 N--CA 1.499 1.994 0 O-C-N 121.22 -0.925 . . . . 0.0 110.075 179.271 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 4.6 tm-20 -56.82 -35.99 69.44 Favored 'General case' 0 N--CA 1.499 1.979 0 O-C-N 121.53 -0.732 . . . . 0.0 110.663 179.587 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 57' ' ' LEU . . . . . 0.426 ' O ' ' HB2' ' A' ' 60' ' ' MET . 0.7 OUTLIER -69.58 -29.26 66.77 Favored 'General case' 0 N--CA 1.499 1.98 0 O-C-N 121.33 -0.856 . . . . 0.0 110.87 179.983 . . . . . . . . 3 3 . 1 . 019 nuclear orig core ' A' A ' 58' ' ' GLN . . . . . 0.42 ' O ' HG22 ' A' ' 61' ' ' ILE . 0.0 OUTLIER -56.86 -49.74 74.57 Favored 'General case' 0 N--CA 1.498 1.941 0 O-C-N 121.051 -1.031 . . . . 0.0 109.451 179.642 . . . . . . . . 3 3 . 1 . 019 nuclear orig core ' A' A ' 59' ' ' GLU . . . . . . . . . . . . . 0.7 OUTLIER -64.65 -38.1 89.85 Favored 'General case' 0 N--CA 1.495 1.805 0 N-CA-C 108.418 -0.956 . . . . 0.0 108.418 177.971 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 60' ' ' MET . . . . . 0.426 ' HB2' ' O ' ' A' ' 57' ' ' LEU . 7.5 mmm -58.8 -39.1 80.15 Favored 'General case' 0 N--CA 1.496 1.838 0 O-C-N 121.795 -0.566 . . . . 0.0 110.096 178.772 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 61' ' ' ILE . . . . . 0.65 HD13 ' HA ' ' A' ' 71' ' ' THR . 5.1 tt -76.72 -26.9 16.59 Favored 'Isoleucine or valine' 0 N--CA 1.498 1.943 0 O-C-N 121.435 -0.791 . . . . 0.0 110.575 179.729 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 62' ' ' ASP . . . . . 0.541 ' N ' HG22 ' A' ' 61' ' ' ILE . 1.8 t70 -62.32 -25.22 67.76 Favored 'General case' 0 N--CA 1.498 1.948 0 O-C-N 121.417 -0.802 . . . . 0.0 110.487 179.683 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 63' ' ' GLU . . . . . . . . . . . . . 16.2 tt0 -47.28 -42.39 20.79 Favored 'General case' 0 N--CA 1.501 2.097 0 O-C-N 121.613 -0.68 . . . . 0.0 110.961 179.459 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 64' ' ' VAL . . . . . . . . . . . . . 27.5 m -127.45 30.14 1.81 Allowed 'Isoleucine or valine' 0 N--CA 1.498 1.96 0 O-C-N 121.342 -0.849 . . . . 0.0 110.85 179.929 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 65' ' ' ASP . . . . . . . . . . . . . 19.3 t70 -119.9 -97.82 0.46 Allowed 'General case' 0 N--CA 1.495 1.78 0 O-C-N 121.173 -0.955 . . . . 0.0 110.062 179.589 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 66' ' ' GLU . . . . . . . . . . . . . 1.4 mm-40 47.24 35.34 3.66 Favored 'General case' 0 N--CA 1.502 2.126 0 O-C-N 121.354 -0.841 . . . . 0.0 110.967 -179.903 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 67' ' ' ASP . . . . . . . . . . . . . 4.4 p-10 -114.09 7.45 16.71 Favored 'General case' 0 N--CA 1.497 1.884 0 O-C-N 121.213 -0.93 . . . . 0.0 111.367 -179.691 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 68' ' ' GLY . . . . . . . . . . . . . . . 98.34 -27.1 21.0 Favored Glycine 0 N--CA 1.497 2.759 0 N-CA-C 110.45 -1.06 . . . . 0.0 110.45 179.888 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 69' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -80.34 -42.36 23.08 Favored 'General case' 0 N--CA 1.498 1.951 0 O-C-N 121.22 -1.165 . . . . 0.0 111.01 -179.612 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 70' ' ' GLY . . . . . . . . . . . . . . . 81.13 6.77 89.16 Favored Glycine 0 N--CA 1.499 2.854 0 C-N-CA 120.205 -0.997 . . . . 0.0 110.871 179.959 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 71' ' ' THR . . . . . 0.65 ' HA ' HD13 ' A' ' 61' ' ' ILE . 2.7 m -124.33 140.53 52.87 Favored 'General case' 0 N--CA 1.498 1.955 0 O-C-N 121.09 -1.241 . . . . 0.0 109.842 179.697 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 72' ' ' VAL . . . . . . . . . . . . . 3.0 t -92.35 123.63 44.52 Favored 'Isoleucine or valine' 0 N--CA 1.495 1.791 0 O-C-N 121.426 -0.796 . . . . 0.0 110.723 -179.633 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 73' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER -97.28 -163.5 1.05 Allowed 'General case' 0 N--CA 1.494 1.736 0 O-C-N 121.525 -0.735 . . . . 0.0 109.671 179.28 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 74' ' ' PHE . . . . . . . . . . . . . 11.1 t80 -64.97 -45.49 85.47 Favored 'General case' 0 N--CA 1.499 2.023 0 O-C-N 121.067 -1.02 . . . . 0.0 110.475 179.771 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 75' ' ' ASP . . . . . . . . . . . . . 16.3 t70 -59.85 -50.76 72.54 Favored 'General case' 0 N--CA 1.498 1.974 0 O-C-N 121.358 -0.839 . . . . 0.0 109.978 179.389 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 76' ' ' GLU . . . . . . . . . . . . . 43.5 mt-10 -62.18 -40.7 96.91 Favored 'General case' 0 N--CA 1.498 1.943 0 O-C-N 121.515 -0.741 . . . . 0.0 109.553 179.167 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 77' ' ' PHE . . . . . 0.423 ' CZ ' ' HE2' ' A' ' 81' ' ' MET . 71.8 t80 -60.83 -44.19 97.27 Favored 'General case' 0 N--CA 1.496 1.872 0 O-C-N 121.617 -0.677 . . . . 0.0 109.703 178.712 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 78' ' ' LEU . . . . . . . . . . . . . 52.6 mt -65.98 -43.62 87.29 Favored 'General case' 0 N--CA 1.5 2.046 0 O-C-N 121.567 -0.708 . . . . 0.0 110.087 179.389 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 79' ' ' VAL . . . . . . . . . . . . . 45.2 t -60.2 -44.68 95.94 Favored 'Isoleucine or valine' 0 N--CA 1.497 1.891 0 O-C-N 121.61 -0.681 . . . . 0.0 109.393 179.374 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 80' ' ' MET . . . . . . . . . . . . . 2.3 ttp -62.78 -39.77 95.26 Favored 'General case' 0 N--CA 1.495 1.812 0 O-C-N 121.517 -0.74 . . . . 0.0 110.013 178.923 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 81' ' ' MET . . . . . 0.423 ' HE2' ' CZ ' ' A' ' 77' ' ' PHE . 11.2 mmt -62.33 -44.29 96.84 Favored 'General case' 0 N--CA 1.498 1.948 0 O-C-N 121.57 -0.706 . . . . 0.0 110.743 179.946 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 82' ' ' VAL . . . . . 0.519 HG12 ' N ' ' A' ' 83' ' ' ARG . 2.4 p -70.21 -26.57 29.69 Favored 'Isoleucine or valine' 0 N--CA 1.5 2.05 0 O-C-N 121.169 -0.957 . . . . 0.0 110.292 179.514 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 83' ' ' ARG . . . . . 0.519 ' N ' HG12 ' A' ' 82' ' ' VAL . 4.0 mtp180 -74.6 -33.68 62.68 Favored 'General case' 0 N--CA 1.495 1.795 0 O-C-N 121.222 -0.924 . . . . 0.0 109.444 178.742 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 84' ' ' CYS . . . . . . . . . . . . . 0.1 OUTLIER -71.59 -11.52 60.89 Favored 'General case' 0 N--CA 1.496 1.869 0 O-C-N 121.703 -0.623 . . . . 0.0 110.921 179.323 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 85' ' ' MET . . . . . . . . . . . . . 12.2 tpp . . . . . 0 N--CA 1.5 2.029 0 O-C-N 121.315 -0.865 . . . . 0.0 111.563 -179.953 . . . . . . . . 0 0 . 1 . 019 nuclear orig core ' B' B ' 149' ' ' SER . . . . . . . . . . . . . 89.0 p . . . . . 0 N--CA 1.496 1.839 0 CA-C-O 121.284 0.564 . . . . 0.0 110.391 . . . . . . . . . 0 0 . 1 . 019 nuclear orig core ' B' B ' 150' ' ' ALA . . . . . . . . . . . . . . . -58.85 -50.09 75.28 Favored 'General case' 0 N--CA 1.498 1.974 0 O-C-N 121.482 -0.761 . . . . 0.0 111.104 -179.652 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' B' B ' 151' ' ' ASP . . . . . . . . . . . . . 7.2 p-10 -60.62 -35.75 76.92 Favored 'General case' 0 N--CA 1.502 2.137 0 O-C-N 121.371 -0.83 . . . . 0.0 111.252 -179.804 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' B' B ' 152' ' ' ALA . . . . . . . . . . . . . . . -74.36 -38.82 63.1 Favored 'General case' 0 N--CA 1.496 1.825 0 O-C-N 121.131 -0.981 . . . . 0.0 110.252 179.645 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' B' B ' 153' ' ' MET . . . . . . . . . . . . . 0.4 OUTLIER -64.66 -47.97 76.49 Favored 'General case' 0 N--CA 1.498 1.962 0 O-C-N 121.41 -0.806 . . . . 0.0 110.608 179.973 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' B' B ' 154' ' ' MET . . . . . 0.414 ' HG3' ' N ' ' B' ' 155' ' ' GLN . 17.2 ptp -63.84 -30.25 71.36 Favored 'General case' 0 N--CA 1.5 2.04 0 O-C-N 121.167 -0.958 . . . . 0.0 110.298 179.57 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' B' B ' 155' ' ' GLN . . . . . 0.414 ' N ' ' HG3' ' B' ' 154' ' ' MET . 0.2 OUTLIER -65.54 -35.79 81.88 Favored 'General case' 0 N--CA 1.498 1.961 0 O-C-N 121.327 -0.858 . . . . 0.0 110.201 179.074 . . . . . . . . 3 3 . 1 . 019 nuclear orig core ' B' B ' 156' ' ' ALA . . . . . . . . . . . . . . . -87.28 -43.77 11.92 Favored 'General case' 0 N--CA 1.495 1.799 0 O-C-N 121.431 -0.793 . . . . 0.0 110.143 179.719 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' B' B ' 157' ' ' LEU . . . . . 0.568 HD22 ' HA ' ' A' ' 27' ' ' PHE . 0.9 OUTLIER -64.67 -48.65 73.96 Favored 'General case' 0 N--CA 1.498 1.972 0 O-C-N 121.614 -0.679 . . . . 0.0 110.481 179.969 . . . . . . . . 3 3 . 1 . 019 nuclear orig core ' B' B ' 158' ' ' LEU . . . . . . . . . . . . . 6.3 mt . . . . . 0 N--CA 1.498 1.947 0 O-C-N 121.161 -0.962 . . . . 0.0 110.856 -179.988 . . . . . . . . 0 0 . 1 . 020 nuclear orig core ' A' A ' 4' ' ' ILE . . . . . . . . . . . . . 1.8 pp . . . . . 0 N--CA 1.499 2.009 0 CA-C-O 120.866 0.365 . . . . 0.0 110.626 . . . . . . . . . 0 0 . 1 . 020 nuclear orig core ' A' A ' 5' ' ' TYR . . . . . 0.4 ' CE1' ' HG2' ' A' ' 83' ' ' ARG . 16.5 m-85 -72.07 -42.55 66.08 Favored 'General case' 0 N--CA 1.496 1.872 0 O-C-N 121.252 -0.905 . . . . 0.0 109.767 179.407 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -66.5 -44.13 83.44 Favored 'General case' 0 N--CA 1.495 1.791 0 O-C-N 121.541 -0.724 . . . . 0.0 109.771 179.121 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 7' ' ' ALA . . . . . . . . . . . . . . . -52.42 -41.26 63.06 Favored 'General case' 0 N--CA 1.498 1.973 0 O-C-N 121.464 -0.773 . . . . 0.0 109.936 179.12 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 8' ' ' ALA . . . . . . . . . . . . . . . -60.12 -33.07 71.63 Favored 'General case' 0 N--CA 1.498 1.948 0 O-C-N 121.515 -0.741 . . . . 0.0 110.633 179.203 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 9' ' ' VAL . . . . . . . . . . . . . 84.5 t -84.61 -37.46 12.64 Favored 'Isoleucine or valine' 0 N--CA 1.498 1.958 0 O-C-N 121.459 -0.776 . . . . 0.0 110.566 179.996 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 10' ' ' GLU . . . . . . . . . . . . . 0.5 OUTLIER -67.98 -26.31 65.86 Favored 'General case' 0 N--CA 1.499 2.022 0 O-C-N 121.431 -0.793 . . . . 0.0 112.447 -178.73 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 11' ' ' GLN . . . . . . . . . . . . . 0.8 OUTLIER -134.13 65.82 1.56 Allowed 'General case' 0 N--CA 1.498 1.974 0 O-C-N 120.638 -1.289 . . . . 0.0 112.18 -179.346 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 12' ' ' LEU . . . . . 0.529 HD13 ' HB2' ' A' ' 17' ' ' LYS . 4.4 pp -110.41 160.17 16.82 Favored 'General case' 0 N--CA 1.499 2.01 0 O-C-N 121.236 -0.915 . . . . 0.0 109.317 177.854 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 13' ' ' THR . . . . . . . . . . . . . 60.5 p -73.91 157.05 36.97 Favored 'General case' 0 N--CA 1.505 2.276 0 O-C-N 121.084 -1.01 . . . . 0.0 111.456 -178.627 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 14' ' ' GLU . . . . . . . . . . . . . 3.0 tp10 -53.18 -34.82 58.59 Favored 'General case' 0 N--CA 1.495 1.801 0 O-C-N 121.828 -0.545 . . . . 0.0 110.338 179.848 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 1.2 mp0 -63.29 -43.88 96.64 Favored 'General case' 0 N--CA 1.496 1.829 0 O-C-N 121.601 -0.687 . . . . 0.0 109.59 179.389 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 16' ' ' GLN . . . . . . . . . . . . . 0.1 OUTLIER -58.52 -37.88 76.56 Favored 'General case' 0 N--CA 1.498 1.931 0 CA-C-O 121.587 0.708 . . . . 0.0 110.144 179.269 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 17' ' ' LYS . . . . . 0.529 ' HB2' HD13 ' A' ' 12' ' ' LEU . 1.3 ttpt -77.8 -33.72 52.41 Favored 'General case' 0 N--CA 1.493 1.709 0 O-C-N 121.5 -0.75 . . . . 0.0 109.986 179.173 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 18' ' ' ASN . . . . . . . . . . . . . 52.5 m-20 -68.42 -46.31 70.25 Favored 'General case' 0 N--CA 1.498 1.973 0 O-C-N 121.417 -0.802 . . . . 0.0 110.847 179.92 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 12.6 pt-20 -60.61 -35.84 77.12 Favored 'General case' 0 N--CA 1.502 2.131 0 O-C-N 121.173 -0.954 . . . . 0.0 110.121 179.856 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 20' ' ' PHE . . . . . . . . . . . . . 18.4 m-30 -77.12 -32.18 56.28 Favored 'General case' 0 N--CA 1.496 1.847 0 O-C-N 121.317 -0.864 . . . . 0.0 109.927 178.923 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 21' ' ' LYS . . . . . . . . . . . . . 2.9 tptp -60.97 -46.95 88.67 Favored 'General case' 0 N--CA 1.498 1.956 0 O-C-N 121.484 -0.76 . . . . 0.0 109.649 178.961 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 22' ' ' ALA . . . . . . . . . . . . . . . -61.73 -50.23 73.24 Favored 'General case' 0 N--CA 1.499 1.989 0 O-C-N 121.395 -0.816 . . . . 0.0 109.869 179.324 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 23' ' ' ALA . . . . . . . . . . . . . . . -59.04 -40.44 85.05 Favored 'General case' 0 N--CA 1.498 1.929 0 O-C-N 121.557 -0.715 . . . . 0.0 109.647 178.94 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 24' ' ' PHE . . . . . . . . . . . . . 73.9 t80 -64.55 -43.8 92.78 Favored 'General case' 0 N--CA 1.498 1.946 0 O-C-N 121.788 -0.57 . . . . 0.0 109.89 179.212 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 25' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER -56.6 -45.47 81.42 Favored 'General case' 0 N--CA 1.499 2.013 0 O-C-N 121.475 -0.766 . . . . 0.0 110.496 179.573 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 26' ' ' ILE . . . . . 0.433 ' HB ' HD13 ' B' ' 157' ' ' LEU . 6.6 mt -70.56 -31.75 47.41 Favored 'Isoleucine or valine' 0 N--CA 1.498 1.966 0 O-C-N 121.168 -0.957 . . . . 0.0 109.518 179.143 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 27' ' ' PHE . . . . . . . . . . . . . 0.2 OUTLIER -74.46 -22.5 59.08 Favored 'General case' 0 N--CA 1.496 1.845 0 O-C-N 121.102 -0.999 . . . . 0.0 110.774 179.186 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 28' ' ' VAL . . . . . 0.421 HG11 HG13 ' A' ' 36' ' ' ILE . 10.6 m -107.36 10.6 9.13 Favored 'Isoleucine or valine' 0 N--CA 1.501 2.076 0 O-C-N 121.153 -0.967 . . . . 0.0 111.902 -179.354 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 29' ' ' LEU . . . . . . . . . . . . . 4.6 pp -57.13 136.85 56.4 Favored 'General case' 0 N--CA 1.504 2.242 0 O-C-N 120.77 -1.206 . . . . 0.0 109.398 179.379 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 30' ' ' GLY . . . . . . . . . . . . . . . 90.39 -49.6 3.22 Favored Glycine 0 N--CA 1.495 2.628 0 N-CA-C 108.093 -2.003 . . . . 0.0 108.093 -177.838 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 31' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.491 1.616 0 O-C-N 121.617 -0.931 . . . . 0.0 108.727 178.481 . . . . . . . . 0 0 . 1 . 020 nuclear orig core ' A' A ' 35' ' ' CYS . . . . . . . . . . . . . 28.3 p . . . . . 0 N--CA 1.495 1.79 0 CA-C-O 121.281 0.563 . . . . 0.0 110.203 . . . . . . . . . 0 0 . 1 . 020 nuclear orig core ' A' A ' 36' ' ' ILE . . . . . 0.421 HG13 HG11 ' A' ' 28' ' ' VAL . 17.9 mt -121.42 118.59 56.46 Favored 'Isoleucine or valine' 0 N--CA 1.494 1.752 0 O-C-N 121.383 -0.823 . . . . 0.0 109.987 -179.965 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 37' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -101.07 163.19 12.4 Favored 'General case' 0 N--CA 1.493 1.72 0 O-C-N 121.558 -0.714 . . . . 0.0 109.637 179.167 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 38' ' ' THR . . . . . 0.428 ' CG2' ' HA ' ' A' ' 58' ' ' GLN . 77.7 p -64.27 -32.76 74.47 Favored 'General case' 0 N--CA 1.5 2.045 0 O-C-N 121.31 -0.869 . . . . 0.0 110.595 -179.829 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 39' ' ' LYS . . . . . 0.47 ' HA ' ' CB ' ' A' ' 54' ' ' PRO . 11.6 mttp -60.88 -34.33 74.46 Favored 'General case' 0 N--CA 1.496 1.864 0 O-C-N 121.518 -0.739 . . . . 0.0 109.465 178.777 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 1.2 mp0 -83.42 -30.55 27.23 Favored 'General case' 0 N--CA 1.497 1.921 0 O-C-N 121.485 -0.76 . . . . 0.0 109.604 178.471 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 41' ' ' LEU . . . . . 0.552 HD23 ' HB3' ' A' ' 57' ' ' LEU . 6.4 tp -62.46 -39.83 94.67 Favored 'General case' 0 N--CA 1.497 1.877 0 O-C-N 121.412 -0.805 . . . . 0.0 110.412 179.574 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 42' ' ' GLY . . . . . 0.508 ' HA2' ' HB2' ' A' ' 45' ' ' MET . . . -53.92 -36.18 55.17 Favored Glycine 0 N--CA 1.495 2.616 0 N-CA-C 110.831 -0.908 . . . . 0.0 110.831 -179.049 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 43' ' ' LYS . . . . . . . . . . . . . 1.6 mtmt -55.21 -34.13 63.65 Favored 'General case' 0 N--CA 1.502 2.145 0 O-C-N 121.381 -1.07 . . . . 0.0 110.561 179.711 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 44' ' ' VAL . . . . . . . . . . . . . 42.1 t -93.07 -36.72 7.74 Favored 'Isoleucine or valine' 0 N--CA 1.498 1.936 0 O-C-N 121.334 -0.854 . . . . 0.0 109.6 178.921 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 45' ' ' MET . . . . . 0.508 ' HB2' ' HA2' ' A' ' 42' ' ' GLY . 0.3 OUTLIER -58.29 -38.08 76.3 Favored 'General case' 0 N--CA 1.5 2.036 0 O-C-N 121.47 -0.769 . . . . 0.0 110.777 179.646 . . . . . . . . 3 3 . 1 . 020 nuclear orig core ' A' A ' 46' ' ' ARG . . . . . 0.461 ' HA ' ' C ' ' A' ' 50' ' ' GLN . 16.6 ptt180 -63.44 -23.68 67.5 Favored 'General case' 0 N--CA 1.499 2.012 0 O-C-N 121.304 -0.872 . . . . 0.0 110.911 179.97 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 47' ' ' MET . . . . . . . . . . . . . 7.1 ttp -82.14 1.18 37.41 Favored 'General case' 0 N--CA 1.495 1.798 0 O-C-N 121.397 -0.815 . . . . 0.0 110.731 179.389 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 48' ' ' LEU . . . . . . . . . . . . . 45.1 mt -131.16 -50.7 1.02 Allowed 'General case' 0 N--CA 1.496 1.83 0 O-C-N 121.078 -1.014 . . . . 0.0 111.052 -179.82 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 49' ' ' GLY . . . . . 0.512 ' O ' ' HB2' ' A' ' 50' ' ' GLN . . . -125.52 38.04 2.37 Favored Glycine 0 N--CA 1.498 2.772 0 C-N-CA 119.866 -1.159 . . . . 0.0 110.987 -179.14 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 50' ' ' GLN . . . . . 0.512 ' HB2' ' O ' ' A' ' 49' ' ' GLY . 10.9 mt-30 67.12 -50.06 0.48 Allowed 'General case' 0 N--CA 1.512 2.636 0 CA-C-N 117.913 0.857 . . . . 0.0 112.498 179.122 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 51' ' ' ASN . . . . . 0.456 ' HB3' ' O ' ' A' ' 50' ' ' GLN . 8.3 t30 64.94 101.24 0.04 OUTLIER Pre-proline 0 N--CA 1.504 2.258 0 O-C-N 121.414 -0.804 . . . . 0.0 110.542 -179.185 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 52' ' ' PRO . . . . . . . . . . . . . 44.3 Cg_endo -74.64 -52.87 0.11 Allowed 'Trans proline' 0 C--N 1.312 -1.352 0 O-C-N 123.938 1.494 . . . . 0.0 111.464 -179.642 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 53' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -149.31 153.04 36.96 Favored Pre-proline 0 N--CA 1.5 2.048 0 O-C-N 121.131 -0.981 . . . . 0.0 111.073 -179.63 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 54' ' ' PRO . . . . . 0.47 ' CB ' ' HA ' ' A' ' 39' ' ' LYS . 46.4 Cg_endo -71.75 -36.28 6.55 Favored 'Trans proline' 0 C--N 1.313 -1.331 0 O-C-N 124.205 1.634 . . . . 0.0 110.69 179.563 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 55' ' ' GLU . . . . . 0.452 ' O ' ' HB3' ' A' ' 58' ' ' GLN . 0.7 OUTLIER -65.11 -27.78 68.98 Favored 'General case' 0 N--CA 1.5 2.063 0 O-C-N 121.338 -0.851 . . . . 0.0 110.959 179.931 . . . . . . . . 3 3 . 1 . 020 nuclear orig core ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 24.0 tt0 -66.8 -30.12 70.24 Favored 'General case' 0 N--CA 1.498 1.93 0 O-C-N 121.119 -0.988 . . . . 0.0 110.275 179.28 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 57' ' ' LEU . . . . . 0.552 ' HB3' HD23 ' A' ' 41' ' ' LEU . 29.7 mt -80.31 -9.54 59.74 Favored 'General case' 0 N--CA 1.496 1.843 0 O-C-N 121.253 -0.904 . . . . 0.0 111.414 -179.889 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 58' ' ' GLN . . . . . 0.452 ' HB3' ' O ' ' A' ' 55' ' ' GLU . 0.0 OUTLIER -56.74 -42.11 78.69 Favored 'General case' 0 N--CA 1.5 2.052 0 O-C-N 121.032 -1.042 . . . . 0.0 110.142 -179.819 . . . . . . . . 3 3 . 1 . 020 nuclear orig core ' A' A ' 59' ' ' GLU . . . . . . . . . . . . . 7.8 tt0 -59.2 -35.94 74.49 Favored 'General case' 0 N--CA 1.498 1.963 0 O-C-N 121.37 -0.831 . . . . 0.0 110.035 179.175 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 60' ' ' MET . . . . . . . . . . . . . 2.5 tpp -59.18 -46.2 89.04 Favored 'General case' 0 N--CA 1.498 1.95 0 O-C-N 121.584 -0.698 . . . . 0.0 109.989 179.304 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 61' ' ' ILE . . . . . 0.41 HG12 ' CG2' ' A' ' 72' ' ' VAL . 1.9 mt -72.65 -41.1 62.81 Favored 'Isoleucine or valine' 0 N--CA 1.497 1.884 0 O-C-N 121.352 -0.843 . . . . 0.0 109.716 179.276 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 62' ' ' ASP . . . . . . . . . . . . . 75.1 m-20 -53.62 -31.11 45.83 Favored 'General case' 0 N--CA 1.501 2.098 0 O-C-N 121.476 -0.765 . . . . 0.0 110.956 179.566 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 63' ' ' GLU . . . . . . . . . . . . . 0.3 OUTLIER -68.27 -25.54 65.22 Favored 'General case' 0 N--CA 1.5 2.028 0 O-C-N 121.359 -0.838 . . . . 0.0 111.254 179.958 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 64' ' ' VAL . . . . . . . . . . . . . 20.1 t -121.76 6.34 5.89 Favored 'Isoleucine or valine' 0 N--CA 1.501 2.098 0 O-C-N 121.162 -0.962 . . . . 0.0 111.436 -179.328 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 65' ' ' ASP . . . . . . . . . . . . . 5.6 t70 -98.35 73.94 2.16 Favored 'General case' 0 N--CA 1.496 1.833 0 O-C-N 120.706 -1.246 . . . . 0.0 110.459 179.87 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 66' ' ' GLU . . . . . . . . . . . . . 4.6 mp0 -88.56 55.91 3.58 Favored 'General case' 0 N--CA 1.496 1.832 0 O-C-N 121.239 -0.913 . . . . 0.0 108.978 179.23 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 67' ' ' ASP . . . . . . . . . . . . . 2.1 t70 -126.58 -59.33 1.29 Allowed 'General case' 0 N--CA 1.493 1.71 0 O-C-N 121.6 -0.688 . . . . 0.0 110.944 -178.759 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 68' ' ' GLY . . . . . . . . . . . . . . . 143.09 -40.18 1.26 Allowed Glycine 0 N--CA 1.494 2.518 0 N-CA-C 109.715 -1.354 . . . . 0.0 109.715 -179.434 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 69' ' ' SER . . . . . . . . . . . . . 59.6 p -63.89 -29.0 70.22 Favored 'General case' 0 N--CA 1.5 2.031 0 O-C-N 121.404 -1.057 . . . . 0.0 111.206 -179.9 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 70' ' ' GLY . . . . . . . . . . . . . . . 86.72 -12.91 60.14 Favored Glycine 0 N--CA 1.497 2.717 0 C-N-CA 119.875 -1.155 . . . . 0.0 110.569 -179.806 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 71' ' ' THR . . . . . . . . . . . . . 3.5 m -101.09 138.0 38.71 Favored 'General case' 0 N--CA 1.497 1.91 0 O-C-N 121.028 -1.278 . . . . 0.0 109.681 179.694 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 72' ' ' VAL . . . . . 0.41 ' CG2' HG12 ' A' ' 61' ' ' ILE . 8.1 t -82.36 125.63 39.88 Favored 'Isoleucine or valine' 0 N--CA 1.496 1.861 0 O-C-N 121.704 -0.622 . . . . 0.0 110.793 -179.634 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 73' ' ' ASP . . . . . . . . . . . . . 0.8 OUTLIER -99.75 -163.17 1.01 Allowed 'General case' 0 N--CA 1.494 1.757 0 O-C-N 121.41 -0.806 . . . . 0.0 109.564 179.206 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 74' ' ' PHE . . . . . . . . . . . . . 65.4 t80 -63.16 -45.78 90.23 Favored 'General case' 0 N--CA 1.5 2.039 0 O-C-N 121.161 -0.962 . . . . 0.0 110.361 179.827 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 75' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -62.22 -51.72 66.65 Favored 'General case' 0 N--CA 1.499 1.979 0 O-C-N 121.373 -0.83 . . . . 0.0 110.616 179.897 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 76' ' ' GLU . . . . . 0.407 ' O ' HG11 ' A' ' 79' ' ' VAL . 55.5 mt-10 -64.88 -23.22 67.17 Favored 'General case' 0 N--CA 1.501 2.076 0 O-C-N 121.326 -0.859 . . . . 0.0 110.085 179.449 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 77' ' ' PHE . . . . . . . . . . . . . 88.4 t80 -79.34 -35.31 41.22 Favored 'General case' 0 N--CA 1.496 1.868 0 O-C-N 121.3 -0.875 . . . . 0.0 109.677 178.872 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 78' ' ' LEU . . . . . . . . . . . . . 65.5 mt -62.41 -50.42 71.58 Favored 'General case' 0 N--CA 1.498 1.944 0 O-C-N 121.412 -0.805 . . . . 0.0 109.984 179.454 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 79' ' ' VAL . . . . . 0.407 HG11 ' O ' ' A' ' 76' ' ' GLU . 7.4 p -62.74 -31.91 53.86 Favored 'Isoleucine or valine' 0 N--CA 1.5 2.065 0 O-C-N 121.369 -0.832 . . . . 0.0 109.797 179.066 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 80' ' ' MET . . . . . . . . . . . . . 5.2 ttp -65.71 -38.94 90.58 Favored 'General case' 0 N--CA 1.496 1.839 0 O-C-N 121.255 -0.903 . . . . 0.0 109.47 178.633 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 81' ' ' MET . . . . . . . . . . . . . 7.6 mmt -62.08 -41.62 98.36 Favored 'General case' 0 N--CA 1.497 1.881 0 O-C-N 121.501 -0.749 . . . . 0.0 110.036 179.261 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 82' ' ' VAL . . . . . . . . . . . . . 30.6 t -61.41 -35.85 69.21 Favored 'Isoleucine or valine' 0 N--CA 1.5 2.04 0 O-C-N 121.245 -0.909 . . . . 0.0 109.21 178.79 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 83' ' ' ARG . . . . . 0.4 ' HG2' ' CE1' ' A' ' 5' ' ' TYR . 8.5 mtt180 -68.18 -26.1 65.57 Favored 'General case' 0 N--CA 1.498 1.938 0 O-C-N 121.422 -0.799 . . . . 0.0 109.761 178.496 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 84' ' ' CYS . . . . . 0.466 ' HB3' ' HA ' ' B' ' 149' ' ' SER . 73.2 m -85.25 11.6 9.69 Favored 'General case' 0 N--CA 1.499 2.009 0 O-C-N 121.364 -0.835 . . . . 0.0 111.097 179.468 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 85' ' ' MET . . . . . . . . . . . . . 2.6 tpp . . . . . 0 N--CA 1.499 2.008 0 O-C-N 121.043 -1.036 . . . . 0.0 111.071 179.782 . . . . . . . . 0 0 . 1 . 020 nuclear orig core ' B' B ' 149' ' ' SER . . . . . 0.466 ' HA ' ' HB3' ' A' ' 84' ' ' CYS . 74.0 p . . . . . 0 N--CA 1.495 1.789 0 CA-C-O 121.429 0.633 . . . . 0.0 111.068 . . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' B' B ' 150' ' ' ALA . . . . . . . . . . . . . . . -65.49 -49.4 69.18 Favored 'General case' 0 N--CA 1.494 1.772 0 O-C-N 121.704 -0.623 . . . . 0.0 110.766 -179.831 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' B' B ' 151' ' ' ASP . . . . . . . . . . . . . 5.7 p-10 -54.95 -38.84 68.24 Favored 'General case' 0 N--CA 1.502 2.17 0 O-C-N 121.539 -0.726 . . . . 0.0 110.885 179.932 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' B' B ' 152' ' ' ALA . . . . . . . . . . . . . . . -74.64 -44.21 51.56 Favored 'General case' 0 N--CA 1.496 1.851 0 O-C-N 121.296 -0.878 . . . . 0.0 110.43 179.678 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' B' B ' 153' ' ' MET . . . . . . . . . . . . . 2.1 mmt -67.67 -31.73 71.91 Favored 'General case' 0 N--CA 1.498 1.962 0 O-C-N 121.267 -0.896 . . . . 0.0 110.65 179.841 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' B' B ' 154' ' ' MET . . . . . . . . . . . . . 4.4 ttm -57.61 -44.0 85.13 Favored 'General case' 0 N--CA 1.5 2.049 0 O-C-N 121.361 -0.837 . . . . 0.0 110.501 179.876 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' B' B ' 155' ' ' GLN . . . . . . . . . . . . . 1.3 tm0? -66.11 -37.19 85.12 Favored 'General case' 0 N--CA 1.5 2.06 0 O-C-N 121.384 -0.822 . . . . 0.0 110.354 179.631 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' B' B ' 156' ' ' ALA . . . . . . . . . . . . . . . -76.74 -34.29 58.09 Favored 'General case' 0 N--CA 1.499 2.022 0 O-C-N 121.478 -0.764 . . . . 0.0 111.178 -179.753 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' B' B ' 157' ' ' LEU . . . . . 0.439 HD12 ' HA ' ' B' ' 157' ' ' LEU . 3.1 mm? -85.22 -49.68 8.0 Favored 'General case' 0 N--CA 1.5 2.044 0 O-C-N 121.186 -0.946 . . . . 0.0 110.522 -179.565 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' B' B ' 158' ' ' LEU . . . . . . . . . . . . . 3.7 mp . . . . . 0 N--CA 1.496 1.865 0 O-C-N 121.275 -0.89 . . . . 0.0 110.01 179.967 . . . . . . . . 0 0 . 1 . 001 nuclear orig full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 0.2 OUTLIER . . . . . 0 N--CA 1.498 1.932 0 CA-C-O 121.058 0.456 . . . . 0.0 110.55 . . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 2' ' ' ASP . . . . . . . . . . . . . 0.8 OUTLIER -123.52 -172.59 2.55 Favored 'General case' 0 N--CA 1.494 1.773 0 O-C-N 121.573 -0.705 . . . . 0.0 110.31 179.81 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 3' ' ' ASP . . . . . . . . . . . . . 3.5 t70 53.65 46.01 26.86 Favored 'General case' 0 N--CA 1.501 2.101 0 O-C-N 121.513 -0.742 . . . . 0.0 110.52 -179.873 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 4' ' ' ILE . . . . . . . . . . . . . 2.8 mp -86.88 -43.48 15.98 Favored 'Isoleucine or valine' 0 N--CA 1.496 1.87 0 O-C-N 121.033 -1.042 . . . . 0.0 110.05 179.943 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 5' ' ' TYR . . . . . . . . . . . . . 9.6 m-85 -71.04 -37.85 72.56 Favored 'General case' 0 N--CA 1.496 1.863 0 O-C-N 121.226 -0.921 . . . . 0.0 110.585 179.849 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -70.49 -32.09 69.46 Favored 'General case' 0 N--CA 1.498 1.963 0 O-C-N 121.16 -0.962 . . . . 0.0 110.04 179.336 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 7' ' ' ALA . . . . . . . . . . . . . . . -55.6 -41.38 73.34 Favored 'General case' 0 N--CA 1.497 1.92 0 O-C-N 121.384 -0.823 . . . . 0.0 109.254 178.54 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 8' ' ' ALA . . . . . . . . . . . . . . . -69.94 -37.04 75.75 Favored 'General case' 0 N--CA 1.495 1.78 0 O-C-N 121.705 -0.622 . . . . 0.0 109.423 178.487 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 9' ' ' VAL . . . . . 0.439 HG21 ' HA ' ' A' ' 79' ' ' VAL . 53.3 t -60.58 -45.11 97.74 Favored 'Isoleucine or valine' 0 N--CA 1.5 2.048 0 O-C-N 121.637 -0.664 . . . . 0.0 109.806 179.148 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 10' ' ' GLU . . . . . . . . . . . . . 25.3 mt-10 -66.06 -46.25 78.47 Favored 'General case' 0 N--CA 1.498 1.932 0 O-C-N 121.567 -0.708 . . . . 0.0 110.068 179.602 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 11' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -80.71 -84.76 0.1 Allowed 'General case' 0 N--CA 1.488 1.455 0 O-C-N 121.531 -0.731 . . . . 0.0 109.661 179.655 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 12' ' ' LEU . . . . . . . . . . . . . 0.8 OUTLIER 53.23 -159.59 0.14 Allowed 'General case' 0 N--CA 1.501 2.08 0 O-C-N 121.428 -0.795 . . . . 0.0 111.047 179.472 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 13' ' ' THR . . . . . 0.448 HG22 ' HB2' ' A' ' 16' ' ' GLN . 0.0 OUTLIER -142.96 154.69 44.3 Favored 'General case' 0 N--CA 1.495 1.824 0 O-C-N 121.301 -0.874 . . . . 0.0 109.913 179.813 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 14' ' ' GLU . . . . . . . . . . . . . 0.7 OUTLIER -54.15 -39.82 66.88 Favored 'General case' 0 N--CA 1.491 1.6 0 O-C-N 121.696 -0.627 . . . . 0.0 111.015 -179.58 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 1.4 mp0 -55.56 -45.4 77.28 Favored 'General case' 0 N--CA 1.498 1.943 0 O-C-N 121.475 -0.766 . . . . 0.0 110.629 179.742 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 16' ' ' GLN . . . . . 0.448 ' HB2' HG22 ' A' ' 13' ' ' THR . 69.0 mt-30 -86.01 -33.19 21.12 Favored 'General case' 0 N--CA 1.499 1.991 0 O-C-N 121.344 -0.848 . . . . 0.0 110.983 179.929 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 17' ' ' LYS . . . . . . . . . . . . . 0.4 OUTLIER -65.03 -52.88 53.46 Favored 'General case' 0 N--CA 1.5 2.063 0 O-C-N 121.596 -0.69 . . . . 0.0 110.035 -179.963 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 18' ' ' ASN . . . . . . . . . . . . . 1.3 t-20 -62.37 -32.22 72.99 Favored 'General case' 0 N--CA 1.497 1.902 0 O-C-N 121.545 -0.722 . . . . 0.0 109.462 178.9 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 0.7 OUTLIER -61.37 -45.07 95.91 Favored 'General case' 0 N--CA 1.495 1.817 0 O-C-N 121.558 -0.714 . . . . 0.0 109.687 178.966 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 20' ' ' PHE . . . . . . . . . . . . . 13.4 m-85 -62.77 -35.92 81.37 Favored 'General case' 0 N--CA 1.498 1.974 0 O-C-N 121.409 -0.807 . . . . 0.0 109.438 178.873 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 21' ' ' LYS . . . . . . . . . . . . . 9.5 tptp -64.76 -46.22 83.08 Favored 'General case' 0 N--CA 1.498 1.938 0 O-C-N 121.516 -0.74 . . . . 0.0 109.389 178.602 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 22' ' ' ALA . . . . . . . . . . . . . . . -66.8 -31.15 71.59 Favored 'General case' 0 N--CA 1.498 1.949 0 O-C-N 121.599 -0.688 . . . . 0.0 110.202 179.085 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 23' ' ' ALA . . . . . . . . . . . . . . . -87.17 -7.97 57.41 Favored 'General case' 0 N--CA 1.497 1.899 0 O-C-N 121.231 -0.918 . . . . 0.0 110.806 179.448 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 24' ' ' PHE . . . . . . . . . . . . . 93.1 t80 -87.6 -49.89 6.87 Favored 'General case' 0 N--CA 1.498 1.937 0 O-C-N 121.236 -0.915 . . . . 0.0 111.631 -179.265 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 25' ' ' ASP . . . . . . . . . . . . . 5.4 p-10 -58.05 -38.45 76.3 Favored 'General case' 0 N--CA 1.503 2.22 0 O-C-N 121.086 -1.009 . . . . 0.0 111.535 -178.817 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 26' ' ' ILE . . . . . . . . . . . . . 34.2 mt -65.84 -35.54 75.38 Favored 'Isoleucine or valine' 0 N--CA 1.5 2.055 0 O-C-N 120.854 -1.154 . . . . 0.0 109.386 178.918 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 27' ' ' PHE . . . . . 0.544 ' HB3' HG12 ' A' ' 36' ' ' ILE . 0.2 OUTLIER -66.13 -48.48 70.7 Favored 'General case' 0 N--CA 1.497 1.912 0 O-C-N 121.346 -0.846 . . . . 0.0 109.292 178.843 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 28' ' ' VAL . . . . . 0.448 HG13 HG13 ' A' ' 36' ' ' ILE . 2.2 p -112.18 95.75 4.1 Favored 'Isoleucine or valine' 0 N--CA 1.497 1.882 0 O-C-N 121.678 -0.638 . . . . 0.0 109.658 178.986 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 29' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -96.18 -39.56 9.63 Favored 'General case' 0 N--CA 1.5 2.06 0 O-C-N 121.371 -0.83 . . . . 0.0 109.879 -179.898 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 30' ' ' GLY . . . . . . . . . . . . . . . -135.32 55.86 0.72 Allowed Glycine 0 N--CA 1.494 2.559 0 N-CA-C 109.121 -1.591 . . . . 0.0 109.121 179.615 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 31' ' ' ALA . . . . . 0.412 ' HB3' ' HG3' ' A' ' 40' ' ' GLU . . . -119.83 105.25 10.93 Favored 'General case' 0 N--CA 1.492 1.642 0 O-C-N 121.479 -1.012 . . . . 0.0 110.43 -179.712 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 32' ' ' GLU . . . . . . . . . . . . . 1.1 mp0 51.62 -114.95 0.85 Allowed 'General case' 0 N--CA 1.499 1.991 0 O-C-N 121.866 -0.521 . . . . 0.0 111.054 179.679 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -112.4 37.25 3.09 Favored 'General case' 0 N--CA 1.497 1.901 0 O-C-N 120.862 -1.149 . . . . 0.0 110.882 -179.503 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 34' ' ' GLY . . . . . 0.431 ' HA2' HG23 ' A' ' 28' ' ' VAL . . . 92.14 42.35 4.67 Favored Glycine 0 N--CA 1.496 2.685 0 N-CA-C 110.17 -1.172 . . . . 0.0 110.17 179.58 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 35' ' ' CYS . . . . . . . . . . . . . 84.0 m -127.02 123.92 38.16 Favored 'General case' 0 N--CA 1.492 1.644 0 O-C-N 121.341 -1.094 . . . . 0.0 109.612 179.4 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 36' ' ' ILE . . . . . 0.544 HG12 ' HB3' ' A' ' 27' ' ' PHE . 87.2 mt -59.2 113.89 0.8 Allowed 'Isoleucine or valine' 0 N--CA 1.498 1.974 0 O-C-N 121.369 -0.832 . . . . 0.0 110.133 -179.724 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 37' ' ' SER . . . . . . . . . . . . . 0.2 OUTLIER -107.47 -172.96 2.17 Favored 'General case' 0 N--CA 1.496 1.854 0 O-C-N 121.581 -0.699 . . . . 0.0 110.373 -179.684 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 38' ' ' THR . . . . . . . . . . . . . 17.6 p -59.23 -42.63 91.49 Favored 'General case' 0 N--CA 1.504 2.228 0 O-C-N 121.338 -0.851 . . . . 0.0 110.831 -179.861 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 39' ' ' LYS . . . . . . . . . . . . . 4.1 ttmt -64.54 -41.44 96.34 Favored 'General case' 0 N--CA 1.5 2.056 0 O-C-N 121.454 -0.779 . . . . 0.0 111.298 -179.602 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 40' ' ' GLU . . . . . 0.412 ' HG3' ' HB3' ' A' ' 31' ' ' ALA . 8.8 mm-40 -67.31 -46.0 74.82 Favored 'General case' 0 N--CA 1.499 2.025 0 O-C-N 121.257 -0.902 . . . . 0.0 109.925 -179.85 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 41' ' ' LEU . . . . . 0.48 HD21 ' HB3' ' A' ' 57' ' ' LEU . 3.9 tp -63.58 -40.33 96.69 Favored 'General case' 0 N--CA 1.496 1.838 0 O-C-N 121.344 -0.848 . . . . 0.0 109.561 179.0 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 42' ' ' GLY . . . . . . . . . . . . . . . -60.5 -31.57 74.97 Favored Glycine 0 N--CA 1.494 2.524 0 N-CA-C 110.144 -1.182 . . . . 0.0 110.144 179.576 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 43' ' ' LYS . . . . . . . . . . . . . 0.5 OUTLIER -58.59 -47.97 82.51 Favored 'General case' 0 N--CA 1.5 2.038 0 O-C-N 121.272 -1.134 . . . . 0.0 109.563 179.219 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 44' ' ' VAL . . . . . . . . . . . . . 86.9 t -71.5 -29.78 36.42 Favored 'Isoleucine or valine' 0 N--CA 1.498 1.961 0 O-C-N 121.511 -0.743 . . . . 0.0 109.847 178.889 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 45' ' ' MET . . . . . . . . . . . . . 5.6 mmt -58.9 -39.04 80.31 Favored 'General case' 0 N--CA 1.501 2.079 0 O-C-N 121.344 -0.848 . . . . 0.0 109.861 179.147 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 46' ' ' ARG . . . . . . . . . . . . . 1.6 ttp180 -64.32 -32.41 74.01 Favored 'General case' 0 N--CA 1.496 1.875 0 O-C-N 121.624 -0.673 . . . . 0.0 110.434 179.408 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 47' ' ' MET . . . . . . . . . . . . . 12.0 mmm -61.24 -37.83 84.47 Favored 'General case' 0 N--CA 1.502 2.165 0 O-C-N 121.392 -0.818 . . . . 0.0 110.102 179.524 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 48' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -68.17 -37.98 81.56 Favored 'General case' 0 N--CA 1.497 1.904 0 O-C-N 121.413 -0.805 . . . . 0.0 110.186 179.537 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 49' ' ' GLY . . . . . . . . . . . . . . . 130.77 11.1 2.42 Favored Glycine 0 N--CA 1.497 2.716 0 C-N-CA 120.506 -0.854 . . . . 0.0 111.18 179.537 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 50' ' ' GLN . . . . . . . . . . . . . 0.1 OUTLIER -127.78 138.01 52.6 Favored 'General case' 0 N--CA 1.495 1.789 0 O-C-N 120.887 -1.361 . . . . 0.0 110.524 179.934 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 51' ' ' ASN . . . . . . . . . . . . . 1.4 m120 -122.18 80.32 44.07 Favored Pre-proline 0 N--CA 1.495 1.787 0 O-C-N 121.551 -0.718 . . . . 0.0 109.721 179.713 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 52' ' ' PRO . . . . . . . . . . . . . 49.8 Cg_endo -78.03 168.18 22.39 Favored 'Trans proline' 0 C--N 1.316 -1.136 0 O-C-N 123.885 1.466 . . . . 0.0 111.078 -179.292 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 53' ' ' THR . . . . . 0.542 ' HB ' ' HD2' ' A' ' 54' ' ' PRO . 41.3 p -76.56 168.81 24.8 Favored Pre-proline 0 N--CA 1.498 1.951 0 O-C-N 121.473 -0.767 . . . . 0.0 109.694 179.411 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 54' ' ' PRO . . . . . 0.542 ' HD2' ' HB ' ' A' ' 53' ' ' THR . 40.8 Cg_endo -64.83 -25.62 60.33 Favored 'Trans proline' 0 N--CA 1.491 1.338 0 O-C-N 123.45 1.237 . . . . 0.0 110.888 -179.984 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 55' ' ' GLU . . . . . . . . . . . . . 0.6 OUTLIER -64.79 -39.49 93.68 Favored 'General case' 0 N--CA 1.498 1.962 0 O-C-N 121.437 -0.789 . . . . 0.0 109.974 179.091 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 0.6 OUTLIER -54.22 -46.48 72.51 Favored 'General case' 0 N--CA 1.499 1.988 0 O-C-N 121.634 -0.666 . . . . 0.0 109.985 179.526 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 57' ' ' LEU . . . . . 0.48 ' HB3' HD21 ' A' ' 41' ' ' LEU . 0.7 OUTLIER -77.83 -28.01 50.1 Favored 'General case' 0 N--CA 1.492 1.673 0 O-C-N 121.334 -0.854 . . . . 0.0 110.245 179.545 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 58' ' ' GLN . . . . . 0.593 ' HG3' ' N ' ' A' ' 59' ' ' GLU . 0.0 OUTLIER -59.76 -34.2 72.68 Favored 'General case' 0 N--CA 1.497 1.884 0 O-C-N 121.08 -1.012 . . . . 0.0 109.077 179.054 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 59' ' ' GLU . . . . . 0.593 ' N ' ' HG3' ' A' ' 58' ' ' GLN . 0.5 OUTLIER -69.63 -37.05 76.65 Favored 'General case' 0 N--CA 1.494 1.763 0 N-CA-C 108.505 -0.924 . . . . 0.0 108.505 177.781 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 60' ' ' MET . . . . . . . . . . . . . 4.1 mtm -63.1 -44.62 95.16 Favored 'General case' 0 N--CA 1.496 1.867 0 O-C-N 121.809 -0.557 . . . . 0.0 109.835 178.602 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 61' ' ' ILE . . . . . 0.467 HG13 HG23 ' A' ' 72' ' ' VAL . 0.2 OUTLIER -66.93 -33.6 64.45 Favored 'Isoleucine or valine' 0 N--CA 1.498 1.968 0 O-C-N 121.624 -0.673 . . . . 0.0 110.472 179.826 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 62' ' ' ASP . . . . . 0.421 ' N ' HG21 ' A' ' 61' ' ' ILE . 0.9 OUTLIER -70.2 -35.86 74.22 Favored 'General case' 0 N--CA 1.498 1.947 0 O-C-N 121.27 -0.894 . . . . 0.0 110.276 179.607 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 63' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER -65.78 -35.73 81.54 Favored 'General case' 0 N--CA 1.497 1.912 0 O-C-N 121.355 -0.841 . . . . 0.0 111.174 -179.882 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 64' ' ' VAL . . . . . . . . . . . . . 33.4 m -102.54 -15.58 7.8 Favored 'Isoleucine or valine' 0 N--CA 1.502 2.126 0 O-C-N 121.212 -0.93 . . . . 0.0 111.964 -179.359 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 65' ' ' ASP . . . . . . . . . . . . . 21.6 t0 -131.74 140.74 49.34 Favored 'General case' 0 N--CA 1.498 1.956 0 O-C-N 120.843 -1.16 . . . . 0.0 111.6 -179.774 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 66' ' ' GLU . . . . . . . . . . . . . 3.3 tp10 -155.46 40.01 0.4 Allowed 'General case' 0 N--CA 1.492 1.631 0 CA-C-O 121.477 0.656 . . . . 0.0 109.43 179.017 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 67' ' ' ASP . . . . . . . . . . . . . 12.1 p-10 -99.15 4.49 46.85 Favored 'General case' 0 N--CA 1.498 1.962 0 O-C-N 121.437 -0.789 . . . . 0.0 111.536 -179.532 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 68' ' ' GLY . . . . . . . . . . . . . . . 105.8 -32.39 7.45 Favored Glycine 0 N--CA 1.493 2.452 0 N-CA-C 109.543 -1.423 . . . . 0.0 109.543 -179.724 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 69' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER -69.07 -42.8 75.73 Favored 'General case' 0 N--CA 1.495 1.823 0 O-C-N 121.396 -1.061 . . . . 0.0 110.428 179.826 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 70' ' ' GLY . . . . . . . . . . . . . . . 72.78 29.76 64.82 Favored Glycine 0 N--CA 1.496 2.688 0 N-CA-C 109.248 -1.541 . . . . 0.0 109.248 -179.781 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 71' ' ' THR . . . . . 0.423 ' HA ' HD12 ' A' ' 61' ' ' ILE . 0.2 OUTLIER -136.39 143.07 43.8 Favored 'General case' 0 N--CA 1.492 1.638 0 O-C-N 121.622 -0.928 . . . . 0.0 108.968 179.938 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 72' ' ' VAL . . . . . 0.467 HG23 HG13 ' A' ' 61' ' ' ILE . 3.9 t -75.5 110.63 10.71 Favored 'Isoleucine or valine' 0 N--CA 1.497 1.891 0 O-C-N 121.635 -0.665 . . . . 0.0 110.235 -179.585 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 73' ' ' ASP . . . . . . . . . . . . . 46.0 m-20 -83.03 -174.57 5.37 Favored 'General case' 0 N--CA 1.496 1.848 0 O-C-N 121.596 -0.69 . . . . 0.0 109.431 179.72 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 74' ' ' PHE . . . . . . . . . . . . . 52.2 t80 -60.62 -47.69 85.09 Favored 'General case' 0 N--CA 1.5 2.027 0 O-C-N 121.093 -1.004 . . . . 0.0 109.792 179.701 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 75' ' ' ASP . . . . . 0.456 ' HA ' HD21 ' A' ' 78' ' ' LEU . 23.6 t70 -62.14 -52.33 64.29 Favored 'General case' 0 N--CA 1.494 1.729 0 O-C-N 121.66 -0.65 . . . . 0.0 110.148 179.534 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 76' ' ' GLU . . . . . . . . . . . . . 18.4 mt-10 -57.65 -38.38 74.98 Favored 'General case' 0 N--CA 1.5 2.028 0 O-C-N 121.534 -0.729 . . . . 0.0 110.508 179.631 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 77' ' ' PHE . . . . . . . . . . . . . 58.0 t80 -63.48 -48.15 78.85 Favored 'General case' 0 N--CA 1.496 1.848 0 O-C-N 121.367 -0.833 . . . . 0.0 109.619 179.019 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 78' ' ' LEU . . . . . 0.456 HD21 ' HA ' ' A' ' 75' ' ' ASP . 0.1 OUTLIER -71.13 -30.93 67.11 Favored 'General case' 0 N--CA 1.496 1.867 0 O-C-N 121.45 -0.781 . . . . 0.0 109.734 179.117 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 79' ' ' VAL . . . . . 0.442 ' N ' ' HG ' ' A' ' 78' ' ' LEU . 4.8 t -68.4 -39.71 81.23 Favored 'Isoleucine or valine' 0 N--CA 1.501 2.093 0 O-C-N 121.216 -0.927 . . . . 0.0 109.102 178.276 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 80' ' ' MET . . . . . 0.508 ' HG2' ' HAI' ' A' ' 91' ' ' SXK . 26.0 ttp -68.5 -27.46 66.15 Favored 'General case' 0 N--CA 1.495 1.822 0 O-C-N 121.562 -0.711 . . . . 0.0 109.936 179.057 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 81' ' ' MET . . . . . 0.4 ' O ' ' HB2' ' A' ' 85' ' ' MET . 8.1 mmt -67.01 -55.17 15.58 Favored 'General case' 0 N--CA 1.496 1.845 0 O-C-N 121.467 -0.77 . . . . 0.0 110.793 179.948 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 82' ' ' VAL . . . . . . . . . . . . . 20.2 m -59.46 -30.66 44.9 Favored 'Isoleucine or valine' 0 N--CA 1.503 2.177 0 O-C-N 121.424 -0.798 . . . . 0.0 110.681 -179.829 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 83' ' ' ARG . . . . . . . . . . . . . 5.3 mtp-105 -52.6 -47.27 67.05 Favored 'General case' 0 N--CA 1.5 2.047 0 O-C-N 121.468 -0.77 . . . . 0.0 110.297 179.424 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 84' ' ' CYS . . . . . . . . . . . . . 36.1 m -94.3 -4.35 48.88 Favored 'General case' 0 N--CA 1.499 2.0 0 O-C-N 121.426 -0.796 . . . . 0.0 110.465 178.968 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 85' ' ' MET . . . . . 0.494 ' O ' ' HB2' ' A' ' 86' ' ' LYS . 3.3 ttm -82.47 -11.83 58.23 Favored 'General case' 0 N--CA 1.497 1.923 0 O-C-N 121.219 -0.925 . . . . 0.0 111.118 179.503 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 86' ' ' LYS . . . . . 0.494 ' HB2' ' O ' ' A' ' 85' ' ' MET . 0.0 OUTLIER 63.57 -176.34 0.16 Allowed 'General case' 0 N--CA 1.505 2.301 0 O-C-N 121.435 -0.791 . . . . 0.0 110.553 -179.686 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 87' ' ' ASP . . . . . . . . . . . . . 7.7 p-10 -109.7 -175.37 2.73 Favored 'General case' 0 N--CA 1.499 1.992 0 O-C-N 121.082 -1.011 . . . . 0.0 111.212 -179.393 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 88' ' ' ASP . . . . . . . . . . . . . 6.6 p-10 -95.98 -25.17 16.04 Favored 'General case' 0 N--CA 1.499 2.011 0 O-C-N 121.503 -0.748 . . . . 0.0 111.665 -179.113 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 89' ' ' SER . . . . . . . . . . . . . 8.0 m . . . . . 0 N--CA 1.503 2.178 0 CA-C-O 117.75 -1.119 . . . . 0.0 111.244 -179.582 . . . . . . . . 0 0 . 1 . 001 nuclear orig full ' B' B ' 144' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.497 1.877 0 CA-C-O 121.043 0.449 . . . . 0.0 110.112 . . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 145' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -114.58 57.31 0.71 Allowed 'General case' 0 N--CA 1.494 1.769 0 O-C-N 121.39 -0.819 . . . . 0.0 110.346 -179.616 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' B' B ' 146' ' ' VAL . . . . . . . . . . . . . 72.0 t -121.76 103.29 13.32 Favored 'Isoleucine or valine' 0 N--CA 1.499 1.991 0 O-C-N 121.217 -0.927 . . . . 0.0 110.127 -179.941 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 147' ' ' ARG . . . . . . . . . . . . . 16.7 tpp180 -164.84 135.91 4.12 Favored 'General case' 0 N--CA 1.497 1.893 0 O-C-N 121.505 -0.747 . . . . 0.0 109.944 -179.879 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 148' ' ' ILE . . . . . . . . . . . . . 2.7 mp -132.06 142.29 43.24 Favored 'Isoleucine or valine' 0 N--CA 1.496 1.863 0 O-C-N 121.469 -0.77 . . . . 0.0 110.63 -179.352 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 149' ' ' SER . . . . . 0.442 ' HB3' ' HB2' ' B' ' 152' ' ' ALA . 2.2 t -112.75 158.06 20.56 Favored 'General case' 0 N--CA 1.497 1.895 0 O-C-N 121.563 -0.71 . . . . 0.0 109.563 179.348 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' B' B ' 150' ' ' ALA . . . . . . . . . . . . . . . -57.79 -55.47 34.47 Favored 'General case' 0 N--CA 1.499 2.008 0 O-C-N 121.261 -0.899 . . . . 0.0 110.542 -179.828 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 151' ' ' ASP . . . . . . . . . . . . . 18.5 t70 -65.27 -41.54 94.12 Favored 'General case' 0 N--CA 1.497 1.894 0 O-C-N 121.328 -0.858 . . . . 0.0 110.58 179.752 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 152' ' ' ALA . . . . . 0.442 ' HB2' ' HB3' ' B' ' 149' ' ' SER . . . -59.84 -52.37 65.74 Favored 'General case' 0 N--CA 1.499 2.013 0 O-C-N 121.414 -0.804 . . . . 0.0 110.649 179.981 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' B' B ' 153' ' ' MET . . . . . . . . . . . . . 1.3 tpt -63.22 -40.56 97.8 Favored 'General case' 0 N--CA 1.497 1.892 0 O-C-N 121.291 -0.881 . . . . 0.0 110.183 179.779 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 154' ' ' MET . . . . . . . . . . . . . 1.7 mtp -63.34 -43.85 96.53 Favored 'General case' 0 N--CA 1.501 2.118 0 O-C-N 121.346 -0.846 . . . . 0.0 110.121 179.345 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 155' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -60.25 -40.17 89.35 Favored 'General case' 0 N--CA 1.498 1.965 0 O-C-N 121.635 -0.666 . . . . 0.0 110.049 179.493 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' B' B ' 156' ' ' ALA . . . . . . . . . . . . . . . -78.29 -25.11 46.5 Favored 'General case' 0 N--CA 1.495 1.816 0 O-C-N 121.434 -0.791 . . . . 0.0 110.33 179.213 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 157' ' ' LEU . . . . . 0.492 HD21 ' HA ' ' B' ' 157' ' ' LEU . 0.5 OUTLIER -69.65 -50.36 44.84 Favored 'General case' 0 N--CA 1.497 1.921 0 O-C-N 121.349 -0.844 . . . . 0.0 110.503 179.951 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' B' B ' 158' ' ' LEU . . . . . . . . . . . . . 1.6 mt -116.63 46.83 1.55 Allowed 'General case' 0 N--CA 1.496 1.874 0 O-C-N 121.224 -0.922 . . . . 0.0 110.245 179.713 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 159' ' ' GLY . . . . . . . . . . . . . . . -156.18 -57.2 0.01 OUTLIER Glycine 0 N--CA 1.496 2.644 0 N-CA-C 109.901 -1.28 . . . . 0.0 109.901 -179.957 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 160' ' ' ALA . . . . . . . . . . . . . . . -67.01 97.54 0.5 Allowed 'General case' 0 N--CA 1.496 1.845 0 O-C-N 121.467 -1.019 . . . . 0.0 110.399 -179.972 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 161' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER 51.02 45.93 27.11 Favored 'General case' 0 N--CA 1.501 2.09 0 O-C-N 121.561 -0.712 . . . . 0.0 110.852 179.966 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' B' B ' 162' ' ' ALA . . . . . . . . . . . . . . . -136.2 -49.69 0.68 Allowed 'General case' 0 N--CA 1.495 1.823 0 O-C-N 121.235 -0.915 . . . . 0.0 110.374 -179.926 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 163' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER . . . . . 0 N--CA 1.496 1.848 0 CA-C-O 118.204 -0.903 . . . . 0.0 110.391 179.704 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 90' ' ' ' CA' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 nuclear orig full ' A' A ' 91' ' ' SXK . . . . . 0.508 ' HAI' ' HG2' ' A' ' 80' ' ' MET . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 1.4 mpp? . . . . . 0 N--CA 1.494 1.771 0 CA-C-O 120.907 0.385 . . . . 0.0 110.107 . . . . . . . . . 0 0 . 1 . 002 nuclear orig full ' A' A ' 2' ' ' ASP . . . . . . . . . . . . . 30.5 t70 -108.24 -77.84 0.59 Allowed 'General case' 0 N--CA 1.496 1.856 0 O-C-N 121.371 -0.83 . . . . 0.0 110.433 -179.754 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 3' ' ' ASP . . . . . 0.598 ' HB3' ' HB2' ' A' ' 6' ' ' LYS . 5.1 t70 -132.12 142.07 49.37 Favored 'General case' 0 N--CA 1.493 1.72 0 O-C-N 121.211 -0.93 . . . . 0.0 110.119 -179.98 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 4' ' ' ILE . . . . . 0.408 HG13 ' N ' ' A' ' 5' ' ' TYR . 35.3 pt -67.34 -38.01 80.06 Favored 'Isoleucine or valine' 0 N--CA 1.501 2.094 0 O-C-N 121.544 -0.722 . . . . 0.0 110.615 -179.659 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 5' ' ' TYR . . . . . 0.408 ' N ' HG13 ' A' ' 4' ' ' ILE . 56.8 m-85 -71.1 -21.78 62.18 Favored 'General case' 0 N--CA 1.496 1.834 0 O-C-N 121.297 -0.877 . . . . 0.0 109.749 179.022 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 6' ' ' LYS . . . . . 0.598 ' HB2' ' HB3' ' A' ' 3' ' ' ASP . 0.1 OUTLIER -69.32 -49.64 53.88 Favored 'General case' 0 N--CA 1.494 1.762 0 O-C-N 121.492 -0.755 . . . . 0.0 109.722 178.916 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' A' A ' 7' ' ' ALA . . . . . . . . . . . . . . . -50.56 -38.84 47.4 Favored 'General case' 0 N--CA 1.499 2.017 0 O-C-N 121.572 -0.705 . . . . 0.0 110.345 179.422 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 8' ' ' ALA . . . . . . . . . . . . . . . -59.07 -42.31 90.05 Favored 'General case' 0 N--CA 1.497 1.889 0 O-C-N 121.561 -0.712 . . . . 0.0 109.758 178.978 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 9' ' ' VAL . . . . . 0.488 HG23 HG21 ' A' ' 79' ' ' VAL . 55.3 t -66.91 -42.67 89.22 Favored 'Isoleucine or valine' 0 N--CA 1.498 1.967 0 O-C-N 121.602 -0.686 . . . . 0.0 109.552 178.969 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 10' ' ' GLU . . . . . . . . . . . . . 0.9 OUTLIER -57.93 -39.83 78.96 Favored 'General case' 0 N--CA 1.499 1.989 0 O-C-N 121.484 -0.76 . . . . 0.0 110.041 178.949 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 11' ' ' GLN . . . . . . . . . . . . . 5.4 mt-30 -109.1 48.22 0.88 Allowed 'General case' 0 N--CA 1.495 1.786 0 O-C-N 121.486 -0.759 . . . . 0.0 109.926 179.501 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 12' ' ' LEU . . . . . 0.469 HD22 ' HB3' ' A' ' 16' ' ' GLN . 2.8 mt -82.8 158.73 22.66 Favored 'General case' 0 N--CA 1.5 2.027 0 O-C-N 121.309 -0.869 . . . . 0.0 110.636 -179.874 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 13' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -80.15 153.36 28.7 Favored 'General case' 0 N--CA 1.498 1.945 0 O-C-N 121.49 -0.756 . . . . 0.0 110.488 179.876 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 14' ' ' GLU . . . . . . . . . . . . . 12.4 tp10 -58.17 -47.18 84.2 Favored 'General case' 0 N--CA 1.492 1.673 0 C-N-CA 120.106 -0.637 . . . . 0.0 109.966 179.81 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 5.0 tt0 -57.68 -45.51 85.51 Favored 'General case' 0 N--CA 1.499 2.0 0 O-C-N 121.443 -0.786 . . . . 0.0 109.906 179.157 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 16' ' ' GLN . . . . . 0.469 ' HB3' HD22 ' A' ' 12' ' ' LEU . 3.0 mp0 -63.29 -48.41 78.25 Favored 'General case' 0 N--CA 1.496 1.875 0 CA-C-O 121.648 0.737 . . . . 0.0 110.158 179.381 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 17' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -60.97 -49.33 77.87 Favored 'General case' 0 N--CA 1.496 1.871 0 CA-C-N 116.245 -0.434 . . . . 0.0 110.199 179.647 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 18' ' ' ASN . . . . . . . . . . . . . 0.5 OUTLIER -62.12 -39.95 94.25 Favored 'General case' 0 N--CA 1.497 1.896 0 O-C-N 121.504 -0.748 . . . . 0.0 110.129 179.619 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 7.6 mm-40 -63.89 -49.32 73.18 Favored 'General case' 0 N--CA 1.497 1.907 0 O-C-N 121.51 -0.744 . . . . 0.0 110.001 179.529 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 20' ' ' PHE . . . . . . . . . . . . . 15.6 m-85 -66.49 -35.04 79.28 Favored 'General case' 0 N--CA 1.499 2.0 0 O-C-N 121.365 -0.834 . . . . 0.0 110.235 179.497 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 21' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -58.58 -54.2 49.7 Favored 'General case' 0 N--CA 1.498 1.951 0 O-C-N 121.423 -0.798 . . . . 0.0 109.907 179.434 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 22' ' ' ALA . . . . . . . . . . . . . . . -66.04 -42.07 90.02 Favored 'General case' 0 N--CA 1.496 1.834 0 O-C-N 121.53 -0.732 . . . . 0.0 110.619 179.974 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 23' ' ' ALA . . . . . . . . . . . . . . . -61.99 -40.77 96.78 Favored 'General case' 0 N--CA 1.499 1.994 0 O-C-N 121.324 -0.86 . . . . 0.0 110.105 179.478 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 24' ' ' PHE . . . . . . . . . . . . . 67.9 t80 -60.82 -45.31 94.95 Favored 'General case' 0 N--CA 1.498 1.956 0 O-C-N 121.561 -0.712 . . . . 0.0 110.088 179.392 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 25' ' ' ASP . . . . . . . . . . . . . 3.2 m-20 -60.52 -38.2 83.62 Favored 'General case' 0 N--CA 1.498 1.942 0 O-C-N 121.595 -0.691 . . . . 0.0 110.246 179.694 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 26' ' ' ILE . . . . . . . . . . . . . 57.1 mt -74.68 -26.87 20.13 Favored 'Isoleucine or valine' 0 N--CA 1.5 2.043 0 O-C-N 121.311 -0.868 . . . . 0.0 109.919 179.285 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 27' ' ' PHE . . . . . 0.471 ' HB3' HD12 ' A' ' 36' ' ' ILE . 0.2 OUTLIER -71.4 -37.92 71.5 Favored 'General case' 0 N--CA 1.496 1.866 0 O-C-N 121.288 -0.883 . . . . 0.0 111.245 -179.836 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' A' A ' 28' ' ' VAL . . . . . 0.526 ' CG2' ' HA ' ' A' ' 33' ' ' ASP . 28.1 m -79.71 9.79 0.7 Allowed 'Isoleucine or valine' 0 N--CA 1.503 2.211 0 O-C-N 121.29 -0.881 . . . . 0.0 111.726 -179.518 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 29' ' ' LEU . . . . . . . . . . . . . 2.5 mt -70.63 96.11 1.17 Allowed 'General case' 0 N--CA 1.496 1.834 0 O-C-N 121.001 -1.062 . . . . 0.0 109.737 179.449 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 30' ' ' GLY . . . . . . . . . . . . . . . 143.47 -25.21 2.16 Favored Glycine 0 N--CA 1.493 2.471 0 N-CA-C 109.264 -1.534 . . . . 0.0 109.264 -178.963 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 31' ' ' ALA . . . . . . . . . . . . . . . -98.8 -83.21 0.42 Allowed 'General case' 0 N--CA 1.494 1.757 0 O-C-N 121.42 -1.047 . . . . 0.0 109.951 179.679 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 32' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -157.63 27.41 0.28 Allowed 'General case' 0 N--CA 1.5 2.056 0 O-C-N 121.465 -0.772 . . . . 0.0 110.445 179.82 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 33' ' ' ASP . . . . . 0.526 ' HA ' ' CG2' ' A' ' 28' ' ' VAL . 11.2 m-20 51.76 54.07 11.58 Favored 'General case' 0 N--CA 1.5 2.048 0 O-C-N 121.535 -0.728 . . . . 0.0 111.066 179.819 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 34' ' ' GLY . . . . . . . . . . . . . . . -166.85 -38.51 0.02 OUTLIER Glycine 0 N--CA 1.499 2.883 0 C-N-CA 119.782 -1.199 . . . . 0.0 111.668 -179.817 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 35' ' ' CYS . . . . . . . . . . . . . 0.1 OUTLIER -135.69 156.24 49.15 Favored 'General case' 0 N--CA 1.498 1.975 0 O-C-N 120.981 -1.305 . . . . 0.0 111.353 -178.832 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 36' ' ' ILE . . . . . 0.546 ' HB ' ' HB ' ' A' ' 72' ' ' VAL . 1.2 mp -113.75 126.74 71.28 Favored 'Isoleucine or valine' 0 N--CA 1.496 1.875 0 O-C-N 121.405 -0.809 . . . . 0.0 109.81 179.253 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 37' ' ' SER . . . . . . . . . . . . . 52.1 p -103.06 -168.34 1.5 Allowed 'General case' 0 N--CA 1.497 1.887 0 O-C-N 121.482 -0.761 . . . . 0.0 110.593 -179.902 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 38' ' ' THR . . . . . . . . . . . . . 30.1 p -65.49 -46.21 80.64 Favored 'General case' 0 N--CA 1.501 2.103 0 O-C-N 121.291 -0.88 . . . . 0.0 110.255 179.675 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 39' ' ' LYS . . . . . . . . . . . . . 10.8 mttm -65.75 -38.34 88.83 Favored 'General case' 0 N--CA 1.499 1.99 0 O-C-N 121.484 -0.76 . . . . 0.0 110.031 179.459 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 40' ' ' GLU . . . . . 0.454 ' HB3' HG23 ' A' ' 36' ' ' ILE . 4.2 tp10 -64.69 -30.74 71.76 Favored 'General case' 0 N--CA 1.496 1.832 0 O-C-N 121.528 -0.732 . . . . 0.0 110.22 179.465 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 41' ' ' LEU . . . . . 0.515 HD21 ' HB3' ' A' ' 57' ' ' LEU . 6.0 tp -85.96 -45.84 11.11 Favored 'General case' 0 N--CA 1.496 1.841 0 O-C-N 121.445 -0.784 . . . . 0.0 110.602 179.615 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 42' ' ' GLY . . . . . . . . . . . . . . . -51.71 -39.12 45.95 Favored Glycine 0 N--CA 1.497 2.754 0 N-CA-C 111.141 -0.783 . . . . 0.0 111.141 -178.939 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 43' ' ' LYS . . . . . . . . . . . . . 2.7 pttm -58.9 -30.83 68.08 Favored 'General case' 0 N--CA 1.5 2.056 0 O-C-N 121.242 -1.152 . . . . 0.0 110.793 -179.975 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 44' ' ' VAL . . . . . . . . . . . . . 93.4 t -86.66 -32.49 6.59 Favored 'Isoleucine or valine' 0 N--CA 1.499 2.002 0 O-C-N 121.232 -0.917 . . . . 0.0 109.658 178.765 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 45' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -57.28 -50.67 72.16 Favored 'General case' 0 N--CA 1.5 2.04 0 O-C-N 121.443 -0.785 . . . . 0.0 110.282 179.8 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 46' ' ' ARG . . . . . 0.413 ' N ' ' HB2' ' A' ' 51' ' ' ASN . 0.0 OUTLIER -69.28 -41.04 77.38 Favored 'General case' 0 N--CA 1.499 1.987 0 O-C-N 121.394 -0.816 . . . . 0.0 109.796 179.393 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' A' A ' 47' ' ' MET . . . . . . . . . . . . . 0.2 OUTLIER -62.2 -37.44 85.3 Favored 'General case' 0 N--CA 1.499 1.988 0 O-C-N 121.574 -0.704 . . . . 0.0 110.112 179.238 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 48' ' ' LEU . . . . . 0.512 HD13 ' HG3' ' B' ' 153' ' ' MET . 0.4 OUTLIER -75.86 -46.75 28.59 Favored 'General case' 0 N--CA 1.493 1.686 0 O-C-N 121.446 -0.784 . . . . 0.0 110.229 179.592 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' A' A ' 49' ' ' GLY . . . . . . . . . . . . . . . -161.8 -82.69 0.04 OUTLIER Glycine 0 N--CA 1.494 2.508 0 N-CA-C 110.237 -1.145 . . . . 0.0 110.237 -179.832 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 50' ' ' GLN . . . . . . . . . . . . . 78.2 mt-30 -127.28 143.07 51.31 Favored 'General case' 0 N--CA 1.497 1.891 0 O-C-N 121.408 -1.054 . . . . 0.0 111.144 -179.361 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 51' ' ' ASN . . . . . 0.413 ' HB2' ' N ' ' A' ' 46' ' ' ARG . 33.1 t30 -116.4 110.97 42.35 Favored Pre-proline 0 N--CA 1.493 1.712 0 O-C-N 121.485 -0.759 . . . . 0.0 109.574 178.859 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 52' ' ' PRO . . . . . . . . . . . . . 44.0 Cg_endo -71.34 -92.62 0.01 OUTLIER 'Trans proline' 0 C--N 1.312 -1.361 0 O-C-N 124.003 1.528 . . . . 0.0 111.014 -179.541 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 53' ' ' THR . . . . . . . . . . . . . 0.6 OUTLIER -144.92 160.38 46.91 Favored Pre-proline 0 N--CA 1.495 1.801 0 O-C-N 120.841 -1.162 . . . . 0.0 110.667 -179.532 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 54' ' ' PRO . . . . . . . . . . . . . 43.5 Cg_endo -69.42 -38.14 8.97 Favored 'Trans proline' 0 N--CA 1.492 1.392 0 O-C-N 124.039 1.547 . . . . 0.0 111.307 179.993 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 55' ' ' GLU . . . . . . . . . . . . . 32.6 mt-10 -61.31 -38.44 86.86 Favored 'General case' 0 N--CA 1.499 1.996 0 O-C-N 121.381 -0.825 . . . . 0.0 110.634 -179.837 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 15.1 mm-40 -62.19 -37.99 87.39 Favored 'General case' 0 N--CA 1.498 1.961 0 O-C-N 121.417 -0.802 . . . . 0.0 110.765 179.736 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 57' ' ' LEU . . . . . 0.515 ' HB3' HD21 ' A' ' 41' ' ' LEU . 74.4 mt -68.65 -31.91 71.38 Favored 'General case' 0 N--CA 1.496 1.871 0 O-C-N 121.228 -0.92 . . . . 0.0 110.405 179.952 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 58' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -55.13 -52.56 62.89 Favored 'General case' 0 N--CA 1.498 1.946 0 O-C-N 121.287 -0.883 . . . . 0.0 109.041 179.024 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 59' ' ' GLU . . . . . . . . . . . . . 1.5 tm-20 -66.37 -35.96 81.67 Favored 'General case' 0 N--CA 1.494 1.744 0 N-CA-C 108.958 -0.756 . . . . 0.0 108.958 178.033 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 60' ' ' MET . . . . . . . . . . . . . 3.0 tpp -55.98 -40.68 73.63 Favored 'General case' 0 N--CA 1.498 1.949 0 O-C-N 121.571 -0.705 . . . . 0.0 109.775 178.715 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 61' ' ' ILE . . . . . 0.519 HG21 ' CG2' ' A' ' 72' ' ' VAL . 69.2 mt -71.19 -50.14 43.64 Favored 'Isoleucine or valine' 0 N--CA 1.498 1.959 0 O-C-N 121.446 -0.784 . . . . 0.0 109.302 178.928 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 62' ' ' ASP . . . . . 0.42 ' HA ' ' CB ' ' A' ' 65' ' ' ASP . 5.1 m-20 -58.9 -26.97 64.79 Favored 'General case' 0 N--CA 1.498 1.965 0 O-C-N 121.704 -0.623 . . . . 0.0 110.865 179.64 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 63' ' ' GLU . . . . . . . . . . . . . 3.0 tt0 -50.94 -39.08 53.98 Favored 'General case' 0 N--CA 1.501 2.076 0 O-C-N 121.347 -0.846 . . . . 0.0 109.981 179.179 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 64' ' ' VAL . . . . . 0.404 ' CG2' HG12 ' A' ' 79' ' ' VAL . 9.8 p -125.83 25.78 2.87 Favored 'Isoleucine or valine' 0 N--CA 1.495 1.824 0 O-C-N 121.587 -0.696 . . . . 0.0 110.393 179.259 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 65' ' ' ASP . . . . . 0.42 ' CB ' ' HA ' ' A' ' 62' ' ' ASP . 9.3 t70 -86.74 116.36 24.79 Favored 'General case' 0 N--CA 1.498 1.934 0 O-C-N 121.099 -1.001 . . . . 0.0 110.397 179.886 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 66' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER -80.07 -20.98 43.91 Favored 'General case' 0 N--CA 1.497 1.895 0 O-C-N 121.505 -0.747 . . . . 0.0 110.627 179.457 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 67' ' ' ASP . . . . . . . . . . . . . 70.0 m-20 -80.52 -15.75 55.93 Favored 'General case' 0 N--CA 1.497 1.918 0 O-C-N 121.18 -0.95 . . . . 0.0 111.729 -179.7 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 68' ' ' GLY . . . . . . . . . . . . . . . 66.66 16.68 66.0 Favored Glycine 0 N--CA 1.494 2.56 0 N-CA-C 108.731 -1.747 . . . . 0.0 108.731 -178.17 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 69' ' ' SER . . . . . . . . . . . . . 88.7 p -94.22 -34.53 12.85 Favored 'General case' 0 N--CA 1.492 1.66 0 O-C-N 121.674 -0.898 . . . . 0.0 109.984 -179.86 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 70' ' ' GLY . . . . . . . . . . . . . . . 94.87 30.34 8.48 Favored Glycine 0 N--CA 1.499 2.877 0 N-CA-C 110.137 -1.185 . . . . 0.0 110.137 179.962 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 71' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -128.75 134.34 48.39 Favored 'General case' 0 N--CA 1.499 2.025 0 O-C-N 121.516 -0.991 . . . . 0.0 108.64 179.346 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 72' ' ' VAL . . . . . 0.546 ' HB ' ' HB ' ' A' ' 36' ' ' ILE . 74.0 t -75.61 113.66 14.75 Favored 'Isoleucine or valine' 0 N--CA 1.5 2.043 0 O-C-N 121.199 -0.938 . . . . 0.0 111.375 -178.87 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 73' ' ' ASP . . . . . . . . . . . . . 3.5 m-20 -96.9 -174.61 3.03 Favored 'General case' 0 N--CA 1.493 1.721 0 O-C-N 121.724 -0.61 . . . . 0.0 109.423 178.788 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 74' ' ' PHE . . . . . . . . . . . . . 27.6 t80 -72.37 -40.51 67.25 Favored 'General case' 0 N--CA 1.498 1.943 0 O-C-N 120.928 -1.107 . . . . 0.0 109.747 179.729 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 75' ' ' ASP . . . . . . . . . . . . . 3.0 p-10 -67.69 -36.37 80.53 Favored 'General case' 0 N--CA 1.494 1.734 0 O-C-N 121.705 -0.622 . . . . 0.0 109.977 179.251 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 76' ' ' GLU . . . . . . . . . . . . . 7.6 mt-10 -73.12 -41.46 63.99 Favored 'General case' 0 N--CA 1.494 1.763 0 O-C-N 121.485 -0.76 . . . . 0.0 109.826 179.247 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 77' ' ' PHE . . . . . 0.448 ' O ' ' HG2' ' A' ' 81' ' ' MET . 61.3 t80 -57.76 -49.92 74.98 Favored 'General case' 0 N--CA 1.498 1.963 0 O-C-N 121.669 -0.644 . . . . 0.0 110.653 179.803 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 78' ' ' LEU . . . . . . . . . . . . . 46.6 mt -54.42 -45.98 73.1 Favored 'General case' 0 N--CA 1.501 2.079 0 O-C-N 121.363 -0.836 . . . . 0.0 110.372 179.928 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 79' ' ' VAL . . . . . 0.488 HG21 HG23 ' A' ' 9' ' ' VAL . 75.5 t -66.33 -37.99 80.87 Favored 'Isoleucine or valine' 0 N--CA 1.5 2.035 0 O-C-N 121.51 -0.744 . . . . 0.0 109.773 179.196 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 80' ' ' MET . . . . . 0.454 ' HA ' ' HG2' ' A' ' 83' ' ' ARG . 25.8 ttp -65.74 -41.84 91.67 Favored 'General case' 0 N--CA 1.495 1.786 0 O-C-N 121.53 -0.731 . . . . 0.0 110.837 179.93 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 81' ' ' MET . . . . . 0.448 ' HG2' ' O ' ' A' ' 77' ' ' PHE . 22.8 mmm -66.06 -49.87 66.13 Favored 'General case' 0 N--CA 1.497 1.923 0 O-C-N 121.286 -0.884 . . . . 0.0 111.121 -179.351 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 82' ' ' VAL . . . . . 0.402 ' HA ' ' CE ' ' A' ' 85' ' ' MET . 34.9 m -64.4 -35.19 73.59 Favored 'Isoleucine or valine' 0 N--CA 1.503 2.215 0 O-C-N 121.135 -0.978 . . . . 0.0 111.197 -179.418 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 83' ' ' ARG . . . . . 0.476 ' HG3' ' N ' ' A' ' 84' ' ' CYS . 0.0 OUTLIER -79.33 -21.11 46.32 Favored 'General case' 0 N--CA 1.499 1.996 0 O-C-N 121.094 -1.004 . . . . 0.0 110.642 179.564 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' A' A ' 84' ' ' CYS . . . . . 0.476 ' N ' ' HG3' ' A' ' 83' ' ' ARG . 41.3 t -78.72 -25.17 44.58 Favored 'General case' 0 N--CA 1.498 1.967 0 O-C-N 121.103 -0.998 . . . . 0.0 110.614 179.74 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 85' ' ' MET . . . . . 0.402 ' CE ' ' HA ' ' A' ' 82' ' ' VAL . 7.6 mtm -55.77 -53.93 50.57 Favored 'General case' 0 N--CA 1.501 2.111 0 O-C-N 121.449 -0.782 . . . . 0.0 110.988 -179.882 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 86' ' ' LYS . . . . . . . . . . . . . 1.3 tmtm? -145.67 88.84 1.86 Allowed 'General case' 0 N--CA 1.497 1.89 0 O-C-N 121.209 -0.932 . . . . 0.0 110.72 -179.902 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 87' ' ' ASP . . . . . . . . . . . . . 0.6 OUTLIER -101.77 -58.87 1.8 Allowed 'General case' 0 N--CA 1.495 1.823 0 O-C-N 121.316 -0.865 . . . . 0.0 109.808 179.484 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 88' ' ' ASP . . . . . . . . . . . . . 3.9 m-20 -72.79 125.11 26.75 Favored 'General case' 0 N--CA 1.496 1.833 0 O-C-N 121.457 -0.777 . . . . 0.0 109.813 179.344 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 89' ' ' SER . . . . . . . . . . . . . 31.8 m . . . . . 0 N--CA 1.497 1.905 0 CA-C-O 117.94 -1.028 . . . . 0.0 110.365 -179.807 . . . . . . . . 0 0 . 1 . 002 nuclear orig full ' B' B ' 144' ' ' ARG . . . . . . . . . . . . . 10.8 mtt-85 . . . . . 0 N--CA 1.495 1.819 0 CA-C-O 120.887 0.375 . . . . 0.0 110.282 . . . . . . . . . 0 0 . 1 . 002 nuclear orig full ' B' B ' 145' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER 63.18 170.01 0.15 Allowed 'General case' 0 N--CA 1.503 2.194 0 CA-C-O 121.448 0.642 . . . . 0.0 110.908 -179.75 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' B' B ' 146' ' ' VAL . . . . . . . . . . . . . 3.2 p -103.12 153.01 5.76 Favored 'Isoleucine or valine' 0 N--CA 1.495 1.817 0 O-C-N 121.191 -0.943 . . . . 0.0 110.231 179.936 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 147' ' ' ARG . . . . . . . . . . . . . 0.7 OUTLIER -100.79 107.66 19.28 Favored 'General case' 0 N--CA 1.494 1.769 0 O-C-N 121.376 -0.828 . . . . 0.0 110.68 -179.246 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' B' B ' 148' ' ' ILE . . . . . 0.428 HG13 ' HAH' ' A' ' 91' ' ' SXK . 37.1 mm -107.89 -59.43 3.33 Favored 'Isoleucine or valine' 0 N--CA 1.495 1.79 0 O-C-N 121.505 -0.747 . . . . 0.0 109.751 179.479 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' B' B ' 149' ' ' SER . . . . . 0.425 ' HB3' ' HB1' ' B' ' 152' ' ' ALA . 0.1 OUTLIER 64.3 111.85 0.03 OUTLIER 'General case' 0 N--CA 1.504 2.257 0 CA-C-O 121.474 0.654 . . . . 0.0 111.132 179.551 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' B' B ' 150' ' ' ALA . . . . . . . . . . . . . . . -56.89 -41.76 78.64 Favored 'General case' 0 N--CA 1.5 2.045 0 O-C-N 121.298 -0.876 . . . . 0.0 110.283 179.632 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 151' ' ' ASP . . . . . . . . . . . . . 7.9 p-10 -61.56 -38.72 88.51 Favored 'General case' 0 N--CA 1.498 1.944 0 O-C-N 121.505 -0.747 . . . . 0.0 110.444 179.438 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 152' ' ' ALA . . . . . 0.425 ' HB1' ' HB3' ' B' ' 149' ' ' SER . . . -67.02 -48.32 68.76 Favored 'General case' 0 N--CA 1.497 1.886 0 O-C-N 121.312 -0.868 . . . . 0.0 109.703 179.392 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' B' B ' 153' ' ' MET . . . . . 0.512 ' HG3' HD13 ' A' ' 48' ' ' LEU . 1.6 ttt -64.23 -36.85 85.42 Favored 'General case' 0 N--CA 1.498 1.927 0 O-C-N 121.545 -0.722 . . . . 0.0 110.155 179.221 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' B' B ' 154' ' ' MET . . . . . . . . . . . . . 15.8 mtp -58.82 -48.3 81.79 Favored 'General case' 0 N--CA 1.499 1.977 0 O-C-N 121.571 -0.706 . . . . 0.0 110.092 179.449 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 155' ' ' GLN . . . . . . . . . . . . . 19.1 mt-30 -71.97 -33.33 68.07 Favored 'General case' 0 N--CA 1.498 1.95 0 O-C-N 121.479 -0.763 . . . . 0.0 110.387 179.46 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 156' ' ' ALA . . . . . . . . . . . . . . . -62.98 -42.72 99.91 Favored 'General case' 0 N--CA 1.496 1.848 0 O-C-N 121.42 -0.8 . . . . 0.0 110.497 -179.889 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 157' ' ' LEU . . . . . . . . . . . . . 0.8 OUTLIER -86.4 -54.03 4.66 Favored 'General case' 0 N--CA 1.497 1.9 0 O-C-N 121.356 -0.84 . . . . 0.0 110.298 179.803 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' B' B ' 158' ' ' LEU . . . . . . . . . . . . . 4.8 mt -89.87 67.26 7.18 Favored 'General case' 0 N--CA 1.495 1.803 0 O-C-N 121.368 -0.833 . . . . 0.0 109.907 179.751 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 159' ' ' GLY . . . . . . . . . . . . . . . -162.05 -63.27 0.02 OUTLIER Glycine 0 N--CA 1.495 2.572 0 N-CA-C 109.976 -1.25 . . . . 0.0 109.976 179.997 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 160' ' ' ALA . . . . . 0.504 ' O ' ' HB2' ' B' ' 161' ' ' ARG . . . -68.41 103.7 1.71 Allowed 'General case' 0 N--CA 1.496 1.838 0 O-C-N 121.496 -1.002 . . . . 0.0 110.439 -179.78 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' B' B ' 161' ' ' ARG . . . . . 0.504 ' HB2' ' O ' ' B' ' 160' ' ' ALA . 3.7 mtt-85 69.93 -54.27 0.61 Allowed 'General case' 0 N--CA 1.51 2.54 0 O-C-N 122.038 -0.414 . . . . 0.0 111.699 179.911 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' B' B ' 162' ' ' ALA . . . . . . . . . . . . . . . -100.91 115.1 29.62 Favored 'General case' 0 N--CA 1.494 1.751 0 O-C-N 121.029 -1.045 . . . . 0.0 110.119 -179.665 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 163' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.496 1.843 0 CA-C-O 117.853 -1.07 . . . . 0.0 110.948 -179.867 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 90' ' ' ' CA' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 002 nuclear orig full ' A' A ' 91' ' ' SXK . . . . . 0.428 ' HAH' HG13 ' B' ' 148' ' ' ILE . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 8.8 tpt . . . . . 0 N--CA 1.495 1.793 0 CA-C-O 121.231 0.539 . . . . 0.0 110.202 . . . . . . . . . 0 0 . 1 . 003 nuclear orig full ' A' A ' 2' ' ' ASP . . . . . 0.441 ' HB2' ' HB2' ' A' ' 5' ' ' TYR . 8.1 p-10 -170.99 -45.93 0.02 OUTLIER 'General case' 0 N--CA 1.5 2.058 0 O-C-N 121.467 -0.771 . . . . 0.0 110.157 -179.916 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 3' ' ' ASP . . . . . . . . . . . . . 11.8 m-20 55.07 -82.72 0.01 OUTLIER 'General case' 0 N--CA 1.501 2.102 0 N-CA-C 112.447 0.536 . . . . 0.0 112.447 178.889 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 4' ' ' ILE . . . . . 0.493 HG21 ' HA ' ' A' ' 89' ' ' SER . 49.4 mt -51.41 -36.98 18.15 Favored 'Isoleucine or valine' 0 N--CA 1.504 2.252 0 O-C-N 121.349 -0.844 . . . . 0.0 111.899 -179.011 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 5' ' ' TYR . . . . . 0.485 ' CE1' ' HA ' ' A' ' 83' ' ' ARG . 31.7 m-85 -60.53 -32.66 71.68 Favored 'General case' 0 N--CA 1.502 2.147 0 O-C-N 121.053 -1.03 . . . . 0.0 111.246 -179.501 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -62.68 -38.93 92.3 Favored 'General case' 0 N--CA 1.498 1.941 0 O-C-N 121.117 -0.989 . . . . 0.0 109.741 178.811 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 7' ' ' ALA . . . . . . . . . . . . . . . -59.73 -38.49 81.86 Favored 'General case' 0 N--CA 1.497 1.909 0 O-C-N 121.544 -0.722 . . . . 0.0 110.251 179.13 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 8' ' ' ALA . . . . . . . . . . . . . . . -60.34 -33.93 73.11 Favored 'General case' 0 N--CA 1.498 1.928 0 O-C-N 121.364 -0.835 . . . . 0.0 110.308 179.232 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 9' ' ' VAL . . . . . . . . . . . . . 93.3 t -65.96 -34.88 73.22 Favored 'Isoleucine or valine' 0 N--CA 1.5 2.046 0 O-C-N 121.403 -0.81 . . . . 0.0 109.745 179.3 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 10' ' ' GLU . . . . . . . . . . . . . 22.7 mt-10 -62.98 -31.68 72.85 Favored 'General case' 0 N--CA 1.498 1.93 0 O-C-N 121.376 -0.828 . . . . 0.0 109.951 178.951 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 11' ' ' GLN . . . . . . . . . . . . . 1.0 OUTLIER -67.1 -28.63 68.33 Favored 'General case' 0 N--CA 1.499 1.978 0 O-C-N 121.413 -0.804 . . . . 0.0 110.247 179.202 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 12' ' ' LEU . . . . . . . . . . . . . 81.0 mt -77.11 98.56 5.08 Favored 'General case' 0 N--CA 1.496 1.838 0 O-C-N 121.227 -0.92 . . . . 0.0 109.797 179.661 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 13' ' ' THR . . . . . . . . . . . . . 11.6 p -77.31 -176.2 4.04 Favored 'General case' 0 N--CA 1.498 1.964 0 O-C-N 121.438 -0.789 . . . . 0.0 110.874 -179.588 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 14' ' ' GLU . . . . . . . . . . . . . 0.5 OUTLIER -50.54 -36.32 33.72 Favored 'General case' 0 N--CA 1.496 1.828 0 O-C-N 121.734 -0.604 . . . . 0.0 111.299 -178.848 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 1.9 mp0 -60.82 -46.62 89.83 Favored 'General case' 0 N--CA 1.5 2.033 0 O-C-N 121.422 -0.799 . . . . 0.0 109.972 179.516 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 16' ' ' GLN . . . . . . . . . . . . . 1.1 mp0 -75.96 -35.73 59.55 Favored 'General case' 0 N--CA 1.497 1.913 0 O-C-N 121.567 -0.708 . . . . 0.0 109.986 179.208 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 17' ' ' LYS . . . . . 0.498 ' HD3' HD13 ' A' ' 78' ' ' LEU . 14.0 mmtt -62.92 -41.45 99.48 Favored 'General case' 0 N--CA 1.495 1.812 0 O-C-N 121.925 -0.484 . . . . 0.0 109.811 179.271 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 18' ' ' ASN . . . . . . . . . . . . . 9.4 t30 -62.46 -40.46 96.7 Favored 'General case' 0 N--CA 1.496 1.863 0 O-C-N 121.598 -0.689 . . . . 0.0 110.399 179.587 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 19' ' ' GLU . . . . . 0.482 ' HB3' ' HE1' ' B' ' 154' ' ' MET . 4.5 mm-40 -61.0 -42.87 99.28 Favored 'General case' 0 N--CA 1.501 2.085 0 O-C-N 121.438 -0.789 . . . . 0.0 110.129 179.503 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 20' ' ' PHE . . . . . . . . . . . . . 5.7 m-85 -77.41 -36.42 53.33 Favored 'General case' 0 N--CA 1.499 2.008 0 O-C-N 121.326 -0.859 . . . . 0.0 109.978 179.221 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 21' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -57.79 -48.65 79.08 Favored 'General case' 0 N--CA 1.499 1.993 0 O-C-N 121.645 -0.659 . . . . 0.0 110.15 179.408 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 22' ' ' ALA . . . . . . . . . . . . . . . -59.98 -43.97 94.8 Favored 'General case' 0 N--CA 1.497 1.881 0 O-C-N 121.605 -0.685 . . . . 0.0 110.036 179.597 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 23' ' ' ALA . . . . . . . . . . . . . . . -66.67 -35.44 80.17 Favored 'General case' 0 N--CA 1.497 1.902 0 O-C-N 121.334 -0.854 . . . . 0.0 109.142 178.597 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 24' ' ' PHE . . . . . . . . . . . . . 56.5 t80 -62.4 -34.51 76.87 Favored 'General case' 0 N--CA 1.497 1.876 0 O-C-N 121.737 -0.602 . . . . 0.0 110.173 179.029 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 25' ' ' ASP . . . . . . . . . . . . . 16.5 m-20 -58.45 -52.62 64.85 Favored 'General case' 0 N--CA 1.5 2.026 0 O-C-N 121.523 -0.736 . . . . 0.0 110.503 179.675 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 26' ' ' ILE . . . . . . . . . . . . . 3.2 mt -63.38 -37.75 80.36 Favored 'Isoleucine or valine' 0 N--CA 1.498 1.966 0 O-C-N 121.393 -0.817 . . . . 0.0 109.678 179.527 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 27' ' ' PHE . . . . . . . . . . . . . 0.1 OUTLIER -61.62 -34.43 75.65 Favored 'General case' 0 N--CA 1.498 1.932 0 O-C-N 121.603 -0.685 . . . . 0.0 110.672 179.632 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 28' ' ' VAL . . . . . 0.51 ' HB ' ' O ' ' A' ' 34' ' ' GLY . 16.0 m -101.93 -6.39 9.2 Favored 'Isoleucine or valine' 0 N--CA 1.502 2.169 0 O-C-N 121.166 -0.959 . . . . 0.0 111.527 -179.879 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 29' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -52.73 -56.97 11.76 Favored 'General case' 0 N--CA 1.501 2.112 0 O-C-N 121.129 -0.982 . . . . 0.0 110.886 -179.671 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 30' ' ' GLY . . . . . . . . . . . . . . . -105.28 51.4 0.77 Allowed Glycine 0 N--CA 1.494 2.525 0 N-CA-C 108.851 -1.7 . . . . 0.0 108.851 179.381 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 31' ' ' ALA . . . . . 0.587 ' HA ' ' HG2' ' A' ' 40' ' ' GLU . . . -98.17 33.21 2.22 Favored 'General case' 0 N--CA 1.495 1.775 0 O-C-N 121.37 -1.076 . . . . 0.0 111.562 -179.235 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 32' ' ' GLU . . . . . . . . . . . . . 3.7 mt-10 54.07 -86.25 0.01 OUTLIER 'General case' 0 N--CA 1.505 2.303 0 O-C-N 121.614 -0.679 . . . . 0.0 111.395 179.256 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 5.1 p-10 -69.84 -32.7 71.24 Favored 'General case' 0 N--CA 1.497 1.879 0 O-C-N 121.135 -0.978 . . . . 0.0 110.57 179.866 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 34' ' ' GLY . . . . . 0.51 ' O ' ' HB ' ' A' ' 28' ' ' VAL . . . 136.21 -43.7 1.22 Allowed Glycine 0 N--CA 1.495 2.632 0 C-N-CA 119.886 -1.15 . . . . 0.0 110.54 179.335 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 35' ' ' CYS . . . . . . . . . . . . . 94.9 m -86.63 159.5 19.19 Favored 'General case' 0 N--CA 1.499 1.998 0 O-C-N 121.266 -1.137 . . . . 0.0 110.652 -179.686 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 36' ' ' ILE . . . . . 0.422 HG13 HG12 ' A' ' 28' ' ' VAL . 4.7 mt -68.91 112.23 3.55 Favored 'Isoleucine or valine' 0 N--CA 1.499 1.999 0 O-C-N 121.339 -0.851 . . . . 0.0 110.27 -179.82 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 37' ' ' SER . . . . . . . . . . . . . 18.6 t -101.03 -174.61 2.65 Favored 'General case' 0 N--CA 1.495 1.823 0 O-C-N 121.517 -0.739 . . . . 0.0 109.825 179.558 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 38' ' ' THR . . . . . . . . . . . . . 8.3 p -60.55 -53.33 58.8 Favored 'General case' 0 N--CA 1.504 2.239 0 O-C-N 121.345 -0.847 . . . . 0.0 111.303 -179.447 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 39' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -59.14 -39.63 82.99 Favored 'General case' 0 N--CA 1.502 2.153 0 O-C-N 121.422 -0.799 . . . . 0.0 111.512 -179.22 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 40' ' ' GLU . . . . . 0.587 ' HG2' ' HA ' ' A' ' 31' ' ' ALA . 1.1 mp0 -63.09 -46.18 88.6 Favored 'General case' 0 N--CA 1.502 2.127 0 O-C-N 121.064 -1.023 . . . . 0.0 110.346 179.652 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 41' ' ' LEU . . . . . 0.456 HD12 ' HG3' ' A' ' 45' ' ' MET . 0.1 OUTLIER -58.71 -61.02 2.92 Favored 'General case' 0 N--CA 1.499 1.983 0 O-C-N 121.544 -0.723 . . . . 0.0 109.693 179.192 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' A' A ' 42' ' ' GLY . . . . . 0.456 ' CA ' HD12 ' A' ' 57' ' ' LEU . . . -48.99 -33.33 13.32 Favored Glycine 0 N--CA 1.5 2.907 0 N-CA-C 111.036 -0.826 . . . . 0.0 111.036 179.938 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 43' ' ' LYS . . . . . . . . . . . . . 2.4 tmtt? -56.7 -42.36 79.0 Favored 'General case' 0 N--CA 1.504 2.243 0 O-C-N 121.224 -1.162 . . . . 0.0 110.322 179.912 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 44' ' ' VAL . . . . . . . . . . . . . 76.8 t -76.84 -33.84 21.88 Favored 'Isoleucine or valine' 0 N--CA 1.494 1.762 0 O-C-N 121.296 -0.877 . . . . 0.0 109.265 179.191 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 45' ' ' MET . . . . . 0.493 ' SD ' ' HG3' ' A' ' 52' ' ' PRO . 1.2 mtt -57.73 -55.28 36.97 Favored 'General case' 0 N--CA 1.497 1.913 0 O-C-N 121.514 -0.741 . . . . 0.0 109.825 179.103 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 46' ' ' ARG . . . . . . . . . . . . . 15.4 ptp180 -61.45 -34.22 75.05 Favored 'General case' 0 N--CA 1.502 2.163 0 O-C-N 121.343 -0.848 . . . . 0.0 110.279 179.279 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 47' ' ' MET . . . . . 0.416 ' HE3' ' HB3' ' B' ' 161' ' ' ARG . 16.5 ttp -61.31 -32.9 72.76 Favored 'General case' 0 N--CA 1.499 2.007 0 O-C-N 121.281 -0.887 . . . . 0.0 109.388 178.557 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 48' ' ' LEU . . . . . . . . . . . . . 8.2 tp -85.06 -42.46 14.81 Favored 'General case' 0 N--CA 1.492 1.649 0 O-C-N 121.617 -0.677 . . . . 0.0 110.003 179.164 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 49' ' ' GLY . . . . . . . . . . . . . . . 169.9 -65.8 0.17 Allowed Glycine 0 N--CA 1.497 2.705 0 C-N-CA 119.759 -1.21 . . . . 0.0 110.896 179.882 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 50' ' ' GLN . . . . . . . . . . . . . 1.2 mt-30 -59.59 136.52 58.01 Favored 'General case' 0 N--CA 1.504 2.236 0 O-C-N 121.356 -1.085 . . . . 0.0 111.165 -179.03 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 51' ' ' ASN . . . . . . . . . . . . . 2.2 m-80 -118.74 77.98 15.22 Favored Pre-proline 0 N--CA 1.498 1.937 0 O-C-N 121.282 -0.887 . . . . 0.0 110.693 -179.97 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 52' ' ' PRO . . . . . 0.493 ' HG3' ' SD ' ' A' ' 45' ' ' MET . 54.2 Cg_endo -81.94 163.68 18.06 Favored 'Trans proline' 0 C--N 1.313 -1.294 0 O-C-N 123.814 1.428 . . . . 0.0 110.809 179.768 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 53' ' ' THR . . . . . . . . . . . . . 34.2 p -95.25 161.98 26.26 Favored Pre-proline 0 N--CA 1.496 1.854 0 O-C-N 121.325 -0.859 . . . . 0.0 109.826 179.245 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 54' ' ' PRO . . . . . . . . . . . . . 38.9 Cg_endo -65.85 -32.73 45.23 Favored 'Trans proline' 0 C--N 1.312 -1.362 0 O-C-N 123.703 1.37 . . . . 0.0 110.255 179.355 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 55' ' ' GLU . . . . . . . . . . . . . 12.2 mp0 -66.73 -38.47 86.74 Favored 'General case' 0 N--CA 1.496 1.834 0 O-C-N 121.401 -0.812 . . . . 0.0 109.425 178.558 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 0.3 OUTLIER -74.14 -40.78 62.39 Favored 'General case' 0 N--CA 1.495 1.804 0 O-C-N 121.568 -0.707 . . . . 0.0 110.078 179.298 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 57' ' ' LEU . . . . . 0.536 ' HA ' ' HG3' ' A' ' 60' ' ' MET . 6.7 mt -62.39 -20.25 64.26 Favored 'General case' 0 N--CA 1.5 2.037 0 O-C-N 121.259 -0.9 . . . . 0.0 110.93 179.69 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 58' ' ' GLN . . . . . 0.565 ' HG3' ' N ' ' A' ' 59' ' ' GLU . 0.0 OUTLIER -59.81 -37.55 79.47 Favored 'General case' 0 N--CA 1.496 1.865 0 O-C-N 121.05 -1.031 . . . . 0.0 109.095 179.131 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' A' A ' 59' ' ' GLU . . . . . 0.565 ' N ' ' HG3' ' A' ' 58' ' ' GLN . 0.4 OUTLIER -73.56 -35.81 65.53 Favored 'General case' 0 N--CA 1.497 1.879 0 N-CA-C 108.9 -0.778 . . . . 0.0 108.9 178.128 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' A' A ' 60' ' ' MET . . . . . 0.536 ' HG3' ' HA ' ' A' ' 57' ' ' LEU . 1.6 mmm -58.92 -42.64 90.2 Favored 'General case' 0 N--CA 1.497 1.881 0 O-C-N 121.708 -0.62 . . . . 0.0 109.679 179.04 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 61' ' ' ILE . . . . . 0.653 HG23 HG21 ' A' ' 72' ' ' VAL . 3.2 mt -76.86 -42.29 32.87 Favored 'Isoleucine or valine' 0 N--CA 1.497 1.923 0 O-C-N 121.511 -0.743 . . . . 0.0 109.913 179.226 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 62' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -58.9 -31.5 68.67 Favored 'General case' 0 N--CA 1.502 2.141 0 O-C-N 121.438 -0.789 . . . . 0.0 110.909 179.943 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 63' ' ' GLU . . . . . . . . . . . . . 2.7 tt0 -53.54 -34.73 59.27 Favored 'General case' 0 N--CA 1.5 2.035 0 O-C-N 121.7 -0.625 . . . . 0.0 111.099 179.893 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 64' ' ' VAL . . . . . . . . . . . . . 9.8 p -118.46 16.87 7.04 Favored 'Isoleucine or valine' 0 N--CA 1.497 1.888 0 O-C-N 121.25 -0.906 . . . . 0.0 111.16 179.999 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 65' ' ' ASP . . . . . . . . . . . . . 25.7 t70 -92.6 -88.43 0.21 Allowed 'General case' 0 N--CA 1.498 1.934 0 O-C-N 120.902 -1.124 . . . . 0.0 110.091 179.673 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 66' ' ' GLU . . . . . . . . . . . . . 3.3 mt-10 47.84 38.67 9.26 Favored 'General case' 0 N--CA 1.504 2.24 0 O-C-N 121.374 -0.828 . . . . 0.0 111.326 179.654 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 67' ' ' ASP . . . . . . . . . . . . . 0.8 OUTLIER -114.77 -32.74 5.72 Favored 'General case' 0 N--CA 1.5 2.058 0 O-C-N 121.062 -1.024 . . . . 0.0 111.455 -179.774 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 68' ' ' GLY . . . . . . . . . . . . . . . 140.13 -30.87 2.31 Favored Glycine 0 N--CA 1.497 2.703 0 C-N-CA 120.006 -1.092 . . . . 0.0 110.658 179.923 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 69' ' ' SER . . . . . . . . . . . . . 11.4 p -93.55 -29.68 15.38 Favored 'General case' 0 N--CA 1.499 2.006 0 O-C-N 121.189 -1.183 . . . . 0.0 111.847 -179.358 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 70' ' ' GLY . . . . . . . . . . . . . . . 89.2 -42.62 3.03 Favored Glycine 0 N--CA 1.498 2.824 0 C-N-CA 119.614 -1.279 . . . . 0.0 109.919 -179.383 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 71' ' ' THR . . . . . . . . . . . . . 26.7 m -71.41 153.25 42.42 Favored 'General case' 0 N--CA 1.502 2.128 0 O-C-N 121.373 -1.075 . . . . 0.0 110.38 179.966 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 72' ' ' VAL . . . . . 0.653 HG21 HG23 ' A' ' 61' ' ' ILE . 1.7 t -77.22 138.11 21.13 Favored 'Isoleucine or valine' 0 N--CA 1.501 2.11 0 O-C-N 121.29 -0.881 . . . . 0.0 111.016 -179.579 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 73' ' ' ASP . . . . . . . . . . . . . 5.0 m-20 -104.0 -162.0 0.87 Allowed 'General case' 0 N--CA 1.5 2.042 0 O-C-N 121.597 -0.689 . . . . 0.0 109.858 179.291 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 74' ' ' PHE . . . . . . . . . . . . . 16.9 t80 -78.66 -65.21 1.02 Allowed 'General case' 0 N--CA 1.502 2.16 0 O-C-N 120.927 -1.108 . . . . 0.0 110.015 179.642 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 75' ' ' ASP . . . . . . . . . . . . . 0.6 OUTLIER -60.17 -31.43 70.1 Favored 'General case' 0 N--CA 1.498 1.933 0 O-C-N 121.327 -0.858 . . . . 0.0 109.73 179.34 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 76' ' ' GLU . . . . . . . . . . . . . 3.8 tt0 -65.73 -36.37 83.39 Favored 'General case' 0 N--CA 1.498 1.971 0 O-C-N 121.365 -0.834 . . . . 0.0 108.793 178.07 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 77' ' ' PHE . . . . . 0.426 ' O ' ' HG2' ' A' ' 81' ' ' MET . 19.1 t80 -69.97 -37.98 75.94 Favored 'General case' 0 N--CA 1.494 1.732 0 N-CA-C 108.907 -0.775 . . . . 0.0 108.907 178.301 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 78' ' ' LEU . . . . . 0.498 HD13 ' HD3' ' A' ' 17' ' ' LYS . 17.4 mt -58.88 -44.51 91.12 Favored 'General case' 0 N--CA 1.498 1.954 0 O-C-N 121.581 -0.699 . . . . 0.0 110.292 179.308 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 79' ' ' VAL . . . . . 0.427 ' O ' HG13 ' A' ' 82' ' ' VAL . 9.0 p -72.74 -18.88 18.76 Favored 'Isoleucine or valine' 0 N--CA 1.5 2.034 0 O-C-N 121.334 -0.854 . . . . 0.0 110.211 178.803 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 80' ' ' MET . . . . . 0.423 ' N ' HG11 ' A' ' 79' ' ' VAL . 13.6 ttt -76.58 -39.03 53.89 Favored 'General case' 0 N--CA 1.497 1.91 0 O-C-N 121.226 -0.921 . . . . 0.0 109.783 179.035 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 81' ' ' MET . . . . . 0.426 ' HG2' ' O ' ' A' ' 77' ' ' PHE . 55.3 mmm -60.69 -45.64 93.4 Favored 'General case' 0 N--CA 1.497 1.91 0 O-C-N 121.441 -0.787 . . . . 0.0 110.209 179.479 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 82' ' ' VAL . . . . . 0.427 HG13 ' O ' ' A' ' 79' ' ' VAL . 1.8 p -69.91 -30.6 44.93 Favored 'Isoleucine or valine' 0 N--CA 1.496 1.826 0 O-C-N 121.364 -0.835 . . . . 0.0 110.111 179.558 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 83' ' ' ARG . . . . . 0.485 ' HA ' ' CE1' ' A' ' 5' ' ' TYR . 4.0 mtt-85 -65.5 -44.44 87.01 Favored 'General case' 0 N--CA 1.496 1.871 0 O-C-N 121.278 -0.888 . . . . 0.0 109.369 178.811 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 84' ' ' CYS . . . . . . . . . . . . . 23.9 t -72.63 -38.23 67.8 Favored 'General case' 0 N--CA 1.495 1.816 0 O-C-N 121.619 -0.676 . . . . 0.0 109.788 178.795 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 85' ' ' MET . . . . . 0.416 ' O ' ' CB ' ' A' ' 86' ' ' LYS . 4.0 ttm -69.96 -25.48 63.65 Favored 'General case' 0 N--CA 1.498 1.96 0 O-C-N 121.506 -0.746 . . . . 0.0 110.514 179.453 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 86' ' ' LYS . . . . . 0.416 ' CB ' ' O ' ' A' ' 85' ' ' MET . 0.1 OUTLIER 70.44 115.26 0.05 OUTLIER 'General case' 0 N--CA 1.501 2.109 0 CA-C-O 121.525 0.678 . . . . 0.0 110.796 -179.872 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' A' A ' 87' ' ' ASP . . . . . . . . . . . . . 5.3 p-10 -108.7 -163.55 0.88 Allowed 'General case' 0 N--CA 1.495 1.779 0 O-C-N 121.407 -0.808 . . . . 0.0 110.268 179.872 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 88' ' ' ASP . . . . . . . . . . . . . 3.7 m-20 -60.05 -42.58 94.76 Favored 'General case' 0 N--CA 1.499 1.991 0 O-C-N 121.392 -0.818 . . . . 0.0 110.44 179.905 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 89' ' ' SER . . . . . 0.493 ' HA ' HG21 ' A' ' 4' ' ' ILE . 14.8 m . . . . . 0 N--CA 1.502 2.165 0 CA-C-O 118.11 -0.948 . . . . 0.0 110.8 179.916 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 144' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.498 1.958 0 CA-C-O 120.904 0.383 . . . . 0.0 110.596 . . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 145' ' ' ARG . . . . . 0.514 ' HG3' HG21 ' B' ' 146' ' ' VAL . 36.9 tpt85 -132.12 -63.27 0.81 Allowed 'General case' 0 N--CA 1.5 2.038 0 O-C-N 121.306 -0.871 . . . . 0.0 110.438 -179.91 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' B' B ' 146' ' ' VAL . . . . . 0.514 HG21 ' HG3' ' B' ' 145' ' ' ARG . 40.1 t -105.81 156.7 6.57 Favored 'Isoleucine or valine' 0 N--CA 1.5 2.026 0 O-C-N 121.376 -0.828 . . . . 0.0 110.352 -179.789 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' B' B ' 147' ' ' ARG . . . . . . . . . . . . . 0.3 OUTLIER -114.34 -79.16 0.58 Allowed 'General case' 0 N--CA 1.496 1.842 0 O-C-N 121.394 -0.816 . . . . 0.0 110.59 -179.985 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' B' B ' 148' ' ' ILE . . . . . 0.462 HG12 ' HE3' ' A' ' 45' ' ' MET . 1.1 mp 64.56 156.9 0.0 OUTLIER 'Isoleucine or valine' 0 N--CA 1.504 2.263 0 CA-C-O 121.435 0.636 . . . . 0.0 110.481 -179.479 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' B' B ' 149' ' ' SER . . . . . 0.525 ' HB3' ' HB3' ' B' ' 152' ' ' ALA . 0.7 OUTLIER -127.84 144.77 51.08 Favored 'General case' 0 N--CA 1.496 1.826 0 O-C-N 121.111 -0.993 . . . . 0.0 110.443 -179.824 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' B' B ' 150' ' ' ALA . . . . . . . . . . . . . . . -57.72 -45.57 85.58 Favored 'General case' 0 N--CA 1.499 1.993 0 O-C-N 121.577 -0.702 . . . . 0.0 110.742 -179.915 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 151' ' ' ASP . . . . . . . . . . . . . 6.9 p-10 -67.64 -37.53 82.57 Favored 'General case' 0 N--CA 1.499 2.007 0 O-C-N 121.511 -0.743 . . . . 0.0 110.414 179.703 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 152' ' ' ALA . . . . . 0.525 ' HB3' ' HB3' ' B' ' 149' ' ' SER . . . -62.55 -47.56 83.33 Favored 'General case' 0 N--CA 1.498 1.945 0 O-C-N 121.345 -0.847 . . . . 0.0 109.875 179.367 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' B' B ' 153' ' ' MET . . . . . . . . . . . . . 5.1 mtt -66.16 -39.9 90.14 Favored 'General case' 0 N--CA 1.496 1.846 0 O-C-N 121.692 -0.63 . . . . 0.0 110.029 179.254 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 154' ' ' MET . . . . . 0.482 ' HE1' ' HB3' ' A' ' 19' ' ' GLU . 0.3 OUTLIER -63.01 -51.88 65.11 Favored 'General case' 0 N--CA 1.496 1.83 0 O-C-N 121.622 -0.674 . . . . 0.0 110.314 179.815 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' B' B ' 155' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -64.15 -40.95 97.24 Favored 'General case' 0 N--CA 1.497 1.909 0 O-C-N 121.367 -0.833 . . . . 0.0 110.196 179.377 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' B' B ' 156' ' ' ALA . . . . . . . . . . . . . . . -62.43 -37.76 87.08 Favored 'General case' 0 N--CA 1.499 1.993 0 O-C-N 121.349 -0.844 . . . . 0.0 110.514 179.526 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 157' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -89.13 -1.71 58.21 Favored 'General case' 0 N--CA 1.5 2.03 0 O-C-N 121.205 -0.934 . . . . 0.0 111.284 179.722 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' B' B ' 158' ' ' LEU . . . . . . . . . . . . . 1.5 mt -83.69 -53.83 5.36 Favored 'General case' 0 N--CA 1.5 2.037 0 O-C-N 120.943 -1.098 . . . . 0.0 110.541 179.985 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 159' ' ' GLY . . . . . . . . . . . . . . . -168.46 50.05 0.23 Allowed Glycine 0 N--CA 1.498 2.769 0 N-CA-C 110.09 -1.204 . . . . 0.0 110.09 179.875 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 160' ' ' ALA . . . . . . . . . . . . . . . -108.43 -53.07 2.68 Favored 'General case' 0 N--CA 1.496 1.838 0 O-C-N 121.37 -1.077 . . . . 0.0 110.094 179.843 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 161' ' ' ARG . . . . . 0.416 ' HB3' ' HE3' ' A' ' 47' ' ' MET . 0.0 OUTLIER -147.91 93.95 2.27 Favored 'General case' 0 N--CA 1.496 1.861 0 O-C-N 121.402 -0.811 . . . . 0.0 109.78 179.512 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' B' B ' 162' ' ' ALA . . . . . . . . . . . . . . . -74.11 170.01 16.37 Favored 'General case' 0 N--CA 1.498 1.974 0 O-C-N 121.259 -0.901 . . . . 0.0 110.488 -179.834 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 163' ' ' LYS . . . . . . . . . . . . . 0.4 OUTLIER . . . . . 0 N--CA 1.503 2.189 0 CA-C-O 117.636 -1.173 . . . . 0.0 110.643 -179.781 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 90' ' ' ' CA' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 003 nuclear orig full ' A' A ' 91' ' ' SXK . . . . . 0.421 ' HAK' ' CD2' ' A' ' 41' ' ' LEU . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 46.0 mtm . . . . . 0 N--CA 1.495 1.818 0 N-CA-C 110.003 -0.369 . . . . 0.0 110.003 . . . . . . . . . 0 0 . 1 . 004 nuclear orig full ' A' A ' 2' ' ' ASP . . . . . 0.442 ' CG ' ' HD2' ' A' ' 6' ' ' LYS . 5.7 t0 -134.75 149.64 50.47 Favored 'General case' 0 N--CA 1.495 1.787 0 O-C-N 121.451 -0.781 . . . . 0.0 110.654 -179.766 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 3' ' ' ASP . . . . . . . . . . . . . 27.4 t70 -156.09 -63.81 0.11 Allowed 'General case' 0 N--CA 1.495 1.817 0 O-C-N 121.588 -0.695 . . . . 0.0 109.776 179.712 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 4' ' ' ILE . . . . . 0.458 ' CG2' ' HB2' ' A' ' 88' ' ' ASP . 16.7 mt -77.48 -40.5 28.66 Favored 'Isoleucine or valine' 0 N--CA 1.497 1.889 0 O-C-N 121.464 -0.772 . . . . 0.0 110.595 179.902 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 5' ' ' TYR . . . . . 0.424 ' CE1' ' HD3' ' A' ' 83' ' ' ARG . 72.2 m-85 -59.05 -42.97 91.59 Favored 'General case' 0 N--CA 1.5 2.062 0 O-C-N 121.428 -0.795 . . . . 0.0 110.148 -179.919 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 6' ' ' LYS . . . . . 0.442 ' HD2' ' CG ' ' A' ' 2' ' ' ASP . 0.0 OUTLIER -62.52 -41.22 98.71 Favored 'General case' 0 N--CA 1.497 1.921 0 O-C-N 121.363 -0.836 . . . . 0.0 108.995 178.586 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' A' A ' 7' ' ' ALA . . . . . . . . . . . . . . . -63.6 -38.19 90.19 Favored 'General case' 0 N--CA 1.496 1.838 0 O-C-N 121.562 -0.711 . . . . 0.0 109.94 178.752 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 8' ' ' ALA . . . . . . . . . . . . . . . -58.67 -35.08 72.02 Favored 'General case' 0 N--CA 1.499 1.993 0 O-C-N 121.405 -0.809 . . . . 0.0 109.887 179.193 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 9' ' ' VAL . . . . . 0.495 ' HA ' HD13 ' A' ' 12' ' ' LEU . 40.9 t -61.27 -41.59 90.26 Favored 'Isoleucine or valine' 0 N--CA 1.498 1.946 0 O-C-N 121.495 -0.753 . . . . 0.0 109.493 178.908 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 10' ' ' GLU . . . . . . . . . . . . . 10.1 mt-10 -69.37 -26.91 64.9 Favored 'General case' 0 N--CA 1.498 1.972 0 O-C-N 121.55 -0.719 . . . . 0.0 110.224 179.082 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 11' ' ' GLN . . . . . . . . . . . . . 8.9 mt-30 -73.55 -36.2 65.6 Favored 'General case' 0 N--CA 1.499 2.013 0 O-C-N 121.403 -0.811 . . . . 0.0 110.694 179.91 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 12' ' ' LEU . . . . . 0.495 HD13 ' HA ' ' A' ' 9' ' ' VAL . 18.9 mt -58.5 136.75 57.61 Favored 'General case' 0 N--CA 1.496 1.87 0 O-C-N 121.51 -0.744 . . . . 0.0 110.619 -179.673 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 13' ' ' THR . . . . . . . . . . . . . 82.7 p -81.65 171.98 13.97 Favored 'General case' 0 N--CA 1.499 1.977 0 O-C-N 121.348 -0.845 . . . . 0.0 110.359 179.971 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 14' ' ' GLU . . . . . . . . . . . . . 1.0 OUTLIER -57.27 -34.34 68.54 Favored 'General case' 0 N--CA 1.491 1.583 0 O-C-N 121.511 -0.743 . . . . 0.0 109.981 179.84 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 1.4 mp0 -57.7 -55.48 34.32 Favored 'General case' 0 N--CA 1.497 1.885 0 O-C-N 121.652 -0.655 . . . . 0.0 109.745 179.273 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 16' ' ' GLN . . . . . 0.406 ' HA ' ' HB2' ' A' ' 19' ' ' GLU . 1.7 mt-30 -65.6 -37.77 87.57 Favored 'General case' 0 N--CA 1.498 1.967 0 O-C-N 121.494 -0.754 . . . . 0.0 110.178 179.345 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 17' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -58.91 -49.14 78.9 Favored 'General case' 0 N--CA 1.496 1.872 0 N-CA-C 109.333 -0.618 . . . . 0.0 109.333 179.009 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 18' ' ' ASN . . . . . . . . . . . . . 2.1 t30 -71.05 -34.37 71.19 Favored 'General case' 0 N--CA 1.494 1.762 0 O-C-N 121.62 -0.675 . . . . 0.0 109.449 178.861 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 19' ' ' GLU . . . . . 0.625 ' HB3' ' HE3' ' B' ' 154' ' ' MET . 7.7 mt-10 -56.63 -48.03 78.4 Favored 'General case' 0 N--CA 1.5 2.062 0 O-C-N 121.567 -0.708 . . . . 0.0 110.064 178.991 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 20' ' ' PHE . . . . . . . . . . . . . 18.4 m-85 -66.8 -38.24 86.11 Favored 'General case' 0 N--CA 1.498 1.937 0 O-C-N 121.537 -0.727 . . . . 0.0 110.211 179.586 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 21' ' ' LYS . . . . . . . . . . . . . 14.2 tptt -56.7 -53.04 62.32 Favored 'General case' 0 N--CA 1.5 2.074 0 O-C-N 121.455 -0.778 . . . . 0.0 109.895 179.522 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 22' ' ' ALA . . . . . . . . . . . . . . . -60.1 -45.95 91.22 Favored 'General case' 0 N--CA 1.499 1.989 0 O-C-N 121.518 -0.739 . . . . 0.0 110.046 179.513 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 23' ' ' ALA . . . . . . . . . . . . . . . -61.73 -37.56 84.67 Favored 'General case' 0 N--CA 1.496 1.871 0 O-C-N 121.583 -0.698 . . . . 0.0 109.867 179.131 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 24' ' ' PHE . . . . . . . . . . . . . 25.6 t80 -62.72 -45.39 92.96 Favored 'General case' 0 N--CA 1.495 1.823 0 O-C-N 121.565 -0.709 . . . . 0.0 109.971 179.328 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 25' ' ' ASP . . . . . . . . . . . . . 18.7 m-20 -56.37 -43.75 79.47 Favored 'General case' 0 N--CA 1.498 1.962 0 O-C-N 121.562 -0.711 . . . . 0.0 109.973 179.468 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 26' ' ' ILE . . . . . . . . . . . . . 41.0 mt -71.68 -32.24 44.68 Favored 'Isoleucine or valine' 0 N--CA 1.498 1.974 0 O-C-N 121.523 -0.736 . . . . 0.0 109.825 179.14 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 27' ' ' PHE . . . . . 0.417 ' HB3' HG12 ' A' ' 36' ' ' ILE . 0.2 OUTLIER -63.11 -43.56 98.11 Favored 'General case' 0 N--CA 1.498 1.947 0 O-C-N 121.511 -0.743 . . . . 0.0 110.421 179.727 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' A' A ' 28' ' ' VAL . . . . . . . . . . . . . 5.7 p -110.02 63.6 0.17 Allowed 'Isoleucine or valine' 0 N--CA 1.498 1.951 0 O-C-N 121.283 -0.885 . . . . 0.0 110.952 -179.956 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 29' ' ' LEU . . . . . . . . . . . . . 28.0 mt -80.0 77.17 6.7 Favored 'General case' 0 N--CA 1.499 2.007 0 N-CA-C 107.618 -1.253 . . . . 0.0 107.618 177.87 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 30' ' ' GLY . . . . . . . . . . . . . . . 97.48 -55.43 1.23 Allowed Glycine 0 N--CA 1.491 2.337 0 N-CA-C 107.185 -2.366 . . . . 0.0 107.185 -176.963 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 31' ' ' ALA . . . . . . . . . . . . . . . 52.98 -168.69 0.05 OUTLIER 'General case' 0 N--CA 1.5 2.043 0 CA-C-O 121.556 0.693 . . . . 0.0 111.946 178.367 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 32' ' ' GLU . . . . . . . . . . . . . 2.2 mt-10 -104.76 -50.12 3.36 Favored 'General case' 0 N--CA 1.493 1.689 0 O-C-N 121.528 -0.732 . . . . 0.0 110.405 -179.724 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 9.2 m-20 -104.64 -1.92 25.73 Favored 'General case' 0 N--CA 1.499 1.981 0 O-C-N 121.507 -0.745 . . . . 0.0 111.483 -179.382 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 34' ' ' GLY . . . . . . . . . . . . . . . 108.46 -23.58 24.25 Favored Glycine 0 N--CA 1.497 2.705 0 N-CA-C 109.681 -1.367 . . . . 0.0 109.681 -179.391 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 35' ' ' CYS . . . . . . . . . . . . . 1.2 m -110.33 -167.61 1.21 Allowed 'General case' 0 N--CA 1.495 1.786 0 O-C-N 121.477 -1.014 . . . . 0.0 109.464 179.32 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 36' ' ' ILE . . . . . 0.436 ' HB ' ' HB ' ' A' ' 72' ' ' VAL . 2.5 mp -91.84 98.87 8.87 Favored 'Isoleucine or valine' 0 N--CA 1.495 1.795 0 O-C-N 121.023 -1.048 . . . . 0.0 110.168 179.823 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 37' ' ' SER . . . . . . . . . . . . . 10.1 p -94.0 -165.75 1.38 Allowed 'General case' 0 N--CA 1.498 1.935 0 O-C-N 121.396 -0.815 . . . . 0.0 110.132 179.776 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 38' ' ' THR . . . . . . . . . . . . . 17.7 p -58.93 -39.28 81.12 Favored 'General case' 0 N--CA 1.502 2.138 0 O-C-N 121.284 -0.885 . . . . 0.0 110.527 179.727 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 39' ' ' LYS . . . . . . . . . . . . . 32.7 mttt -67.62 -45.82 74.29 Favored 'General case' 0 N--CA 1.499 1.975 0 O-C-N 121.43 -0.794 . . . . 0.0 110.071 179.567 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 2.4 mp0 -65.21 -40.35 94.04 Favored 'General case' 0 N--CA 1.502 2.129 0 O-C-N 121.383 -0.823 . . . . 0.0 109.93 179.408 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 41' ' ' LEU . . . . . 0.439 ' CD2' ' HAK' ' A' ' 91' ' ' SXK . 0.1 OUTLIER -67.68 -59.27 3.46 Favored 'General case' 0 N--CA 1.496 1.843 0 O-C-N 121.556 -0.715 . . . . 0.0 109.645 179.343 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' A' A ' 42' ' ' GLY . . . . . 0.558 ' HA2' ' HB2' ' A' ' 45' ' ' MET . . . -49.53 -33.48 17.79 Favored Glycine 0 N--CA 1.498 2.819 0 N-CA-C 110.527 -1.029 . . . . 0.0 110.527 179.661 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 43' ' ' LYS . . . . . . . . . . . . . 16.0 ttpt -55.12 -37.39 66.84 Favored 'General case' 0 N--CA 1.502 2.142 0 O-C-N 121.294 -1.121 . . . . 0.0 110.514 179.464 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 44' ' ' VAL . . . . . 0.417 ' HA ' ' HE3' ' A' ' 47' ' ' MET . 42.6 t -90.81 -29.92 4.87 Favored 'Isoleucine or valine' 0 N--CA 1.497 1.912 0 O-C-N 121.277 -0.889 . . . . 0.0 109.815 179.165 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 45' ' ' MET . . . . . 0.558 ' HB2' ' HA2' ' A' ' 42' ' ' GLY . 5.4 mmt -57.57 -43.97 84.93 Favored 'General case' 0 N--CA 1.499 2.015 0 O-C-N 121.499 -0.75 . . . . 0.0 111.111 -179.949 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 46' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -53.3 -16.93 1.48 Allowed 'General case' 0 N--CA 1.504 2.261 0 O-C-N 121.35 -0.844 . . . . 0.0 112.298 -179.423 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 47' ' ' MET . . . . . 0.417 ' HE3' ' HA ' ' A' ' 44' ' ' VAL . 42.7 mtt -82.66 -30.39 29.33 Favored 'General case' 0 N--CA 1.499 2.022 0 O-C-N 120.833 -1.167 . . . . 0.0 111.072 179.717 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 48' ' ' LEU . . . . . 0.485 HD21 ' HA ' ' B' ' 148' ' ' ILE . 5.5 tp -143.43 -48.02 0.3 Allowed 'General case' 0 N--CA 1.495 1.786 0 O-C-N 121.134 -0.979 . . . . 0.0 111.453 -179.177 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 49' ' ' GLY . . . . . 0.42 ' O ' ' HB3' ' A' ' 45' ' ' MET . . . -95.11 102.48 2.86 Favored Glycine 0 N--CA 1.494 2.541 0 N-CA-C 110.09 -1.204 . . . . 0.0 110.09 -179.31 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 50' ' ' GLN . . . . . 0.535 ' HG2' ' HA ' ' B' ' 145' ' ' ARG . 0.9 OUTLIER -46.19 143.48 2.36 Favored 'General case' 0 N--CA 1.502 2.165 0 O-C-N 121.768 -0.842 . . . . 0.0 111.756 -179.941 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' A' A ' 51' ' ' ASN . . . . . . . . . . . . . 1.6 p-10 -130.59 92.69 34.14 Favored Pre-proline 0 N--CA 1.499 2.005 0 O-C-N 121.51 -0.744 . . . . 0.0 109.686 179.463 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 52' ' ' PRO . . . . . . . . . . . . . 43.6 Cg_endo -70.1 -38.67 6.75 Favored 'Trans proline' 0 N--CA 1.491 1.368 0 O-C-N 123.762 1.401 . . . . 0.0 111.4 -179.385 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 53' ' ' THR . . . . . 0.434 HG22 ' HB2' ' A' ' 56' ' ' GLU . 0.0 OUTLIER -145.16 153.54 52.99 Favored Pre-proline 0 N--CA 1.498 1.946 0 O-C-N 121.21 -0.931 . . . . 0.0 110.429 -179.862 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' A' A ' 54' ' ' PRO . . . . . . . . . . . . . 42.9 Cg_endo -68.59 -32.76 23.76 Favored 'Trans proline' 0 C--N 1.313 -1.332 0 O-C-N 124.126 1.593 . . . . 0.0 110.46 179.665 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 55' ' ' GLU . . . . . . . . . . . . . 33.7 mm-40 -61.26 -33.75 74.04 Favored 'General case' 0 N--CA 1.497 1.924 0 O-C-N 121.575 -0.703 . . . . 0.0 110.282 179.462 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 56' ' ' GLU . . . . . 0.434 ' HB2' HG22 ' A' ' 53' ' ' THR . 20.4 tt0 -57.06 -44.17 82.79 Favored 'General case' 0 N--CA 1.498 1.933 0 O-C-N 121.508 -0.745 . . . . 0.0 109.592 179.113 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 57' ' ' LEU . . . . . 0.451 ' O ' ' HB2' ' A' ' 60' ' ' MET . 0.8 OUTLIER -77.1 -31.35 55.85 Favored 'General case' 0 N--CA 1.495 1.789 0 O-C-N 121.51 -0.744 . . . . 0.0 109.753 178.954 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' A' A ' 58' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -54.47 -49.94 68.92 Favored 'General case' 0 N--CA 1.496 1.842 0 O-C-N 121.341 -0.849 . . . . 0.0 109.014 179.076 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 59' ' ' GLU . . . . . . . . . . . . . 4.2 mt-10 -65.53 -34.69 78.86 Favored 'General case' 0 N--CA 1.496 1.872 0 O-C-N 121.712 -0.617 . . . . 0.0 109.432 178.16 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 60' ' ' MET . . . . . 0.451 ' HB2' ' O ' ' A' ' 57' ' ' LEU . 2.1 mmm -59.99 -47.05 87.43 Favored 'General case' 0 N--CA 1.498 1.931 0 O-C-N 121.649 -0.657 . . . . 0.0 110.071 179.449 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 61' ' ' ILE . . . . . 0.589 HG12 HG22 ' A' ' 72' ' ' VAL . 59.5 mt -72.79 -42.15 61.48 Favored 'Isoleucine or valine' 0 N--CA 1.498 1.962 0 O-C-N 121.332 -0.855 . . . . 0.0 110.046 179.437 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 62' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -57.58 -31.27 66.01 Favored 'General case' 0 N--CA 1.501 2.079 0 O-C-N 121.299 -0.876 . . . . 0.0 110.219 179.174 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 63' ' ' GLU . . . . . . . . . . . . . 1.3 tt0 -66.16 -33.03 74.85 Favored 'General case' 0 N--CA 1.496 1.841 0 O-C-N 121.183 -0.948 . . . . 0.0 109.471 178.697 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 64' ' ' VAL . . . . . . . . . . . . . 51.4 t -84.14 -37.01 12.59 Favored 'Isoleucine or valine' 0 N--CA 1.495 1.784 0 O-C-N 121.571 -0.706 . . . . 0.0 110.471 179.418 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 65' ' ' ASP . . . . . . . . . . . . . 0.0 OUTLIER -128.2 146.16 50.81 Favored 'General case' 0 N--CA 1.496 1.848 0 O-C-N 121.155 -0.966 . . . . 0.0 111.93 -179.39 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 66' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -139.79 46.29 1.88 Allowed 'General case' 0 N--CA 1.491 1.597 0 N-CA-C 108.301 -1.0 . . . . 0.0 108.301 178.331 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 67' ' ' ASP . . . . . . . . . . . . . 0.9 OUTLIER -104.59 43.8 1.07 Allowed 'General case' 0 N--CA 1.498 1.93 0 O-C-N 121.702 -0.624 . . . . 0.0 111.118 -178.844 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 68' ' ' GLY . . . . . . . . . . . . . . . 56.83 43.61 92.22 Favored Glycine 0 N--CA 1.499 2.895 0 N-CA-C 110.415 -1.074 . . . . 0.0 110.415 179.26 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 69' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -146.44 -52.2 0.23 Allowed 'General case' 0 N--CA 1.496 1.826 0 O-C-N 121.338 -1.096 . . . . 0.0 110.359 179.968 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 70' ' ' GLY . . . . . . . . . . . . . . . 69.31 23.91 76.2 Favored Glycine 0 N--CA 1.497 2.707 0 N-CA-C 109.95 -1.26 . . . . 0.0 109.95 -179.807 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 71' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -123.86 138.65 54.46 Favored 'General case' 0 N--CA 1.499 1.994 0 O-C-N 121.42 -1.047 . . . . 0.0 109.107 179.755 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 72' ' ' VAL . . . . . 0.589 HG22 HG12 ' A' ' 61' ' ' ILE . 26.1 t -76.17 126.67 37.11 Favored 'Isoleucine or valine' 0 N--CA 1.499 1.991 0 O-C-N 121.422 -0.798 . . . . 0.0 111.527 -178.985 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 73' ' ' ASP . . . . . 0.401 ' O ' ' HB2' ' A' ' 77' ' ' PHE . 0.2 OUTLIER -110.47 -168.0 1.26 Allowed 'General case' 0 N--CA 1.496 1.835 0 O-C-N 121.471 -0.768 . . . . 0.0 109.042 178.369 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' A' A ' 74' ' ' PHE . . . . . . . . . . . . . 25.8 t80 -66.66 -45.81 77.74 Favored 'General case' 0 N--CA 1.501 2.094 0 O-C-N 120.825 -1.172 . . . . 0.0 110.857 -179.83 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 75' ' ' ASP . . . . . . . . . . . . . 24.8 t70 -60.46 -53.95 51.37 Favored 'General case' 0 N--CA 1.5 2.039 0 O-C-N 121.405 -0.809 . . . . 0.0 110.482 179.867 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 76' ' ' GLU . . . . . . . . . . . . . 25.0 mt-10 -59.67 -40.66 88.51 Favored 'General case' 0 N--CA 1.499 1.99 0 O-C-N 121.484 -0.76 . . . . 0.0 110.252 179.572 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 77' ' ' PHE . . . . . 0.436 ' O ' ' HG2' ' A' ' 81' ' ' MET . 38.3 t80 -60.86 -41.37 95.75 Favored 'General case' 0 N--CA 1.496 1.853 0 O-C-N 121.472 -0.768 . . . . 0.0 110.317 179.718 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 78' ' ' LEU . . . . . . . . . . . . . 38.1 mt -60.28 -49.59 76.99 Favored 'General case' 0 N--CA 1.497 1.892 0 O-C-N 121.338 -0.851 . . . . 0.0 110.749 -179.849 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 79' ' ' VAL . . . . . 0.406 ' O ' ' HG3' ' A' ' 83' ' ' ARG . 3.5 m -73.45 -32.42 36.68 Favored 'Isoleucine or valine' 0 N--CA 1.501 2.092 0 O-C-N 121.119 -0.988 . . . . 0.0 109.782 179.626 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 80' ' ' MET . . . . . . . . . . . . . 9.6 ttt -59.03 -49.52 77.57 Favored 'General case' 0 N--CA 1.498 1.944 0 O-C-N 121.372 -0.83 . . . . 0.0 109.616 179.215 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 81' ' ' MET . . . . . 0.476 ' HE2' ' HA ' ' B' ' 150' ' ' ALA . 83.8 mmm -62.64 -33.88 75.93 Favored 'General case' 0 N--CA 1.493 1.681 0 O-C-N 121.57 -0.706 . . . . 0.0 109.512 178.88 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 82' ' ' VAL . . . . . . . . . . . . . 3.2 t -66.34 -36.78 78.19 Favored 'Isoleucine or valine' 0 N--CA 1.497 1.893 0 O-C-N 121.6 -0.687 . . . . 0.0 109.985 179.13 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 83' ' ' ARG . . . . . 0.424 ' HD3' ' CE1' ' A' ' 5' ' ' TYR . 9.7 mtm180 -58.75 -39.5 81.12 Favored 'General case' 0 N--CA 1.502 2.136 0 O-C-N 121.431 -0.793 . . . . 0.0 110.328 179.511 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 84' ' ' CYS . . . . . . . . . . . . . 25.8 m -92.52 -15.88 26.46 Favored 'General case' 0 N--CA 1.499 1.992 0 O-C-N 121.367 -0.833 . . . . 0.0 111.118 179.71 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 85' ' ' MET . . . . . . . . . . . . . 30.7 ttp -95.23 -63.34 1.17 Allowed 'General case' 0 N--CA 1.498 1.957 0 O-C-N 121.196 -0.94 . . . . 0.0 110.405 -179.866 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 86' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -158.91 96.73 1.37 Allowed 'General case' 0 N--CA 1.496 1.845 0 O-C-N 121.125 -0.985 . . . . 0.0 110.755 179.99 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 87' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER -99.86 179.7 4.44 Favored 'General case' 0 N--CA 1.495 1.784 0 O-C-N 121.477 -0.765 . . . . 0.0 109.798 179.223 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 88' ' ' ASP . . . . . 0.458 ' HB2' ' CG2' ' A' ' 4' ' ' ILE . 12.5 m-20 -121.3 120.92 36.51 Favored 'General case' 0 N--CA 1.496 1.836 0 O-C-N 121.189 -0.944 . . . . 0.0 110.516 -179.682 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 89' ' ' SER . . . . . . . . . . . . . 27.0 m . . . . . 0 N--CA 1.502 2.16 0 CA-C-O 118.441 -0.79 . . . . 0.0 110.912 179.846 . . . . . . . . 0 0 . 1 . 004 nuclear orig full ' B' B ' 144' ' ' ARG . . . . . . . . . . . . . 0.2 OUTLIER . . . . . 0 N--CA 1.497 1.897 0 CA-C-O 120.799 0.333 . . . . 0.0 110.742 . . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 145' ' ' ARG . . . . . 0.535 ' HA ' ' HG2' ' A' ' 50' ' ' GLN . 2.1 mmp_? -115.23 -150.18 0.46 Allowed 'General case' 0 N--CA 1.497 1.883 0 O-C-N 121.391 -0.818 . . . . 0.0 110.122 -179.79 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' B' B ' 146' ' ' VAL . . . . . . . . . . . . . 4.8 p -93.96 31.15 0.21 Allowed 'Isoleucine or valine' 0 N--CA 1.501 2.08 0 O-C-N 120.964 -1.085 . . . . 0.0 111.695 -179.274 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 147' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -96.89 86.03 3.92 Favored 'General case' 0 N--CA 1.497 1.885 0 O-C-N 120.783 -1.198 . . . . 0.0 109.84 179.264 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' B' B ' 148' ' ' ILE . . . . . 0.485 ' HA ' HD21 ' A' ' 48' ' ' LEU . 2.5 mp -92.79 119.76 40.99 Favored 'Isoleucine or valine' 0 N--CA 1.497 1.883 0 O-C-N 121.316 -0.865 . . . . 0.0 110.243 -179.683 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' B' B ' 149' ' ' SER . . . . . 0.406 ' HB3' ' HB2' ' B' ' 152' ' ' ALA . 13.3 t -100.28 149.89 23.13 Favored 'General case' 0 N--CA 1.497 1.881 0 O-C-N 121.521 -0.737 . . . . 0.0 110.103 179.551 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' B' B ' 150' ' ' ALA . . . . . 0.476 ' HA ' ' HE2' ' A' ' 81' ' ' MET . . . -59.03 -40.13 84.07 Favored 'General case' 0 N--CA 1.499 2.017 0 O-C-N 121.442 -0.786 . . . . 0.0 110.721 179.926 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' B' B ' 151' ' ' ASP . . . . . . . . . . . . . 16.9 t70 -75.76 -49.33 18.49 Favored 'General case' 0 N--CA 1.497 1.88 0 O-C-N 121.318 -0.864 . . . . 0.0 110.256 179.648 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 152' ' ' ALA . . . . . 0.406 ' HB2' ' HB3' ' B' ' 149' ' ' SER . . . -58.58 -44.91 89.95 Favored 'General case' 0 N--CA 1.498 1.966 0 O-C-N 121.502 -0.749 . . . . 0.0 110.57 179.896 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' B' B ' 153' ' ' MET . . . . . 0.478 ' HE1' HG23 ' B' ' 148' ' ' ILE . 0.2 OUTLIER -65.83 -37.95 87.59 Favored 'General case' 0 N--CA 1.498 1.97 0 O-C-N 121.299 -0.876 . . . . 0.0 109.789 179.312 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' B' B ' 154' ' ' MET . . . . . 0.625 ' HE3' ' HB3' ' A' ' 19' ' ' GLU . 19.9 mmm -61.86 -42.27 98.85 Favored 'General case' 0 N--CA 1.497 1.915 0 O-C-N 121.454 -0.779 . . . . 0.0 109.635 178.862 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' B' B ' 155' ' ' GLN . . . . . . . . . . . . . 18.2 tt0 -67.02 -35.72 80.52 Favored 'General case' 0 N--CA 1.497 1.91 0 O-C-N 121.546 -0.721 . . . . 0.0 109.998 178.979 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 156' ' ' ALA . . . . . 0.511 ' HA ' ' HB1' ' B' ' 160' ' ' ALA . . . -67.72 -42.41 82.0 Favored 'General case' 0 N--CA 1.496 1.835 0 O-C-N 121.496 -0.753 . . . . 0.0 110.121 179.538 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' B' B ' 157' ' ' LEU . . . . . . . . . . . . . 2.4 mt -57.43 -33.76 68.25 Favored 'General case' 0 N--CA 1.499 1.981 0 O-C-N 121.615 -0.678 . . . . 0.0 111.031 179.705 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 158' ' ' LEU . . . . . . . . . . . . . 0.8 OUTLIER -127.45 58.92 1.45 Allowed 'General case' 0 N--CA 1.495 1.824 0 O-C-N 121.377 -0.827 . . . . 0.0 110.793 -179.592 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' B' B ' 159' ' ' GLY . . . . . . . . . . . . . . . 173.59 -52.93 0.15 Allowed Glycine 0 N--CA 1.498 2.786 0 C-N-CA 119.812 -1.185 . . . . 0.0 110.748 179.655 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 160' ' ' ALA . . . . . 0.511 ' HB1' ' HA ' ' B' ' 156' ' ' ALA . . . -59.59 -54.31 47.98 Favored 'General case' 0 N--CA 1.502 2.144 0 O-C-N 121.398 -1.06 . . . . 0.0 110.868 -179.394 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' B' B ' 161' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -135.59 39.5 2.83 Favored 'General case' 0 N--CA 1.495 1.797 0 O-C-N 121.356 -0.84 . . . . 0.0 110.147 -179.895 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' B' B ' 162' ' ' ALA . . . . . . . . . . . . . . . -156.23 96.94 1.74 Allowed 'General case' 0 N--CA 1.496 1.849 0 O-C-N 121.323 -0.861 . . . . 0.0 110.248 -179.873 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 163' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.497 1.91 0 CA-C-O 117.838 -1.077 . . . . 0.0 110.798 179.924 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 90' ' ' ' CA' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 004 nuclear orig full ' A' A ' 91' ' ' SXK . . . . . 0.439 ' HAK' ' CD2' ' A' ' 41' ' ' LEU . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.495 1.823 0 CA-C-O 120.586 0.232 . . . . 0.0 110.401 . . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 2' ' ' ASP . . . . . . . . . . . . . 23.8 t70 58.99 -82.17 0.02 OUTLIER 'General case' 0 N--CA 1.505 2.295 0 O-C-N 121.992 -0.443 . . . . 0.0 111.631 179.668 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 3' ' ' ASP . . . . . . . . . . . . . 8.8 m-20 -57.03 -32.55 66.29 Favored 'General case' 0 N--CA 1.499 2.022 0 O-C-N 121.273 -0.892 . . . . 0.0 111.218 -179.489 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 4' ' ' ILE . . . . . . . . . . . . . 6.1 tp -56.21 -41.79 71.18 Favored 'Isoleucine or valine' 0 N--CA 1.499 2.008 0 O-C-N 121.291 -0.88 . . . . 0.0 110.516 -179.89 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 5' ' ' TYR . . . . . . . . . . . . . 42.1 m-85 -83.82 -32.15 25.47 Favored 'General case' 0 N--CA 1.496 1.868 0 O-C-N 121.33 -0.856 . . . . 0.0 109.289 178.596 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 3.4 ttmt -59.73 -45.73 91.3 Favored 'General case' 0 N--CA 1.499 2.001 0 O-C-N 121.716 -0.615 . . . . 0.0 110.382 179.548 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 7' ' ' ALA . . . . . . . . . . . . . . . -54.25 -42.75 70.28 Favored 'General case' 0 N--CA 1.498 1.949 0 O-C-N 121.666 -0.646 . . . . 0.0 110.113 179.695 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 8' ' ' ALA . . . . . . . . . . . . . . . -66.32 -39.74 89.46 Favored 'General case' 0 N--CA 1.497 1.887 0 O-C-N 121.552 -0.717 . . . . 0.0 110.358 179.374 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 9' ' ' VAL . . . . . 0.501 HG23 ' HA ' ' A' ' 79' ' ' VAL . 97.7 t -60.89 -41.52 89.13 Favored 'Isoleucine or valine' 0 N--CA 1.502 2.165 0 O-C-N 121.474 -0.766 . . . . 0.0 110.447 179.834 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 10' ' ' GLU . . . . . . . . . . . . . 17.9 mt-10 -79.86 -44.13 21.04 Favored 'General case' 0 N--CA 1.495 1.808 0 O-C-N 121.495 -0.753 . . . . 0.0 111.02 -179.641 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 11' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -89.64 39.15 0.94 Allowed 'General case' 0 N--CA 1.499 1.996 0 O-C-N 121.289 -0.882 . . . . 0.0 111.49 -179.532 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 12' ' ' LEU . . . . . 0.494 ' HB3' ' HD3' ' A' ' 17' ' ' LYS . 0.8 OUTLIER -78.65 138.71 38.44 Favored 'General case' 0 N--CA 1.497 1.899 0 O-C-N 120.916 -1.115 . . . . 0.0 109.783 179.165 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' A' A ' 13' ' ' THR . . . . . 0.506 HG23 ' HB2' ' A' ' 15' ' ' GLU . 14.9 t -69.66 164.15 24.02 Favored 'General case' 0 N--CA 1.501 2.079 0 O-C-N 121.264 -0.897 . . . . 0.0 111.396 -179.567 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 14' ' ' GLU . . . . . . . . . . . . . 17.7 tt0 -62.35 -35.89 80.52 Favored 'General case' 0 N--CA 1.495 1.8 0 O-C-N 121.844 -0.535 . . . . 0.0 110.897 -179.422 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 15' ' ' GLU . . . . . 0.506 ' HB2' HG23 ' A' ' 13' ' ' THR . 1.3 mp0 -56.89 -41.71 78.55 Favored 'General case' 0 N--CA 1.499 2.024 0 O-C-N 121.415 -0.803 . . . . 0.0 110.776 -179.838 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 16' ' ' GLN . . . . . . . . . . . . . 81.0 mt-30 -86.35 -44.94 11.67 Favored 'General case' 0 N--CA 1.497 1.907 0 O-C-N 121.333 -0.854 . . . . 0.0 110.796 -179.946 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 17' ' ' LYS . . . . . 0.494 ' HD3' ' HB3' ' A' ' 12' ' ' LEU . 0.2 OUTLIER -59.78 -47.21 86.58 Favored 'General case' 0 N--CA 1.5 2.031 0 O-C-N 121.81 -0.556 . . . . 0.0 110.611 -179.889 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' A' A ' 18' ' ' ASN . . . . . 0.571 ' HA ' ' HG2' ' A' ' 21' ' ' LYS . 32.5 t30 -67.72 -29.49 68.74 Favored 'General case' 0 N--CA 1.495 1.799 0 O-C-N 121.461 -0.775 . . . . 0.0 110.447 179.593 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 12.7 tt0 -73.65 -43.43 59.5 Favored 'General case' 0 N--CA 1.492 1.669 0 O-C-N 121.237 -0.915 . . . . 0.0 109.876 179.444 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 20' ' ' PHE . . . . . . . . . . . . . 16.9 m-85 -73.59 -35.74 65.44 Favored 'General case' 0 N--CA 1.498 1.925 0 O-C-N 121.354 -0.841 . . . . 0.0 110.784 179.869 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 21' ' ' LYS . . . . . 0.571 ' HG2' ' HA ' ' A' ' 18' ' ' ASN . 0.0 OUTLIER -64.13 -30.86 71.9 Favored 'General case' 0 N--CA 1.496 1.868 0 O-C-N 121.14 -0.975 . . . . 0.0 110.207 179.546 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' A' A ' 22' ' ' ALA . . . . . 0.522 ' N ' ' HG3' ' A' ' 21' ' ' LYS . . . -77.15 -31.69 55.76 Favored 'General case' 0 N--CA 1.5 2.034 0 O-C-N 121.401 -0.812 . . . . 0.0 109.603 178.701 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 23' ' ' ALA . . . . . . . . . . . . . . . -85.73 -8.69 58.01 Favored 'General case' 0 N--CA 1.494 1.773 0 O-C-N 121.416 -0.803 . . . . 0.0 110.328 178.96 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 24' ' ' PHE . . . . . . . . . . . . . 73.1 t80 -88.07 -52.05 5.46 Favored 'General case' 0 N--CA 1.494 1.773 0 O-C-N 121.179 -0.951 . . . . 0.0 110.382 -179.823 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 25' ' ' ASP . . . . . . . . . . . . . 3.1 p-10 -60.71 -36.18 78.16 Favored 'General case' 0 N--CA 1.501 2.077 0 O-C-N 121.26 -0.9 . . . . 0.0 110.348 179.85 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 26' ' ' ILE . . . . . . . . . . . . . 81.9 mt -70.1 -34.55 59.77 Favored 'Isoleucine or valine' 0 N--CA 1.5 2.039 0 O-C-N 121.063 -1.023 . . . . 0.0 109.34 178.669 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 27' ' ' PHE . . . . . 0.437 ' CD2' HD11 ' B' ' 157' ' ' LEU . 0.3 OUTLIER -62.09 -43.86 97.91 Favored 'General case' 0 N--CA 1.497 1.888 0 O-C-N 121.463 -0.773 . . . . 0.0 110.248 179.244 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' A' A ' 28' ' ' VAL . . . . . . . . . . . . . 32.6 m -84.9 43.67 0.06 OUTLIER 'Isoleucine or valine' 0 N--CA 1.5 2.051 0 O-C-N 121.503 -0.748 . . . . 0.0 111.443 -179.675 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 29' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -63.11 -55.12 27.98 Favored 'General case' 0 N--CA 1.499 2.02 0 O-C-N 121.019 -1.05 . . . . 0.0 109.718 179.161 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 30' ' ' GLY . . . . . . . . . . . . . . . -103.1 52.89 0.77 Allowed Glycine 0 N--CA 1.497 2.721 0 N-CA-C 108.601 -1.8 . . . . 0.0 108.601 178.787 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 31' ' ' ALA . . . . . 0.522 ' O ' ' HB2' ' A' ' 32' ' ' GLU . . . -102.93 -23.49 13.73 Favored 'General case' 0 N--CA 1.496 1.847 0 O-C-N 121.632 -0.922 . . . . 0.0 111.172 -179.269 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 32' ' ' GLU . . . . . 0.522 ' HB2' ' O ' ' A' ' 31' ' ' ALA . 1.5 mp0 65.84 -68.22 0.13 Allowed 'General case' 0 N--CA 1.505 2.301 0 O-C-N 121.848 -0.533 . . . . 0.0 110.891 -179.674 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 1.6 m-20 -62.16 -38.74 90.16 Favored 'General case' 0 N--CA 1.497 1.922 0 O-C-N 121.264 -0.897 . . . . 0.0 110.553 179.723 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 34' ' ' GLY . . . . . . . . . . . . . . . 118.45 -24.58 8.53 Favored Glycine 0 N--CA 1.496 2.693 0 N-CA-C 110.391 -1.084 . . . . 0.0 110.391 179.858 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 35' ' ' CYS . . . . . . . . . . . . . 99.6 m -88.8 152.52 21.72 Favored 'General case' 0 N--CA 1.499 2.001 0 O-C-N 121.252 -1.146 . . . . 0.0 110.524 -179.797 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 36' ' ' ILE . . . . . . . . . . . . . 66.8 mt -67.07 128.57 30.52 Favored 'Isoleucine or valine' 0 N--CA 1.502 2.152 0 O-C-N 121.323 -0.861 . . . . 0.0 110.462 -179.841 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 37' ' ' SER . . . . . . . . . . . . . 9.1 t -103.81 171.25 7.46 Favored 'General case' 0 N--CA 1.498 1.932 0 O-C-N 121.665 -0.647 . . . . 0.0 110.535 179.812 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 38' ' ' THR . . . . . 0.506 HG22 ' HG2' ' A' ' 58' ' ' GLN . 68.9 p -67.94 -48.75 65.06 Favored 'General case' 0 N--CA 1.502 2.143 0 O-C-N 121.278 -0.889 . . . . 0.0 110.4 -179.983 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 39' ' ' LYS . . . . . . . . . . . . . 0.7 OUTLIER -61.2 -37.97 84.89 Favored 'General case' 0 N--CA 1.5 2.063 0 O-C-N 121.295 -0.878 . . . . 0.0 109.316 178.98 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 12.9 tt0 -63.97 -46.52 84.26 Favored 'General case' 0 N--CA 1.495 1.802 0 CA-C-O 121.305 0.574 . . . . 0.0 109.479 178.874 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 41' ' ' LEU . . . . . 0.486 ' CD2' ' HAK' ' A' ' 91' ' ' SXK . 0.1 OUTLIER -65.56 -58.02 6.79 Favored 'General case' 0 N--CA 1.494 1.763 0 O-C-N 121.634 -0.666 . . . . 0.0 109.275 178.798 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' A' A ' 42' ' ' GLY . . . . . 0.4 ' O ' ' HB2' ' A' ' 45' ' ' MET . . . -47.27 -33.08 7.42 Favored Glycine 0 N--CA 1.502 3.057 0 N-CA-C 111.259 -0.737 . . . . 0.0 111.259 179.985 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 43' ' ' LYS . . . . . . . . . . . . . 1.8 tmtm? -58.98 -36.6 75.15 Favored 'General case' 0 N--CA 1.502 2.129 0 O-C-N 121.063 -1.257 . . . . 0.0 110.232 179.573 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 44' ' ' VAL . . . . . . . . . . . . . 93.9 t -85.05 -22.06 7.71 Favored 'Isoleucine or valine' 0 N--CA 1.498 1.961 0 O-C-N 121.499 -0.751 . . . . 0.0 109.911 179.335 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 45' ' ' MET . . . . . 0.4 ' HB2' ' O ' ' A' ' 42' ' ' GLY . 6.4 mmt -56.52 -36.9 69.73 Favored 'General case' 0 N--CA 1.499 2.02 0 O-C-N 121.262 -0.899 . . . . 0.0 110.326 179.35 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 46' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -62.21 -33.34 74.37 Favored 'General case' 0 N--CA 1.5 2.036 0 O-C-N 121.326 -0.858 . . . . 0.0 110.298 179.207 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 47' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -63.22 -32.28 73.64 Favored 'General case' 0 N--CA 1.501 2.102 0 O-C-N 121.342 -0.849 . . . . 0.0 110.141 179.332 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 48' ' ' LEU . . . . . . . . . . . . . 8.0 mt -93.2 -43.51 8.8 Favored 'General case' 0 N--CA 1.496 1.855 0 O-C-N 121.405 -0.81 . . . . 0.0 109.631 179.347 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 49' ' ' GLY . . . . . . . . . . . . . . . -143.73 -101.6 0.37 Allowed Glycine 0 N--CA 1.493 2.456 0 N-CA-C 109.082 -1.607 . . . . 0.0 109.082 179.557 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 50' ' ' GLN . . . . . . . . . . . . . 12.8 mt-30 -147.21 170.17 17.81 Favored 'General case' 0 N--CA 1.496 1.872 0 O-C-N 121.403 -1.057 . . . . 0.0 110.54 179.83 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 51' ' ' ASN . . . . . . . . . . . . . 44.7 t30 -138.79 104.76 7.49 Favored Pre-proline 0 N--CA 1.495 1.817 0 O-C-N 121.489 -0.757 . . . . 0.0 109.876 179.894 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 52' ' ' PRO . . . . . . . . . . . . . 48.9 Cg_endo -77.94 -50.74 0.08 OUTLIER 'Trans proline' 0 C--N 1.314 -1.267 0 O-C-N 123.771 1.406 . . . . 0.0 111.108 -179.614 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 53' ' ' THR . . . . . 0.487 ' OG1' ' HD2' ' A' ' 54' ' ' PRO . 0.1 OUTLIER -156.89 159.16 31.45 Favored Pre-proline 0 N--CA 1.498 1.931 0 O-C-N 121.142 -0.974 . . . . 0.0 110.739 -179.448 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' A' A ' 54' ' ' PRO . . . . . 0.487 ' HD2' ' OG1' ' A' ' 53' ' ' THR . 42.5 Cg_endo -67.12 -24.57 44.56 Favored 'Trans proline' 0 N--CA 1.49 1.296 0 O-C-N 123.932 1.49 . . . . 0.0 110.69 179.246 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 55' ' ' GLU . . . . . . . . . . . . . 0.9 OUTLIER -59.31 -36.5 75.74 Favored 'General case' 0 N--CA 1.498 1.958 0 O-C-N 121.319 -0.863 . . . . 0.0 109.971 179.178 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 1.2 mm-40 -59.85 -42.93 94.69 Favored 'General case' 0 N--CA 1.497 1.882 0 O-C-N 121.502 -0.749 . . . . 0.0 109.808 179.103 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 57' ' ' LEU . . . . . 0.469 ' HA ' ' HB2' ' A' ' 60' ' ' MET . 2.6 mm? -74.05 -28.89 61.63 Favored 'General case' 0 N--CA 1.494 1.761 0 O-C-N 121.367 -0.833 . . . . 0.0 109.769 178.988 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 58' ' ' GLN . . . . . 0.506 ' HG2' HG22 ' A' ' 38' ' ' THR . 0.0 OUTLIER -54.83 -53.36 56.24 Favored 'General case' 0 N--CA 1.5 2.027 0 O-C-N 121.28 -0.887 . . . . 0.0 109.056 179.127 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' A' A ' 59' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER -61.17 -33.71 73.87 Favored 'General case' 0 N--CA 1.495 1.804 0 N-CA-C 108.848 -0.797 . . . . 0.0 108.848 177.966 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 60' ' ' MET . . . . . 0.469 ' HB2' ' HA ' ' A' ' 57' ' ' LEU . 0.0 OUTLIER -64.65 -37.91 89.2 Favored 'General case' 0 N--CA 1.496 1.838 0 O-C-N 121.753 -0.592 . . . . 0.0 110.052 178.752 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' A' A ' 61' ' ' ILE . . . . . 0.502 HG13 HG22 ' A' ' 72' ' ' VAL . 1.0 OUTLIER -74.57 -43.84 47.79 Favored 'Isoleucine or valine' 0 N--CA 1.496 1.835 0 O-C-N 121.308 -0.87 . . . . 0.0 109.573 179.375 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' A' A ' 62' ' ' ASP . . . . . 0.411 ' N ' ' CG2' ' A' ' 61' ' ' ILE . 2.6 m-20 -55.6 -31.67 62.44 Favored 'General case' 0 N--CA 1.5 2.06 0 O-C-N 121.262 -0.899 . . . . 0.0 109.902 178.874 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 63' ' ' GLU . . . . . . . . . . . . . 7.4 tt0 -59.74 -35.07 73.82 Favored 'General case' 0 N--CA 1.497 1.92 0 O-C-N 121.737 -0.602 . . . . 0.0 110.672 179.226 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 64' ' ' VAL . . . . . . . . . . . . . 9.9 p -124.11 23.38 3.87 Favored 'Isoleucine or valine' 0 N--CA 1.497 1.885 0 O-C-N 121.216 -0.927 . . . . 0.0 110.842 -179.75 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 65' ' ' ASP . . . . . . . . . . . . . 8.5 t70 -131.36 -82.44 0.52 Allowed 'General case' 0 N--CA 1.497 1.909 0 O-C-N 121.172 -0.955 . . . . 0.0 109.654 -179.918 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 66' ' ' GLU . . . . . . . . . . . . . 0.3 OUTLIER 40.81 48.46 2.71 Favored 'General case' 0 N--CA 1.505 2.315 0 O-C-N 121.42 -0.8 . . . . 0.0 112.366 178.734 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 67' ' ' ASP . . . . . . . . . . . . . 4.3 p-10 -117.46 7.39 12.73 Favored 'General case' 0 N--CA 1.501 2.08 0 O-C-N 120.982 -1.074 . . . . 0.0 111.079 179.532 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 68' ' ' GLY . . . . . . . . . . . . . . . 96.3 -5.46 65.35 Favored Glycine 0 N--CA 1.497 2.764 0 N-CA-C 110.521 -1.032 . . . . 0.0 110.521 -179.856 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 69' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -106.07 -43.82 4.74 Favored 'General case' 0 N--CA 1.496 1.838 0 O-C-N 121.049 -1.265 . . . . 0.0 110.496 -179.825 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 70' ' ' GLY . . . . . . . . . . . . . . . 78.78 19.84 72.25 Favored Glycine 0 N--CA 1.497 2.758 0 N-CA-C 109.527 -1.429 . . . . 0.0 109.527 -179.472 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 71' ' ' THR . . . . . . . . . . . . . 0.1 OUTLIER -132.22 124.01 28.11 Favored 'General case' 0 N--CA 1.492 1.643 0 O-C-N 121.601 -0.941 . . . . 0.0 108.652 -179.761 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 72' ' ' VAL . . . . . 0.502 HG22 HG13 ' A' ' 61' ' ' ILE . 4.9 t -75.59 124.54 33.79 Favored 'Isoleucine or valine' 0 N--CA 1.496 1.844 0 O-C-N 121.448 -0.783 . . . . 0.0 111.008 -178.68 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 73' ' ' ASP . . . . . . . . . . . . . 18.0 t70 -95.6 -176.84 3.87 Favored 'General case' 0 N--CA 1.495 1.791 0 O-C-N 121.673 -0.642 . . . . 0.0 109.399 179.145 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 74' ' ' PHE . . . . . . . . . . . . . 28.6 t80 -60.07 -44.62 94.63 Favored 'General case' 0 N--CA 1.498 1.945 0 O-C-N 120.957 -1.09 . . . . 0.0 109.784 179.61 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 75' ' ' ASP . . . . . . . . . . . . . 31.4 t70 -62.71 -48.03 81.02 Favored 'General case' 0 N--CA 1.496 1.864 0 O-C-N 121.543 -0.723 . . . . 0.0 110.287 179.32 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 76' ' ' GLU . . . . . . . . . . . . . 54.0 mt-10 -66.92 -32.67 74.07 Favored 'General case' 0 N--CA 1.498 1.933 0 O-C-N 121.444 -0.785 . . . . 0.0 109.656 179.342 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 77' ' ' PHE . . . . . . . . . . . . . 68.3 t80 -60.74 -39.16 87.64 Favored 'General case' 0 N--CA 1.493 1.708 0 O-C-N 121.513 -0.742 . . . . 0.0 109.44 178.642 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 78' ' ' LEU . . . . . . . . . . . . . 88.9 mt -63.77 -37.94 89.26 Favored 'General case' 0 N--CA 1.498 1.942 0 O-C-N 121.432 -0.792 . . . . 0.0 109.46 178.736 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 79' ' ' VAL . . . . . 0.501 ' HA ' HG23 ' A' ' 9' ' ' VAL . 85.0 t -64.17 -34.74 70.81 Favored 'Isoleucine or valine' 0 N--CA 1.499 2.014 0 O-C-N 121.36 -0.838 . . . . 0.0 109.13 178.405 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 80' ' ' MET . . . . . . . . . . . . . 1.5 ttt -67.88 -39.48 83.69 Favored 'General case' 0 N--CA 1.496 1.842 0 O-C-N 121.552 -0.718 . . . . 0.0 109.53 178.835 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 81' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -65.95 -50.23 65.12 Favored 'General case' 0 N--CA 1.497 1.913 0 O-C-N 121.562 -0.711 . . . . 0.0 110.684 179.702 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 82' ' ' VAL . . . . . 0.495 ' HA ' ' HE1' ' A' ' 85' ' ' MET . 9.4 p -62.19 -30.02 47.9 Favored 'Isoleucine or valine' 0 N--CA 1.5 2.035 0 O-C-N 121.25 -0.906 . . . . 0.0 110.189 179.774 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 83' ' ' ARG . . . . . . . . . . . . . 3.2 mtp-105 -69.24 -46.48 67.21 Favored 'General case' 0 N--CA 1.495 1.78 0 O-C-N 121.354 -0.842 . . . . 0.0 109.392 178.724 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 84' ' ' CYS . . . . . . . . . . . . . 88.6 m -66.92 -32.78 74.27 Favored 'General case' 0 N--CA 1.497 1.906 0 O-C-N 121.61 -0.681 . . . . 0.0 110.155 179.254 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 85' ' ' MET . . . . . 0.495 ' HE1' ' HA ' ' A' ' 82' ' ' VAL . 32.2 mtm -67.23 -31.3 71.56 Favored 'General case' 0 N--CA 1.5 2.033 0 O-C-N 121.453 -0.779 . . . . 0.0 110.249 179.216 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 86' ' ' LYS . . . . . . . . . . . . . 4.9 tptp 58.95 58.56 3.13 Favored 'General case' 0 N--CA 1.5 2.07 0 O-C-N 121.72 -0.613 . . . . 0.0 110.878 179.962 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 87' ' ' ASP . . . . . . . . . . . . . 15.6 m-20 54.3 -153.22 0.3 Allowed 'General case' 0 N--CA 1.502 2.166 0 O-C-N 121.691 -0.631 . . . . 0.0 111.205 179.206 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 88' ' ' ASP . . . . . . . . . . . . . 7.6 p-10 -152.65 -40.12 0.1 Allowed 'General case' 0 N--CA 1.499 1.987 0 O-C-N 121.373 -0.829 . . . . 0.0 110.909 -179.698 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 89' ' ' SER . . . . . . . . . . . . . 3.2 t . . . . . 0 N--CA 1.497 1.876 0 CA-C-O 117.813 -1.089 . . . . 0.0 110.678 179.974 . . . . . . . . 0 0 . 1 . 005 nuclear orig full ' B' B ' 144' ' ' ARG . . . . . . . . . . . . . 1.3 ttt-85 . . . . . 0 N--CA 1.494 1.758 0 CA-C-O 121.118 0.485 . . . . 0.0 110.121 . . . . . . . . . 0 0 . 1 . 005 nuclear orig full ' B' B ' 145' ' ' ARG . . . . . . . . . . . . . 13.3 ttt85 -76.45 141.57 41.3 Favored 'General case' 0 N--CA 1.495 1.821 0 O-C-N 121.454 -0.779 . . . . 0.0 110.466 -179.924 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 146' ' ' VAL . . . . . . . . . . . . . 16.2 m -130.5 154.51 40.68 Favored 'Isoleucine or valine' 0 N--CA 1.5 2.045 0 O-C-N 121.594 -0.692 . . . . 0.0 110.125 179.808 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 147' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -116.92 90.99 3.45 Favored 'General case' 0 N--CA 1.494 1.769 0 O-C-N 121.264 -0.898 . . . . 0.0 110.909 -179.63 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' B' B ' 148' ' ' ILE . . . . . . . . . . . . . 1.8 mp -99.1 121.76 50.06 Favored 'Isoleucine or valine' 0 N--CA 1.497 1.884 0 O-C-N 121.261 -0.9 . . . . 0.0 109.447 179.428 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 149' ' ' SER . . . . . . . . . . . . . 27.5 m -100.33 170.48 8.4 Favored 'General case' 0 N--CA 1.498 1.965 0 O-C-N 121.504 -0.748 . . . . 0.0 110.772 -179.709 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 150' ' ' ALA . . . . . . . . . . . . . . . -60.47 -50.76 72.29 Favored 'General case' 0 N--CA 1.498 1.958 0 O-C-N 121.573 -0.704 . . . . 0.0 110.549 179.909 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 151' ' ' ASP . . . . . . . . . . . . . 7.5 p-10 -61.54 -34.79 76.16 Favored 'General case' 0 N--CA 1.5 2.029 0 O-C-N 121.453 -0.779 . . . . 0.0 110.68 179.771 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 152' ' ' ALA . . . . . . . . . . . . . . . -68.06 -54.4 18.55 Favored 'General case' 0 N--CA 1.497 1.878 0 O-C-N 121.316 -0.865 . . . . 0.0 110.44 179.995 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 153' ' ' MET . . . . . . . . . . . . . 1.1 tpt -66.16 -31.04 71.65 Favored 'General case' 0 N--CA 1.499 1.991 0 O-C-N 121.317 -0.865 . . . . 0.0 110.346 179.597 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 154' ' ' MET . . . . . 0.436 ' HE2' HD11 ' B' ' 158' ' ' LEU . 0.0 OUTLIER -64.12 -41.21 97.31 Favored 'General case' 0 N--CA 1.499 2.009 0 O-C-N 121.348 -0.845 . . . . 0.0 110.326 179.486 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' B' B ' 155' ' ' GLN . . . . . . . . . . . . . 33.6 mt-30 -77.94 -31.75 51.16 Favored 'General case' 0 N--CA 1.499 1.98 0 O-C-N 121.346 -0.846 . . . . 0.0 110.83 179.878 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 156' ' ' ALA . . . . . . . . . . . . . . . -54.93 -45.85 74.87 Favored 'General case' 0 N--CA 1.501 2.11 0 O-C-N 121.386 -0.821 . . . . 0.0 110.959 -179.683 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 157' ' ' LEU . . . . . 0.437 HD11 ' CD2' ' A' ' 27' ' ' PHE . 1.2 tp -80.35 -46.35 16.22 Favored 'General case' 0 N--CA 1.496 1.83 0 O-C-N 121.173 -0.955 . . . . 0.0 110.208 179.71 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' B' B ' 158' ' ' LEU . . . . . 0.436 HD11 ' HE2' ' B' ' 154' ' ' MET . 1.1 mp -79.74 86.12 5.36 Favored 'General case' 0 N--CA 1.495 1.816 0 O-C-N 121.34 -0.85 . . . . 0.0 109.308 179.207 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' B' B ' 159' ' ' GLY . . . . . . . . . . . . . . . 145.73 -41.49 1.03 Allowed Glycine 0 N--CA 1.494 2.547 0 N-CA-C 109.154 -1.578 . . . . 0.0 109.154 -179.157 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 160' ' ' ALA . . . . . . . . . . . . . . . -120.1 26.42 9.27 Favored 'General case' 0 N--CA 1.496 1.856 0 O-C-N 121.438 -1.036 . . . . 0.0 110.849 179.659 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 161' ' ' ARG . . . . . . . . . . . . . 0.4 OUTLIER -150.08 -58.06 0.19 Allowed 'General case' 0 N--CA 1.496 1.85 0 O-C-N 120.938 -1.101 . . . . 0.0 110.957 179.815 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' B' B ' 162' ' ' ALA . . . . . . . . . . . . . . . -118.67 -66.59 1.06 Allowed 'General case' 0 N--CA 1.495 1.796 0 O-C-N 121.375 -0.828 . . . . 0.0 110.733 -179.653 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 163' ' ' LYS . . . . . . . . . . . . . 3.3 mtpt . . . . . 0 N--CA 1.496 1.866 0 CA-C-O 117.883 -1.056 . . . . 0.0 110.284 -179.832 . . . . . . . . 0 0 . 1 . 005 nuclear orig full ' A' A ' 90' ' ' ' CA' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 005 nuclear orig full ' A' A ' 91' ' ' SXK . . . . . 0.486 ' HAK' ' CD2' ' A' ' 41' ' ' LEU . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 3.7 mmm . . . . . 0 N--CA 1.498 1.948 0 CA-C-O 120.905 0.383 . . . . 0.0 110.014 . . . . . . . . . 0 0 . 1 . 006 nuclear orig full ' A' A ' 2' ' ' ASP . . . . . 0.44 ' HB3' ' HB2' ' A' ' 6' ' ' LYS . 32.1 t0 -160.33 157.43 27.96 Favored 'General case' 0 N--CA 1.497 1.898 0 O-C-N 121.464 -0.772 . . . . 0.0 110.842 -179.617 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 3' ' ' ASP . . . . . . . . . . . . . 23.8 t70 -141.82 -67.78 0.39 Allowed 'General case' 0 N--CA 1.494 1.77 0 O-C-N 121.49 -0.756 . . . . 0.0 110.499 179.924 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 4' ' ' ILE . . . . . . . . . . . . . 1.1 tp -65.09 -41.81 92.83 Favored 'Isoleucine or valine' 0 N--CA 1.499 2.023 0 O-C-N 121.333 -0.854 . . . . 0.0 111.107 -179.549 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 5' ' ' TYR . . . . . 0.535 ' CD2' ' HG2' ' A' ' 83' ' ' ARG . 27.2 m-85 -78.84 -34.03 45.47 Favored 'General case' 0 N--CA 1.497 1.885 0 O-C-N 121.037 -1.039 . . . . 0.0 109.781 179.615 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 6' ' ' LYS . . . . . 0.44 ' HB2' ' HB3' ' A' ' 2' ' ' ASP . 11.7 ttpp -61.03 -43.54 98.73 Favored 'General case' 0 N--CA 1.493 1.722 0 O-C-N 121.564 -0.71 . . . . 0.0 109.929 179.159 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 7' ' ' ALA . . . . . . . . . . . . . . . -55.31 -38.94 69.33 Favored 'General case' 0 N--CA 1.5 2.075 0 O-C-N 121.47 -0.769 . . . . 0.0 110.083 179.325 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 8' ' ' ALA . . . . . . . . . . . . . . . -61.0 -39.1 88.42 Favored 'General case' 0 N--CA 1.497 1.915 0 O-C-N 121.481 -0.762 . . . . 0.0 109.614 178.91 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 9' ' ' VAL . . . . . 0.417 ' CG2' ' HA ' ' A' ' 79' ' ' VAL . 59.1 t -64.27 -39.11 84.35 Favored 'Isoleucine or valine' 0 N--CA 1.499 2.0 0 O-C-N 121.532 -0.73 . . . . 0.0 109.288 178.784 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 10' ' ' GLU . . . . . . . . . . . . . 3.4 mt-10 -64.98 -29.07 69.97 Favored 'General case' 0 N--CA 1.5 2.041 0 O-C-N 121.459 -0.776 . . . . 0.0 109.769 178.675 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 11' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -82.62 -19.05 39.09 Favored 'General case' 0 N--CA 1.498 1.972 0 O-C-N 121.445 -0.784 . . . . 0.0 110.69 179.417 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 12' ' ' LEU . . . . . 0.406 ' CD1' ' HA ' ' A' ' 9' ' ' VAL . 18.3 mt -62.99 116.14 5.05 Favored 'General case' 0 N--CA 1.497 1.887 0 O-C-N 121.255 -0.903 . . . . 0.0 110.057 179.857 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 13' ' ' THR . . . . . . . . . . . . . 71.3 p -74.62 167.49 21.66 Favored 'General case' 0 N--CA 1.497 1.902 0 O-C-N 121.297 -0.877 . . . . 0.0 109.888 179.75 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 14' ' ' GLU . . . . . . . . . . . . . 9.7 tp10 -58.23 -34.71 70.73 Favored 'General case' 0 N--CA 1.492 1.671 0 O-C-N 121.588 -0.695 . . . . 0.0 110.643 -179.421 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 17.9 tt0 -59.32 -46.39 88.7 Favored 'General case' 0 N--CA 1.498 1.968 0 O-C-N 121.338 -0.851 . . . . 0.0 109.44 178.981 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 16' ' ' GLN . . . . . . . . . . . . . 3.2 mt-30 -65.15 -37.58 87.87 Favored 'General case' 0 N--CA 1.498 1.949 0 O-C-N 121.531 -0.73 . . . . 0.0 109.871 178.826 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 17' ' ' LYS . . . . . . . . . . . . . 15.8 mtmt -60.58 -40.3 91.22 Favored 'General case' 0 N--CA 1.497 1.882 0 N-CA-C 109.163 -0.68 . . . . 0.0 109.163 178.795 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 18' ' ' ASN . . . . . 0.433 ' HA ' ' HB3' ' A' ' 21' ' ' LYS . 8.2 t30 -64.9 -39.32 93.34 Favored 'General case' 0 N--CA 1.497 1.884 0 O-C-N 121.588 -0.695 . . . . 0.0 109.894 179.107 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 14.9 mt-10 -57.49 -42.49 82.8 Favored 'General case' 0 N--CA 1.499 1.988 0 O-C-N 121.46 -0.775 . . . . 0.0 109.224 178.862 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 20' ' ' PHE . . . . . . . . . . . . . 3.8 m-85 -75.5 -30.11 59.74 Favored 'General case' 0 N--CA 1.494 1.76 0 O-C-N 121.581 -0.699 . . . . 0.0 109.49 178.543 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 21' ' ' LYS . . . . . 0.441 ' HG3' ' N ' ' A' ' 22' ' ' ALA . 0.0 OUTLIER -57.43 -32.55 67.01 Favored 'General case' 0 N--CA 1.498 1.965 0 O-C-N 121.58 -0.7 . . . . 0.0 109.638 179.042 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' A' A ' 22' ' ' ALA . . . . . 0.441 ' N ' ' HG3' ' A' ' 21' ' ' LYS . . . -58.3 -52.98 63.3 Favored 'General case' 0 N--CA 1.497 1.876 0 O-C-N 121.394 -0.816 . . . . 0.0 109.408 178.787 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 23' ' ' ALA . . . . . . . . . . . . . . . -68.89 -35.88 77.38 Favored 'General case' 0 N--CA 1.496 1.865 0 O-C-N 121.602 -0.687 . . . . 0.0 109.548 178.622 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 24' ' ' PHE . . . . . . . . . . . . . 70.8 t80 -61.58 -51.06 70.09 Favored 'General case' 0 N--CA 1.497 1.911 0 O-C-N 121.721 -0.612 . . . . 0.0 110.404 179.446 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 25' ' ' ASP . . . . . . . . . . . . . 0.7 OUTLIER -62.33 -44.91 95.4 Favored 'General case' 0 N--CA 1.498 1.964 0 O-C-N 121.562 -0.711 . . . . 0.0 110.241 179.812 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 26' ' ' ILE . . . . . 0.531 HG23 HD12 ' A' ' 29' ' ' LEU . 22.1 mt -65.84 -29.53 47.22 Favored 'Isoleucine or valine' 0 N--CA 1.498 1.947 0 O-C-N 121.268 -0.895 . . . . 0.0 109.68 179.009 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 27' ' ' PHE . . . . . 0.405 ' HZ ' ' SD ' ' B' ' 153' ' ' MET . 0.1 OUTLIER -62.14 -42.58 99.39 Favored 'General case' 0 N--CA 1.498 1.945 0 O-C-N 121.372 -0.83 . . . . 0.0 110.13 179.033 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' A' A ' 28' ' ' VAL . . . . . 0.452 ' HA ' ' HB2' ' A' ' 31' ' ' ALA . 34.0 m -88.24 37.01 0.07 OUTLIER 'Isoleucine or valine' 0 N--CA 1.5 2.046 0 O-C-N 121.29 -0.881 . . . . 0.0 111.137 -179.846 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 29' ' ' LEU . . . . . 0.531 HD12 HG23 ' A' ' 26' ' ' ILE . 2.7 mt -74.17 -44.89 51.77 Favored 'General case' 0 N--CA 1.498 1.957 0 O-C-N 120.954 -1.091 . . . . 0.0 109.58 178.944 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 30' ' ' GLY . . . . . . . . . . . . . . . -110.46 30.3 8.32 Favored Glycine 0 N--CA 1.494 2.533 0 N-CA-C 109.381 -1.488 . . . . 0.0 109.381 179.071 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 31' ' ' ALA . . . . . 0.452 ' HB2' ' HA ' ' A' ' 28' ' ' VAL . . . -93.21 101.0 13.27 Favored 'General case' 0 N--CA 1.497 1.901 0 O-C-N 121.363 -1.081 . . . . 0.0 110.585 -179.884 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 32' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -60.36 -25.1 65.6 Favored 'General case' 0 N--CA 1.501 2.118 0 O-C-N 121.409 -0.807 . . . . 0.0 110.683 179.552 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 14.2 m-20 -69.54 -28.77 66.29 Favored 'General case' 0 N--CA 1.499 1.991 0 O-C-N 121.384 -0.822 . . . . 0.0 110.461 179.511 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 34' ' ' GLY . . . . . . . . . . . . . . . 109.97 -35.82 4.64 Favored Glycine 0 N--CA 1.497 2.705 0 N-CA-C 109.503 -1.439 . . . . 0.0 109.503 -179.504 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 35' ' ' CYS . . . . . 0.403 ' SG ' ' HB ' ' A' ' 71' ' ' THR . 30.3 p -122.71 -172.3 2.45 Favored 'General case' 0 N--CA 1.499 1.989 0 O-C-N 121.482 -1.011 . . . . 0.0 109.807 179.623 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 36' ' ' ILE . . . . . 0.622 ' HA ' ' HG2' ' A' ' 40' ' ' GLU . 4.2 mt -81.15 104.07 9.13 Favored 'Isoleucine or valine' 0 N--CA 1.497 1.916 0 O-C-N 120.94 -1.1 . . . . 0.0 110.207 179.833 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 37' ' ' SER . . . . . . . . . . . . . 0.9 OUTLIER -107.95 -170.54 1.7 Allowed 'General case' 0 N--CA 1.494 1.752 0 O-C-N 121.644 -0.66 . . . . 0.0 110.014 179.758 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 38' ' ' THR . . . . . . . . . . . . . 23.9 p -63.45 -37.7 88.3 Favored 'General case' 0 N--CA 1.502 2.175 0 O-C-N 121.23 -0.919 . . . . 0.0 110.54 179.726 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 39' ' ' LYS . . . . . . . . . . . . . 9.8 mtmt -63.47 -47.39 82.01 Favored 'General case' 0 N--CA 1.5 2.032 0 O-C-N 121.557 -0.714 . . . . 0.0 111.173 -179.77 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 40' ' ' GLU . . . . . 0.622 ' HG2' ' HA ' ' A' ' 36' ' ' ILE . 0.0 OUTLIER -60.49 -33.66 72.93 Favored 'General case' 0 N--CA 1.502 2.133 0 O-C-N 121.391 -0.818 . . . . 0.0 111.529 -179.074 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' A' A ' 41' ' ' LEU . . . . . 0.678 HD13 ' HG ' ' A' ' 57' ' ' LEU . 3.1 tm? -69.36 -66.73 0.55 Allowed 'General case' 0 N--CA 1.495 1.782 0 O-C-N 121.32 -0.863 . . . . 0.0 110.18 -179.771 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 42' ' ' GLY . . . . . . . . . . . . . . . -44.84 -42.42 7.77 Favored Glycine 0 N--CA 1.5 2.934 0 N-CA-C 110.61 -0.996 . . . . 0.0 110.61 -179.729 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 43' ' ' LYS . . . . . . . . . . . . . 5.1 mttm -56.96 -49.9 74.28 Favored 'General case' 0 N--CA 1.501 2.077 0 O-C-N 121.476 -1.014 . . . . 0.0 110.348 179.617 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 44' ' ' VAL . . . . . . . . . . . . . 21.3 t -67.42 -36.32 76.11 Favored 'Isoleucine or valine' 0 N--CA 1.5 2.07 0 O-C-N 121.334 -0.854 . . . . 0.0 110.179 179.221 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 45' ' ' MET . . . . . 0.483 ' HG3' HD12 ' A' ' 41' ' ' LEU . 1.2 mtt -63.11 -32.34 73.7 Favored 'General case' 0 N--CA 1.499 2.006 0 O-C-N 121.472 -0.767 . . . . 0.0 111.21 -179.89 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 46' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -47.92 -41.64 25.14 Favored 'General case' 0 N--CA 1.503 2.179 0 O-C-N 121.212 -0.93 . . . . 0.0 111.365 -179.786 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 47' ' ' MET . . . . . . . . . . . . . 13.3 ptt? -90.66 -27.69 18.86 Favored 'General case' 0 N--CA 1.5 2.041 0 O-C-N 121.162 -0.961 . . . . 0.0 110.395 179.384 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 48' ' ' LEU . . . . . . . . . . . . . 14.6 tp -128.86 87.45 2.57 Favored 'General case' 0 N--CA 1.492 1.654 0 O-C-N 121.367 -0.833 . . . . 0.0 109.236 179.423 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 49' ' ' GLY . . . . . . . . . . . . . . . 93.53 70.34 1.12 Allowed Glycine 0 N--CA 1.497 2.758 0 N-CA-C 108.504 -1.838 . . . . 0.0 108.504 -178.767 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 50' ' ' GLN . . . . . . . . . . . . . 3.2 mm-40 -36.93 136.41 0.39 Allowed 'General case' 0 N--CA 1.504 2.272 0 CA-C-O 121.574 0.702 . . . . 0.0 112.865 -178.518 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 51' ' ' ASN . . . . . . . . . . . . . 37.2 t30 -100.75 116.28 64.34 Favored Pre-proline 0 N--CA 1.493 1.725 0 O-C-N 121.843 -0.536 . . . . 0.0 110.048 179.353 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 52' ' ' PRO . . . . . . . . . . . . . 42.8 Cg_endo -73.26 -64.31 0.03 OUTLIER 'Trans proline' 0 C--N 1.311 -1.407 0 O-C-N 123.928 1.488 . . . . 0.0 111.705 -179.829 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 53' ' ' THR . . . . . . . . . . . . . 1.0 OUTLIER -118.25 152.64 50.92 Favored Pre-proline 0 N--CA 1.498 1.964 0 O-C-N 121.111 -0.993 . . . . 0.0 110.942 -179.252 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 54' ' ' PRO . . . . . . . . . . . . . 45.0 Cg_endo -71.69 -37.2 5.51 Favored 'Trans proline' 0 N--CA 1.492 1.401 0 O-C-N 123.941 1.495 . . . . 0.0 111.267 179.983 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 55' ' ' GLU . . . . . . . . . . . . . 2.5 mp0 -62.8 -32.3 73.45 Favored 'General case' 0 N--CA 1.5 2.03 0 O-C-N 121.374 -0.829 . . . . 0.0 110.732 -179.895 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 2.5 tt0 -51.9 -40.25 60.38 Favored 'General case' 0 N--CA 1.499 2.023 0 O-C-N 121.604 -0.685 . . . . 0.0 111.117 -179.997 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 57' ' ' LEU . . . . . 0.678 ' HG ' HD13 ' A' ' 41' ' ' LEU . 0.4 OUTLIER -73.62 -31.51 63.58 Favored 'General case' 0 N--CA 1.499 2.016 0 O-C-N 121.082 -1.012 . . . . 0.0 110.153 179.778 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' A' A ' 58' ' ' GLN . . . . . 0.443 ' O ' HG23 ' A' ' 61' ' ' ILE . 0.0 OUTLIER -58.08 -44.19 87.43 Favored 'General case' 0 N--CA 1.496 1.842 0 O-C-N 121.191 -0.943 . . . . 0.0 108.465 178.951 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' A' A ' 59' ' ' GLU . . . . . . . . . . . . . 2.0 mp0 -61.12 -36.09 78.79 Favored 'General case' 0 N--CA 1.496 1.874 0 O-C-N 121.282 -0.887 . . . . 0.0 108.68 177.831 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 60' ' ' MET . . . . . . . . . . . . . 0.4 OUTLIER -62.61 -36.89 84.2 Favored 'General case' 0 N--CA 1.497 1.907 0 O-C-N 121.725 -0.609 . . . . 0.0 109.867 178.618 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 61' ' ' ILE . . . . . 0.443 HG23 ' O ' ' A' ' 58' ' ' GLN . 0.8 OUTLIER -83.77 -31.78 8.37 Favored 'Isoleucine or valine' 0 N--CA 1.498 1.946 0 O-C-N 121.41 -0.806 . . . . 0.0 111.039 -179.916 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' A' A ' 62' ' ' ASP . . . . . . . . . . . . . 2.7 m-20 -58.04 -47.57 82.72 Favored 'General case' 0 N--CA 1.5 2.065 0 O-C-N 121.289 -0.882 . . . . 0.0 111.233 -179.37 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 63' ' ' GLU . . . . . . . . . . . . . 0.9 OUTLIER -63.5 -36.21 83.02 Favored 'General case' 0 N--CA 1.5 2.028 0 O-C-N 121.274 -0.891 . . . . 0.0 110.799 -179.875 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 64' ' ' VAL . . . . . . . . . . . . . 84.4 t -84.36 -30.44 7.28 Favored 'Isoleucine or valine' 0 N--CA 1.498 1.944 0 O-C-N 121.33 -0.856 . . . . 0.0 111.465 -179.49 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 65' ' ' ASP . . . . . . . . . . . . . 16.9 t70 -133.72 137.78 45.44 Favored 'General case' 0 N--CA 1.497 1.885 0 O-C-N 121.006 -1.058 . . . . 0.0 111.76 -179.368 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 66' ' ' GLU . . . . . . . . . . . . . 0.3 OUTLIER -148.17 45.39 1.07 Allowed 'General case' 0 N--CA 1.495 1.796 0 CA-C-O 121.573 0.701 . . . . 0.0 109.245 178.694 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 67' ' ' ASP . . . . . . . . . . . . . 12.7 p-10 -102.78 13.18 35.03 Favored 'General case' 0 N--CA 1.499 1.992 0 O-C-N 121.448 -0.783 . . . . 0.0 111.567 -179.359 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 68' ' ' GLY . . . . . . . . . . . . . . . 107.79 -51.55 0.71 Allowed Glycine 0 N--CA 1.496 2.657 0 C-N-CA 120.039 -1.077 . . . . 0.0 110.497 179.422 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 69' ' ' SER . . . . . . . . . . . . . 82.3 p -64.07 -55.78 19.68 Favored 'General case' 0 N--CA 1.501 2.11 0 O-C-N 121.241 -1.152 . . . . 0.0 110.876 -179.418 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 70' ' ' GLY . . . . . . . . . . . . . . . 89.75 34.74 8.2 Favored Glycine 0 N--CA 1.495 2.595 0 N-CA-C 108.326 -1.91 . . . . 0.0 108.326 -179.283 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 71' ' ' THR . . . . . 0.419 ' HA ' HD12 ' A' ' 61' ' ' ILE . 3.1 p -131.0 143.03 50.41 Favored 'General case' 0 N--CA 1.489 1.49 0 O-C-N 122.029 -0.689 . . . . 0.0 109.694 -179.29 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 72' ' ' VAL . . . . . 0.503 HG13 ' HE3' ' A' ' 80' ' ' MET . 93.3 t -75.59 107.37 6.32 Favored 'Isoleucine or valine' 0 N--CA 1.496 1.87 0 O-C-N 121.545 -0.722 . . . . 0.0 110.598 -179.724 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 73' ' ' ASP . . . . . . . . . . . . . 1.1 m-20 -75.25 -175.34 2.66 Favored 'General case' 0 N--CA 1.497 1.913 0 O-C-N 121.415 -0.803 . . . . 0.0 110.244 179.601 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 74' ' ' PHE . . . . . . . . . . . . . 39.0 t80 -65.16 -58.09 6.88 Favored 'General case' 0 N--CA 1.499 2.002 0 O-C-N 121.194 -0.941 . . . . 0.0 109.779 179.951 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 75' ' ' ASP . . . . . 0.482 ' HA ' HD12 ' A' ' 78' ' ' LEU . 0.5 OUTLIER -65.79 -34.64 78.65 Favored 'General case' 0 N--CA 1.495 1.783 0 O-C-N 121.553 -0.717 . . . . 0.0 109.86 179.174 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' A' A ' 76' ' ' GLU . . . . . . . . . . . . . 19.3 mt-10 -63.67 -40.42 96.78 Favored 'General case' 0 N--CA 1.497 1.903 0 O-C-N 121.451 -0.78 . . . . 0.0 109.502 178.715 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 77' ' ' PHE . . . . . . . . . . . . . 57.6 t80 -56.86 -40.46 76.17 Favored 'General case' 0 N--CA 1.498 1.972 0 O-C-N 121.621 -0.674 . . . . 0.0 110.541 179.48 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 78' ' ' LEU . . . . . 0.482 HD12 ' HA ' ' A' ' 75' ' ' ASP . 27.2 mt -55.45 -40.5 71.65 Favored 'General case' 0 N--CA 1.502 2.16 0 O-C-N 121.463 -0.773 . . . . 0.0 110.63 179.831 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 79' ' ' VAL . . . . . 0.417 ' HA ' ' CG2' ' A' ' 9' ' ' VAL . 77.8 t -62.5 -34.85 67.0 Favored 'Isoleucine or valine' 0 N--CA 1.502 2.125 0 O-C-N 121.497 -0.752 . . . . 0.0 110.033 179.496 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 80' ' ' MET . . . . . 0.503 ' HE3' HG13 ' A' ' 72' ' ' VAL . 18.9 ttp -73.58 -35.27 65.4 Favored 'General case' 0 N--CA 1.494 1.732 0 O-C-N 121.342 -0.849 . . . . 0.0 110.305 179.539 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 81' ' ' MET . . . . . . . . . . . . . 12.0 mmm -66.62 -46.76 74.8 Favored 'General case' 0 N--CA 1.499 1.979 0 O-C-N 121.424 -0.798 . . . . 0.0 110.715 -179.719 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 82' ' ' VAL . . . . . . . . . . . . . 33.2 m -62.81 -32.64 56.5 Favored 'Isoleucine or valine' 0 N--CA 1.504 2.243 0 O-C-N 121.128 -0.983 . . . . 0.0 110.441 179.88 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 83' ' ' ARG . . . . . 0.535 ' HG2' ' CD2' ' A' ' 5' ' ' TYR . 69.8 mtt180 -66.84 -34.52 77.99 Favored 'General case' 0 N--CA 1.497 1.908 0 O-C-N 121.38 -0.825 . . . . 0.0 109.835 179.132 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 84' ' ' CYS . . . . . . . . . . . . . 79.5 m -77.41 -28.93 52.81 Favored 'General case' 0 N--CA 1.496 1.856 0 O-C-N 121.502 -0.749 . . . . 0.0 109.983 178.914 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 85' ' ' MET . . . . . . . . . . . . . 42.0 mtm -76.62 -32.39 58.01 Favored 'General case' 0 N--CA 1.497 1.903 0 O-C-N 121.582 -0.699 . . . . 0.0 110.76 179.838 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 86' ' ' LYS . . . . . . . . . . . . . 5.8 tmtt? 59.91 75.69 0.39 Allowed 'General case' 0 N--CA 1.503 2.217 0 O-C-N 121.589 -0.695 . . . . 0.0 110.76 -179.961 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 87' ' ' ASP . . . . . . . . . . . . . 5.9 p-10 -76.88 -26.29 54.03 Favored 'General case' 0 N--CA 1.5 2.051 0 O-C-N 121.289 -0.882 . . . . 0.0 111.123 179.972 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 88' ' ' ASP . . . . . . . . . . . . . 7.9 p-10 -85.96 163.26 18.12 Favored 'General case' 0 N--CA 1.497 1.891 0 O-C-N 121.055 -1.028 . . . . 0.0 110.72 -179.902 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 89' ' ' SER . . . . . . . . . . . . . 67.2 m . . . . . 0 N--CA 1.499 2.017 0 CA-C-O 117.818 -1.087 . . . . 0.0 110.927 -179.622 . . . . . . . . 0 0 . 1 . 006 nuclear orig full ' B' B ' 144' ' ' ARG . . . . . . . . . . . . . 2.0 ptt-85 . . . . . 0 N--CA 1.499 1.981 0 CA-C-O 120.69 0.281 . . . . 0.0 111.12 . . . . . . . . . 0 0 . 1 . 006 nuclear orig full ' B' B ' 145' ' ' ARG . . . . . 0.5 ' O ' ' HB ' ' B' ' 146' ' ' VAL . 0.0 OUTLIER -91.03 98.58 11.86 Favored 'General case' 0 N--CA 1.494 1.747 0 O-C-N 121.094 -1.004 . . . . 0.0 110.059 179.444 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' B' B ' 146' ' ' VAL . . . . . 0.5 ' HB ' ' O ' ' B' ' 145' ' ' ARG . 3.0 t 65.57 143.24 0.01 OUTLIER 'Isoleucine or valine' 0 N--CA 1.507 2.39 0 CA-C-O 121.559 0.695 . . . . 0.0 110.87 -179.69 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' B' B ' 147' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -138.53 126.93 23.1 Favored 'General case' 0 N--CA 1.496 1.846 0 O-C-N 121.136 -0.977 . . . . 0.0 110.382 -179.755 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' B' B ' 148' ' ' ILE . . . . . 0.421 HD13 ' HE1' ' A' ' 45' ' ' MET . 1.0 OUTLIER -108.3 -27.66 2.91 Favored 'Isoleucine or valine' 0 N--CA 1.501 2.089 0 O-C-N 121.354 -0.841 . . . . 0.0 111.243 -179.921 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' B' B ' 149' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER 64.59 109.66 0.03 OUTLIER 'General case' 0 N--CA 1.505 2.315 0 O-C-N 121.639 -0.663 . . . . 0.0 111.154 179.865 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' B' B ' 150' ' ' ALA . . . . . . . . . . . . . . . -55.29 -42.76 74.08 Favored 'General case' 0 N--CA 1.501 2.118 0 O-C-N 121.412 -0.805 . . . . 0.0 110.824 179.955 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 151' ' ' ASP . . . . . . . . . . . . . 4.2 p-10 -53.92 -39.33 65.74 Favored 'General case' 0 N--CA 1.502 2.135 0 O-C-N 121.613 -0.679 . . . . 0.0 110.741 179.743 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 152' ' ' ALA . . . . . . . . . . . . . . . -87.14 -40.1 14.93 Favored 'General case' 0 N--CA 1.496 1.833 0 O-C-N 121.365 -0.834 . . . . 0.0 110.318 179.555 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 153' ' ' MET . . . . . 0.407 ' HE2' HD12 ' B' ' 148' ' ' ILE . 5.7 ttt -60.09 -44.9 94.46 Favored 'General case' 0 N--CA 1.498 1.971 0 O-C-N 121.484 -0.76 . . . . 0.0 110.627 179.875 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' B' B ' 154' ' ' MET . . . . . . . . . . . . . 19.7 ttt -62.46 -43.63 98.34 Favored 'General case' 0 N--CA 1.497 1.917 0 O-C-N 121.474 -0.766 . . . . 0.0 110.428 179.773 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 155' ' ' GLN . . . . . . . . . . . . . 0.6 OUTLIER -65.42 -43.07 91.7 Favored 'General case' 0 N--CA 1.499 2.005 0 O-C-N 121.522 -0.737 . . . . 0.0 110.587 179.771 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' B' B ' 156' ' ' ALA . . . . . . . . . . . . . . . -63.43 -34.86 78.68 Favored 'General case' 0 N--CA 1.499 1.983 0 O-C-N 121.336 -0.853 . . . . 0.0 110.587 179.817 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 157' ' ' LEU . . . . . 0.463 HD22 HG21 ' A' ' 26' ' ' ILE . 24.8 tp -80.83 -49.46 11.05 Favored 'General case' 0 N--CA 1.495 1.809 0 O-C-N 121.301 -0.875 . . . . 0.0 110.611 179.849 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' B' B ' 158' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -71.69 106.29 4.03 Favored 'General case' 0 N--CA 1.499 2.009 0 O-C-N 121.287 -0.883 . . . . 0.0 110.069 179.825 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' B' B ' 159' ' ' GLY . . . . . . . . . . . . . . . 126.99 -33.56 3.33 Favored Glycine 0 N--CA 1.496 2.656 0 N-CA-C 109.939 -1.264 . . . . 0.0 109.939 -179.704 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 160' ' ' ALA . . . . . . . . . . . . . . . -110.75 -33.45 6.54 Favored 'General case' 0 N--CA 1.499 1.982 0 O-C-N 121.208 -1.172 . . . . 0.0 111.213 -179.69 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 161' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -116.14 -19.62 10.2 Favored 'General case' 0 N--CA 1.502 2.147 0 O-C-N 121.122 -0.987 . . . . 0.0 111.506 -179.453 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' B' B ' 162' ' ' ALA . . . . . . . . . . . . . . . -91.4 -51.84 5.08 Favored 'General case' 0 N--CA 1.497 1.904 0 O-C-N 121.115 -0.991 . . . . 0.0 111.1 -179.482 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 163' ' ' LYS . . . . . 0.501 ' HA ' ' HE3' ' B' ' 163' ' ' LYS . 0.1 OUTLIER . . . . . 0 N--CA 1.497 1.917 0 CA-C-O 117.801 -1.095 . . . . 0.0 110.543 179.943 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 90' ' ' ' CA' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 006 nuclear orig full ' A' A ' 91' ' ' SXK . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 007 nuclear orig full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.496 1.873 0 CA-C-O 120.705 0.288 . . . . 0.0 110.252 . . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 2' ' ' ASP . . . . . . . . . . . . . 3.6 m-20 -74.81 124.97 27.8 Favored 'General case' 0 N--CA 1.496 1.857 0 O-C-N 121.318 -0.864 . . . . 0.0 109.686 179.645 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 3' ' ' ASP . . . . . 0.592 ' HB3' ' HB2' ' A' ' 6' ' ' LYS . 5.8 t70 68.57 150.9 0.08 Allowed 'General case' 0 N--CA 1.503 2.205 0 CA-C-O 121.638 0.732 . . . . 0.0 110.4 -179.031 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 4' ' ' ILE . . . . . . . . . . . . . 5.3 mt -94.57 -47.39 13.33 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.682 0 O-C-N 121.316 -0.865 . . . . 0.0 109.294 179.704 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 5' ' ' TYR . . . . . . . . . . . . . 39.7 m-85 -68.77 -36.53 78.44 Favored 'General case' 0 N--CA 1.494 1.758 0 O-C-N 121.605 -0.684 . . . . 0.0 109.454 178.896 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 6' ' ' LYS . . . . . 0.592 ' HB2' ' HB3' ' A' ' 3' ' ' ASP . 0.3 OUTLIER -64.99 -42.7 94.28 Favored 'General case' 0 N--CA 1.496 1.846 0 O-C-N 121.451 -0.78 . . . . 0.0 109.031 178.483 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' A' A ' 7' ' ' ALA . . . . . . . . . . . . . . . -61.46 -35.99 79.18 Favored 'General case' 0 N--CA 1.496 1.868 0 O-C-N 121.464 -0.772 . . . . 0.0 109.338 178.306 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 8' ' ' ALA . . . . . . . . . . . . . . . -66.57 -26.39 67.1 Favored 'General case' 0 N--CA 1.498 1.938 0 O-C-N 121.497 -0.752 . . . . 0.0 110.232 179.03 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 9' ' ' VAL . . . . . 0.451 ' HB ' ' O ' ' A' ' 6' ' ' LYS . 57.1 t -59.51 -40.27 81.46 Favored 'Isoleucine or valine' 0 N--CA 1.498 1.963 0 O-C-N 121.301 -0.874 . . . . 0.0 109.416 179.036 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 10' ' ' GLU . . . . . . . . . . . . . 0.9 OUTLIER -61.69 -30.28 70.64 Favored 'General case' 0 N--CA 1.496 1.848 0 O-C-N 121.417 -0.802 . . . . 0.0 110.01 178.828 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 11' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -60.04 -33.81 72.55 Favored 'General case' 0 N--CA 1.5 2.035 0 O-C-N 121.407 -0.808 . . . . 0.0 109.388 178.406 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 12' ' ' LEU . . . . . 0.669 ' HB3' ' CB ' ' A' ' 16' ' ' GLN . 19.4 mt -67.62 -23.76 65.39 Favored 'General case' 0 N--CA 1.498 1.959 0 O-C-N 121.687 -0.633 . . . . 0.0 109.703 178.494 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 13' ' ' THR . . . . . . . . . . . . . 1.3 p 74.2 165.78 0.29 Allowed 'General case' 0 N--CA 1.51 2.555 0 C-N-CA 123.47 0.708 . . . . 0.0 110.86 -179.594 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 14' ' ' GLU . . . . . . . . . . . . . 1.1 tp10 -57.33 -30.63 64.96 Favored 'General case' 0 N--CA 1.494 1.751 0 O-C-N 121.645 -0.659 . . . . 0.0 110.779 -178.958 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER -57.53 -47.4 82.1 Favored 'General case' 0 N--CA 1.495 1.782 0 O-C-N 121.436 -0.79 . . . . 0.0 109.395 178.803 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 16' ' ' GLN . . . . . 0.669 ' CB ' ' HB3' ' A' ' 12' ' ' LEU . 27.3 mt-30 -72.79 -38.55 67.2 Favored 'General case' 0 N--CA 1.495 1.815 0 O-C-N 121.459 -0.776 . . . . 0.0 110.076 178.951 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 17' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -56.68 -45.99 81.39 Favored 'General case' 0 N--CA 1.498 1.943 0 N-CA-C 109.259 -0.645 . . . . 0.0 109.259 179.132 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 18' ' ' ASN . . . . . . . . . . . . . 21.2 m-80 -71.21 -36.48 71.91 Favored 'General case' 0 N--CA 1.494 1.766 0 O-C-N 121.603 -0.686 . . . . 0.0 109.249 178.281 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 15.2 mt-10 -62.24 -52.13 64.98 Favored 'General case' 0 N--CA 1.498 1.96 0 O-C-N 121.568 -0.707 . . . . 0.0 109.95 179.108 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 20' ' ' PHE . . . . . 0.463 ' CE1' ' HG2' ' A' ' 81' ' ' MET . 17.7 m-85 -62.51 -40.03 95.42 Favored 'General case' 0 N--CA 1.497 1.921 0 O-C-N 121.497 -0.752 . . . . 0.0 109.841 179.467 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 21' ' ' LYS . . . . . . . . . . . . . 13.8 tptt -59.1 -46.16 89.01 Favored 'General case' 0 N--CA 1.499 1.993 0 O-C-N 121.433 -0.792 . . . . 0.0 109.534 178.93 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 22' ' ' ALA . . . . . . . . . . . . . . . -68.74 -46.42 68.93 Favored 'General case' 0 N--CA 1.496 1.829 0 O-C-N 121.626 -0.671 . . . . 0.0 109.918 179.436 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 23' ' ' ALA . . . . . . . . . . . . . . . -62.53 -34.72 77.47 Favored 'General case' 0 N--CA 1.498 1.963 0 O-C-N 121.432 -0.792 . . . . 0.0 109.538 178.808 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 24' ' ' PHE . . . . . . . . . . . . . 65.5 t80 -60.39 -48.25 82.55 Favored 'General case' 0 N--CA 1.496 1.829 0 N-CA-C 109.138 -0.69 . . . . 0.0 109.138 178.839 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 25' ' ' ASP . . . . . . . . . . . . . 0.9 OUTLIER -64.36 -34.42 78.12 Favored 'General case' 0 N--CA 1.496 1.852 0 O-C-N 121.54 -0.725 . . . . 0.0 109.361 178.663 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 26' ' ' ILE . . . . . 0.466 HD13 ' CD1' ' A' ' 29' ' ' LEU . 15.9 mm -67.06 -34.69 71.4 Favored 'Isoleucine or valine' 0 N--CA 1.498 1.926 0 O-C-N 121.328 -0.857 . . . . 0.0 109.112 178.372 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 27' ' ' PHE . . . . . . . . . . . . . 0.2 OUTLIER -65.4 -34.52 78.5 Favored 'General case' 0 N--CA 1.498 1.966 0 O-C-N 121.569 -0.707 . . . . 0.0 110.587 179.366 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 28' ' ' VAL . . . . . 0.48 ' HA ' ' HB3' ' A' ' 31' ' ' ALA . 32.9 m -93.4 1.5 9.47 Favored 'Isoleucine or valine' 0 N--CA 1.502 2.142 0 O-C-N 121.283 -0.886 . . . . 0.0 112.064 -179.39 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 29' ' ' LEU . . . . . 0.466 ' CD1' HD13 ' A' ' 26' ' ' ILE . 2.3 mt -63.28 -45.92 89.19 Favored 'General case' 0 N--CA 1.501 2.089 0 O-C-N 120.821 -1.174 . . . . 0.0 109.688 179.33 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 30' ' ' GLY . . . . . . . . . . . . . . . -103.66 43.66 1.63 Allowed Glycine 0 N--CA 1.492 2.414 0 N-CA-C 108.561 -1.815 . . . . 0.0 108.561 178.643 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 31' ' ' ALA . . . . . 0.48 ' HB3' ' HA ' ' A' ' 28' ' ' VAL . . . -104.44 130.85 52.31 Favored 'General case' 0 N--CA 1.496 1.838 0 O-C-N 121.528 -0.984 . . . . 0.0 111.197 -179.18 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 32' ' ' GLU . . . . . . . . . . . . . 2.7 mp0 -77.65 -31.09 52.48 Favored 'General case' 0 N--CA 1.498 1.93 0 O-C-N 121.568 -0.708 . . . . 0.0 110.076 179.205 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 1.2 m-20 -78.66 -36.4 43.87 Favored 'General case' 0 N--CA 1.496 1.85 0 O-C-N 121.513 -0.742 . . . . 0.0 110.54 -179.949 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 34' ' ' GLY . . . . . . . . . . . . . . . 120.65 -36.86 3.22 Favored Glycine 0 N--CA 1.497 2.71 0 N-CA-C 109.411 -1.476 . . . . 0.0 109.411 -179.52 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 35' ' ' CYS . . . . . . . . . . . . . 1.3 m -120.26 -171.31 2.14 Favored 'General case' 0 N--CA 1.497 1.881 0 O-C-N 121.595 -0.944 . . . . 0.0 109.965 179.57 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 36' ' ' ILE . . . . . 0.446 HG13 ' CG1' ' A' ' 28' ' ' VAL . 96.6 mt -90.27 101.64 12.49 Favored 'Isoleucine or valine' 0 N--CA 1.496 1.829 0 O-C-N 121.117 -0.99 . . . . 0.0 110.57 -179.781 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 37' ' ' SER . . . . . . . . . . . . . 83.8 p -113.55 -179.36 3.62 Favored 'General case' 0 N--CA 1.494 1.733 0 N-CA-C 108.983 -0.747 . . . . 0.0 108.983 178.854 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 38' ' ' THR . . . . . 0.545 HG22 ' HG2' ' A' ' 58' ' ' GLN . 8.6 p -62.6 -41.18 98.82 Favored 'General case' 0 N--CA 1.5 2.041 0 O-C-N 120.963 -1.086 . . . . 0.0 110.056 179.515 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 39' ' ' LYS . . . . . 0.557 ' HA ' ' HB3' ' A' ' 54' ' ' PRO . 1.0 OUTLIER -60.94 -35.16 76.01 Favored 'General case' 0 N--CA 1.501 2.079 0 O-C-N 121.485 -0.759 . . . . 0.0 110.018 179.263 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 1.1 tp10 -83.41 -39.2 20.93 Favored 'General case' 0 N--CA 1.493 1.709 0 O-C-N 121.507 -0.746 . . . . 0.0 109.636 179.041 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 41' ' ' LEU . . . . . 0.564 HD11 ' HG2' ' A' ' 45' ' ' MET . 9.1 tp -62.63 -49.0 76.91 Favored 'General case' 0 N--CA 1.498 1.957 0 O-C-N 121.623 -0.673 . . . . 0.0 110.588 179.72 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 42' ' ' GLY . . . . . 0.402 ' HA2' ' HB2' ' A' ' 45' ' ' MET . . . -54.36 -38.41 62.23 Favored Glycine 0 N--CA 1.494 2.549 0 N-CA-C 110.84 -0.904 . . . . 0.0 110.84 -179.038 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 43' ' ' LYS . . . . . . . . . . . . . 0.4 OUTLIER -54.49 -41.48 69.62 Favored 'General case' 0 N--CA 1.503 2.199 0 O-C-N 121.309 -1.112 . . . . 0.0 110.298 179.686 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 44' ' ' VAL . . . . . . . . . . . . . 44.0 t -83.08 -36.65 13.09 Favored 'Isoleucine or valine' 0 N--CA 1.499 2.014 0 O-C-N 121.349 -0.844 . . . . 0.0 109.876 179.21 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 45' ' ' MET . . . . . 0.663 ' HB3' ' HB2' ' A' ' 51' ' ' ASN . 69.4 mmm -61.91 -41.22 97.67 Favored 'General case' 0 N--CA 1.501 2.098 0 O-C-N 121.527 -0.733 . . . . 0.0 110.47 179.815 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 46' ' ' ARG . . . . . . . . . . . . . 8.9 tpt180 -67.34 -36.98 82.52 Favored 'General case' 0 N--CA 1.497 1.885 0 O-C-N 121.304 -0.872 . . . . 0.0 109.592 179.153 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 47' ' ' MET . . . . . . . . . . . . . 43.2 ttp -75.59 -1.97 26.99 Favored 'General case' 0 N--CA 1.499 1.977 0 O-C-N 121.559 -0.713 . . . . 0.0 110.46 178.704 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 48' ' ' LEU . . . . . . . . . . . . . 4.2 tp -119.66 -54.74 2.15 Favored 'General case' 0 N--CA 1.493 1.702 0 O-C-N 121.024 -1.048 . . . . 0.0 109.728 179.95 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 49' ' ' GLY . . . . . . . . . . . . . . . -114.04 -116.62 3.25 Favored Glycine 0 N--CA 1.494 2.515 0 N-CA-C 109.221 -1.552 . . . . 0.0 109.221 179.426 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 50' ' ' GLN . . . . . 0.499 ' O ' ' HD3' ' A' ' 52' ' ' PRO . 0.8 OUTLIER -139.11 13.68 2.63 Favored 'General case' 0 N--CA 1.5 2.067 0 O-C-N 121.375 -1.074 . . . . 0.0 111.933 -179.866 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' A' A ' 51' ' ' ASN . . . . . 0.663 ' HB2' ' HB3' ' A' ' 45' ' ' MET . 8.2 m120 -78.0 108.88 8.35 Favored Pre-proline 0 N--CA 1.505 2.291 0 O-C-N 121.02 -1.05 . . . . 0.0 109.633 179.897 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 52' ' ' PRO . . . . . 0.499 ' HD3' ' O ' ' A' ' 50' ' ' GLN . 45.2 Cg_endo -93.15 -73.6 0.0 OUTLIER 'Trans proline' 0 C--N 1.313 -1.292 0 C-N-CA 121.728 1.619 . . . . 0.0 112.627 -177.983 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 53' ' ' THR . . . . . . . . . . . . . 11.7 p -67.9 142.55 95.61 Favored Pre-proline 0 N--CA 1.499 1.986 0 O-C-N 121.311 -0.868 . . . . 0.0 111.599 -178.298 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 54' ' ' PRO . . . . . 0.557 ' HB3' ' HA ' ' A' ' 39' ' ' LYS . 43.4 Cg_endo -67.41 -32.81 31.38 Favored 'Trans proline' 0 N--CA 1.491 1.359 0 O-C-N 124.285 1.676 . . . . 0.0 110.893 179.577 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 55' ' ' GLU . . . . . . . . . . . . . 1.6 mp0 -57.92 -31.95 67.29 Favored 'General case' 0 N--CA 1.502 2.144 0 O-C-N 121.4 -0.813 . . . . 0.0 109.988 179.508 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 1.0 OUTLIER -62.8 -38.48 90.86 Favored 'General case' 0 N--CA 1.496 1.874 0 O-C-N 121.543 -0.723 . . . . 0.0 110.13 179.408 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 57' ' ' LEU . . . . . 0.403 HD13 ' CE ' ' A' ' 60' ' ' MET . 0.5 OUTLIER -87.5 -12.55 45.6 Favored 'General case' 0 N--CA 1.495 1.801 0 O-C-N 121.291 -0.88 . . . . 0.0 110.66 179.624 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' A' A ' 58' ' ' GLN . . . . . 0.561 ' O ' HG23 ' A' ' 61' ' ' ILE . 0.0 OUTLIER -56.27 -38.09 70.68 Favored 'General case' 0 N--CA 1.502 2.154 0 O-C-N 121.218 -0.926 . . . . 0.0 110.55 179.838 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' A' A ' 59' ' ' GLU . . . . . . . . . . . . . 0.9 OUTLIER -58.95 -32.16 69.36 Favored 'General case' 0 N--CA 1.498 1.951 0 O-C-N 121.018 -1.052 . . . . 0.0 109.439 178.82 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 60' ' ' MET . . . . . 0.403 ' CE ' HD13 ' A' ' 57' ' ' LEU . 40.7 mtm -78.41 -47.47 17.51 Favored 'General case' 0 N--CA 1.495 1.786 0 O-C-N 121.586 -0.696 . . . . 0.0 110.244 179.03 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 61' ' ' ILE . . . . . 0.561 HG23 ' O ' ' A' ' 58' ' ' GLN . 11.0 tt -62.36 -41.57 92.21 Favored 'Isoleucine or valine' 0 N--CA 1.501 2.108 0 O-C-N 121.219 -0.926 . . . . 0.0 110.39 179.812 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 62' ' ' ASP . . . . . . . . . . . . . 0.8 OUTLIER -64.77 -36.3 83.88 Favored 'General case' 0 N--CA 1.499 2.015 0 O-C-N 121.249 -0.907 . . . . 0.0 110.159 179.286 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 63' ' ' GLU . . . . . . . . . . . . . 3.1 tt0 -63.0 -28.56 70.18 Favored 'General case' 0 N--CA 1.498 1.954 0 O-C-N 121.48 -0.762 . . . . 0.0 110.435 179.196 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 64' ' ' VAL . . . . . . . . . . . . . 4.0 t -114.95 25.85 4.03 Favored 'Isoleucine or valine' 0 N--CA 1.498 1.971 0 O-C-N 121.203 -0.936 . . . . 0.0 110.567 179.838 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 65' ' ' ASP . . . . . 0.476 ' HB2' ' O ' ' A' ' 61' ' ' ILE . 16.9 t70 -110.64 -73.9 0.67 Allowed 'General case' 0 N--CA 1.5 2.03 0 O-C-N 120.966 -1.084 . . . . 0.0 110.551 179.973 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 66' ' ' GLU . . . . . . . . . . . . . 7.7 tt0 57.92 23.31 9.67 Favored 'General case' 0 N--CA 1.501 2.109 0 O-C-N 121.607 -0.683 . . . . 0.0 110.86 -179.396 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 67' ' ' ASP . . . . . . . . . . . . . 64.9 m-20 -111.85 5.29 18.9 Favored 'General case' 0 N--CA 1.496 1.853 0 O-C-N 121.257 -0.902 . . . . 0.0 110.948 179.669 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 68' ' ' GLY . . . . . . . . . . . . . . . 63.49 38.06 95.74 Favored Glycine 0 N--CA 1.495 2.599 0 N-CA-C 108.703 -1.759 . . . . 0.0 108.703 -178.931 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 69' ' ' SER . . . . . . . . . . . . . 71.0 p -139.11 -53.53 0.57 Allowed 'General case' 0 N--CA 1.495 1.8 0 O-C-N 121.626 -0.926 . . . . 0.0 110.73 -179.1 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 70' ' ' GLY . . . . . . . . . . . . . . . 90.25 45.35 4.43 Favored Glycine 0 N--CA 1.497 2.738 0 N-CA-C 108.639 -1.785 . . . . 0.0 108.639 -179.308 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 71' ' ' THR . . . . . . . . . . . . . 0.9 OUTLIER -140.44 126.1 19.17 Favored 'General case' 0 N--CA 1.493 1.72 0 O-C-N 121.861 -0.788 . . . . 0.0 109.993 -179.154 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 72' ' ' VAL . . . . . 0.449 ' CG2' HG13 ' A' ' 61' ' ' ILE . 53.9 t -80.66 105.88 11.06 Favored 'Isoleucine or valine' 0 N--CA 1.497 1.879 0 O-C-N 121.535 -0.728 . . . . 0.0 110.567 -179.98 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 73' ' ' ASP . . . . . . . . . . . . . 1.1 t70 -85.29 -162.9 0.76 Allowed 'General case' 0 N--CA 1.495 1.799 0 O-C-N 121.366 -0.834 . . . . 0.0 109.854 179.287 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 74' ' ' PHE . . . . . . . . . . . . . 25.7 t80 -64.91 -50.86 64.84 Favored 'General case' 0 N--CA 1.499 1.988 0 O-C-N 121.085 -1.009 . . . . 0.0 110.278 -179.917 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 75' ' ' ASP . . . . . . . . . . . . . 25.0 t70 -60.19 -49.61 76.93 Favored 'General case' 0 N--CA 1.497 1.902 0 O-C-N 121.543 -0.723 . . . . 0.0 109.947 179.31 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 76' ' ' GLU . . . . . . . . . . . . . 30.5 mt-10 -60.73 -37.93 83.42 Favored 'General case' 0 N--CA 1.498 1.929 0 O-C-N 121.473 -0.767 . . . . 0.0 110.468 179.633 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 77' ' ' PHE . . . . . . . . . . . . . 42.6 t80 -59.63 -48.29 82.24 Favored 'General case' 0 N--CA 1.498 1.973 0 O-C-N 121.317 -0.864 . . . . 0.0 110.142 179.445 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 78' ' ' LEU . . . . . . . . . . . . . 16.2 mt -66.84 -37.88 85.32 Favored 'General case' 0 N--CA 1.501 2.09 0 O-C-N 121.41 -0.806 . . . . 0.0 110.023 179.579 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 79' ' ' VAL . . . . . . . . . . . . . 39.2 t -59.71 -36.7 67.27 Favored 'Isoleucine or valine' 0 N--CA 1.499 2.025 0 O-C-N 121.49 -0.756 . . . . 0.0 110.012 179.192 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 80' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -69.99 -40.34 75.35 Favored 'General case' 0 N--CA 1.496 1.849 0 O-C-N 121.359 -0.838 . . . . 0.0 109.868 179.332 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 81' ' ' MET . . . . . 0.463 ' HG2' ' CE1' ' A' ' 20' ' ' PHE . 0.0 OUTLIER -62.53 -48.4 79.71 Favored 'General case' 0 N--CA 1.496 1.848 0 O-C-N 121.557 -0.714 . . . . 0.0 109.976 179.515 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' A' A ' 82' ' ' VAL . . . . . . . . . . . . . 34.3 m -67.44 -28.18 41.27 Favored 'Isoleucine or valine' 0 N--CA 1.499 2.018 0 O-C-N 121.251 -0.905 . . . . 0.0 109.805 179.016 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 83' ' ' ARG . . . . . . . . . . . . . 7.2 mtt85 -61.58 -39.97 93.08 Favored 'General case' 0 N--CA 1.497 1.91 0 O-C-N 121.348 -0.845 . . . . 0.0 109.518 178.779 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 84' ' ' CYS . . . . . . . . . . . . . 5.2 t -62.49 -35.57 79.77 Favored 'General case' 0 N--CA 1.498 1.95 0 O-C-N 121.542 -0.724 . . . . 0.0 110.002 178.882 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 85' ' ' MET . . . . . 0.423 ' O ' ' HB3' ' A' ' 86' ' ' LYS . 0.0 OUTLIER -75.75 -35.17 60.26 Favored 'General case' 0 N--CA 1.499 1.982 0 O-C-N 121.408 -0.807 . . . . 0.0 110.353 179.341 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' A' A ' 86' ' ' LYS . . . . . 0.467 ' HA ' ' HE2' ' A' ' 86' ' ' LYS . 0.0 OUTLIER 61.81 -85.09 0.02 OUTLIER 'General case' 0 N--CA 1.499 2.008 0 O-C-N 121.962 -0.461 . . . . 0.0 110.895 -179.611 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' A' A ' 87' ' ' ASP . . . . . . . . . . . . . 3.9 m-20 -129.45 62.79 1.52 Allowed 'General case' 0 N--CA 1.495 1.775 0 O-C-N 121.134 -0.979 . . . . 0.0 110.311 -179.84 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 88' ' ' ASP . . . . . . . . . . . . . 3.0 t70 -109.46 106.84 16.75 Favored 'General case' 0 N--CA 1.495 1.802 0 O-C-N 121.23 -0.918 . . . . 0.0 110.196 179.892 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 89' ' ' SER . . . . . . . . . . . . . 26.4 p . . . . . 0 N--CA 1.496 1.871 0 CA-C-O 118.265 -0.874 . . . . 0.0 110.527 -179.884 . . . . . . . . 0 0 . 1 . 007 nuclear orig full ' B' B ' 144' ' ' ARG . . . . . . . . . . . . . 20.2 tpt85 . . . . . 0 N--CA 1.5 2.051 0 N-CA-C 110.155 -0.313 . . . . 0.0 110.155 . . . . . . . . . 0 0 . 1 . 007 nuclear orig full ' B' B ' 145' ' ' ARG . . . . . . . . . . . . . 21.1 mtt85 -75.07 -56.66 4.51 Favored 'General case' 0 N--CA 1.498 1.97 0 O-C-N 121.223 -0.923 . . . . 0.0 109.808 179.372 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 146' ' ' VAL . . . . . 0.63 HG21 ' HAF' ' A' ' 91' ' ' SXK . 27.6 m -119.23 -177.01 1.12 Allowed 'Isoleucine or valine' 0 N--CA 1.498 1.964 0 O-C-N 121.687 -0.633 . . . . 0.0 109.325 179.138 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' B' B ' 147' ' ' ARG . . . . . 0.45 ' HA ' ' HD2' ' B' ' 147' ' ' ARG . 12.4 mmm180 -137.85 60.02 1.64 Allowed 'General case' 0 N--CA 1.498 1.927 0 O-C-N 121.049 -1.032 . . . . 0.0 111.118 -179.744 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' B' B ' 148' ' ' ILE . . . . . . . . . . . . . 1.8 mp -90.68 117.5 34.07 Favored 'Isoleucine or valine' 0 N--CA 1.496 1.859 0 O-C-N 121.29 -0.881 . . . . 0.0 109.475 179.078 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 149' ' ' SER . . . . . . . . . . . . . 34.8 p -84.95 164.89 18.05 Favored 'General case' 0 N--CA 1.497 1.91 0 O-C-N 121.506 -0.746 . . . . 0.0 110.957 -179.432 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 150' ' ' ALA . . . . . . . . . . . . . . . -67.94 -28.5 67.53 Favored 'General case' 0 N--CA 1.494 1.761 0 O-C-N 121.568 -0.707 . . . . 0.0 110.438 179.482 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 151' ' ' ASP . . . . . . . . . . . . . 22.9 t70 -75.27 -39.43 59.75 Favored 'General case' 0 N--CA 1.499 2.005 0 O-C-N 121.32 -0.863 . . . . 0.0 110.563 179.561 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 152' ' ' ALA . . . . . . . . . . . . . . . -52.47 -36.71 55.48 Favored 'General case' 0 N--CA 1.501 2.117 0 O-C-N 121.508 -0.745 . . . . 0.0 110.992 -179.871 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 153' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -77.47 -35.77 53.45 Favored 'General case' 0 N--CA 1.495 1.815 0 O-C-N 121.17 -0.956 . . . . 0.0 110.477 179.712 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' B' B ' 154' ' ' MET . . . . . . . . . . . . . 0.7 OUTLIER -62.91 -53.4 54.65 Favored 'General case' 0 N--CA 1.5 2.034 0 O-C-N 121.264 -0.898 . . . . 0.0 110.095 179.685 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' B' B ' 155' ' ' GLN . . . . . . . . . . . . . 2.1 pp0? -62.81 -22.15 66.43 Favored 'General case' 0 N--CA 1.5 2.075 0 O-C-N 121.187 -0.945 . . . . 0.0 110.379 179.101 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 156' ' ' ALA . . . . . . . . . . . . . . . -82.58 -40.96 20.17 Favored 'General case' 0 N--CA 1.495 1.79 0 O-C-N 121.235 -0.916 . . . . 0.0 110.448 179.266 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 157' ' ' LEU . . . . . . . . . . . . . 2.0 mt -91.69 -59.11 2.21 Favored 'General case' 0 N--CA 1.499 2.008 0 O-C-N 121.29 -0.882 . . . . 0.0 110.408 179.996 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 158' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -65.97 -42.11 90.33 Favored 'General case' 0 N--CA 1.499 2.014 0 O-C-N 121.305 -0.872 . . . . 0.0 110.46 179.745 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' B' B ' 159' ' ' GLY . . . . . . . . . . . . . . . -59.84 -27.62 64.59 Favored Glycine 0 N--CA 1.498 2.8 0 N-CA-C 110.154 -1.179 . . . . 0.0 110.154 179.718 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 160' ' ' ALA . . . . . . . . . . . . . . . -91.67 -30.25 16.42 Favored 'General case' 0 N--CA 1.496 1.829 0 O-C-N 121.286 -1.126 . . . . 0.0 111.404 -179.892 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 161' ' ' ARG . . . . . . . . . . . . . 77.6 mtt-85 -110.98 -61.33 1.71 Allowed 'General case' 0 N--CA 1.502 2.149 0 O-C-N 121.027 -1.045 . . . . 0.0 111.69 -179.193 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 162' ' ' ALA . . . . . . . . . . . . . . . -78.31 93.24 4.63 Favored 'General case' 0 N--CA 1.501 2.093 0 O-C-N 121.238 -0.914 . . . . 0.0 111.229 -179.036 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 163' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.498 1.938 0 O-C-N 121.379 -0.826 . . . . 0.0 110.721 179.568 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 90' ' ' ' CA' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 007 nuclear orig full ' A' A ' 91' ' ' SXK . . . . . 0.63 ' HAF' HG21 ' B' ' 146' ' ' VAL . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 4.3 mtt . . . . . 0 N--CA 1.495 1.813 0 CA-C-O 120.984 0.421 . . . . 0.0 110.265 . . . . . . . . . 0 0 . 1 . 008 nuclear orig full ' A' A ' 2' ' ' ASP . . . . . 0.626 ' HB3' ' HB2' ' A' ' 6' ' ' LYS . 5.2 t70 -92.9 163.82 13.55 Favored 'General case' 0 N--CA 1.496 1.861 0 O-C-N 121.384 -0.823 . . . . 0.0 110.335 -179.906 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 3' ' ' ASP . . . . . . . . . . . . . 2.4 p-10 -121.15 -42.76 2.46 Favored 'General case' 0 N--CA 1.497 1.923 0 O-C-N 121.525 -0.734 . . . . 0.0 111.459 -179.515 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 4' ' ' ILE . . . . . . . . . . . . . 1.7 tt -94.15 -39.82 10.88 Favored 'Isoleucine or valine' 0 N--CA 1.501 2.108 0 O-C-N 121.087 -1.008 . . . . 0.0 111.615 -179.002 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 5' ' ' TYR . . . . . 0.489 ' CG ' ' HG2' ' A' ' 83' ' ' ARG . 57.5 m-85 -76.75 -38.8 53.52 Favored 'General case' 0 N--CA 1.5 2.026 0 O-C-N 121.098 -1.001 . . . . 0.0 110.156 179.989 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 6' ' ' LYS . . . . . 0.626 ' HB2' ' HB3' ' A' ' 2' ' ' ASP . 12.3 ttpp -66.37 -37.81 86.14 Favored 'General case' 0 N--CA 1.494 1.771 0 O-C-N 121.411 -0.806 . . . . 0.0 109.456 178.9 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 7' ' ' ALA . . . . . . . . . . . . . . . -56.17 -43.64 78.56 Favored 'General case' 0 N--CA 1.498 1.971 0 O-C-N 121.534 -0.729 . . . . 0.0 110.209 179.313 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 8' ' ' ALA . . . . . . . . . . . . . . . -61.09 -39.85 91.48 Favored 'General case' 0 N--CA 1.499 2.018 0 O-C-N 121.437 -0.789 . . . . 0.0 109.977 179.149 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 9' ' ' VAL . . . . . 0.532 HG21 ' C ' ' A' ' 78' ' ' LEU . 53.0 t -75.36 -43.65 42.8 Favored 'Isoleucine or valine' 0 N--CA 1.496 1.864 0 O-C-N 121.483 -0.761 . . . . 0.0 110.32 179.587 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 10' ' ' GLU . . . . . 0.425 ' CD ' ' HG2' ' A' ' 6' ' ' LYS . 58.6 mt-10 -57.8 -36.73 72.6 Favored 'General case' 0 N--CA 1.498 1.935 0 O-C-N 121.437 -0.789 . . . . 0.0 109.701 179.383 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 11' ' ' GLN . . . . . . . . . . . . . 0.2 OUTLIER -108.19 47.83 0.88 Allowed 'General case' 0 N--CA 1.482 1.152 0 O-C-N 121.417 -0.802 . . . . 0.0 109.704 179.363 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 12' ' ' LEU . . . . . . . . . . . . . 1.5 mt -82.03 150.68 27.47 Favored 'General case' 0 N--CA 1.497 1.911 0 O-C-N 121.304 -0.873 . . . . 0.0 110.714 -179.748 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 13' ' ' THR . . . . . . . . . . . . . 45.4 p -83.12 152.69 25.19 Favored 'General case' 0 N--CA 1.498 1.956 0 O-C-N 121.462 -0.774 . . . . 0.0 109.922 179.396 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 14' ' ' GLU . . . . . 0.611 ' HA ' ' HD3' ' A' ' 17' ' ' LYS . 5.0 tp10 -56.71 -32.2 65.26 Favored 'General case' 0 N--CA 1.492 1.666 0 O-C-N 121.554 -0.716 . . . . 0.0 110.767 -179.415 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 1.5 mp0 -60.58 -47.85 84.38 Favored 'General case' 0 N--CA 1.497 1.889 0 O-C-N 121.355 -0.84 . . . . 0.0 109.805 179.351 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 16' ' ' GLN . . . . . . . . . . . . . 5.4 mt-30 -77.45 -27.89 52.28 Favored 'General case' 0 N--CA 1.496 1.832 0 O-C-N 121.259 -0.9 . . . . 0.0 110.607 179.347 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 17' ' ' LYS . . . . . 0.611 ' HD3' ' HA ' ' A' ' 14' ' ' GLU . 0.2 OUTLIER -60.53 -46.67 89.31 Favored 'General case' 0 N--CA 1.498 1.965 0 O-C-N 121.513 -0.742 . . . . 0.0 109.547 179.138 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' A' A ' 18' ' ' ASN . . . . . . . . . . . . . 50.5 t30 -72.77 -34.26 66.84 Favored 'General case' 0 N--CA 1.496 1.863 0 O-C-N 121.581 -0.699 . . . . 0.0 109.926 179.061 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 3.6 tt0 -60.47 -49.15 78.72 Favored 'General case' 0 N--CA 1.497 1.903 0 O-C-N 121.477 -0.764 . . . . 0.0 109.578 179.265 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 20' ' ' PHE . . . . . . . . . . . . . 16.9 m-85 -68.1 -32.36 72.61 Favored 'General case' 0 N--CA 1.499 2.0 0 O-C-N 121.316 -0.865 . . . . 0.0 110.092 179.123 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 21' ' ' LYS . . . . . . . . . . . . . 13.9 tptp -58.42 -45.44 88.46 Favored 'General case' 0 N--CA 1.495 1.822 0 O-C-N 121.604 -0.685 . . . . 0.0 109.611 179.43 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 22' ' ' ALA . . . . . . . . . . . . . . . -59.43 -44.23 92.95 Favored 'General case' 0 N--CA 1.496 1.847 0 O-C-N 121.514 -0.742 . . . . 0.0 110.271 179.373 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 23' ' ' ALA . . . . . . . . . . . . . . . -64.87 -44.48 89.54 Favored 'General case' 0 N--CA 1.501 2.088 0 O-C-N 121.283 -0.886 . . . . 0.0 109.926 179.209 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 24' ' ' PHE . . . . . 0.521 ' CD2' HD11 ' A' ' 36' ' ' ILE . 40.8 t80 -66.75 -38.73 87.22 Favored 'General case' 0 N--CA 1.496 1.835 0 O-C-N 121.609 -0.682 . . . . 0.0 110.303 179.505 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 25' ' ' ASP . . . . . . . . . . . . . 9.1 t70 -54.73 -52.36 62.73 Favored 'General case' 0 N--CA 1.501 2.115 0 O-C-N 121.606 -0.684 . . . . 0.0 111.012 -179.805 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 26' ' ' ILE . . . . . . . . . . . . . 19.7 mt -69.8 -27.8 34.61 Favored 'Isoleucine or valine' 0 N--CA 1.498 1.959 0 O-C-N 121.145 -0.972 . . . . 0.0 110.266 179.856 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 27' ' ' PHE . . . . . . . . . . . . . 0.3 OUTLIER -65.23 -32.75 74.58 Favored 'General case' 0 N--CA 1.498 1.956 0 O-C-N 121.244 -0.91 . . . . 0.0 111.05 179.81 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 28' ' ' VAL . . . . . . . . . . . . . 33.0 m -91.75 34.02 0.11 Allowed 'Isoleucine or valine' 0 N--CA 1.501 2.12 0 O-C-N 121.121 -0.987 . . . . 0.0 110.816 179.945 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 29' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -67.02 -42.18 85.37 Favored 'General case' 0 N--CA 1.498 1.945 0 O-C-N 121.111 -0.993 . . . . 0.0 110.176 179.459 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 30' ' ' GLY . . . . . . . . . . . . . . . -105.92 40.2 2.58 Favored Glycine 0 N--CA 1.495 2.578 0 N-CA-C 109.488 -1.445 . . . . 0.0 109.488 179.475 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 31' ' ' ALA . . . . . . . . . . . . . . . -120.89 94.55 4.38 Favored 'General case' 0 N--CA 1.496 1.849 0 O-C-N 121.364 -1.08 . . . . 0.0 110.203 -179.982 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 32' ' ' GLU . . . . . . . . . . . . . 8.0 tt0 -63.02 -31.64 72.83 Favored 'General case' 0 N--CA 1.5 2.04 0 O-C-N 121.452 -0.78 . . . . 0.0 110.691 -179.921 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 8.9 p-10 -67.28 -30.05 69.83 Favored 'General case' 0 N--CA 1.496 1.872 0 O-C-N 121.403 -0.81 . . . . 0.0 110.501 179.435 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 34' ' ' GLY . . . . . . . . . . . . . . . 112.68 -35.32 4.67 Favored Glycine 0 N--CA 1.498 2.803 0 O-C-N 121.13 -0.981 . . . . 0.0 110.755 179.265 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 35' ' ' CYS . . . . . . . . . . . . . 58.2 m -87.4 -170.22 2.94 Favored 'General case' 0 N--CA 1.497 1.889 0 O-C-N 121.219 -1.165 . . . . 0.0 110.339 -179.863 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 36' ' ' ILE . . . . . 0.521 HD11 ' CD2' ' A' ' 24' ' ' PHE . 25.9 mt -102.13 129.26 53.79 Favored 'Isoleucine or valine' 0 N--CA 1.496 1.863 0 O-C-N 121.168 -0.957 . . . . 0.0 110.425 -179.685 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 37' ' ' SER . . . . . . . . . . . . . 3.4 t -107.17 163.68 12.8 Favored 'General case' 0 N--CA 1.495 1.795 0 O-C-N 121.484 -0.76 . . . . 0.0 109.722 179.133 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 38' ' ' THR . . . . . 0.455 HG21 HD13 ' A' ' 61' ' ' ILE . 77.1 p -63.05 -30.38 71.55 Favored 'General case' 0 N--CA 1.501 2.105 0 O-C-N 121.294 -0.879 . . . . 0.0 110.27 179.64 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 39' ' ' LYS . . . . . . . . . . . . . 1.6 mptp? -58.93 -42.96 91.02 Favored 'General case' 0 N--CA 1.497 1.912 0 O-C-N 121.535 -0.728 . . . . 0.0 109.837 179.343 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 1.6 mp0 -74.25 -37.22 63.84 Favored 'General case' 0 N--CA 1.498 1.942 0 O-C-N 121.463 -0.773 . . . . 0.0 109.942 179.442 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 41' ' ' LEU . . . . . . . . . . . . . 6.2 tp -60.69 -47.56 85.7 Favored 'General case' 0 N--CA 1.495 1.789 0 O-C-N 121.499 -0.751 . . . . 0.0 109.807 179.499 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 42' ' ' GLY . . . . . . . . . . . . . . . -54.62 -39.84 68.22 Favored Glycine 0 N--CA 1.494 2.536 0 N-CA-C 109.887 -1.285 . . . . 0.0 109.887 179.688 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 43' ' ' LYS . . . . . . . . . . . . . 16.0 mttp -58.34 -40.19 81.49 Favored 'General case' 0 N--CA 1.501 2.084 0 O-C-N 121.34 -1.094 . . . . 0.0 110.033 179.171 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 44' ' ' VAL . . . . . . . . . . . . . 45.0 t -75.25 -38.45 41.11 Favored 'Isoleucine or valine' 0 N--CA 1.497 1.901 0 O-C-N 121.36 -0.838 . . . . 0.0 109.39 179.108 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 45' ' ' MET . . . . . . . . . . . . . 1.6 mmt -57.14 -43.29 82.28 Favored 'General case' 0 N--CA 1.498 1.936 0 O-C-N 121.713 -0.617 . . . . 0.0 110.031 179.343 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 46' ' ' ARG . . . . . . . . . . . . . 0.4 OUTLIER -63.12 -39.9 96.04 Favored 'General case' 0 N--CA 1.496 1.853 0 O-C-N 121.571 -0.706 . . . . 0.0 109.783 179.234 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 47' ' ' MET . . . . . . . . . . . . . 6.0 ttp -63.54 -29.35 70.63 Favored 'General case' 0 N--CA 1.497 1.875 0 O-C-N 121.569 -0.707 . . . . 0.0 110.188 179.036 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 48' ' ' LEU . . . . . . . . . . . . . 1.9 tt -72.13 -39.64 68.66 Favored 'General case' 0 N--CA 1.495 1.823 0 O-C-N 121.391 -0.818 . . . . 0.0 110.65 179.618 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 49' ' ' GLY . . . . . . . . . . . . . . . 144.29 -29.85 1.9 Allowed Glycine 0 N--CA 1.499 2.859 0 C-N-CA 120.113 -1.041 . . . . 0.0 110.627 179.982 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 50' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -127.07 129.8 48.69 Favored 'General case' 0 N--CA 1.501 2.082 0 O-C-N 121.21 -1.171 . . . . 0.0 111.166 -179.628 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 51' ' ' ASN . . . . . . . . . . . . . 43.3 t30 -172.15 104.87 0.35 Allowed Pre-proline 0 N--CA 1.496 1.845 0 O-C-N 121.549 -0.719 . . . . 0.0 110.363 179.319 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 52' ' ' PRO . . . . . . . . . . . . . 43.3 Cg_endo -76.95 -71.8 0.01 OUTLIER 'Trans proline' 0 C--N 1.311 -1.396 0 O-C-N 123.859 1.452 . . . . 0.0 110.565 179.562 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 53' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -139.96 150.77 63.47 Favored Pre-proline 0 N--CA 1.501 2.079 0 O-C-N 121.172 -0.955 . . . . 0.0 109.812 179.641 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 54' ' ' PRO . . . . . 0.452 ' O ' ' HB ' ' A' ' 38' ' ' THR . 45.3 Cg_endo -70.4 -48.17 0.63 Allowed 'Trans proline' 0 N--CA 1.491 1.368 0 O-C-N 123.837 1.44 . . . . 0.0 111.208 -179.483 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 55' ' ' GLU . . . . . 0.482 ' O ' ' HB2' ' A' ' 58' ' ' GLN . 11.3 mm-40 -66.63 -20.01 65.9 Favored 'General case' 0 N--CA 1.499 2.013 0 O-C-N 121.19 -0.944 . . . . 0.0 110.855 -179.983 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 7.6 tt0 -61.3 -25.41 67.1 Favored 'General case' 0 N--CA 1.499 1.976 0 O-C-N 121.149 -0.97 . . . . 0.0 110.321 178.981 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 57' ' ' LEU . . . . . . . . . . . . . 4.6 mt -85.78 -9.21 57.44 Favored 'General case' 0 N--CA 1.498 1.939 0 O-C-N 121.39 -0.819 . . . . 0.0 111.672 -179.875 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 58' ' ' GLN . . . . . 0.482 ' HB2' ' O ' ' A' ' 55' ' ' GLU . 1.7 mm100 -48.69 -53.86 17.1 Favored 'General case' 0 N--CA 1.505 2.302 0 O-C-N 121.136 -0.978 . . . . 0.0 111.38 -179.362 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 59' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -51.27 -33.91 30.55 Favored 'General case' 0 N--CA 1.502 2.153 0 O-C-N 121.299 -0.876 . . . . 0.0 110.881 179.868 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 60' ' ' MET . . . . . . . . . . . . . 1.5 ttp -75.31 -35.36 61.26 Favored 'General case' 0 N--CA 1.496 1.871 0 O-C-N 121.294 -0.879 . . . . 0.0 110.646 179.406 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 61' ' ' ILE . . . . . 0.521 HG13 ' CG2' ' A' ' 72' ' ' VAL . 8.6 tt -65.22 -31.75 55.26 Favored 'Isoleucine or valine' 0 N--CA 1.501 2.083 0 O-C-N 121.021 -1.049 . . . . 0.0 110.276 179.62 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 62' ' ' ASP . . . . . 0.507 ' N ' HG22 ' A' ' 61' ' ' ILE . 22.6 m-20 -76.99 -28.86 55.23 Favored 'General case' 0 N--CA 1.496 1.873 0 O-C-N 121.268 -0.895 . . . . 0.0 109.955 179.066 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 63' ' ' GLU . . . . . . . . . . . . . 6.6 mt-10 -59.11 -49.58 77.33 Favored 'General case' 0 N--CA 1.5 2.063 0 O-C-N 121.518 -0.739 . . . . 0.0 110.411 179.37 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 64' ' ' VAL . . . . . . . . . . . . . 14.6 p -84.33 -10.79 11.67 Favored 'Isoleucine or valine' 0 N--CA 1.497 1.9 0 O-C-N 121.661 -0.65 . . . . 0.0 111.122 -179.679 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 65' ' ' ASP . . . . . . . . . . . . . 24.9 t70 -69.13 133.72 48.39 Favored 'General case' 0 N--CA 1.497 1.887 0 O-C-N 120.945 -1.097 . . . . 0.0 110.032 179.553 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 66' ' ' GLU . . . . . . . . . . . . . 25.4 mt-10 -128.73 25.89 5.63 Favored 'General case' 0 N--CA 1.495 1.823 0 O-C-N 121.322 -0.861 . . . . 0.0 111.219 -179.493 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 67' ' ' ASP . . . . . . . . . . . . . 1.6 p-10 -124.97 -21.2 4.75 Favored 'General case' 0 N--CA 1.498 1.967 0 O-C-N 120.822 -1.174 . . . . 0.0 112.162 -179.878 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 68' ' ' GLY . . . . . . . . . . . . . . . 114.91 -37.13 3.62 Favored Glycine 0 N--CA 1.497 2.762 0 O-C-N 120.825 -1.172 . . . . 0.0 110.466 179.665 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 69' ' ' SER . . . . . . . . . . . . . 38.9 p -58.87 -32.0 69.08 Favored 'General case' 0 N--CA 1.502 2.162 0 O-C-N 121.361 -1.082 . . . . 0.0 110.996 -179.883 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 70' ' ' GLY . . . . . . . . . . . . . . . 93.27 -40.1 2.86 Favored Glycine 0 N--CA 1.499 2.845 0 N-CA-C 110.185 -1.166 . . . . 0.0 110.185 -179.824 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 71' ' ' THR . . . . . . . . . . . . . 14.0 m -64.34 144.69 56.97 Favored 'General case' 0 N--CA 1.501 2.113 0 O-C-N 121.262 -1.14 . . . . 0.0 110.273 -179.841 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 72' ' ' VAL . . . . . 0.521 ' CG2' HG13 ' A' ' 61' ' ' ILE . 2.1 t -77.62 119.36 26.16 Favored 'Isoleucine or valine' 0 N--CA 1.497 1.901 0 O-C-N 121.377 -0.827 . . . . 0.0 110.105 179.867 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 73' ' ' ASP . . . . . . . . . . . . . 45.6 m-20 -92.78 -173.31 3.28 Favored 'General case' 0 N--CA 1.496 1.831 0 O-C-N 121.616 -0.678 . . . . 0.0 109.887 179.839 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 74' ' ' PHE . . . . . . . . . . . . . 26.0 t80 -64.97 -48.45 73.99 Favored 'General case' 0 N--CA 1.495 1.821 0 O-C-N 121.195 -0.94 . . . . 0.0 110.052 179.602 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 75' ' ' ASP . . . . . 0.446 ' HA ' HD12 ' A' ' 78' ' ' LEU . 29.0 t70 -60.45 -49.82 76.02 Favored 'General case' 0 N--CA 1.498 1.927 0 O-C-N 121.579 -0.701 . . . . 0.0 109.97 179.323 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 76' ' ' GLU . . . . . . . . . . . . . 43.8 mt-10 -60.77 -41.6 95.82 Favored 'General case' 0 N--CA 1.498 1.973 0 O-C-N 121.592 -0.693 . . . . 0.0 109.8 179.135 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 77' ' ' PHE . . . . . . . . . . . . . 43.9 t80 -58.99 -45.57 90.31 Favored 'General case' 0 N--CA 1.498 1.945 0 O-C-N 121.575 -0.703 . . . . 0.0 109.528 178.888 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 78' ' ' LEU . . . . . 0.532 ' C ' HG21 ' A' ' 9' ' ' VAL . 14.2 mt -56.92 -46.47 82.0 Favored 'General case' 0 N--CA 1.498 1.945 0 O-C-N 121.678 -0.639 . . . . 0.0 110.083 179.438 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 79' ' ' VAL . . . . . 0.465 ' HA ' HG22 ' A' ' 9' ' ' VAL . 86.3 t -61.7 -35.16 65.77 Favored 'Isoleucine or valine' 0 N--CA 1.501 2.119 0 O-C-N 121.463 -0.773 . . . . 0.0 109.835 179.453 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 80' ' ' MET . . . . . 0.486 ' CG ' ' HAI' ' A' ' 91' ' ' SXK . 12.4 ttp -70.66 -37.61 73.7 Favored 'General case' 0 N--CA 1.494 1.738 0 O-C-N 121.507 -0.745 . . . . 0.0 110.532 179.566 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 81' ' ' MET . . . . . . . . . . . . . 68.4 mmm -62.77 -53.03 60.63 Favored 'General case' 0 N--CA 1.499 1.982 0 O-C-N 121.253 -0.904 . . . . 0.0 110.336 179.929 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 82' ' ' VAL . . . . . . . . . . . . . 13.4 p -63.26 -29.78 48.1 Favored 'Isoleucine or valine' 0 N--CA 1.501 2.113 0 O-C-N 121.302 -0.874 . . . . 0.0 110.132 179.333 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 83' ' ' ARG . . . . . 0.489 ' HG2' ' CG ' ' A' ' 5' ' ' TYR . 0.0 OUTLIER -62.24 -52.13 64.98 Favored 'General case' 0 N--CA 1.498 1.937 0 O-C-N 121.299 -0.876 . . . . 0.0 110.293 179.32 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' A' A ' 84' ' ' CYS . . . . . . . . . . . . . 0.1 OUTLIER -77.33 -22.79 51.33 Favored 'General case' 0 N--CA 1.498 1.956 0 O-C-N 121.495 -0.753 . . . . 0.0 110.88 179.928 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 85' ' ' MET . . . . . 0.456 ' HB2' ' HB2' ' B' ' 150' ' ' ALA . 22.9 ttp -66.3 -41.25 90.0 Favored 'General case' 0 N--CA 1.496 1.861 0 O-C-N 121.35 -0.844 . . . . 0.0 110.138 179.665 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 86' ' ' LYS . . . . . . . . . . . . . 1.4 tmtt? -140.8 90.3 2.33 Favored 'General case' 0 N--CA 1.493 1.717 0 O-C-N 121.438 -0.789 . . . . 0.0 110.241 -179.998 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 87' ' ' ASP . . . . . . . . . . . . . 4.6 m-20 -79.7 68.77 5.86 Favored 'General case' 0 N--CA 1.496 1.867 0 O-C-N 121.271 -0.893 . . . . 0.0 110.076 179.828 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 88' ' ' ASP . . . . . . . . . . . . . 18.1 t70 -160.73 157.59 27.23 Favored 'General case' 0 N--CA 1.495 1.803 0 O-C-N 121.416 -0.802 . . . . 0.0 109.993 -179.879 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 89' ' ' SER . . . . . . . . . . . . . 2.9 p . . . . . 0 N--CA 1.499 2.016 0 CA-C-O 117.849 -1.072 . . . . 0.0 110.449 179.911 . . . . . . . . 0 0 . 1 . 008 nuclear orig full ' B' B ' 144' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.497 1.905 0 CA-C-O 121.109 0.481 . . . . 0.0 110.269 . . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 145' ' ' ARG . . . . . . . . . . . . . 6.3 tpt180 -74.97 -45.5 41.82 Favored 'General case' 0 N--CA 1.497 1.903 0 O-C-N 121.438 -0.789 . . . . 0.0 110.275 179.865 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 146' ' ' VAL . . . . . . . . . . . . . 2.2 t -92.63 136.83 23.73 Favored 'Isoleucine or valine' 0 N--CA 1.497 1.909 0 O-C-N 121.254 -0.904 . . . . 0.0 109.204 179.437 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 147' ' ' ARG . . . . . . . . . . . . . 1.5 mtm-85 -105.05 109.91 22.1 Favored 'General case' 0 N--CA 1.496 1.85 0 O-C-N 121.19 -0.944 . . . . 0.0 111.413 -178.843 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 148' ' ' ILE . . . . . . . . . . . . . 3.4 mp -133.22 -69.14 0.4 Allowed 'Isoleucine or valine' 0 N--CA 1.497 1.894 0 O-C-N 121.603 -0.686 . . . . 0.0 109.573 179.384 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 149' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER 57.13 -171.68 0.09 Allowed 'General case' 0 N--CA 1.501 2.112 0 O-C-N 121.753 -0.592 . . . . 0.0 111.188 179.674 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' B' B ' 150' ' ' ALA . . . . . 0.456 ' HB2' ' HB2' ' A' ' 85' ' ' MET . . . -108.68 -59.73 1.84 Allowed 'General case' 0 N--CA 1.495 1.809 0 O-C-N 121.299 -0.876 . . . . 0.0 110.162 179.898 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' B' B ' 151' ' ' ASP . . . . . . . . . . . . . 6.4 p-10 -58.34 -30.9 67.08 Favored 'General case' 0 N--CA 1.5 2.059 0 O-C-N 121.491 -0.755 . . . . 0.0 110.805 179.59 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 152' ' ' ALA . . . . . . . . . . . . . . . -71.81 -47.5 52.84 Favored 'General case' 0 N--CA 1.496 1.845 0 O-C-N 121.343 -0.848 . . . . 0.0 110.169 179.708 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 153' ' ' MET . . . . . . . . . . . . . 7.1 mmt -68.31 -37.43 80.6 Favored 'General case' 0 N--CA 1.499 1.988 0 O-C-N 121.333 -0.854 . . . . 0.0 110.482 179.679 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 154' ' ' MET . . . . . . . . . . . . . 39.7 mtp -58.68 -45.02 90.33 Favored 'General case' 0 N--CA 1.499 2.009 0 O-C-N 121.401 -0.812 . . . . 0.0 110.513 179.836 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 155' ' ' GLN . . . . . . . . . . . . . 6.7 tp-100 -60.37 -42.22 95.34 Favored 'General case' 0 N--CA 1.5 2.068 0 O-C-N 121.422 -0.799 . . . . 0.0 110.503 179.895 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 156' ' ' ALA . . . . . . . . . . . . . . . -66.68 -39.3 88.06 Favored 'General case' 0 N--CA 1.499 1.997 0 O-C-N 121.428 -0.795 . . . . 0.0 110.34 179.608 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 157' ' ' LEU . . . . . 0.405 ' HA ' HD23 ' B' ' 157' ' ' LEU . 0.2 OUTLIER -67.86 -35.93 79.41 Favored 'General case' 0 N--CA 1.499 2.013 0 O-C-N 121.449 -0.782 . . . . 0.0 110.782 179.872 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' B' B ' 158' ' ' LEU . . . . . . . . . . . . . 12.0 mt -69.57 -45.86 67.69 Favored 'General case' 0 N--CA 1.498 1.97 0 O-C-N 121.326 -0.859 . . . . 0.0 110.777 -179.862 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 159' ' ' GLY . . . . . . . . . . . . . . . -89.04 48.93 3.5 Favored Glycine 0 N--CA 1.498 2.829 0 N-CA-C 110.085 -1.206 . . . . 0.0 110.085 -179.878 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 160' ' ' ALA . . . . . . . . . . . . . . . -112.97 27.18 9.84 Favored 'General case' 0 N--CA 1.496 1.853 0 O-C-N 121.387 -1.066 . . . . 0.0 110.692 179.939 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 161' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER 55.41 62.34 2.5 Favored 'General case' 0 N--CA 1.503 2.182 0 O-C-N 121.469 -0.769 . . . . 0.0 111.145 179.913 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' B' B ' 162' ' ' ALA . . . . . . . . . . . . . . . -69.98 -34.15 72.98 Favored 'General case' 0 N--CA 1.499 2.017 0 O-C-N 121.149 -0.969 . . . . 0.0 110.041 179.238 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 163' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.493 1.71 0 CA-C-O 118.211 -0.899 . . . . 0.0 109.982 179.673 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 90' ' ' ' CA' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 008 nuclear orig full ' A' A ' 91' ' ' SXK . . . . . 0.486 ' HAI' ' CG ' ' A' ' 80' ' ' MET . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 1' ' ' MET . . . . . 0.433 ' O ' ' HB3' ' A' ' 2' ' ' ASP . 1.5 tpt . . . . . 0 N--CA 1.499 2.008 0 CA-C-O 120.757 0.313 . . . . 0.0 110.355 . . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 2' ' ' ASP . . . . . 0.433 ' HB3' ' O ' ' A' ' 1' ' ' MET . 17.9 t70 65.93 149.79 0.05 OUTLIER 'General case' 0 N--CA 1.505 2.301 0 CA-C-O 121.627 0.727 . . . . 0.0 111.355 -179.929 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 3' ' ' ASP . . . . . . . . . . . . . 0.9 OUTLIER -133.23 3.38 3.65 Favored 'General case' 0 N--CA 1.497 1.916 0 O-C-N 121.352 -0.843 . . . . 0.0 111.344 179.836 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 4' ' ' ILE . . . . . . . . . . . . . 11.7 mt -65.55 -49.67 76.6 Favored 'Isoleucine or valine' 0 N--CA 1.5 2.035 0 O-C-N 120.829 -1.169 . . . . 0.0 110.147 179.89 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 5' ' ' TYR . . . . . . . . . . . . . 13.0 m-85 -60.21 -36.4 77.58 Favored 'General case' 0 N--CA 1.499 2.007 0 O-C-N 121.248 -0.907 . . . . 0.0 110.668 179.778 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 6' ' ' LYS . . . . . 0.458 ' HB3' ' HE3' ' A' ' 6' ' ' LYS . 26.1 ttpp -79.77 -46.46 16.95 Favored 'General case' 0 N--CA 1.494 1.774 0 O-C-N 121.201 -0.937 . . . . 0.0 110.415 179.718 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 7' ' ' ALA . . . . . . . . . . . . . . . -56.55 -46.67 80.58 Favored 'General case' 0 N--CA 1.498 1.937 0 O-C-N 121.45 -0.781 . . . . 0.0 110.309 179.858 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 8' ' ' ALA . . . . . 0.469 ' O ' ' HG ' ' A' ' 12' ' ' LEU . . . -58.33 -44.27 88.59 Favored 'General case' 0 N--CA 1.498 1.959 0 O-C-N 121.286 -0.884 . . . . 0.0 109.532 179.1 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 9' ' ' VAL . . . . . 0.44 HG21 HG23 ' A' ' 79' ' ' VAL . 10.9 t -67.19 -40.91 86.12 Favored 'Isoleucine or valine' 0 N--CA 1.497 1.891 0 O-C-N 121.657 -0.652 . . . . 0.0 110.512 179.446 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 10' ' ' GLU . . . . . . . . . . . . . 55.2 mt-10 -67.85 -43.51 79.32 Favored 'General case' 0 N--CA 1.5 2.056 0 O-C-N 121.416 -0.802 . . . . 0.0 111.588 -179.348 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 11' ' ' GLN . . . . . . . . . . . . . 3.1 mp0 -86.24 -80.16 0.24 Allowed 'General case' 0 N--CA 1.496 1.844 0 O-C-N 121.308 -0.87 . . . . 0.0 111.091 -178.786 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 12' ' ' LEU . . . . . 0.469 ' HG ' ' O ' ' A' ' 8' ' ' ALA . 4.8 mt 57.33 -168.45 0.12 Allowed 'General case' 0 N--CA 1.504 2.271 0 O-C-N 121.476 -0.765 . . . . 0.0 109.981 -179.076 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 13' ' ' THR . . . . . 0.442 ' OG1' ' HB2' ' A' ' 16' ' ' GLN . 76.0 p -120.49 159.58 24.89 Favored 'General case' 0 N--CA 1.499 1.995 0 O-C-N 120.867 -1.146 . . . . 0.0 110.078 179.406 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 14' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -53.15 -43.08 66.71 Favored 'General case' 0 N--CA 1.493 1.703 0 C-N-CA 120.278 -0.569 . . . . 0.0 110.441 -179.632 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 1.2 mp0 -65.38 -59.23 4.24 Favored 'General case' 0 N--CA 1.496 1.83 0 O-C-N 121.56 -0.713 . . . . 0.0 110.31 -179.956 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 16' ' ' GLN . . . . . 0.442 ' HB2' ' OG1' ' A' ' 13' ' ' THR . 0.9 OUTLIER -50.65 -52.73 36.95 Favored 'General case' 0 N--CA 1.501 2.098 0 O-C-N 121.352 -0.843 . . . . 0.0 111.257 -179.728 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' A' A ' 17' ' ' LYS . . . . . 0.425 ' O ' ' HB3' ' A' ' 21' ' ' LYS . 3.2 tttp -57.92 -41.25 82.3 Favored 'General case' 0 N--CA 1.501 2.09 0 O-C-N 121.827 -0.546 . . . . 0.0 110.7 179.847 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 18' ' ' ASN . . . . . . . . . . . . . 12.8 m-20 -70.95 -48.45 53.36 Favored 'General case' 0 N--CA 1.501 2.079 0 O-C-N 121.259 -0.9 . . . . 0.0 110.207 179.592 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 0.5 OUTLIER -59.12 -46.14 89.09 Favored 'General case' 0 N--CA 1.495 1.8 0 O-C-N 121.611 -0.68 . . . . 0.0 110.436 179.933 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 20' ' ' PHE . . . . . 0.477 ' CE1' ' HG2' ' A' ' 81' ' ' MET . 19.6 m-30 -64.54 -38.0 89.49 Favored 'General case' 0 N--CA 1.498 1.965 0 O-C-N 121.29 -0.881 . . . . 0.0 110.004 179.562 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 21' ' ' LYS . . . . . 0.514 ' HG3' ' N ' ' A' ' 22' ' ' ALA . 0.0 OUTLIER -62.9 -36.68 84.14 Favored 'General case' 0 N--CA 1.5 2.05 0 O-C-N 121.38 -0.825 . . . . 0.0 109.242 178.725 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' A' A ' 22' ' ' ALA . . . . . 0.514 ' N ' ' HG3' ' A' ' 21' ' ' LYS . . . -70.03 -49.39 51.77 Favored 'General case' 0 N--CA 1.494 1.736 0 O-C-N 121.47 -0.769 . . . . 0.0 109.382 178.841 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 23' ' ' ALA . . . . . . . . . . . . . . . -61.74 -41.59 97.86 Favored 'General case' 0 N--CA 1.496 1.835 0 O-C-N 121.685 -0.635 . . . . 0.0 109.848 179.087 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 24' ' ' PHE . . . . . 0.504 ' CE1' ' HA ' ' A' ' 74' ' ' PHE . 82.7 t80 -61.33 -45.65 93.53 Favored 'General case' 0 N--CA 1.498 1.941 0 O-C-N 121.69 -0.631 . . . . 0.0 110.257 179.582 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 25' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -53.73 -51.47 63.21 Favored 'General case' 0 N--CA 1.498 1.973 0 O-C-N 121.661 -0.649 . . . . 0.0 110.504 179.87 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 26' ' ' ILE . . . . . 0.465 HD13 HD13 ' B' ' 157' ' ' LEU . 2.8 mt -69.07 -31.63 51.03 Favored 'Isoleucine or valine' 0 N--CA 1.498 1.975 0 O-C-N 121.221 -0.924 . . . . 0.0 110.148 179.532 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 27' ' ' PHE . . . . . . . . . . . . . 0.2 OUTLIER -67.15 -43.2 82.92 Favored 'General case' 0 N--CA 1.497 1.898 0 O-C-N 121.126 -0.984 . . . . 0.0 110.259 179.505 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 28' ' ' VAL . . . . . . . . . . . . . 12.8 m -81.72 -16.69 11.99 Favored 'Isoleucine or valine' 0 N--CA 1.502 2.14 0 O-C-N 121.182 -0.948 . . . . 0.0 110.397 179.322 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 29' ' ' LEU . . . . . . . . . . . . . 1.5 tp -61.13 118.52 6.91 Favored 'General case' 0 N--CA 1.49 1.528 0 N-CA-C 108.354 -0.98 . . . . 0.0 108.354 178.979 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 30' ' ' GLY . . . . . . . . . . . . . . . 99.68 22.97 11.38 Favored Glycine 0 N--CA 1.496 2.683 0 N-CA-C 109.678 -1.369 . . . . 0.0 109.678 -178.206 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 31' ' ' ALA . . . . . . . . . . . . . . . -110.14 133.07 53.59 Favored 'General case' 0 N--CA 1.496 1.857 0 O-C-N 121.349 -1.089 . . . . 0.0 109.516 179.596 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 32' ' ' GLU . . . . . . . . . . . . . 2.0 mp0 -85.02 82.78 8.3 Favored 'General case' 0 N--CA 1.497 1.885 0 O-C-N 121.259 -0.901 . . . . 0.0 110.716 -179.143 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 3.2 m-20 49.16 43.64 22.68 Favored 'General case' 0 N--CA 1.503 2.224 0 O-C-N 121.875 -0.516 . . . . 0.0 111.391 179.658 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 34' ' ' GLY . . . . . . . . . . . . . . . -137.7 26.96 2.86 Favored Glycine 0 N--CA 1.496 2.679 0 C-N-CA 120.019 -1.086 . . . . 0.0 110.56 179.774 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 35' ' ' CYS . . . . . . . . . . . . . 59.1 m 43.39 -100.06 0.03 OUTLIER 'General case' 0 N--CA 1.504 2.274 0 CA-C-N 117.928 0.864 . . . . 0.0 111.131 179.592 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 36' ' ' ILE . . . . . . . . . . . . . 69.1 mt -129.31 92.52 1.82 Allowed 'Isoleucine or valine' 0 N--CA 1.495 1.804 0 O-C-N 120.99 -1.069 . . . . 0.0 109.987 179.478 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 37' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -95.08 -173.77 3.05 Favored 'General case' 0 N--CA 1.495 1.794 0 O-C-N 121.277 -0.889 . . . . 0.0 109.345 179.283 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 38' ' ' THR . . . . . . . . . . . . . 1.6 p -59.72 -33.52 71.73 Favored 'General case' 0 N--CA 1.499 2.001 0 O-C-N 121.062 -1.024 . . . . 0.0 109.792 179.376 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 39' ' ' LYS . . . . . . . . . . . . . 23.5 ttpp -62.69 -38.6 91.02 Favored 'General case' 0 N--CA 1.499 1.981 0 O-C-N 121.526 -0.734 . . . . 0.0 109.708 178.755 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 0.6 OUTLIER -66.7 -33.6 75.99 Favored 'General case' 0 N--CA 1.498 1.929 0 O-C-N 121.661 -0.65 . . . . 0.0 109.839 179.355 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 41' ' ' LEU . . . . . 0.595 HD13 ' SD ' ' A' ' 45' ' ' MET . 2.8 tm? -66.21 -63.73 1.01 Allowed 'General case' 0 N--CA 1.497 1.875 0 O-C-N 121.385 -0.822 . . . . 0.0 108.946 178.464 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 42' ' ' GLY . . . . . 0.575 ' HA2' ' HB2' ' A' ' 45' ' ' MET . . . -46.96 -28.03 3.73 Favored Glycine 0 N--CA 1.499 2.876 0 N-CA-C 111.08 -0.808 . . . . 0.0 111.08 179.911 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 43' ' ' LYS . . . . . 0.437 ' HA ' ' HD2' ' A' ' 46' ' ' ARG . 0.0 OUTLIER -49.96 -50.93 45.06 Favored 'General case' 0 N--CA 1.501 2.115 0 O-C-N 121.364 -1.08 . . . . 0.0 110.389 179.733 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' A' A ' 44' ' ' VAL . . . . . 0.566 HG22 ' SD ' ' A' ' 45' ' ' MET . 13.6 m -75.68 -35.89 32.39 Favored 'Isoleucine or valine' 0 N--CA 1.502 2.129 0 O-C-N 121.376 -0.828 . . . . 0.0 109.732 179.106 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 45' ' ' MET . . . . . 0.595 ' SD ' HD13 ' A' ' 41' ' ' LEU . 0.0 OUTLIER -57.27 -30.23 64.51 Favored 'General case' 0 N--CA 1.498 1.927 0 O-C-N 121.215 -0.928 . . . . 0.0 110.757 178.679 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' A' A ' 46' ' ' ARG . . . . . 0.437 ' HD2' ' HA ' ' A' ' 43' ' ' LYS . 43.5 mtt85 -58.46 -47.56 83.61 Favored 'General case' 0 N--CA 1.501 2.107 0 O-C-N 121.276 -0.89 . . . . 0.0 109.547 179.135 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 47' ' ' MET . . . . . . . . . . . . . 45.7 mtm -66.05 -30.42 70.94 Favored 'General case' 0 N--CA 1.499 2.014 0 O-C-N 121.59 -0.694 . . . . 0.0 109.687 178.866 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 48' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -71.63 -46.63 58.52 Favored 'General case' 0 N--CA 1.497 1.887 0 O-C-N 121.538 -0.726 . . . . 0.0 110.186 179.334 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 49' ' ' GLY . . . . . . . . . . . . . . . 117.05 -17.14 12.91 Favored Glycine 0 N--CA 1.497 2.765 0 C-N-CA 120.51 -0.852 . . . . 0.0 111.176 179.543 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 50' ' ' GLN . . . . . . . . . . . . . 2.3 mt-30 -109.83 104.38 13.32 Favored 'General case' 0 N--CA 1.499 2.016 0 O-C-N 120.886 -1.361 . . . . 0.0 111.122 -179.427 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 51' ' ' ASN . . . . . . . . . . . . . 31.7 t30 -154.92 101.58 2.32 Favored Pre-proline 0 N--CA 1.496 1.873 0 O-C-N 121.465 -0.772 . . . . 0.0 110.003 179.283 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 52' ' ' PRO . . . . . 0.465 ' HD3' ' HD3' ' B' ' 144' ' ' ARG . 50.5 Cg_endo -77.1 -91.46 0.0 OUTLIER 'Trans proline' 0 C--N 1.315 -1.207 0 O-C-N 123.787 1.414 . . . . 0.0 111.268 -179.411 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 53' ' ' THR . . . . . . . . . . . . . 3.1 p -130.91 163.67 47.31 Favored Pre-proline 0 N--CA 1.493 1.691 0 O-C-N 120.93 -1.106 . . . . 0.0 110.774 -179.228 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 54' ' ' PRO . . . . . . . . . . . . . 43.0 Cg_endo -72.48 -33.76 8.31 Favored 'Trans proline' 0 C--N 1.314 -1.28 0 O-C-N 123.955 1.503 . . . . 0.0 110.266 179.487 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 55' ' ' GLU . . . . . . . . . . . . . 3.5 mp0 -61.68 -30.46 70.76 Favored 'General case' 0 N--CA 1.497 1.886 0 O-C-N 121.564 -0.71 . . . . 0.0 110.653 179.751 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 3.0 tt0 -61.17 -39.52 90.45 Favored 'General case' 0 N--CA 1.498 1.941 0 O-C-N 121.384 -0.823 . . . . 0.0 110.639 179.559 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 57' ' ' LEU . . . . . 0.479 HD21 ' HG ' ' A' ' 41' ' ' LEU . 1.1 mt -90.25 -9.68 47.1 Favored 'General case' 0 N--CA 1.497 1.911 0 O-C-N 121.249 -0.907 . . . . 0.0 111.379 -179.878 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 58' ' ' GLN . . . . . 0.464 ' O ' HG21 ' A' ' 61' ' ' ILE . 9.8 mm-40 -59.43 -47.06 86.91 Favored 'General case' 0 N--CA 1.501 2.107 0 O-C-N 120.999 -1.063 . . . . 0.0 110.056 179.665 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 59' ' ' GLU . . . . . . . . . . . . . 0.5 OUTLIER -63.95 -32.84 74.52 Favored 'General case' 0 N--CA 1.502 2.157 0 O-C-N 121.07 -1.019 . . . . 0.0 109.89 178.912 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 60' ' ' MET . . . . . . . . . . . . . 4.2 tmm? -65.92 -35.96 82.05 Favored 'General case' 0 N--CA 1.496 1.862 0 O-C-N 121.424 -0.798 . . . . 0.0 110.32 179.428 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 61' ' ' ILE . . . . . 0.533 HG13 ' CG2' ' A' ' 72' ' ' VAL . 1.1 tt -63.26 -29.12 46.44 Favored 'Isoleucine or valine' 0 N--CA 1.499 1.992 0 O-C-N 121.326 -0.859 . . . . 0.0 110.708 179.645 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 62' ' ' ASP . . . . . 0.459 ' N ' HG21 ' A' ' 61' ' ' ILE . 3.7 m-20 -62.21 -45.25 94.18 Favored 'General case' 0 N--CA 1.498 1.933 0 O-C-N 121.185 -0.947 . . . . 0.0 110.145 179.644 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 63' ' ' GLU . . . . . . . . . . . . . 4.0 tm-20 -69.51 -42.61 74.48 Favored 'General case' 0 N--CA 1.498 1.956 0 O-C-N 121.537 -0.727 . . . . 0.0 110.247 179.431 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 64' ' ' VAL . . . . . . . . . . . . . 77.0 t -72.19 -23.96 22.02 Favored 'Isoleucine or valine' 0 N--CA 1.498 1.952 0 O-C-N 121.383 -0.823 . . . . 0.0 110.901 -179.947 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 65' ' ' ASP . . . . . 0.469 ' O ' ' HG2' ' A' ' 66' ' ' GLU . 17.1 t70 -86.93 -68.17 0.77 Allowed 'General case' 0 N--CA 1.497 1.882 0 O-C-N 121.079 -1.013 . . . . 0.0 110.298 -179.878 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 66' ' ' GLU . . . . . 0.469 ' HG2' ' O ' ' A' ' 65' ' ' ASP . 0.4 OUTLIER 44.02 28.76 0.28 Allowed 'General case' 0 N--CA 1.507 2.414 0 N-CA-C 112.615 0.598 . . . . 0.0 112.615 179.903 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' A' A ' 67' ' ' ASP . . . . . . . . . . . . . 0.0 OUTLIER -110.57 -23.53 11.06 Favored 'General case' 0 N--CA 1.498 1.932 0 O-C-N 120.723 -1.236 . . . . 0.0 111.236 179.623 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 68' ' ' GLY . . . . . . . . . . . . . . . 131.22 -50.19 0.9 Allowed Glycine 0 N--CA 1.495 2.59 0 N-CA-C 110.255 -1.138 . . . . 0.0 110.255 -179.981 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 69' ' ' SER . . . . . . . . . . . . . 5.4 p -66.84 -37.2 84.02 Favored 'General case' 0 N--CA 1.499 1.979 0 O-C-N 121.392 -1.063 . . . . 0.0 111.192 -179.491 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 70' ' ' GLY . . . . . . . . . . . . . . . 99.42 -43.73 1.78 Allowed Glycine 0 N--CA 1.496 2.691 0 N-CA-C 110.365 -1.094 . . . . 0.0 110.365 179.781 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 71' ' ' THR . . . . . . . . . . . . . 0.6 OUTLIER -71.82 139.3 48.88 Favored 'General case' 0 N--CA 1.503 2.205 0 O-C-N 121.197 -1.178 . . . . 0.0 110.443 -179.63 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 72' ' ' VAL . . . . . 0.533 ' CG2' HG13 ' A' ' 61' ' ' ILE . 6.6 t -75.88 131.34 35.11 Favored 'Isoleucine or valine' 0 N--CA 1.498 1.964 0 O-C-N 121.543 -0.723 . . . . 0.0 110.395 179.844 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 73' ' ' ASP . . . . . . . . . . . . . 29.5 m-20 -117.29 -164.11 0.97 Allowed 'General case' 0 N--CA 1.5 2.03 0 O-C-N 121.373 -0.83 . . . . 0.0 110.55 -179.935 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 74' ' ' PHE . . . . . 0.504 ' HA ' ' CE1' ' A' ' 24' ' ' PHE . 87.9 t80 -66.2 -45.83 79.41 Favored 'General case' 0 N--CA 1.502 2.156 0 O-C-N 121.38 -0.825 . . . . 0.0 110.305 179.849 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 75' ' ' ASP . . . . . . . . . . . . . 1.1 m-20 -58.56 -47.8 83.01 Favored 'General case' 0 N--CA 1.497 1.887 0 O-C-N 121.58 -0.7 . . . . 0.0 109.886 179.441 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 76' ' ' GLU . . . . . . . . . . . . . 2.1 mt-10 -67.65 -33.96 76.0 Favored 'General case' 0 N--CA 1.496 1.844 0 O-C-N 121.501 -0.749 . . . . 0.0 109.821 179.044 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 77' ' ' PHE . . . . . . . . . . . . . 47.9 t80 -56.82 -40.27 75.71 Favored 'General case' 0 N--CA 1.5 2.071 0 O-C-N 121.409 -0.807 . . . . 0.0 108.915 178.324 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 78' ' ' LEU . . . . . . . . . . . . . 66.6 mt -69.36 -42.88 74.65 Favored 'General case' 0 N--CA 1.495 1.779 0 N-CA-C 109.041 -0.725 . . . . 0.0 109.041 178.21 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 79' ' ' VAL . . . . . 0.446 ' O ' HG12 ' A' ' 82' ' ' VAL . 71.9 t -63.71 -34.97 71.18 Favored 'Isoleucine or valine' 0 N--CA 1.501 2.085 0 O-C-N 121.588 -0.695 . . . . 0.0 109.924 178.984 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 80' ' ' MET . . . . . . . . . . . . . 0.5 OUTLIER -69.07 -43.07 75.33 Favored 'General case' 0 N--CA 1.495 1.807 0 O-C-N 121.344 -0.848 . . . . 0.0 109.685 179.223 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 81' ' ' MET . . . . . 0.477 ' HG2' ' CE1' ' A' ' 20' ' ' PHE . 12.9 tpp -65.09 -49.39 70.17 Favored 'General case' 0 N--CA 1.497 1.919 0 O-C-N 121.556 -0.715 . . . . 0.0 109.949 179.556 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 82' ' ' VAL . . . . . 0.482 HG21 ' HB3' ' A' ' 87' ' ' ASP . 7.2 p -61.57 -27.95 43.08 Favored 'Isoleucine or valine' 0 N--CA 1.501 2.115 0 O-C-N 121.256 -0.902 . . . . 0.0 109.492 178.549 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 83' ' ' ARG . . . . . . . . . . . . . 1.6 mtt180 -71.65 -39.63 70.2 Favored 'General case' 0 N--CA 1.499 1.989 0 O-C-N 121.427 -0.796 . . . . 0.0 109.54 178.466 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 84' ' ' CYS . . . . . . . . . . . . . 0.0 OUTLIER -69.08 -50.69 46.06 Favored 'General case' 0 N--CA 1.5 2.053 0 O-C-N 121.499 -0.751 . . . . 0.0 110.47 179.872 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 85' ' ' MET . . . . . 0.494 ' HG3' ' HB2' ' A' ' 87' ' ' ASP . 2.5 ptt? -77.2 -3.41 39.44 Favored 'General case' 0 N--CA 1.499 2.025 0 O-C-N 121.259 -0.901 . . . . 0.0 111.202 179.85 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 86' ' ' LYS . . . . . . . . . . . . . 1.4 ttpp 56.97 45.05 21.91 Favored 'General case' 0 N--CA 1.5 2.049 0 O-C-N 121.336 -0.853 . . . . 0.0 111.215 179.672 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 87' ' ' ASP . . . . . 0.494 ' HB2' ' HG3' ' A' ' 85' ' ' MET . 17.3 t70 -84.87 87.03 7.3 Favored 'General case' 0 N--CA 1.494 1.733 0 O-C-N 121.12 -0.987 . . . . 0.0 109.376 179.15 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 88' ' ' ASP . . . . . . . . . . . . . 19.6 m-20 -83.39 76.64 9.9 Favored 'General case' 0 N--CA 1.494 1.77 0 O-C-N 121.332 -0.855 . . . . 0.0 110.132 -179.538 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 89' ' ' SER . . . . . . . . . . . . . 4.2 m . . . . . 0 N--CA 1.496 1.85 0 CA-C-O 117.918 -1.039 . . . . 0.0 110.393 -179.837 . . . . . . . . 0 0 . 1 . 009 nuclear orig full ' B' B ' 144' ' ' ARG . . . . . 0.465 ' HD3' ' HD3' ' A' ' 52' ' ' PRO . 10.3 ttp-105 . . . . . 0 N--CA 1.495 1.808 0 CA-C-O 121.002 0.43 . . . . 0.0 110.148 . . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 145' ' ' ARG . . . . . . . . . . . . . 16.8 mmt180 -91.21 147.73 22.85 Favored 'General case' 0 N--CA 1.497 1.917 0 O-C-N 121.356 -0.84 . . . . 0.0 109.923 179.737 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 146' ' ' VAL . . . . . . . . . . . . . 11.3 p -150.04 145.77 17.1 Favored 'Isoleucine or valine' 0 N--CA 1.498 1.926 0 O-C-N 121.37 -0.831 . . . . 0.0 110.515 -179.788 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 147' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -92.17 -27.58 17.6 Favored 'General case' 0 N--CA 1.498 1.974 0 O-C-N 121.399 -0.813 . . . . 0.0 111.38 -179.595 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' B' B ' 148' ' ' ILE . . . . . . . . . . . . . 21.2 mm 61.64 80.34 0.07 OUTLIER 'Isoleucine or valine' 0 N--CA 1.506 2.341 0 O-C-N 121.559 -0.713 . . . . 0.0 110.413 -179.695 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 149' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -80.79 112.78 18.48 Favored 'General case' 0 N--CA 1.496 1.867 0 O-C-N 121.157 -0.964 . . . . 0.0 109.994 179.756 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' B' B ' 150' ' ' ALA . . . . . . . . . . . . . . . -58.58 -41.01 84.76 Favored 'General case' 0 N--CA 1.499 1.977 0 O-C-N 121.603 -0.686 . . . . 0.0 110.749 -179.644 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 151' ' ' ASP . . . . . . . . . . . . . 7.2 p-10 -64.3 -38.1 89.84 Favored 'General case' 0 N--CA 1.5 2.03 0 O-C-N 121.46 -0.775 . . . . 0.0 110.599 179.574 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 152' ' ' ALA . . . . . . . . . . . . . . . -78.06 -46.78 19.93 Favored 'General case' 0 N--CA 1.496 1.852 0 O-C-N 121.368 -0.833 . . . . 0.0 110.295 179.742 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 153' ' ' MET . . . . . . . . . . . . . 8.5 tpp -56.69 -43.7 80.75 Favored 'General case' 0 N--CA 1.499 1.992 0 O-C-N 121.494 -0.754 . . . . 0.0 110.332 179.728 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 154' ' ' MET . . . . . 0.514 ' O ' ' HB2' ' B' ' 158' ' ' LEU . 9.0 mmm -58.01 -52.75 64.21 Favored 'General case' 0 N--CA 1.498 1.946 0 O-C-N 121.442 -0.786 . . . . 0.0 110.448 179.88 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' B' B ' 155' ' ' GLN . . . . . . . . . . . . . 0.9 OUTLIER -62.44 -32.64 73.53 Favored 'General case' 0 N--CA 1.499 1.993 0 O-C-N 121.434 -0.791 . . . . 0.0 111.001 -179.959 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' B' B ' 156' ' ' ALA . . . . . . . . . . . . . . . -55.52 -34.92 65.08 Favored 'General case' 0 N--CA 1.501 2.094 0 O-C-N 121.38 -0.825 . . . . 0.0 111.095 179.954 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 157' ' ' LEU . . . . . 0.465 HD13 HD13 ' A' ' 26' ' ' ILE . 1.6 pp -112.43 8.22 19.37 Favored 'General case' 0 N--CA 1.5 2.054 0 O-C-N 121.17 -0.956 . . . . 0.0 111.796 -179.709 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' B' B ' 158' ' ' LEU . . . . . 0.514 ' HB2' ' O ' ' B' ' 154' ' ' MET . 0.0 OUTLIER -117.23 -46.68 2.69 Favored 'General case' 0 N--CA 1.498 1.968 0 O-C-N 120.922 -1.111 . . . . 0.0 110.682 179.682 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' B' B ' 159' ' ' GLY . . . . . . . . . . . . . . . -135.04 63.7 0.6 Allowed Glycine 0 N--CA 1.497 2.709 0 N-CA-C 110.273 -1.131 . . . . 0.0 110.273 -179.587 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 160' ' ' ALA . . . . . . . . . . . . . . . -138.92 -74.31 0.38 Allowed 'General case' 0 N--CA 1.498 1.955 0 O-C-N 121.423 -1.045 . . . . 0.0 110.297 179.556 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 161' ' ' ARG . . . . . . . . . . . . . 2.8 tpt180 -159.85 51.89 0.34 Allowed 'General case' 0 N--CA 1.498 1.95 0 O-C-N 121.298 -0.876 . . . . 0.0 110.088 179.83 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 162' ' ' ALA . . . . . . . . . . . . . . . -138.89 116.53 11.39 Favored 'General case' 0 N--CA 1.494 1.766 0 O-C-N 121.302 -0.874 . . . . 0.0 110.14 -179.9 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 163' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.496 1.825 0 CA-C-O 117.914 -1.041 . . . . 0.0 110.531 -179.75 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 90' ' ' ' CA' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 009 nuclear orig full ' A' A ' 91' ' ' SXK . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 010 nuclear orig full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 13.8 mmt . . . . . 0 N--CA 1.499 2.005 0 N-CA-C 109.627 -0.509 . . . . 0.0 109.627 . . . . . . . . . 0 0 . 1 . 010 nuclear orig full ' A' A ' 2' ' ' ASP . . . . . . . . . . . . . 7.3 m-20 -128.38 112.48 14.45 Favored 'General case' 0 N--CA 1.495 1.787 0 O-C-N 121.36 -0.837 . . . . 0.0 110.722 -179.033 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 3' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER 52.69 60.33 3.87 Favored 'General case' 0 N--CA 1.502 2.142 0 CA-C-O 121.42 0.628 . . . . 0.0 111.653 179.554 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 4' ' ' ILE . . . . . . . . . . . . . 23.6 mm -93.19 -52.55 9.7 Favored 'Isoleucine or valine' 0 N--CA 1.497 1.882 0 O-C-N 121.201 -0.937 . . . . 0.0 109.661 179.412 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 5' ' ' TYR . . . . . . . . . . . . . 1.2 m-85 -96.14 -36.85 10.82 Favored 'General case' 0 N--CA 1.494 1.773 0 O-C-N 121.473 -0.767 . . . . 0.0 109.471 179.124 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 2.0 tmmt? -63.22 -28.36 69.98 Favored 'General case' 0 N--CA 1.497 1.893 0 O-C-N 121.433 -0.792 . . . . 0.0 109.819 178.664 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 7' ' ' ALA . . . . . . . . . . . . . . . -53.58 -44.83 69.66 Favored 'General case' 0 N--CA 1.497 1.923 0 O-C-N 121.609 -0.682 . . . . 0.0 109.287 178.948 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 8' ' ' ALA . . . . . . . . . . . . . . . -67.29 -43.65 81.23 Favored 'General case' 0 N--CA 1.495 1.802 0 O-C-N 121.533 -0.729 . . . . 0.0 109.256 178.331 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 9' ' ' VAL . . . . . 0.518 HG21 ' HA ' ' A' ' 79' ' ' VAL . 53.0 t -56.62 -40.42 69.07 Favored 'Isoleucine or valine' 0 N--CA 1.5 2.075 0 O-C-N 121.8 -0.563 . . . . 0.0 110.404 179.585 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 10' ' ' GLU . . . . . . . . . . . . . 0.7 OUTLIER -63.77 -44.41 93.47 Favored 'General case' 0 N--CA 1.496 1.853 0 O-C-N 121.437 -0.789 . . . . 0.0 111.333 -179.604 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 11' ' ' GLN . . . . . . . . . . . . . 4.3 mt-30 -139.69 82.84 1.9 Allowed 'General case' 0 N--CA 1.496 1.839 0 O-C-N 121.138 -0.976 . . . . 0.0 111.184 -179.704 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 12' ' ' LEU . . . . . . . . . . . . . 36.1 mt -70.79 -74.23 0.15 Allowed 'General case' 0 N--CA 1.498 1.956 0 O-C-N 121.197 -0.94 . . . . 0.0 108.792 178.703 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 13' ' ' THR . . . . . 0.483 ' HB ' ' HB2' ' A' ' 16' ' ' GLN . 2.1 m -157.21 156.55 32.75 Favored 'General case' 0 N--CA 1.494 1.731 0 N-CA-C 108.657 -0.868 . . . . 0.0 108.657 178.55 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 14' ' ' GLU . . . . . . . . . . . . . 2.7 tp10 -53.97 -33.06 55.92 Favored 'General case' 0 N--CA 1.494 1.741 0 O-C-N 121.531 -0.73 . . . . 0.0 110.825 -179.394 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 1.7 mp0 -90.72 -44.37 9.52 Favored 'General case' 0 N--CA 1.495 1.78 0 O-C-N 121.316 -0.865 . . . . 0.0 110.649 179.973 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 16' ' ' GLN . . . . . 0.483 ' HB2' ' HB ' ' A' ' 13' ' ' THR . 0.8 OUTLIER -48.24 -59.89 3.07 Favored 'General case' 0 N--CA 1.503 2.194 0 O-C-N 121.503 -0.748 . . . . 0.0 111.123 -179.408 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' A' A ' 17' ' ' LYS . . . . . . . . . . . . . 1.0 OUTLIER -56.91 -39.73 74.99 Favored 'General case' 0 N--CA 1.498 1.962 0 O-C-N 121.891 -0.506 . . . . 0.0 110.375 179.898 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 18' ' ' ASN . . . . . . . . . . . . . 2.1 t-20 -66.56 -39.63 88.6 Favored 'General case' 0 N--CA 1.499 2.022 0 O-C-N 121.302 -0.874 . . . . 0.0 110.129 179.26 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 17.0 mt-10 -62.23 -40.41 96.04 Favored 'General case' 0 N--CA 1.497 1.916 0 O-C-N 121.327 -0.858 . . . . 0.0 109.673 179.078 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 20' ' ' PHE . . . . . . . . . . . . . 33.9 m-85 -66.35 -31.53 72.37 Favored 'General case' 0 N--CA 1.498 1.936 0 O-C-N 121.482 -0.761 . . . . 0.0 109.559 178.728 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 21' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -60.22 -43.69 95.79 Favored 'General case' 0 N--CA 1.497 1.92 0 O-C-N 121.438 -0.789 . . . . 0.0 109.05 178.836 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 22' ' ' ALA . . . . . . . . . . . . . . . -72.18 -39.91 68.31 Favored 'General case' 0 N--CA 1.495 1.804 0 O-C-N 121.637 -0.664 . . . . 0.0 109.394 178.681 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 23' ' ' ALA . . . . . 0.41 ' HB3' ' CD1' ' B' ' 158' ' ' LEU . . . -65.7 -28.67 69.24 Favored 'General case' 0 N--CA 1.498 1.971 0 O-C-N 121.345 -0.847 . . . . 0.0 109.778 178.821 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 24' ' ' PHE . . . . . . . . . . . . . 23.7 t80 -69.53 -34.03 73.65 Favored 'General case' 0 N--CA 1.495 1.787 0 O-C-N 121.581 -0.7 . . . . 0.0 110.188 179.514 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 25' ' ' ASP . . . . . . . . . . . . . 21.5 m-20 -52.26 -53.11 47.99 Favored 'General case' 0 N--CA 1.501 2.12 0 O-C-N 121.367 -0.833 . . . . 0.0 111.024 179.875 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 26' ' ' ILE . . . . . 0.498 ' HA ' HD22 ' A' ' 29' ' ' LEU . 1.1 pt -75.01 -20.46 16.48 Favored 'Isoleucine or valine' 0 N--CA 1.503 2.179 0 O-C-N 121.256 -0.902 . . . . 0.0 111.077 -179.866 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 27' ' ' PHE . . . . . 0.415 ' CZ ' HG23 ' A' ' 44' ' ' VAL . 0.1 OUTLIER -75.83 -17.5 59.81 Favored 'General case' 0 N--CA 1.496 1.848 0 O-C-N 120.933 -1.104 . . . . 0.0 110.196 179.169 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' A' A ' 28' ' ' VAL . . . . . . . . . . . . . 20.6 m -129.25 26.27 1.92 Allowed 'Isoleucine or valine' 0 N--CA 1.499 1.997 0 O-C-N 121.305 -0.872 . . . . 0.0 110.74 179.93 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 29' ' ' LEU . . . . . 0.498 HD22 ' HA ' ' A' ' 26' ' ' ILE . 3.5 pp -74.29 -27.32 60.67 Favored 'General case' 0 N--CA 1.501 2.094 0 O-C-N 120.996 -1.065 . . . . 0.0 111.068 -179.854 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 30' ' ' GLY . . . . . . . . . . . . . . . -105.72 42.27 1.95 Allowed Glycine 0 N--CA 1.495 2.607 0 N-CA-C 109.784 -1.326 . . . . 0.0 109.784 179.866 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 31' ' ' ALA . . . . . 0.435 ' HB3' ' HG3' ' A' ' 40' ' ' GLU . . . -145.74 127.45 15.25 Favored 'General case' 0 N--CA 1.494 1.756 0 O-C-N 121.395 -1.062 . . . . 0.0 110.426 -179.847 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 32' ' ' GLU . . . . . . . . . . . . . 1.7 mp0 -76.84 -15.17 59.79 Favored 'General case' 0 N--CA 1.501 2.09 0 O-C-N 121.391 -0.818 . . . . 0.0 110.622 179.678 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 7.6 m-20 -69.63 -30.14 67.79 Favored 'General case' 0 N--CA 1.497 1.894 0 O-C-N 121.302 -0.874 . . . . 0.0 110.792 -179.949 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 34' ' ' GLY . . . . . . . . . . . . . . . 87.51 12.11 67.64 Favored Glycine 0 N--CA 1.496 2.681 0 N-CA-C 109.996 -1.242 . . . . 0.0 109.996 -179.511 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 35' ' ' CYS . . . . . . . . . . . . . 64.2 m -136.47 168.78 18.81 Favored 'General case' 0 N--CA 1.495 1.818 0 O-C-N 121.301 -1.117 . . . . 0.0 110.116 -179.921 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 36' ' ' ILE . . . . . 0.457 HG21 HD21 ' A' ' 41' ' ' LEU . 78.7 mt -81.34 105.07 10.81 Favored 'Isoleucine or valine' 0 N--CA 1.498 1.946 0 O-C-N 121.142 -0.974 . . . . 0.0 110.21 -179.907 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 37' ' ' SER . . . . . . . . . . . . . 89.2 p -96.14 -177.24 3.92 Favored 'General case' 0 N--CA 1.495 1.809 0 O-C-N 121.502 -0.749 . . . . 0.0 110.237 179.773 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 38' ' ' THR . . . . . 0.442 ' HB ' ' O ' ' A' ' 54' ' ' PRO . 1.8 p -59.38 -43.94 92.83 Favored 'General case' 0 N--CA 1.502 2.129 0 O-C-N 121.438 -0.789 . . . . 0.0 110.459 179.789 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 39' ' ' LYS . . . . . 0.565 ' HA ' ' HB3' ' A' ' 54' ' ' PRO . 0.0 OUTLIER -62.98 -45.52 92.02 Favored 'General case' 0 N--CA 1.496 1.85 0 O-C-N 121.57 -0.706 . . . . 0.0 110.092 179.527 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' A' A ' 40' ' ' GLU . . . . . 0.435 ' HG3' ' HB3' ' A' ' 31' ' ' ALA . 19.0 mm-40 -69.42 -29.03 66.66 Favored 'General case' 0 N--CA 1.498 1.947 0 O-C-N 121.414 -0.804 . . . . 0.0 110.39 179.647 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 41' ' ' LEU . . . . . 0.573 ' CD2' ' HAK' ' A' ' 91' ' ' SXK . 0.1 OUTLIER -73.32 -61.29 1.88 Allowed 'General case' 0 N--CA 1.497 1.904 0 O-C-N 121.253 -0.904 . . . . 0.0 108.833 178.603 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' A' A ' 42' ' ' GLY . . . . . 0.543 ' HA2' ' HB2' ' A' ' 45' ' ' MET . . . -49.53 -30.96 13.75 Favored Glycine 0 N--CA 1.499 2.856 0 N-CA-C 109.933 -1.267 . . . . 0.0 109.933 179.112 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 43' ' ' LYS . . . . . 0.43 ' HB3' ' O ' ' A' ' 40' ' ' GLU . 0.9 OUTLIER -48.98 -48.87 42.9 Favored 'General case' 0 N--CA 1.502 2.145 0 O-C-N 121.623 -0.928 . . . . 0.0 110.653 179.344 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' A' A ' 44' ' ' VAL . . . . . 0.415 HG23 ' CZ ' ' A' ' 27' ' ' PHE . 28.5 m -82.87 -23.86 8.54 Favored 'Isoleucine or valine' 0 N--CA 1.501 2.092 0 O-C-N 121.373 -0.83 . . . . 0.0 110.461 179.563 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 45' ' ' MET . . . . . 0.543 ' HB2' ' HA2' ' A' ' 42' ' ' GLY . 0.0 OUTLIER -65.43 -38.27 89.4 Favored 'General case' 0 N--CA 1.499 1.997 0 O-C-N 121.337 -0.852 . . . . 0.0 110.321 179.404 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' A' A ' 46' ' ' ARG . . . . . 0.435 ' CB ' ' HB3' ' A' ' 51' ' ' ASN . 13.2 ttt180 -62.19 -51.58 67.23 Favored 'General case' 0 N--CA 1.5 2.039 0 O-C-N 121.626 -0.671 . . . . 0.0 110.962 -179.746 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 47' ' ' MET . . . . . . . . . . . . . 4.9 ptm -67.25 -28.23 67.88 Favored 'General case' 0 N--CA 1.498 1.971 0 O-C-N 121.296 -0.877 . . . . 0.0 111.186 -179.661 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 48' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -79.83 -46.01 17.69 Favored 'General case' 0 N--CA 1.497 1.879 0 O-C-N 121.051 -1.031 . . . . 0.0 110.708 179.932 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 49' ' ' GLY . . . . . . . . . . . . . . . -147.21 -77.83 0.02 OUTLIER Glycine 0 N--CA 1.496 2.679 0 N-CA-C 110.107 -1.197 . . . . 0.0 110.107 -179.875 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 50' ' ' GLN . . . . . . . . . . . . . 2.4 pp0? -147.98 160.72 42.53 Favored 'General case' 0 N--CA 1.498 1.946 0 O-C-N 121.306 -1.114 . . . . 0.0 111.083 -179.822 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 51' ' ' ASN . . . . . 0.435 ' HB3' ' CB ' ' A' ' 46' ' ' ARG . 24.7 t30 -175.0 93.44 0.29 Allowed Pre-proline 0 N--CA 1.494 1.764 0 O-C-N 121.779 -0.576 . . . . 0.0 109.641 179.467 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 52' ' ' PRO . . . . . . . . . . . . . 42.1 Cg_endo -73.17 -65.95 0.03 OUTLIER 'Trans proline' 0 C--N 1.312 -1.387 0 O-C-N 123.658 1.346 . . . . 0.0 110.187 -179.943 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 53' ' ' THR . . . . . . . . . . . . . 1.8 p -129.94 155.76 80.1 Favored Pre-proline 0 N--CA 1.489 1.512 0 O-C-N 121.4 -0.813 . . . . 0.0 109.579 179.29 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 54' ' ' PRO . . . . . 0.565 ' HB3' ' HA ' ' A' ' 39' ' ' LYS . 40.4 Cg_endo -66.29 -28.3 47.43 Favored 'Trans proline' 0 C--N 1.31 -1.475 0 O-C-N 123.742 1.39 . . . . 0.0 111.071 -179.982 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 55' ' ' GLU . . . . . . . . . . . . . 1.1 mp0 -60.03 -34.85 73.94 Favored 'General case' 0 N--CA 1.501 2.117 0 O-C-N 121.218 -0.926 . . . . 0.0 110.684 179.559 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 27.1 tt0 -62.52 -21.75 65.77 Favored 'General case' 0 N--CA 1.5 2.059 0 O-C-N 121.404 -0.81 . . . . 0.0 111.529 -179.886 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 57' ' ' LEU . . . . . 0.447 ' N ' ' CD2' ' A' ' 57' ' ' LEU . 3.4 mm? -79.44 -12.51 59.89 Favored 'General case' 0 N--CA 1.499 2.018 0 O-C-N 121.022 -1.049 . . . . 0.0 111.115 -179.916 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 58' ' ' GLN . . . . . 0.431 ' O ' HG22 ' A' ' 61' ' ' ILE . 5.0 pt20 -52.65 -35.36 54.75 Favored 'General case' 0 N--CA 1.5 2.041 0 O-C-N 121.072 -1.018 . . . . 0.0 110.445 -179.712 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 59' ' ' GLU . . . . . . . . . . . . . 6.8 mm-40 -56.22 -34.4 66.27 Favored 'General case' 0 N--CA 1.5 2.038 0 O-C-N 121.02 -1.05 . . . . 0.0 109.891 178.834 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 60' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -82.22 -33.17 29.44 Favored 'General case' 0 N--CA 1.495 1.813 0 O-C-N 121.68 -0.637 . . . . 0.0 110.625 179.522 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 61' ' ' ILE . . . . . 0.468 HG13 HG21 ' A' ' 72' ' ' VAL . 3.4 tt -81.4 -31.69 11.57 Favored 'Isoleucine or valine' 0 N--CA 1.498 1.955 0 O-C-N 121.17 -0.956 . . . . 0.0 111.044 -179.505 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 62' ' ' ASP . . . . . 0.417 ' N ' HG22 ' A' ' 61' ' ' ILE . 6.7 m-20 -69.44 -44.85 70.45 Favored 'General case' 0 N--CA 1.496 1.849 0 O-C-N 121.125 -0.984 . . . . 0.0 111.032 -179.679 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 63' ' ' GLU . . . . . 0.443 ' HG3' ' N ' ' A' ' 64' ' ' VAL . 0.6 OUTLIER -62.47 -23.49 66.94 Favored 'General case' 0 N--CA 1.501 2.076 0 O-C-N 121.333 -0.854 . . . . 0.0 111.714 -179.43 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' A' A ' 64' ' ' VAL . . . . . 0.443 ' N ' ' HG3' ' A' ' 63' ' ' GLU . 44.2 t -107.85 -24.9 3.83 Favored 'Isoleucine or valine' 0 N--CA 1.501 2.096 0 O-C-N 121.014 -1.054 . . . . 0.0 111.648 -179.235 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 65' ' ' ASP . . . . . . . . . . . . . 22.4 t70 -75.91 -91.39 0.03 OUTLIER 'General case' 0 N--CA 1.5 2.028 0 O-C-N 120.949 -1.094 . . . . 0.0 110.456 -179.627 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 66' ' ' GLU . . . . . . . . . . . . . 3.6 mm-40 49.28 33.37 5.14 Favored 'General case' 0 N--CA 1.502 2.174 0 O-C-N 121.333 -0.854 . . . . 0.0 111.544 179.958 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 67' ' ' ASP . . . . . . . . . . . . . 1.9 p-10 -115.24 -22.7 9.3 Favored 'General case' 0 N--CA 1.499 2.018 0 O-C-N 120.968 -1.082 . . . . 0.0 111.475 -179.932 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 68' ' ' GLY . . . . . . . . . . . . . . . 127.68 -30.78 3.91 Favored Glycine 0 N--CA 1.495 2.592 0 N-CA-C 110.074 -1.21 . . . . 0.0 110.074 -179.849 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 69' ' ' SER . . . . . . . . . . . . . 0.9 OUTLIER -78.24 -35.36 48.38 Favored 'General case' 0 N--CA 1.497 1.916 0 O-C-N 121.289 -1.124 . . . . 0.0 111.033 -179.786 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 70' ' ' GLY . . . . . . . . . . . . . . . 91.26 -50.49 3.04 Favored Glycine 0 N--CA 1.499 2.883 0 N-CA-C 110.197 -1.161 . . . . 0.0 110.197 179.89 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 71' ' ' THR . . . . . . . . . . . . . 54.9 m -79.13 154.58 29.23 Favored 'General case' 0 N--CA 1.502 2.13 0 O-C-N 121.298 -1.119 . . . . 0.0 110.977 -179.417 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 72' ' ' VAL . . . . . 0.468 HG21 HG13 ' A' ' 61' ' ' ILE . 2.4 t -81.57 128.82 38.39 Favored 'Isoleucine or valine' 0 N--CA 1.498 1.974 0 O-C-N 121.727 -0.608 . . . . 0.0 110.453 179.728 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 73' ' ' ASP . . . . . . . . . . . . . 1.4 p30 -102.44 -161.07 0.82 Allowed 'General case' 0 N--CA 1.498 1.927 0 O-C-N 121.574 -0.704 . . . . 0.0 109.881 179.263 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 74' ' ' PHE . . . . . . . . . . . . . 45.5 t80 -67.99 -53.06 28.84 Favored 'General case' 0 N--CA 1.499 1.983 0 O-C-N 121.129 -0.982 . . . . 0.0 110.69 -179.577 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 75' ' ' ASP . . . . . . . . . . . . . 1.0 OUTLIER -59.5 -43.01 93.44 Favored 'General case' 0 N--CA 1.498 1.927 0 O-C-N 121.498 -0.751 . . . . 0.0 110.473 179.91 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 76' ' ' GLU . . . . . 0.426 ' HG2' HG13 ' A' ' 64' ' ' VAL . 1.5 mt-10 -65.13 -42.2 94.08 Favored 'General case' 0 N--CA 1.497 1.917 0 O-C-N 121.498 -0.751 . . . . 0.0 109.961 179.335 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 77' ' ' PHE . . . . . . . . . . . . . 25.4 t80 -59.26 -37.34 77.38 Favored 'General case' 0 N--CA 1.497 1.886 0 O-C-N 121.483 -0.761 . . . . 0.0 109.658 179.155 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 78' ' ' LEU . . . . . . . . . . . . . 41.4 mt -66.36 -34.18 77.39 Favored 'General case' 0 N--CA 1.497 1.893 0 O-C-N 121.411 -0.806 . . . . 0.0 109.914 178.987 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 79' ' ' VAL . . . . . 0.518 ' HA ' HG21 ' A' ' 9' ' ' VAL . 55.3 t -64.25 -42.93 96.96 Favored 'Isoleucine or valine' 0 N--CA 1.498 1.955 0 O-C-N 121.359 -0.838 . . . . 0.0 109.699 179.056 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 80' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -60.48 -34.14 73.62 Favored 'General case' 0 N--CA 1.498 1.937 0 O-C-N 121.4 -0.813 . . . . 0.0 110.034 179.318 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 81' ' ' MET . . . . . . . . . . . . . 8.9 mmt -62.92 -53.44 53.98 Favored 'General case' 0 N--CA 1.498 1.955 0 O-C-N 121.459 -0.776 . . . . 0.0 110.34 179.732 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 82' ' ' VAL . . . . . . . . . . . . . 0.6 OUTLIER -66.7 -24.55 33.01 Favored 'Isoleucine or valine' 0 N--CA 1.503 2.189 0 O-C-N 121.165 -0.959 . . . . 0.0 110.035 179.236 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 83' ' ' ARG . . . . . . . . . . . . . 0.6 OUTLIER -78.38 -35.18 47.64 Favored 'General case' 0 N--CA 1.497 1.921 0 O-C-N 121.248 -0.907 . . . . 0.0 109.613 178.829 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 84' ' ' CYS . . . . . . . . . . . . . 1.0 OUTLIER -70.03 -28.91 65.87 Favored 'General case' 0 N--CA 1.498 1.942 0 O-C-N 121.504 -0.747 . . . . 0.0 110.645 179.531 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 85' ' ' MET . . . . . . . . . . . . . 34.0 mtt -51.17 -49.29 61.2 Favored 'General case' 0 N--CA 1.502 2.158 0 O-C-N 121.68 -0.637 . . . . 0.0 110.759 179.867 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 86' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER 66.91 -68.4 0.15 Allowed 'General case' 0 N--CA 1.504 2.275 0 O-C-N 121.872 -0.517 . . . . 0.0 111.331 179.695 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 87' ' ' ASP . . . . . . . . . . . . . 21.2 t70 -114.19 -65.28 1.2 Allowed 'General case' 0 N--CA 1.496 1.856 0 O-C-N 121.195 -0.941 . . . . 0.0 110.509 -179.832 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 88' ' ' ASP . . . . . . . . . . . . . 1.4 t70 -91.04 167.83 12.1 Favored 'General case' 0 N--CA 1.497 1.884 0 O-C-N 121.17 -0.956 . . . . 0.0 110.346 179.876 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 89' ' ' SER . . . . . . . . . . . . . 72.4 m . . . . . 0 N--CA 1.496 1.853 0 CA-C-O 118.24 -0.886 . . . . 0.0 110.515 179.957 . . . . . . . . 0 0 . 1 . 010 nuclear orig full ' B' B ' 144' ' ' ARG . . . . . . . . . . . . . 10.5 ttt85 . . . . . 0 N--CA 1.494 1.759 0 CA-C-O 120.992 0.425 . . . . 0.0 110.308 . . . . . . . . . 0 0 . 1 . 010 nuclear orig full ' B' B ' 145' ' ' ARG . . . . . . . . . . . . . 4.3 tpt180 -155.51 132.54 10.75 Favored 'General case' 0 N--CA 1.494 1.75 0 O-C-N 121.403 -0.81 . . . . 0.0 110.29 -179.746 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 146' ' ' VAL . . . . . . . . . . . . . 30.3 t -121.23 147.61 25.03 Favored 'Isoleucine or valine' 0 N--CA 1.496 1.861 0 O-C-N 121.391 -0.818 . . . . 0.0 109.909 179.946 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 147' ' ' ARG . . . . . 0.44 ' O ' ' HB ' ' B' ' 148' ' ' ILE . 0.1 OUTLIER -77.38 -46.97 21.07 Favored 'General case' 0 N--CA 1.499 2.002 0 O-C-N 121.492 -0.755 . . . . 0.0 110.946 -179.619 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' B' B ' 148' ' ' ILE . . . . . 0.44 ' HB ' ' O ' ' B' ' 147' ' ' ARG . 41.0 mm 63.88 161.01 0.0 OUTLIER 'Isoleucine or valine' 0 N--CA 1.507 2.421 0 CA-C-O 121.276 0.56 . . . . 0.0 110.303 -179.444 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' B' B ' 149' ' ' SER . . . . . . . . . . . . . 6.5 t -153.98 144.08 22.04 Favored 'General case' 0 N--CA 1.498 1.97 0 O-C-N 120.91 -1.119 . . . . 0.0 110.728 179.911 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 150' ' ' ALA . . . . . . . . . . . . . . . -56.35 -43.15 78.82 Favored 'General case' 0 N--CA 1.498 1.944 0 O-C-N 121.494 -0.754 . . . . 0.0 110.543 179.767 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 151' ' ' ASP . . . . . . . . . . . . . 4.8 m-20 -71.11 -48.11 54.15 Favored 'General case' 0 N--CA 1.498 1.95 0 O-C-N 121.406 -0.809 . . . . 0.0 110.28 179.786 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 152' ' ' ALA . . . . . . . . . . . . . . . -60.53 -48.3 82.38 Favored 'General case' 0 N--CA 1.498 1.949 0 O-C-N 121.544 -0.723 . . . . 0.0 110.648 179.88 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 153' ' ' MET . . . . . . . . . . . . . 0.5 OUTLIER -63.25 -37.72 88.35 Favored 'General case' 0 N--CA 1.499 1.985 0 O-C-N 121.364 -0.835 . . . . 0.0 110.195 179.693 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' B' B ' 154' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -65.47 -42.76 91.89 Favored 'General case' 0 N--CA 1.497 1.922 0 O-C-N 121.285 -0.884 . . . . 0.0 110.144 179.461 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' B' B ' 155' ' ' GLN . . . . . . . . . . . . . 14.3 mt-30 -62.92 -42.0 99.65 Favored 'General case' 0 N--CA 1.5 2.053 0 O-C-N 121.54 -0.725 . . . . 0.0 110.32 179.424 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 156' ' ' ALA . . . . . . . . . . . . . . . -70.0 -36.26 75.0 Favored 'General case' 0 N--CA 1.496 1.858 0 O-C-N 121.438 -0.789 . . . . 0.0 110.171 179.73 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 157' ' ' LEU . . . . . . . . . . . . . 4.1 mp -71.05 -61.74 1.65 Allowed 'General case' 0 N--CA 1.496 1.841 0 O-C-N 121.645 -0.659 . . . . 0.0 110.351 -179.967 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 158' ' ' LEU . . . . . 0.41 ' CD1' ' HB3' ' A' ' 23' ' ' ALA . 17.5 mt -108.0 62.58 0.61 Allowed 'General case' 0 N--CA 1.497 1.918 0 O-C-N 121.261 -0.899 . . . . 0.0 109.971 179.821 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' B' B ' 159' ' ' GLY . . . . . . . . . . . . . . . -170.74 -43.11 0.03 OUTLIER Glycine 0 N--CA 1.496 2.682 0 N-CA-C 110.248 -1.141 . . . . 0.0 110.248 -179.831 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 160' ' ' ALA . . . . . . . . . . . . . . . -59.77 97.55 0.04 OUTLIER 'General case' 0 N--CA 1.499 1.999 0 O-C-N 121.435 -1.038 . . . . 0.0 110.362 179.969 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 161' ' ' ARG . . . . . . . . . . . . . 1.8 ttm-85 69.99 -61.12 0.46 Allowed 'General case' 0 N--CA 1.505 2.289 0 O-C-N 121.863 -0.523 . . . . 0.0 111.102 -179.641 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 162' ' ' ALA . . . . . . . . . . . . . . . -93.73 163.63 13.46 Favored 'General case' 0 N--CA 1.497 1.895 0 O-C-N 121.172 -0.955 . . . . 0.0 110.611 -179.929 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 163' ' ' LYS . . . . . . . . . . . . . 0.3 OUTLIER . . . . . 0 N--CA 1.497 1.925 0 CA-C-O 117.821 -1.085 . . . . 0.0 110.431 179.84 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 90' ' ' ' CA' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 010 nuclear orig full ' A' A ' 91' ' ' SXK . . . . . 0.573 ' HAK' ' CD2' ' A' ' 41' ' ' LEU . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.497 1.895 0 CA-C-O 121.111 0.481 . . . . 0.0 110.635 . . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 2' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -99.51 -27.68 13.6 Favored 'General case' 0 N--CA 1.499 1.975 0 O-C-N 121.453 -0.779 . . . . 0.0 110.938 -179.961 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 3' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -59.46 -22.5 61.62 Favored 'General case' 0 N--CA 1.501 2.098 0 O-C-N 121.391 -0.818 . . . . 0.0 111.817 -179.481 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 4' ' ' ILE . . . . . . . . . . . . . 11.6 mt -49.93 -53.72 9.87 Favored 'Isoleucine or valine' 0 N--CA 1.503 2.219 0 O-C-N 121.277 -0.889 . . . . 0.0 110.267 179.762 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 5' ' ' TYR . . . . . . . . . . . . . 6.8 m-85 -73.52 -34.31 65.18 Favored 'General case' 0 N--CA 1.5 2.051 0 O-C-N 121.288 -0.883 . . . . 0.0 109.967 179.155 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 6' ' ' LYS . . . . . 0.462 ' O ' HG11 ' A' ' 9' ' ' VAL . 0.0 OUTLIER -59.78 -32.34 70.51 Favored 'General case' 0 N--CA 1.497 1.924 0 O-C-N 121.44 -0.787 . . . . 0.0 110.214 179.576 . . . . . . . . 3 3 . 1 . 011 nuclear orig full ' A' A ' 7' ' ' ALA . . . . . . . . . . . . . . . -55.88 -34.32 65.39 Favored 'General case' 0 N--CA 1.497 1.912 0 O-C-N 121.282 -0.886 . . . . 0.0 109.693 178.865 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 8' ' ' ALA . . . . . . . . . . . . . . . -71.72 -45.42 61.84 Favored 'General case' 0 N--CA 1.497 1.892 0 O-C-N 121.523 -0.736 . . . . 0.0 110.331 179.375 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 9' ' ' VAL . . . . . 0.514 ' HA ' HD11 ' A' ' 12' ' ' LEU . 0.3 OUTLIER -63.66 -28.98 46.1 Favored 'Isoleucine or valine' 0 N--CA 1.5 2.064 0 O-C-N 121.152 -0.967 . . . . 0.0 109.999 179.398 . . . . . . . . 3 3 . 1 . 011 nuclear orig full ' A' A ' 10' ' ' GLU . . . . . . . . . . . . . 1.1 tt0 -73.26 -31.98 64.41 Favored 'General case' 0 N--CA 1.493 1.677 0 O-C-N 121.606 -0.684 . . . . 0.0 110.366 179.299 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 11' ' ' GLN . . . . . . . . . . . . . 27.4 mt-30 -85.22 2.81 42.2 Favored 'General case' 0 N--CA 1.499 2.008 0 O-C-N 121.331 -0.856 . . . . 0.0 111.577 -179.84 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 12' ' ' LEU . . . . . 0.514 HD11 ' HA ' ' A' ' 9' ' ' VAL . 4.5 mt -73.2 136.83 44.75 Favored 'General case' 0 N--CA 1.5 2.033 0 O-C-N 120.877 -1.14 . . . . 0.0 110.197 179.823 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 13' ' ' THR . . . . . . . . . . . . . 3.2 m -92.26 157.6 16.58 Favored 'General case' 0 N--CA 1.503 2.196 0 O-C-N 121.323 -0.861 . . . . 0.0 111.008 -179.602 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 14' ' ' GLU . . . . . . . . . . . . . 8.5 tp10 -51.96 -41.75 62.35 Favored 'General case' 0 N--CA 1.496 1.847 0 O-C-N 121.809 -0.557 . . . . 0.0 110.607 -179.918 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 23.5 mt-10 -58.5 -43.78 89.22 Favored 'General case' 0 N--CA 1.498 1.967 0 O-C-N 121.544 -0.723 . . . . 0.0 110.512 179.56 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 16' ' ' GLN . . . . . . . . . . . . . 0.8 OUTLIER -70.5 -37.07 74.11 Favored 'General case' 0 N--CA 1.498 1.931 0 O-C-N 121.491 -0.755 . . . . 0.0 110.284 179.745 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 17' ' ' LYS . . . . . . . . . . . . . 2.6 tptt -62.98 -45.68 91.28 Favored 'General case' 0 N--CA 1.496 1.873 0 N-CA-C 109.083 -0.71 . . . . 0.0 109.083 178.756 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 18' ' ' ASN . . . . . . . . . . . . . 15.7 m-80 -70.07 -27.98 65.06 Favored 'General case' 0 N--CA 1.497 1.901 0 O-C-N 121.439 -0.788 . . . . 0.0 109.757 178.642 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 7.3 tt0 -67.33 -51.42 52.56 Favored 'General case' 0 N--CA 1.495 1.776 0 O-C-N 121.445 -0.784 . . . . 0.0 109.247 178.967 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 20' ' ' PHE . . . . . . . . . . . . . 30.6 m-85 -67.19 -27.4 67.23 Favored 'General case' 0 N--CA 1.497 1.877 0 O-C-N 121.328 -0.858 . . . . 0.0 109.798 178.936 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 21' ' ' LYS . . . . . . . . . . . . . 3.1 tptt -58.04 -46.82 84.73 Favored 'General case' 0 N--CA 1.499 1.995 0 O-C-N 121.377 -0.827 . . . . 0.0 109.62 178.885 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 22' ' ' ALA . . . . . . . . . . . . . . . -63.27 -46.67 85.71 Favored 'General case' 0 N--CA 1.496 1.832 0 O-C-N 121.541 -0.725 . . . . 0.0 109.745 179.235 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 23' ' ' ALA . . . . . . . . . . . . . . . -60.65 -42.88 97.87 Favored 'General case' 0 N--CA 1.498 1.962 0 O-C-N 121.516 -0.74 . . . . 0.0 109.625 178.946 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 24' ' ' PHE . . . . . . . . . . . . . 59.4 t80 -59.38 -47.92 83.6 Favored 'General case' 0 N--CA 1.494 1.766 0 O-C-N 121.567 -0.708 . . . . 0.0 109.666 179.139 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 25' ' ' ASP . . . . . . . . . . . . . 1.1 m-20 -56.39 -41.41 76.21 Favored 'General case' 0 N--CA 1.498 1.955 0 O-C-N 121.692 -0.63 . . . . 0.0 110.393 179.475 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 26' ' ' ILE . . . . . 0.525 HG21 ' HG ' ' B' ' 157' ' ' LEU . 38.1 mm -64.87 -30.12 49.39 Favored 'Isoleucine or valine' 0 N--CA 1.501 2.109 0 O-C-N 121.389 -0.819 . . . . 0.0 110.047 179.262 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 27' ' ' PHE . . . . . 0.451 ' CE1' ' HB ' ' A' ' 44' ' ' VAL . 0.1 OUTLIER -75.38 -28.98 59.71 Favored 'General case' 0 N--CA 1.496 1.833 0 O-C-N 121.435 -0.791 . . . . 0.0 111.115 -179.954 . . . . . . . . 3 3 . 1 . 011 nuclear orig full ' A' A ' 28' ' ' VAL . . . . . 0.402 HG12 ' HG3' ' A' ' 40' ' ' GLU . 0.0 OUTLIER -113.75 -79.17 0.38 Allowed 'Isoleucine or valine' 0 N--CA 1.498 1.95 0 O-C-N 121.138 -0.976 . . . . 0.0 110.748 179.859 . . . . . . . . 3 3 . 1 . 011 nuclear orig full ' A' A ' 29' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER 67.19 -68.89 0.14 Allowed 'General case' 0 N--CA 1.504 2.262 0 O-C-N 121.644 -0.66 . . . . 0.0 110.407 -179.615 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 30' ' ' GLY . . . . . . . . . . . . . . . -98.36 40.84 2.37 Favored Glycine 0 N--CA 1.494 2.545 0 N-CA-C 109.538 -1.425 . . . . 0.0 109.538 179.138 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 31' ' ' ALA . . . . . . . . . . . . . . . -77.57 178.66 7.09 Favored 'General case' 0 N--CA 1.499 2.017 0 O-C-N 121.306 -1.114 . . . . 0.0 110.681 -179.892 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 32' ' ' GLU . . . . . . . . . . . . . 1.2 mp0 -88.5 -56.89 3.12 Favored 'General case' 0 N--CA 1.5 2.027 0 O-C-N 121.348 -0.845 . . . . 0.0 110.422 -179.676 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 2.5 m-20 -116.22 33.64 5.43 Favored 'General case' 0 N--CA 1.494 1.761 0 O-C-N 121.414 -0.804 . . . . 0.0 110.523 -179.855 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 34' ' ' GLY . . . . . . . . . . . . . . . 63.12 44.72 96.79 Favored Glycine 0 N--CA 1.497 2.761 0 N-CA-C 109.842 -1.303 . . . . 0.0 109.842 179.991 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 35' ' ' CYS . . . . . . . . . . . . . 12.9 p -140.99 142.66 34.26 Favored 'General case' 0 N--CA 1.496 1.835 0 O-C-N 121.408 -1.054 . . . . 0.0 110.4 -179.551 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 36' ' ' ILE . . . . . . . . . . . . . 69.5 mt -78.05 96.42 1.85 Allowed 'Isoleucine or valine' 0 N--CA 1.496 1.86 0 O-C-N 121.416 -0.802 . . . . 0.0 110.059 -179.988 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 37' ' ' SER . . . . . . . . . . . . . 91.5 p -87.92 -176.79 5.6 Favored 'General case' 0 N--CA 1.496 1.833 0 O-C-N 121.407 -0.808 . . . . 0.0 109.766 179.452 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 38' ' ' THR . . . . . . . . . . . . . 7.3 p -55.45 -36.98 67.14 Favored 'General case' 0 N--CA 1.5 2.032 0 O-C-N 121.361 -0.837 . . . . 0.0 110.487 179.819 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 39' ' ' LYS . . . . . . . . . . . . . 4.2 mtmp? -71.23 -44.92 64.41 Favored 'General case' 0 N--CA 1.499 1.983 0 O-C-N 121.416 -0.802 . . . . 0.0 110.583 179.818 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 40' ' ' GLU . . . . . 0.402 ' HG3' HG12 ' A' ' 28' ' ' VAL . 9.9 mm-40 -63.61 -38.61 91.76 Favored 'General case' 0 N--CA 1.501 2.094 0 O-C-N 121.393 -0.817 . . . . 0.0 110.647 -179.811 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 41' ' ' LEU . . . . . 0.538 HD12 ' CD1' ' A' ' 57' ' ' LEU . 1.8 tm? -66.14 -66.39 0.56 Allowed 'General case' 0 N--CA 1.499 2.0 0 O-C-N 121.297 -0.877 . . . . 0.0 109.346 179.124 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 42' ' ' GLY . . . . . 0.6 ' HA2' ' HB2' ' A' ' 45' ' ' MET . . . -48.03 -33.28 10.08 Favored Glycine 0 N--CA 1.501 3.011 0 N-CA-C 110.873 -0.891 . . . . 0.0 110.873 179.881 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 43' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -52.52 -46.24 66.61 Favored 'General case' 0 N--CA 1.503 2.178 0 O-C-N 121.383 -1.069 . . . . 0.0 110.566 179.54 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 44' ' ' VAL . . . . . 0.451 ' HB ' ' CE1' ' A' ' 27' ' ' PHE . 60.4 t -87.99 -21.61 7.02 Favored 'Isoleucine or valine' 0 N--CA 1.499 1.992 0 O-C-N 121.446 -0.784 . . . . 0.0 110.673 179.828 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 45' ' ' MET . . . . . 0.6 ' HB2' ' HA2' ' A' ' 42' ' ' GLY . 0.2 OUTLIER -57.44 -24.91 58.41 Favored 'General case' 0 N--CA 1.502 2.165 0 O-C-N 121.214 -0.929 . . . . 0.0 111.55 -179.957 . . . . . . . . 3 3 . 1 . 011 nuclear orig full ' A' A ' 46' ' ' ARG . . . . . 0.453 ' HA ' ' HG3' ' A' ' 50' ' ' GLN . 4.9 mtm180 -50.33 -36.06 30.39 Favored 'General case' 0 N--CA 1.502 2.13 0 O-C-N 121.321 -0.862 . . . . 0.0 111.119 179.989 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 47' ' ' MET . . . . . . . . . . . . . 20.3 mtm -80.15 -30.86 38.99 Favored 'General case' 0 N--CA 1.497 1.899 0 O-C-N 121.359 -0.838 . . . . 0.0 110.889 -179.96 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 48' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -134.47 84.43 2.11 Favored 'General case' 0 N--CA 1.485 1.287 0 O-C-N 121.211 -0.93 . . . . 0.0 110.872 -179.457 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 49' ' ' GLY . . . . . . . . . . . . . . . 81.02 89.95 0.55 Allowed Glycine 0 N--CA 1.495 2.614 0 N-CA-C 109.828 -1.309 . . . . 0.0 109.828 179.722 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 50' ' ' GLN . . . . . 0.453 ' HG3' ' HA ' ' A' ' 46' ' ' ARG . 7.9 mp0 -65.83 152.49 44.29 Favored 'General case' 0 N--CA 1.498 1.953 0 O-C-N 121.525 -0.985 . . . . 0.0 110.661 -179.943 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 51' ' ' ASN . . . . . . . . . . . . . 16.3 p-10 -97.41 110.84 56.47 Favored Pre-proline 0 N--CA 1.494 1.76 0 O-C-N 121.535 -0.728 . . . . 0.0 110.125 179.551 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 52' ' ' PRO . . . . . . . . . . . . . 41.7 Cg_endo -69.21 -43.33 3.19 Favored 'Trans proline' 0 C--N 1.312 -1.343 0 O-C-N 123.676 1.356 . . . . 0.0 110.832 -179.885 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 53' ' ' THR . . . . . . . . . . . . . 0.6 OUTLIER -126.93 146.78 58.78 Favored Pre-proline 0 N--CA 1.495 1.824 0 O-C-N 121.336 -0.853 . . . . 0.0 110.282 -179.991 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 54' ' ' PRO . . . . . . . . . . . . . 40.9 Cg_endo -67.37 -36.96 18.91 Favored 'Trans proline' 0 N--CA 1.491 1.371 0 O-C-N 123.729 1.384 . . . . 0.0 110.781 179.811 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 55' ' ' GLU . . . . . 0.476 ' HG2' ' N ' ' A' ' 56' ' ' GLU . 3.1 pm0 -64.29 -24.6 67.72 Favored 'General case' 0 N--CA 1.498 1.965 0 O-C-N 121.365 -0.834 . . . . 0.0 110.748 179.432 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 56' ' ' GLU . . . . . 0.476 ' N ' ' HG2' ' A' ' 55' ' ' GLU . 27.0 tt0 -65.35 -25.41 67.57 Favored 'General case' 0 N--CA 1.498 1.951 0 O-C-N 121.174 -0.954 . . . . 0.0 110.401 179.399 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 57' ' ' LEU . . . . . 0.538 ' CD1' HD12 ' A' ' 41' ' ' LEU . 4.7 mt -94.13 -18.79 21.41 Favored 'General case' 0 N--CA 1.496 1.85 0 O-C-N 121.155 -0.966 . . . . 0.0 110.189 179.362 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 58' ' ' GLN . . . . . . . . . . . . . 4.0 mm100 -59.78 -39.84 86.27 Favored 'General case' 0 N--CA 1.499 2.016 0 O-C-N 121.059 -1.026 . . . . 0.0 109.966 179.638 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 59' ' ' GLU . . . . . 0.518 ' O ' ' HB2' ' A' ' 63' ' ' GLU . 0.0 OUTLIER -59.82 -29.39 68.21 Favored 'General case' 0 N--CA 1.5 2.052 0 O-C-N 121.359 -0.838 . . . . 0.0 109.392 178.576 . . . . . . . . 3 3 . 1 . 011 nuclear orig full ' A' A ' 60' ' ' MET . . . . . 0.425 ' HB2' ' O ' ' A' ' 57' ' ' LEU . 0.0 OUTLIER -72.87 -20.69 61.05 Favored 'General case' 0 N--CA 1.493 1.716 0 O-C-N 121.586 -0.696 . . . . 0.0 109.596 178.207 . . . . . . . . 3 3 . 1 . 011 nuclear orig full ' A' A ' 61' ' ' ILE . . . . . 0.453 ' HA ' HG23 ' A' ' 72' ' ' VAL . 28.9 mm -85.14 -59.21 2.89 Favored 'Isoleucine or valine' 0 N--CA 1.496 1.874 0 O-C-N 121.514 -0.741 . . . . 0.0 110.468 179.941 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 62' ' ' ASP . . . . . . . . . . . . . 25.2 m-20 -60.16 -33.44 72.19 Favored 'General case' 0 N--CA 1.501 2.11 0 O-C-N 121.736 -0.602 . . . . 0.0 112.115 -178.58 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 63' ' ' GLU . . . . . 0.518 ' HB2' ' O ' ' A' ' 59' ' ' GLU . 0.6 OUTLIER -56.35 -42.36 77.63 Favored 'General case' 0 N--CA 1.504 2.266 0 O-C-N 121.169 -0.957 . . . . 0.0 110.939 -179.492 . . . . . . . . 3 3 . 1 . 011 nuclear orig full ' A' A ' 64' ' ' VAL . . . . . 0.463 HG11 ' HB3' ' A' ' 80' ' ' MET . 34.5 m -99.79 -18.0 6.49 Favored 'Isoleucine or valine' 0 N--CA 1.501 2.094 0 O-C-N 121.308 -0.87 . . . . 0.0 111.224 179.872 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 65' ' ' ASP . . . . . 0.463 ' HA ' ' CD ' ' A' ' 76' ' ' GLU . 23.6 t70 -68.37 -87.12 0.02 OUTLIER 'General case' 0 N--CA 1.496 1.831 0 O-C-N 121.371 -0.831 . . . . 0.0 110.521 -179.596 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 66' ' ' GLU . . . . . . . . . . . . . 7.6 mm-40 48.51 33.28 3.91 Favored 'General case' 0 N--CA 1.502 2.135 0 O-C-N 121.35 -0.843 . . . . 0.0 111.171 -179.971 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 67' ' ' ASP . . . . . . . . . . . . . 0.7 OUTLIER -116.88 -18.29 10.21 Favored 'General case' 0 N--CA 1.499 1.995 0 O-C-N 121.104 -0.998 . . . . 0.0 111.601 -179.633 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 68' ' ' GLY . . . . . . . . . . . . . . . 123.05 -30.07 5.14 Favored Glycine 0 N--CA 1.498 2.804 0 N-CA-C 110.42 -1.072 . . . . 0.0 110.42 179.782 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 69' ' ' SER . . . . . . . . . . . . . 1.0 OUTLIER -78.93 -35.58 43.08 Favored 'General case' 0 N--CA 1.499 2.001 0 O-C-N 121.23 -1.159 . . . . 0.0 110.891 -179.635 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 70' ' ' GLY . . . . . . . . . . . . . . . 76.39 28.02 60.57 Favored Glycine 0 N--CA 1.498 2.8 0 N-CA-C 110.391 -1.084 . . . . 0.0 110.391 179.951 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 71' ' ' THR . . . . . . . . . . . . . 2.3 m -144.18 140.67 29.48 Favored 'General case' 0 N--CA 1.499 2.008 0 O-C-N 121.24 -1.153 . . . . 0.0 109.45 179.448 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 72' ' ' VAL . . . . . 0.453 HG23 ' HA ' ' A' ' 61' ' ' ILE . 24.7 t -75.69 124.49 33.82 Favored 'Isoleucine or valine' 0 N--CA 1.497 1.909 0 O-C-N 121.58 -0.7 . . . . 0.0 110.734 -179.586 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 73' ' ' ASP . . . . . . . . . . . . . 1.1 p30 -111.45 -161.38 0.75 Allowed 'General case' 0 N--CA 1.498 1.949 0 O-C-N 121.539 -0.726 . . . . 0.0 110.037 179.258 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 74' ' ' PHE . . . . . . . . . . . . . 16.9 t80 -66.72 -47.99 70.6 Favored 'General case' 0 N--CA 1.5 2.063 0 O-C-N 121.063 -1.023 . . . . 0.0 111.328 -178.91 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 75' ' ' ASP . . . . . 0.414 ' HA ' HD13 ' A' ' 78' ' ' LEU . 0.4 OUTLIER -68.25 -42.65 79.34 Favored 'General case' 0 N--CA 1.496 1.828 0 O-C-N 121.136 -0.978 . . . . 0.0 110.632 -179.621 . . . . . . . . 3 3 . 1 . 011 nuclear orig full ' A' A ' 76' ' ' GLU . . . . . 0.463 ' CD ' ' HA ' ' A' ' 65' ' ' ASP . 2.6 mt-10 -64.86 -30.45 71.45 Favored 'General case' 0 N--CA 1.498 1.935 0 O-C-N 121.207 -0.933 . . . . 0.0 109.742 178.767 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 77' ' ' PHE . . . . . 0.506 ' HA ' ' SD ' ' A' ' 80' ' ' MET . 67.4 t80 -58.96 -28.1 65.98 Favored 'General case' 0 N--CA 1.5 2.056 0 O-C-N 121.539 -0.725 . . . . 0.0 109.835 178.575 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 78' ' ' LEU . . . . . 0.414 HD13 ' HA ' ' A' ' 75' ' ' ASP . 20.0 mt -77.31 -35.36 54.98 Favored 'General case' 0 N--CA 1.495 1.797 0 O-C-N 121.352 -0.843 . . . . 0.0 110.257 179.297 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 79' ' ' VAL . . . . . . . . . . . . . 61.8 t -56.67 -57.21 10.21 Favored 'Isoleucine or valine' 0 N--CA 1.502 2.151 0 O-C-N 121.395 -0.816 . . . . 0.0 110.253 179.795 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 80' ' ' MET . . . . . 0.506 ' SD ' ' HA ' ' A' ' 77' ' ' PHE . 0.0 OUTLIER -57.17 -34.92 68.96 Favored 'General case' 0 N--CA 1.502 2.135 0 O-C-N 121.425 -0.797 . . . . 0.0 110.402 179.626 . . . . . . . . 3 3 . 1 . 011 nuclear orig full ' A' A ' 81' ' ' MET . . . . . . . . . . . . . 12.3 mmt -65.58 -43.87 88.44 Favored 'General case' 0 N--CA 1.498 1.967 0 O-C-N 121.365 -0.834 . . . . 0.0 110.063 179.129 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 82' ' ' VAL . . . . . . . . . . . . . 55.0 t -63.96 -34.62 69.58 Favored 'Isoleucine or valine' 0 N--CA 1.503 2.184 0 O-C-N 121.425 -0.797 . . . . 0.0 110.146 179.317 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 83' ' ' ARG . . . . . . . . . . . . . 31.7 mtt180 -66.5 -44.39 82.72 Favored 'General case' 0 N--CA 1.497 1.915 0 O-C-N 121.548 -0.72 . . . . 0.0 110.381 179.864 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 84' ' ' CYS . . . . . . . . . . . . . 84.1 m -71.95 -39.31 69.47 Favored 'General case' 0 N--CA 1.498 1.953 0 O-C-N 121.434 -0.791 . . . . 0.0 110.003 179.439 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 85' ' ' MET . . . . . 0.417 ' O ' ' CB ' ' A' ' 86' ' ' LYS . 38.1 ttp -76.19 -13.92 60.17 Favored 'General case' 0 N--CA 1.497 1.925 0 O-C-N 121.502 -0.749 . . . . 0.0 110.797 179.527 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 86' ' ' LYS . . . . . 0.417 ' CB ' ' O ' ' A' ' 85' ' ' MET . 0.2 OUTLIER 71.67 113.07 0.06 Allowed 'General case' 0 N--CA 1.502 2.146 0 O-C-N 121.581 -0.7 . . . . 0.0 110.429 -179.757 . . . . . . . . 3 3 . 1 . 011 nuclear orig full ' A' A ' 87' ' ' ASP . . . . . . . . . . . . . 8.4 p-10 -62.22 -34.98 77.53 Favored 'General case' 0 N--CA 1.5 2.036 0 O-C-N 121.554 -0.716 . . . . 0.0 110.814 179.989 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 88' ' ' ASP . . . . . . . . . . . . . 14.5 t70 -71.43 123.53 22.58 Favored 'General case' 0 N--CA 1.495 1.787 0 O-C-N 121.313 -0.867 . . . . 0.0 110.061 179.634 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 89' ' ' SER . . . . . . . . . . . . . 0.5 OUTLIER . . . . . 0 N--CA 1.498 1.944 0 CA-C-O 118.139 -0.934 . . . . 0.0 110.404 179.994 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B ' 144' ' ' ARG . . . . . . . . . . . . . 1.7 ttt85 . . . . . 0 N--CA 1.497 1.921 0 CA-C-O 120.888 0.375 . . . . 0.0 110.068 . . . . . . . . . 0 0 . 1 . 011 nuclear orig full ' B' B ' 145' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -71.23 97.36 1.53 Allowed 'General case' 0 N--CA 1.498 1.95 0 O-C-N 121.361 -0.837 . . . . 0.0 110.26 -179.966 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' B' B ' 146' ' ' VAL . . . . . . . . . . . . . 9.5 p -110.05 41.51 0.34 Allowed 'Isoleucine or valine' 0 N--CA 1.498 1.928 0 O-C-N 121.465 -0.772 . . . . 0.0 110.715 -179.674 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B ' 147' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -97.5 80.18 2.82 Favored 'General case' 0 N--CA 1.496 1.85 0 O-C-N 121.13 -0.981 . . . . 0.0 109.766 179.394 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' B' B ' 148' ' ' ILE . . . . . . . . . . . . . 1.1 mp -83.39 151.87 3.93 Favored 'Isoleucine or valine' 0 N--CA 1.497 1.889 0 O-C-N 121.565 -0.709 . . . . 0.0 110.407 -179.673 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B ' 149' ' ' SER . . . . . . . . . . . . . 78.9 p -103.85 -177.07 3.26 Favored 'General case' 0 N--CA 1.497 1.9 0 O-C-N 121.367 -0.833 . . . . 0.0 110.449 179.667 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B ' 150' ' ' ALA . . . . . . . . . . . . . . . -88.75 -45.46 9.77 Favored 'General case' 0 N--CA 1.498 1.944 0 O-C-N 121.258 -0.901 . . . . 0.0 110.523 -179.955 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B ' 151' ' ' ASP . . . . . . . . . . . . . 8.0 p-10 -56.8 -41.64 78.1 Favored 'General case' 0 N--CA 1.503 2.188 0 O-C-N 121.537 -0.727 . . . . 0.0 111.076 -179.977 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B ' 152' ' ' ALA . . . . . . . . . . . . . . . -66.35 -43.09 87.05 Favored 'General case' 0 N--CA 1.498 1.94 0 O-C-N 121.293 -0.879 . . . . 0.0 110.286 179.78 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B ' 153' ' ' MET . . . . . . . . . . . . . 7.3 mmt -63.17 -48.32 78.9 Favored 'General case' 0 N--CA 1.496 1.867 0 O-C-N 121.553 -0.717 . . . . 0.0 109.968 179.516 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B ' 154' ' ' MET . . . . . . . . . . . . . 22.9 mmm -59.99 -37.57 80.05 Favored 'General case' 0 N--CA 1.498 1.957 0 O-C-N 121.566 -0.709 . . . . 0.0 110.092 179.309 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B ' 155' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -69.47 -38.91 77.94 Favored 'General case' 0 N--CA 1.499 2.021 0 O-C-N 121.537 -0.727 . . . . 0.0 110.938 179.696 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' B' B ' 156' ' ' ALA . . . . . 0.455 ' HA ' ' HB2' ' B' ' 160' ' ' ALA . . . -75.91 -45.34 35.81 Favored 'General case' 0 N--CA 1.498 1.945 0 O-C-N 121.249 -0.907 . . . . 0.0 110.777 -179.507 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' B' B ' 157' ' ' LEU . . . . . 0.525 ' HG ' HG21 ' A' ' 26' ' ' ILE . 1.4 mp -60.08 -37.08 78.84 Favored 'General case' 0 N--CA 1.499 2.024 0 O-C-N 121.469 -0.77 . . . . 0.0 111.142 -179.737 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' B' B ' 158' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -131.61 55.09 1.88 Allowed 'General case' 0 N--CA 1.496 1.829 0 O-C-N 121.254 -0.904 . . . . 0.0 110.297 -179.886 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' B' B ' 159' ' ' GLY . . . . . 0.474 ' HA2' ' HG2' ' B' ' 163' ' ' LYS . . . -174.08 -59.03 0.05 OUTLIER Glycine 0 N--CA 1.497 2.766 0 C-N-CA 119.973 -1.108 . . . . 0.0 110.433 -179.982 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' B' B ' 160' ' ' ALA . . . . . 0.455 ' HB2' ' HA ' ' B' ' 156' ' ' ALA . . . -76.45 107.7 8.9 Favored 'General case' 0 N--CA 1.497 1.918 0 O-C-N 121.334 -1.098 . . . . 0.0 110.638 -179.56 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' B' B ' 161' ' ' ARG . . . . . 0.503 ' HA ' ' NH2' ' B' ' 161' ' ' ARG . 0.0 OUTLIER 71.28 -40.91 0.49 Allowed 'General case' 0 N--CA 1.507 2.389 0 O-C-N 121.82 -0.55 . . . . 0.0 112.242 179.826 . . . . . . . . 3 3 . 1 . 011 nuclear orig full ' B' B ' 162' ' ' ALA . . . . . . . . . . . . . . . -50.55 -33.03 20.2 Favored 'General case' 0 N--CA 1.504 2.257 0 O-C-N 120.885 -1.134 . . . . 0.0 110.633 179.691 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B ' 163' ' ' LYS . . . . . 0.474 ' HG2' ' HA2' ' B' ' 159' ' ' GLY . 0.0 OUTLIER . . . . . 0 N--CA 1.497 1.911 0 CA-C-O 117.877 -1.059 . . . . 0.0 110.456 178.994 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 90' ' ' ' CA' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 011 nuclear orig full ' A' A ' 91' ' ' SXK . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 012 nuclear orig full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 2.5 tpt . . . . . 0 N--CA 1.495 1.805 0 CA-C-O 120.915 0.388 . . . . 0.0 110.351 . . . . . . . . . 0 0 . 1 . 012 nuclear orig full ' A' A ' 2' ' ' ASP . . . . . . . . . . . . . 0.6 OUTLIER -126.44 147.81 49.74 Favored 'General case' 0 N--CA 1.496 1.848 0 O-C-N 121.522 -0.736 . . . . 0.0 110.564 179.933 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 3' ' ' ASP . . . . . . . . . . . . . 7.2 p-10 -127.42 -21.63 3.81 Favored 'General case' 0 N--CA 1.494 1.766 0 O-C-N 121.725 -0.609 . . . . 0.0 111.08 179.756 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 4' ' ' ILE . . . . . . . . . . . . . 2.0 mp -82.92 -57.27 4.7 Favored 'Isoleucine or valine' 0 N--CA 1.501 2.099 0 O-C-N 121.013 -1.054 . . . . 0.0 110.316 -179.873 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 5' ' ' TYR . . . . . . . . . . . . . 0.4 OUTLIER -55.88 -31.5 62.87 Favored 'General case' 0 N--CA 1.502 2.135 0 O-C-N 121.333 -0.854 . . . . 0.0 110.181 179.448 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -58.02 -38.35 76.02 Favored 'General case' 0 N--CA 1.497 1.886 0 O-C-N 121.602 -0.686 . . . . 0.0 110.589 179.408 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 7' ' ' ALA . . . . . . . . . . . . . . . -61.42 -44.16 97.62 Favored 'General case' 0 N--CA 1.499 2.024 0 O-C-N 121.396 -0.815 . . . . 0.0 110.643 179.644 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 8' ' ' ALA . . . . . . . . . . . . . . . -74.73 -12.26 60.37 Favored 'General case' 0 N--CA 1.499 2.018 0 O-C-N 121.302 -0.874 . . . . 0.0 111.371 179.988 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 9' ' ' VAL . . . . . . . . . . . . . 48.1 t -101.58 -52.68 8.23 Favored 'Isoleucine or valine' 0 N--CA 1.498 1.961 0 O-C-N 121.142 -0.974 . . . . 0.0 110.601 -179.684 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 10' ' ' GLU . . . . . . . . . . . . . 21.9 mm-40 -86.77 -18.62 30.65 Favored 'General case' 0 N--CA 1.494 1.765 0 O-C-N 121.303 -0.873 . . . . 0.0 111.163 -179.544 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 11' ' ' GLN . . . . . . . . . . . . . 0.6 OUTLIER -120.27 59.29 0.9 Allowed 'General case' 0 N--CA 1.496 1.86 0 O-C-N 120.974 -1.078 . . . . 0.0 111.088 -179.933 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 12' ' ' LEU . . . . . 0.481 HD12 ' HB3' ' A' ' 16' ' ' GLN . 0.0 OUTLIER -92.99 -73.14 0.57 Allowed 'General case' 0 N--CA 1.501 2.121 0 O-C-N 120.988 -1.07 . . . . 0.0 108.721 178.33 . . . . . . . . 3 3 . 1 . 012 nuclear orig full ' A' A ' 13' ' ' THR . . . . . 0.462 ' HB ' ' HB2' ' A' ' 16' ' ' GLN . 1.6 m -152.23 147.53 26.49 Favored 'General case' 0 N--CA 1.498 1.945 0 O-C-N 121.528 -0.732 . . . . 0.0 109.346 179.034 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 14' ' ' GLU . . . . . . . . . . . . . 0.3 OUTLIER -54.07 -46.24 71.95 Favored 'General case' 0 N--CA 1.494 1.728 0 O-C-N 121.714 -0.616 . . . . 0.0 111.013 -179.238 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 7.0 tp10 -76.87 -26.72 54.54 Favored 'General case' 0 N--CA 1.496 1.839 0 O-C-N 121.297 -0.877 . . . . 0.0 111.048 179.96 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 16' ' ' GLN . . . . . 0.481 ' HB3' HD12 ' A' ' 12' ' ' LEU . 2.5 mt-30 -56.23 -42.44 77.3 Favored 'General case' 0 N--CA 1.503 2.191 0 O-C-N 121.156 -0.965 . . . . 0.0 110.711 -179.897 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 17' ' ' LYS . . . . . . . . . . . . . 6.7 mttm -65.95 -45.7 80.83 Favored 'General case' 0 N--CA 1.496 1.863 0 N-CA-C 109.245 -0.65 . . . . 0.0 109.245 179.145 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 18' ' ' ASN . . . . . . . . . . . . . 61.9 t30 -64.07 -37.28 86.88 Favored 'General case' 0 N--CA 1.497 1.906 0 O-C-N 121.779 -0.576 . . . . 0.0 109.628 178.736 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 5.6 tt0 -67.07 -52.62 39.87 Favored 'General case' 0 N--CA 1.495 1.799 0 O-C-N 121.543 -0.723 . . . . 0.0 109.363 179.108 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 20' ' ' PHE . . . . . . . . . . . . . 4.0 m-85 -58.58 -34.16 70.78 Favored 'General case' 0 N--CA 1.499 2.012 0 O-C-N 121.419 -0.801 . . . . 0.0 109.699 179.121 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 21' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -61.43 -46.51 89.8 Favored 'General case' 0 N--CA 1.498 1.925 0 O-C-N 121.439 -0.788 . . . . 0.0 109.19 178.852 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 22' ' ' ALA . . . . . . . . . . . . . . . -59.77 -47.9 83.82 Favored 'General case' 0 N--CA 1.499 1.978 0 O-C-N 121.387 -0.82 . . . . 0.0 109.532 179.107 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 23' ' ' ALA . . . . . . . . . . . . . . . -61.02 -41.02 95.75 Favored 'General case' 0 N--CA 1.497 1.919 0 O-C-N 121.455 -0.778 . . . . 0.0 109.412 178.563 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 24' ' ' PHE . . . . . 0.405 ' O ' HG23 ' A' ' 28' ' ' VAL . 37.7 t80 -67.12 -45.98 75.53 Favored 'General case' 0 N--CA 1.497 1.891 0 O-C-N 121.767 -0.583 . . . . 0.0 110.112 179.339 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 25' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER -53.38 -46.38 69.6 Favored 'General case' 0 N--CA 1.5 2.071 0 O-C-N 121.606 -0.684 . . . . 0.0 110.26 179.72 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 26' ' ' ILE . . . . . 0.485 ' HB ' HD21 ' B' ' 157' ' ' LEU . 51.0 mt -72.45 -30.27 34.05 Favored 'Isoleucine or valine' 0 N--CA 1.497 1.909 0 O-C-N 121.465 -0.772 . . . . 0.0 109.68 179.171 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 27' ' ' PHE . . . . . . . . . . . . . 0.8 OUTLIER -63.52 -38.82 92.59 Favored 'General case' 0 N--CA 1.498 1.932 0 O-C-N 121.434 -0.791 . . . . 0.0 110.299 179.363 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 28' ' ' VAL . . . . . 0.405 HG23 ' O ' ' A' ' 24' ' ' PHE . 34.9 m -93.78 36.68 0.1 Allowed 'Isoleucine or valine' 0 N--CA 1.501 2.11 0 O-C-N 121.265 -0.897 . . . . 0.0 110.811 179.838 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 29' ' ' LEU . . . . . . . . . . . . . 0.9 OUTLIER -70.22 106.45 3.32 Favored 'General case' 0 N--CA 1.499 1.996 0 O-C-N 121.012 -1.055 . . . . 0.0 109.816 179.476 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 30' ' ' GLY . . . . . . . . . . . . . . . 109.9 -30.87 7.97 Favored Glycine 0 N--CA 1.494 2.556 0 N-CA-C 109.352 -1.499 . . . . 0.0 109.352 -179.228 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 31' ' ' ALA . . . . . . . . . . . . . . . -82.85 94.78 7.75 Favored 'General case' 0 N--CA 1.495 1.779 0 O-C-N 121.411 -1.052 . . . . 0.0 109.642 179.549 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 32' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -62.03 -19.52 62.97 Favored 'General case' 0 N--CA 1.503 2.206 0 O-C-N 121.431 -0.793 . . . . 0.0 111.445 -179.627 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 15.7 t70 -54.48 -37.43 65.25 Favored 'General case' 0 N--CA 1.498 1.938 0 O-C-N 121.459 -0.776 . . . . 0.0 110.901 179.931 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 34' ' ' GLY . . . . . . . . . . . . . . . 88.93 24.91 30.91 Favored Glycine 0 N--CA 1.496 2.657 0 N-CA-C 110.148 -1.181 . . . . 0.0 110.148 -179.927 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 35' ' ' CYS . . . . . . . . . . . . . 56.3 m -138.4 167.73 21.26 Favored 'General case' 0 N--CA 1.496 1.848 0 O-C-N 121.231 -1.158 . . . . 0.0 110.656 -179.984 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 36' ' ' ILE . . . . . . . . . . . . . 0.5 OUTLIER -102.28 112.58 36.02 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.613 0 CA-C-O 121.44 0.638 . . . . 0.0 109.361 179.596 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 37' ' ' SER . . . . . . . . . . . . . 0.2 OUTLIER -108.57 -173.18 2.21 Favored 'General case' 0 N--CA 1.494 1.728 0 O-C-N 121.413 -0.805 . . . . 0.0 110.628 -179.417 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 38' ' ' THR . . . . . . . . . . . . . 57.2 p -66.21 -42.17 89.12 Favored 'General case' 0 N--CA 1.499 1.99 0 O-C-N 121.486 -0.759 . . . . 0.0 110.911 -179.73 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 39' ' ' LYS . . . . . . . . . . . . . 47.9 mtmt -58.43 -45.57 88.21 Favored 'General case' 0 N--CA 1.502 2.13 0 O-C-N 121.45 -0.781 . . . . 0.0 110.731 -179.87 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 1.1 mp0 -71.86 -27.94 63.21 Favored 'General case' 0 N--CA 1.499 2.005 0 O-C-N 121.551 -0.718 . . . . 0.0 110.522 -179.855 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 41' ' ' LEU . . . . . 0.461 HD23 ' HB3' ' A' ' 57' ' ' LEU . 6.9 tp -72.58 -53.48 11.82 Favored 'General case' 0 N--CA 1.497 1.894 0 O-C-N 121.208 -0.932 . . . . 0.0 110.452 179.72 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 42' ' ' GLY . . . . . . . . . . . . . . . -56.44 -35.89 67.98 Favored Glycine 0 N--CA 1.496 2.666 0 N-CA-C 110.4 -1.08 . . . . 0.0 110.4 -179.406 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 43' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -56.56 -37.16 70.17 Favored 'General case' 0 N--CA 1.5 2.052 0 O-C-N 121.345 -1.091 . . . . 0.0 109.907 179.218 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 44' ' ' VAL . . . . . . . . . . . . . 88.6 t -85.18 -31.8 7.06 Favored 'Isoleucine or valine' 0 N--CA 1.497 1.917 0 O-C-N 121.483 -0.76 . . . . 0.0 109.761 178.837 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 45' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -58.52 -53.33 59.5 Favored 'General case' 0 N--CA 1.5 2.034 0 O-C-N 121.398 -0.814 . . . . 0.0 109.96 179.496 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 46' ' ' ARG . . . . . 0.519 ' HA ' ' HB2' ' A' ' 51' ' ' ASN . 1.9 ppt_? -64.25 -28.72 69.93 Favored 'General case' 0 N--CA 1.499 2.011 0 O-C-N 121.377 -0.827 . . . . 0.0 109.938 179.125 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 47' ' ' MET . . . . . . . . . . . . . 13.9 ttp -66.95 -36.22 81.72 Favored 'General case' 0 N--CA 1.495 1.824 0 O-C-N 121.455 -0.778 . . . . 0.0 109.501 178.856 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 48' ' ' LEU . . . . . . . . . . . . . 28.5 mt -75.28 -40.35 58.77 Favored 'General case' 0 N--CA 1.498 1.959 0 O-C-N 121.516 -0.74 . . . . 0.0 110.0 179.151 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 49' ' ' GLY . . . . . . . . . . . . . . . 139.02 -50.81 0.78 Allowed Glycine 0 N--CA 1.495 2.575 0 N-CA-C 109.96 -1.256 . . . . 0.0 109.96 -179.773 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 50' ' ' GLN . . . . . . . . . . . . . 0.6 OUTLIER -84.89 99.69 11.11 Favored 'General case' 0 N--CA 1.498 1.939 0 O-C-N 121.331 -1.1 . . . . 0.0 110.739 -179.662 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 51' ' ' ASN . . . . . 0.519 ' HB2' ' HA ' ' A' ' 46' ' ' ARG . 14.2 t30 -129.69 101.08 18.84 Favored Pre-proline 0 N--CA 1.496 1.856 0 O-C-N 121.473 -0.767 . . . . 0.0 109.992 179.723 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 52' ' ' PRO . . . . . . . . . . . . . 46.1 Cg_endo -73.56 -92.3 0.01 OUTLIER 'Trans proline' 0 C--N 1.314 -1.252 0 O-C-N 123.821 1.432 . . . . 0.0 111.23 -179.569 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 53' ' ' THR . . . . . . . . . . . . . 0.1 OUTLIER -139.54 151.1 65.77 Favored Pre-proline 0 N--CA 1.502 2.164 0 O-C-N 120.918 -1.114 . . . . 0.0 110.432 -179.375 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 54' ' ' PRO . . . . . . . . . . . . . 41.8 Cg_endo -69.21 -40.31 6.37 Favored 'Trans proline' 0 N--CA 1.489 1.247 0 O-C-N 123.841 1.443 . . . . 0.0 110.667 179.807 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 55' ' ' GLU . . . . . . . . . . . . . 3.6 mp0 -66.48 -31.14 71.69 Favored 'General case' 0 N--CA 1.496 1.832 0 O-C-N 121.449 -0.782 . . . . 0.0 109.869 179.375 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 16.0 tt0 -63.7 -34.62 78.28 Favored 'General case' 0 N--CA 1.496 1.838 0 O-C-N 121.528 -0.733 . . . . 0.0 110.231 179.291 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 57' ' ' LEU . . . . . 0.461 ' HB3' HD23 ' A' ' 41' ' ' LEU . 56.7 mt -67.25 -25.63 66.17 Favored 'General case' 0 N--CA 1.496 1.853 0 O-C-N 121.186 -0.946 . . . . 0.0 110.273 179.491 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 58' ' ' GLN . . . . . 0.551 ' O ' HG23 ' A' ' 61' ' ' ILE . 0.0 OUTLIER -64.31 -29.77 70.84 Favored 'General case' 0 N--CA 1.498 1.958 0 O-C-N 121.064 -1.022 . . . . 0.0 108.969 178.793 . . . . . . . . 3 3 . 1 . 012 nuclear orig full ' A' A ' 59' ' ' GLU . . . . . 0.503 ' N ' ' HG3' ' A' ' 58' ' ' GLN . 17.8 mm-40 -81.28 -32.22 33.29 Favored 'General case' 0 N--CA 1.492 1.632 0 N-CA-C 107.89 -1.152 . . . . 0.0 107.89 177.415 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 60' ' ' MET . . . . . 0.422 ' HE1' HD23 ' A' ' 57' ' ' LEU . 0.3 OUTLIER -68.86 -44.4 73.41 Favored 'General case' 0 N--CA 1.495 1.793 0 O-C-N 121.91 -0.494 . . . . 0.0 109.953 178.799 . . . . . . . . 3 3 . 1 . 012 nuclear orig full ' A' A ' 61' ' ' ILE . . . . . 0.551 HG23 ' O ' ' A' ' 58' ' ' GLN . 12.6 tt -62.71 -31.34 51.84 Favored 'Isoleucine or valine' 0 N--CA 1.497 1.915 0 O-C-N 121.493 -0.754 . . . . 0.0 110.201 179.631 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 62' ' ' ASP . . . . . 0.519 ' HA ' ' HB3' ' A' ' 65' ' ' ASP . 17.6 t70 -64.41 -35.47 81.01 Favored 'General case' 0 N--CA 1.499 1.987 0 O-C-N 121.459 -0.776 . . . . 0.0 110.838 179.675 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 63' ' ' GLU . . . . . . . . . . . . . 5.1 tt0 -51.31 -38.51 53.34 Favored 'General case' 0 N--CA 1.503 2.225 0 O-C-N 121.399 -0.813 . . . . 0.0 110.291 179.571 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 64' ' ' VAL . . . . . . . . . . . . . 65.0 t -100.3 -24.67 4.06 Favored 'Isoleucine or valine' 0 N--CA 1.497 1.883 0 O-C-N 121.516 -0.74 . . . . 0.0 109.966 179.015 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 65' ' ' ASP . . . . . 0.519 ' HB3' ' HA ' ' A' ' 62' ' ' ASP . 18.4 t70 -79.57 -93.03 0.04 OUTLIER 'General case' 0 N--CA 1.494 1.728 0 O-C-N 121.529 -0.732 . . . . 0.0 110.58 -179.595 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 66' ' ' GLU . . . . . . . . . . . . . 0.5 OUTLIER 47.05 32.31 1.89 Allowed 'General case' 0 N--CA 1.501 2.12 0 O-C-N 121.389 -0.819 . . . . 0.0 111.073 -179.592 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 67' ' ' ASP . . . . . . . . . . . . . 4.9 p-10 -118.31 1.63 11.85 Favored 'General case' 0 N--CA 1.498 1.926 0 O-C-N 121.135 -0.978 . . . . 0.0 111.695 -179.559 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 68' ' ' GLY . . . . . . . . . . . . . . . 106.13 -41.33 2.2 Favored Glycine 0 N--CA 1.495 2.605 0 N-CA-C 109.908 -1.277 . . . . 0.0 109.908 179.949 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 69' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -60.9 -51.24 70.11 Favored 'General case' 0 N--CA 1.501 2.095 0 O-C-N 121.482 -1.01 . . . . 0.0 110.778 -179.732 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 70' ' ' GLY . . . . . . . . . . . . . . . 100.06 -28.04 17.54 Favored Glycine 0 N--CA 1.498 2.783 0 C-N-CA 120.152 -1.023 . . . . 0.0 110.959 179.535 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 71' ' ' THR . . . . . . . . . . . . . 11.7 t -104.89 159.89 15.44 Favored 'General case' 0 N--CA 1.5 2.025 0 O-C-N 120.997 -1.296 . . . . 0.0 111.389 -179.533 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 72' ' ' VAL . . . . . 0.467 HG21 HG13 ' A' ' 61' ' ' ILE . 2.5 t -94.35 118.44 40.35 Favored 'Isoleucine or valine' 0 N--CA 1.497 1.884 0 O-C-N 121.751 -0.593 . . . . 0.0 110.239 179.922 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 73' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -91.8 -166.76 1.63 Allowed 'General case' 0 N--CA 1.495 1.809 0 O-C-N 121.165 -0.96 . . . . 0.0 110.012 179.519 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 74' ' ' PHE . . . . . . . . . . . . . 77.3 t80 -61.57 -45.23 95.03 Favored 'General case' 0 N--CA 1.499 2.02 0 O-C-N 121.17 -0.956 . . . . 0.0 110.558 179.827 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 75' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -62.88 -46.2 88.96 Favored 'General case' 0 N--CA 1.499 1.989 0 O-C-N 121.432 -0.793 . . . . 0.0 110.536 179.819 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 76' ' ' GLU . . . . . . . . . . . . . 27.3 mt-10 -63.98 -36.97 85.72 Favored 'General case' 0 N--CA 1.501 2.084 0 O-C-N 121.441 -0.787 . . . . 0.0 109.807 179.35 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 77' ' ' PHE . . . . . . . . . . . . . 5.9 t80 -55.67 -43.43 76.35 Favored 'General case' 0 N--CA 1.494 1.772 0 O-C-N 121.759 -0.588 . . . . 0.0 109.818 179.266 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 78' ' ' LEU . . . . . . . . . . . . . 35.0 mt -70.41 -45.05 66.71 Favored 'General case' 0 N--CA 1.497 1.881 0 O-C-N 121.467 -0.771 . . . . 0.0 110.491 179.553 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 79' ' ' VAL . . . . . . . . . . . . . 24.1 t -58.59 -34.13 50.45 Favored 'Isoleucine or valine' 0 N--CA 1.502 2.138 0 O-C-N 121.335 -0.853 . . . . 0.0 109.202 178.968 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 80' ' ' MET . . . . . 0.432 ' CE ' ' HAI' ' A' ' 91' ' ' SXK . 0.8 OUTLIER -73.77 -42.27 61.28 Favored 'General case' 0 N--CA 1.493 1.693 0 O-C-N 121.526 -0.734 . . . . 0.0 109.238 178.489 . . . . . . . . 3 3 . 1 . 012 nuclear orig full ' A' A ' 81' ' ' MET . . . . . 0.51 ' HG3' ' CB ' ' B' ' 150' ' ' ALA . 0.0 OUTLIER -55.11 -51.25 67.0 Favored 'General case' 0 N--CA 1.499 2.014 0 O-C-N 121.76 -0.588 . . . . 0.0 110.559 179.576 . . . . . . . . 3 3 . 1 . 012 nuclear orig full ' A' A ' 82' ' ' VAL . . . . . 0.462 HG21 ' N ' ' A' ' 83' ' ' ARG . 33.7 m -65.99 -29.07 45.68 Favored 'Isoleucine or valine' 0 N--CA 1.502 2.156 0 O-C-N 121.453 -0.779 . . . . 0.0 110.671 179.931 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 83' ' ' ARG . . . . . 0.462 ' N ' HG21 ' A' ' 82' ' ' VAL . 2.1 mtt180 -64.95 -43.0 94.15 Favored 'General case' 0 N--CA 1.496 1.827 0 O-C-N 121.255 -0.903 . . . . 0.0 109.395 179.237 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 84' ' ' CYS . . . . . . . . . . . . . 0.0 OUTLIER -72.05 -42.63 66.05 Favored 'General case' 0 N--CA 1.495 1.777 0 O-C-N 121.549 -0.719 . . . . 0.0 110.123 179.17 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 85' ' ' MET . . . . . 0.406 ' O ' ' HB2' ' A' ' 86' ' ' LYS . 70.7 mtm -74.01 -6.82 49.72 Favored 'General case' 0 N--CA 1.499 2.019 0 O-C-N 121.473 -0.767 . . . . 0.0 111.225 179.834 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 86' ' ' LYS . . . . . 0.406 ' HB2' ' O ' ' A' ' 85' ' ' MET . 47.9 mmtm 58.69 65.61 1.21 Allowed 'General case' 0 N--CA 1.501 2.079 0 O-C-N 121.377 -0.827 . . . . 0.0 110.84 -179.978 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 87' ' ' ASP . . . . . 0.447 ' O ' ' CB ' ' A' ' 88' ' ' ASP . 5.0 m-20 -93.74 -166.2 1.46 Allowed 'General case' 0 N--CA 1.496 1.836 0 O-C-N 121.558 -0.714 . . . . 0.0 110.104 179.595 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 88' ' ' ASP . . . . . 0.447 ' CB ' ' O ' ' A' ' 87' ' ' ASP . 0.4 OUTLIER 72.34 -60.99 0.51 Allowed 'General case' 0 N--CA 1.506 2.344 0 O-C-N 121.653 -0.654 . . . . 0.0 110.995 179.959 . . . . . . . . 3 3 . 1 . 012 nuclear orig full ' A' A ' 89' ' ' SER . . . . . . . . . . . . . 0.6 OUTLIER . . . . . 0 N--CA 1.497 1.896 0 CA-C-O 118.205 -0.902 . . . . 0.0 110.428 -179.962 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B ' 144' ' ' ARG . . . . . . . . . . . . . 0.6 OUTLIER . . . . . 0 N--CA 1.497 1.882 0 CA-C-O 120.901 0.382 . . . . 0.0 110.122 . . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B ' 145' ' ' ARG . . . . . . . . . . . . . 0.7 OUTLIER -112.42 -63.22 1.46 Allowed 'General case' 0 N--CA 1.495 1.808 0 O-C-N 121.386 -0.821 . . . . 0.0 109.489 179.357 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' B' B ' 146' ' ' VAL . . . . . 0.644 ' HB ' ' HAF' ' A' ' 91' ' ' SXK . 0.0 OUTLIER -155.91 -81.64 0.0 OUTLIER 'Isoleucine or valine' 0 N--CA 1.502 2.156 0 O-C-N 121.628 -0.67 . . . . 0.0 109.355 179.225 . . . . . . . . 3 3 . 1 . 012 nuclear orig full ' B' B ' 147' ' ' ARG . . . . . . . . . . . . . 28.8 mtt-85 43.13 50.57 5.59 Favored 'General case' 0 N--CA 1.504 2.246 0 O-C-N 121.55 -0.719 . . . . 0.0 112.183 178.864 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B ' 148' ' ' ILE . . . . . 0.433 HG21 ' SD ' ' B' ' 153' ' ' MET . 1.1 mp -81.81 124.26 38.86 Favored 'Isoleucine or valine' 0 N--CA 1.497 1.911 0 O-C-N 121.011 -1.056 . . . . 0.0 109.766 179.371 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' B' B ' 149' ' ' SER . . . . . . . . . . . . . 6.8 t -88.31 171.43 10.17 Favored 'General case' 0 N--CA 1.496 1.874 0 O-C-N 121.43 -0.794 . . . . 0.0 111.246 -179.417 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B ' 150' ' ' ALA . . . . . 0.51 ' CB ' ' HG3' ' A' ' 81' ' ' MET . . . -61.54 -51.67 67.64 Favored 'General case' 0 N--CA 1.497 1.901 0 O-C-N 121.73 -0.606 . . . . 0.0 110.509 179.732 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' B' B ' 151' ' ' ASP . . . . . . . . . . . . . 6.8 p-10 -61.57 -31.92 71.98 Favored 'General case' 0 N--CA 1.499 2.018 0 O-C-N 121.627 -0.671 . . . . 0.0 110.717 179.685 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B ' 152' ' ' ALA . . . . . . . . . . . . . . . -70.16 -46.52 64.5 Favored 'General case' 0 N--CA 1.497 1.902 0 O-C-N 121.21 -0.931 . . . . 0.0 110.545 179.987 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B ' 153' ' ' MET . . . . . 0.433 ' SD ' HG21 ' B' ' 148' ' ' ILE . 1.5 tpt -75.2 -37.65 61.08 Favored 'General case' 0 N--CA 1.498 1.947 0 O-C-N 121.287 -0.883 . . . . 0.0 110.848 -179.99 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' B' B ' 154' ' ' MET . . . . . . . . . . . . . 2.7 ttp -70.6 -50.54 36.05 Favored 'General case' 0 N--CA 1.498 1.938 0 O-C-N 121.302 -0.874 . . . . 0.0 110.918 -179.652 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B ' 155' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -64.39 -35.77 81.98 Favored 'General case' 0 N--CA 1.5 2.052 0 O-C-N 121.273 -0.892 . . . . 0.0 110.801 -179.752 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' B' B ' 156' ' ' ALA . . . . . 0.496 ' HA ' ' HB1' ' B' ' 160' ' ' ALA . . . -59.31 -46.91 87.3 Favored 'General case' 0 N--CA 1.498 1.933 0 O-C-N 121.303 -0.873 . . . . 0.0 110.112 179.604 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' B' B ' 157' ' ' LEU . . . . . 0.485 HD21 ' HB ' ' A' ' 26' ' ' ILE . 14.8 tp -61.22 -53.79 52.38 Favored 'General case' 0 N--CA 1.496 1.859 0 O-C-N 121.586 -0.696 . . . . 0.0 110.4 179.653 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' B' B ' 158' ' ' LEU . . . . . . . . . . . . . 1.6 mt -104.54 94.27 5.23 Favored 'General case' 0 N--CA 1.495 1.79 0 O-C-N 121.451 -0.781 . . . . 0.0 109.792 179.624 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B ' 159' ' ' GLY . . . . . . . . . . . . . . . 137.99 -58.11 0.63 Allowed Glycine 0 N--CA 1.494 2.567 0 N-CA-C 109.422 -1.471 . . . . 0.0 109.422 -179.631 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B ' 160' ' ' ALA . . . . . 0.496 ' HB1' ' HA ' ' B' ' 156' ' ' ALA . . . -88.35 -16.27 33.44 Favored 'General case' 0 N--CA 1.498 1.969 0 O-C-N 121.471 -1.017 . . . . 0.0 110.892 179.841 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' B' B ' 161' ' ' ARG . . . . . . . . . . . . . 2.8 mmp_? -125.19 -65.39 1.02 Allowed 'General case' 0 N--CA 1.497 1.922 0 O-C-N 121.15 -0.969 . . . . 0.0 110.71 -179.86 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B ' 162' ' ' ALA . . . . . . . . . . . . . . . -115.57 164.57 14.12 Favored 'General case' 0 N--CA 1.497 1.884 0 O-C-N 121.329 -0.857 . . . . 0.0 110.374 179.994 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B ' 163' ' ' LYS . . . . . 0.404 ' HD2' ' C ' ' B' ' 163' ' ' LYS . 0.0 OUTLIER . . . . . 0 N--CA 1.495 1.777 0 CA-C-O 118.2 -0.905 . . . . 0.0 110.018 179.953 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 90' ' ' ' CA' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 012 nuclear orig full ' A' A ' 91' ' ' SXK . . . . . 0.644 ' HAF' ' HB ' ' B' ' 146' ' ' VAL . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.496 1.84 0 CA-C-O 120.932 0.396 . . . . 0.0 110.352 . . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 2' ' ' ASP . . . . . . . . . . . . . 15.0 t70 -107.79 -63.4 1.32 Allowed 'General case' 0 N--CA 1.495 1.788 0 O-C-N 121.448 -0.783 . . . . 0.0 110.624 -179.916 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 3' ' ' ASP . . . . . 0.58 ' HB3' ' CB ' ' A' ' 6' ' ' LYS . 3.8 t0 -152.6 140.72 20.34 Favored 'General case' 0 N--CA 1.494 1.752 0 O-C-N 121.283 -0.886 . . . . 0.0 111.45 -178.942 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 4' ' ' ILE . . . . . . . . . . . . . 7.8 mt -94.56 -37.3 7.8 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.72 0 N-CA-C 108.975 -0.75 . . . . 0.0 108.975 178.479 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 5' ' ' TYR . . . . . 0.407 ' CD2' ' HA ' ' A' ' 83' ' ' ARG . 47.8 m-85 -73.56 -30.61 63.16 Favored 'General case' 0 N--CA 1.496 1.853 0 O-C-N 121.644 -0.66 . . . . 0.0 109.92 179.124 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 6' ' ' LYS . . . . . 0.58 ' CB ' ' HB3' ' A' ' 3' ' ' ASP . 0.3 OUTLIER -56.67 -34.24 67.18 Favored 'General case' 0 N--CA 1.498 1.939 0 O-C-N 121.613 -0.679 . . . . 0.0 109.855 179.041 . . . . . . . . 3 3 . 1 . 013 nuclear orig full ' A' A ' 7' ' ' ALA . . . . . . . . . . . . . . . -61.76 -43.05 99.61 Favored 'General case' 0 N--CA 1.496 1.859 0 O-C-N 121.519 -0.738 . . . . 0.0 109.965 179.187 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 8' ' ' ALA . . . . . . . . . . . . . . . -60.66 -34.01 73.67 Favored 'General case' 0 N--CA 1.501 2.081 0 O-C-N 121.438 -0.789 . . . . 0.0 110.829 179.521 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 9' ' ' VAL . . . . . 0.434 ' CG2' ' HA ' ' A' ' 79' ' ' VAL . 72.9 t -58.73 -43.84 88.73 Favored 'Isoleucine or valine' 0 N--CA 1.501 2.09 0 O-C-N 121.437 -0.79 . . . . 0.0 111.064 -179.92 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 10' ' ' GLU . . . . . . . . . . . . . 12.0 mm-40 -89.76 -1.9 58.11 Favored 'General case' 0 N--CA 1.496 1.842 0 O-C-N 121.257 -0.902 . . . . 0.0 111.166 -179.949 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 11' ' ' GLN . . . . . . . . . . . . . 4.1 mt-30 -99.63 -22.76 15.29 Favored 'General case' 0 N--CA 1.496 1.839 0 O-C-N 121.086 -1.009 . . . . 0.0 110.978 179.78 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 12' ' ' LEU . . . . . 0.448 ' HB2' ' HG2' ' A' ' 16' ' ' GLN . 4.6 pp -67.2 171.9 5.28 Favored 'General case' 0 N--CA 1.505 2.287 0 O-C-N 121.069 -1.019 . . . . 0.0 110.998 -179.811 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 13' ' ' THR . . . . . . . . . . . . . 76.4 p -92.84 159.97 15.14 Favored 'General case' 0 N--CA 1.501 2.092 0 O-C-N 121.332 -0.855 . . . . 0.0 110.854 -179.572 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 14' ' ' GLU . . . . . . . . . . . . . 0.8 OUTLIER -56.77 -28.76 61.78 Favored 'General case' 0 N--CA 1.493 1.716 0 O-C-N 121.643 -0.661 . . . . 0.0 110.653 -179.967 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 1.3 mp0 -60.6 -41.33 94.53 Favored 'General case' 0 N--CA 1.498 1.973 0 O-C-N 121.439 -0.788 . . . . 0.0 110.167 179.419 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 16' ' ' GLN . . . . . 0.448 ' HG2' ' HB2' ' A' ' 12' ' ' LEU . 0.0 OUTLIER -80.24 -33.59 37.85 Favored 'General case' 0 N--CA 1.491 1.591 0 O-C-N 121.423 -0.798 . . . . 0.0 110.087 179.539 . . . . . . . . 3 3 . 1 . 013 nuclear orig full ' A' A ' 17' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -70.78 -40.11 72.79 Favored 'General case' 0 N--CA 1.498 1.961 0 O-C-N 121.552 -0.718 . . . . 0.0 110.054 179.305 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 18' ' ' ASN . . . . . . . . . . . . . 3.9 t30 -61.24 -34.6 75.41 Favored 'General case' 0 N--CA 1.497 1.878 0 O-C-N 121.513 -0.742 . . . . 0.0 109.995 179.331 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -62.98 -49.2 75.62 Favored 'General case' 0 N--CA 1.498 1.966 0 O-C-N 121.497 -0.752 . . . . 0.0 109.809 179.295 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 20' ' ' PHE . . . . . . . . . . . . . 12.9 m-85 -64.55 -34.64 78.71 Favored 'General case' 0 N--CA 1.5 2.055 0 O-C-N 121.419 -0.8 . . . . 0.0 110.005 179.098 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 21' ' ' LYS . . . . . . . . . . . . . 1.6 tptp -55.23 -47.35 75.48 Favored 'General case' 0 N--CA 1.498 1.956 0 O-C-N 121.566 -0.709 . . . . 0.0 110.201 179.591 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 22' ' ' ALA . . . . . . . . . . . . . . . -56.07 -44.87 79.33 Favored 'General case' 0 N--CA 1.499 1.996 0 O-C-N 121.598 -0.689 . . . . 0.0 110.082 179.575 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 23' ' ' ALA . . . . . . . . . . . . . . . -66.99 -35.89 80.95 Favored 'General case' 0 N--CA 1.497 1.887 0 O-C-N 121.353 -0.842 . . . . 0.0 109.66 178.726 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 24' ' ' PHE . . . . . . . . . . . . . 76.9 t80 -65.69 -37.85 87.62 Favored 'General case' 0 N--CA 1.497 1.917 0 O-C-N 121.582 -0.699 . . . . 0.0 110.223 179.309 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 25' ' ' ASP . . . . . . . . . . . . . 51.5 m-20 -56.18 -39.72 72.82 Favored 'General case' 0 N--CA 1.501 2.083 0 O-C-N 121.549 -0.719 . . . . 0.0 110.733 179.903 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 26' ' ' ILE . . . . . 0.538 HG12 ' HD3' ' B' ' 161' ' ' ARG . 6.7 mt -71.02 -31.68 45.87 Favored 'Isoleucine or valine' 0 N--CA 1.499 1.986 0 O-C-N 121.174 -0.954 . . . . 0.0 109.846 179.379 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 27' ' ' PHE . . . . . . . . . . . . . 0.2 OUTLIER -71.09 -39.68 71.97 Favored 'General case' 0 N--CA 1.496 1.846 0 O-C-N 121.359 -0.838 . . . . 0.0 110.291 179.522 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 28' ' ' VAL . . . . . 0.46 HG13 HG13 ' A' ' 36' ' ' ILE . 23.5 m -87.99 9.07 2.27 Favored 'Isoleucine or valine' 0 N--CA 1.501 2.086 0 O-C-N 121.365 -0.834 . . . . 0.0 111.281 179.862 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 29' ' ' LEU . . . . . 0.48 HD11 ' HA ' ' A' ' 26' ' ' ILE . 0.7 OUTLIER -61.08 105.82 0.53 Allowed 'General case' 0 N--CA 1.497 1.907 0 O-C-N 121.022 -1.049 . . . . 0.0 110.058 -179.936 . . . . . . . . 3 3 . 1 . 013 nuclear orig full ' A' A ' 30' ' ' GLY . . . . . . . . . . . . . . . 96.09 16.62 37.58 Favored Glycine 0 N--CA 1.495 2.623 0 N-CA-C 110.366 -1.094 . . . . 0.0 110.366 -179.577 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 31' ' ' ALA . . . . . . . . . . . . . . . -125.17 87.8 2.77 Favored 'General case' 0 N--CA 1.493 1.719 0 O-C-N 121.024 -1.28 . . . . 0.0 109.959 179.768 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 32' ' ' GLU . . . . . . . . . . . . . 4.0 mt-10 53.46 -91.69 0.03 OUTLIER 'General case' 0 N--CA 1.502 2.153 0 O-C-N 122.001 -0.437 . . . . 0.0 111.19 -179.899 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 7.5 p-10 -143.36 -40.51 0.31 Allowed 'General case' 0 N--CA 1.498 1.96 0 O-C-N 121.132 -0.98 . . . . 0.0 111.277 -179.679 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 34' ' ' GLY . . . . . . . . . . . . . . . -164.26 56.24 0.27 Allowed Glycine 0 N--CA 1.497 2.728 0 N-CA-C 110.104 -1.198 . . . . 0.0 110.104 -179.585 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 35' ' ' CYS . . . . . . . . . . . . . 25.8 p -132.92 149.52 52.24 Favored 'General case' 0 N--CA 1.499 1.99 0 O-C-N 121.456 -1.026 . . . . 0.0 110.359 179.659 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 36' ' ' ILE . . . . . 0.529 ' HB ' ' HB ' ' A' ' 72' ' ' VAL . 31.0 mt -123.85 130.35 73.97 Favored 'Isoleucine or valine' 0 N--CA 1.497 1.888 0 O-C-N 121.369 -0.832 . . . . 0.0 110.618 -179.826 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 37' ' ' SER . . . . . . . . . . . . . 1.7 t -122.51 -176.49 3.39 Favored 'General case' 0 N--CA 1.496 1.871 0 O-C-N 121.64 -0.662 . . . . 0.0 109.877 179.307 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 38' ' ' THR . . . . . 0.493 ' HB ' ' HA ' ' A' ' 54' ' ' PRO . 54.7 p -65.12 -36.45 84.31 Favored 'General case' 0 N--CA 1.503 2.216 0 O-C-N 121.329 -0.857 . . . . 0.0 110.617 179.891 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 39' ' ' LYS . . . . . . . . . . . . . 7.1 mttm -66.73 -44.47 81.46 Favored 'General case' 0 N--CA 1.498 1.95 0 O-C-N 121.39 -0.818 . . . . 0.0 110.476 179.761 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 1.2 mp0 -71.81 -23.3 61.53 Favored 'General case' 0 N--CA 1.497 1.916 0 O-C-N 121.494 -0.754 . . . . 0.0 110.935 -179.864 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 41' ' ' LEU . . . . . 0.416 HD21 ' CD1' ' A' ' 57' ' ' LEU . 5.4 tp -63.2 -47.51 82.26 Favored 'General case' 0 N--CA 1.498 1.944 0 O-C-N 121.079 -1.013 . . . . 0.0 110.157 179.774 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 42' ' ' GLY . . . . . 0.494 ' HA2' ' HB2' ' A' ' 45' ' ' MET . . . -55.94 -28.81 54.06 Favored Glycine 0 N--CA 1.495 2.614 0 N-CA-C 110.478 -1.049 . . . . 0.0 110.478 -179.951 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 43' ' ' LYS . . . . . . . . . . . . . 13.5 ttmt -50.99 -47.89 61.42 Favored 'General case' 0 N--CA 1.501 2.079 0 O-C-N 121.374 -1.074 . . . . 0.0 109.984 179.039 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 44' ' ' VAL . . . . . . . . . . . . . 38.1 t -80.5 -29.14 11.93 Favored 'Isoleucine or valine' 0 N--CA 1.498 1.954 0 O-C-N 121.557 -0.714 . . . . 0.0 110.03 179.053 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 45' ' ' MET . . . . . 0.494 ' HB2' ' HA2' ' A' ' 42' ' ' GLY . 5.1 mmt -57.09 -40.63 77.34 Favored 'General case' 0 N--CA 1.501 2.093 0 O-C-N 121.345 -0.847 . . . . 0.0 110.268 179.654 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 46' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -59.32 -40.61 86.84 Favored 'General case' 0 N--CA 1.501 2.109 0 O-C-N 121.411 -0.805 . . . . 0.0 110.224 179.383 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 47' ' ' MET . . . . . . . . . . . . . 0.2 OUTLIER -59.76 -43.09 94.48 Favored 'General case' 0 N--CA 1.499 1.981 0 O-C-N 121.493 -0.755 . . . . 0.0 110.185 179.552 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 48' ' ' LEU . . . . . . . . . . . . . 83.9 mt -78.21 -37.49 45.33 Favored 'General case' 0 N--CA 1.498 1.931 0 O-C-N 121.443 -0.785 . . . . 0.0 109.875 179.153 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 49' ' ' GLY . . . . . . . . . . . . . . . 115.92 50.56 0.43 Allowed Glycine 0 N--CA 1.495 2.629 0 N-CA-C 109.582 -1.407 . . . . 0.0 109.582 179.792 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 50' ' ' GLN . . . . . . . . . . . . . 25.1 mt-30 -132.6 145.59 51.22 Favored 'General case' 0 N--CA 1.497 1.923 0 O-C-N 121.408 -1.054 . . . . 0.0 110.111 -179.829 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 51' ' ' ASN . . . . . . . . . . . . . 1.2 t30 -132.36 62.56 63.86 Favored Pre-proline 0 N--CA 1.497 1.919 0 O-C-N 121.273 -0.892 . . . . 0.0 110.959 -179.887 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 52' ' ' PRO . . . . . 0.534 ' HG2' HD12 ' A' ' 57' ' ' LEU . 51.3 Cg_endo -78.16 157.43 30.06 Favored 'Trans proline' 0 C--N 1.314 -1.255 0 O-C-N 123.656 1.345 . . . . 0.0 110.624 179.569 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 53' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -85.14 153.82 59.92 Favored Pre-proline 0 N--CA 1.499 1.98 0 O-C-N 121.235 -0.916 . . . . 0.0 110.191 179.728 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 54' ' ' PRO . . . . . 0.493 ' HA ' ' HB ' ' A' ' 38' ' ' THR . 39.9 Cg_endo -66.15 -47.44 3.43 Favored 'Trans proline' 0 C--N 1.313 -1.303 0 O-C-N 123.686 1.361 . . . . 0.0 110.623 -179.693 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 55' ' ' GLU . . . . . . . . . . . . . 1.3 tt0 -61.45 -30.49 70.62 Favored 'General case' 0 N--CA 1.498 1.95 0 O-C-N 121.307 -0.87 . . . . 0.0 109.834 178.917 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 1.7 tm-20 -73.6 -45.8 50.96 Favored 'General case' 0 N--CA 1.495 1.781 0 O-C-N 121.461 -0.774 . . . . 0.0 110.029 179.252 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 57' ' ' LEU . . . . . 0.534 HD12 ' HG2' ' A' ' 52' ' ' PRO . 15.6 mt -69.63 -18.16 63.57 Favored 'General case' 0 N--CA 1.497 1.898 0 O-C-N 121.246 -0.908 . . . . 0.0 110.813 179.736 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 58' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -52.68 -51.23 61.16 Favored 'General case' 0 N--CA 1.497 1.921 0 O-C-N 121.084 -1.01 . . . . 0.0 110.538 179.723 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 59' ' ' GLU . . . . . . . . . . . . . 6.8 mm-40 -56.86 -32.23 65.61 Favored 'General case' 0 N--CA 1.499 1.987 0 O-C-N 121.603 -0.686 . . . . 0.0 110.138 179.386 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 60' ' ' MET . . . . . . . . . . . . . 11.5 tpp -59.14 -38.56 79.97 Favored 'General case' 0 N--CA 1.497 1.894 0 O-C-N 121.386 -0.821 . . . . 0.0 109.685 178.863 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 61' ' ' ILE . . . . . 0.533 HG21 HG22 ' A' ' 72' ' ' VAL . 15.9 mt -70.73 -41.65 77.59 Favored 'Isoleucine or valine' 0 N--CA 1.497 1.885 0 O-C-N 121.433 -0.792 . . . . 0.0 109.353 178.862 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 62' ' ' ASP . . . . . 0.473 ' HA ' ' HB3' ' A' ' 65' ' ' ASP . 17.8 m-20 -54.84 -32.37 60.51 Favored 'General case' 0 N--CA 1.5 2.036 0 O-C-N 121.596 -0.69 . . . . 0.0 110.719 179.522 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 63' ' ' GLU . . . . . . . . . . . . . 1.4 tm-20 -50.27 -43.35 53.28 Favored 'General case' 0 N--CA 1.5 2.072 0 O-C-N 121.641 -0.662 . . . . 0.0 110.878 179.914 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 64' ' ' VAL . . . . . . . . . . . . . 27.2 m -113.08 0.2 9.08 Favored 'Isoleucine or valine' 0 N--CA 1.501 2.092 0 O-C-N 121.265 -0.897 . . . . 0.0 111.219 179.631 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 65' ' ' ASP . . . . . 0.473 ' HB3' ' HA ' ' A' ' 62' ' ' ASP . 19.7 t70 -86.32 -95.18 0.08 Allowed 'General case' 0 N--CA 1.498 1.949 0 O-C-N 121.211 -0.931 . . . . 0.0 110.37 179.927 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 66' ' ' GLU . . . . . . . . . . . . . 2.3 tp10 50.89 35.21 11.86 Favored 'General case' 0 N--CA 1.502 2.161 0 O-C-N 121.214 -0.929 . . . . 0.0 111.253 -179.759 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 67' ' ' ASP . . . . . . . . . . . . . 3.8 p-10 -117.2 -5.45 11.35 Favored 'General case' 0 N--CA 1.501 2.084 0 O-C-N 121.1 -1.0 . . . . 0.0 111.673 -179.946 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 68' ' ' GLY . . . . . . . . . . . . . . . 109.66 -26.46 14.37 Favored Glycine 0 N--CA 1.496 2.64 0 N-CA-C 110.239 -1.145 . . . . 0.0 110.239 179.822 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 69' ' ' SER . . . . . . . . . . . . . 0.5 OUTLIER -79.68 -41.22 27.29 Favored 'General case' 0 N--CA 1.498 1.955 0 O-C-N 121.227 -1.161 . . . . 0.0 110.731 -179.769 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 70' ' ' GLY . . . . . . . . . . . . . . . 74.0 26.57 68.51 Favored Glycine 0 N--CA 1.497 2.756 0 N-CA-C 109.643 -1.383 . . . . 0.0 109.643 -179.578 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 71' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -140.11 148.29 41.49 Favored 'General case' 0 N--CA 1.497 1.879 0 O-C-N 121.527 -0.984 . . . . 0.0 109.193 179.931 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 72' ' ' VAL . . . . . 0.533 HG22 HG21 ' A' ' 61' ' ' ILE . 59.4 t -75.34 114.78 15.83 Favored 'Isoleucine or valine' 0 N--CA 1.498 1.957 0 O-C-N 121.367 -0.833 . . . . 0.0 110.539 -179.553 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 73' ' ' ASP . . . . . . . . . . . . . 4.6 m-20 -86.23 -166.32 1.51 Allowed 'General case' 0 N--CA 1.498 1.973 0 O-C-N 121.331 -0.856 . . . . 0.0 109.242 179.263 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 74' ' ' PHE . . . . . . . . . . . . . 53.4 t80 -74.25 -58.38 3.33 Favored 'General case' 0 N--CA 1.498 1.964 0 O-C-N 120.841 -1.162 . . . . 0.0 109.714 179.328 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 75' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -63.84 -33.82 76.54 Favored 'General case' 0 N--CA 1.496 1.864 0 O-C-N 121.452 -0.78 . . . . 0.0 110.162 179.552 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 76' ' ' GLU . . . . . . . . . . . . . 6.1 tt0 -62.16 -38.67 89.93 Favored 'General case' 0 N--CA 1.497 1.893 0 O-C-N 121.23 -0.918 . . . . 0.0 108.884 178.507 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 77' ' ' PHE . . . . . . . . . . . . . 65.2 t80 -62.72 -38.63 91.22 Favored 'General case' 0 N--CA 1.494 1.753 0 O-C-N 121.69 -0.631 . . . . 0.0 109.355 178.347 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 78' ' ' LEU . . . . . 0.419 ' HB3' HG13 ' A' ' 9' ' ' VAL . 14.3 mt -60.86 -36.59 79.54 Favored 'General case' 0 N--CA 1.498 1.967 0 O-C-N 121.475 -0.765 . . . . 0.0 110.049 178.899 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 79' ' ' VAL . . . . . 0.486 HG22 ' HA ' ' A' ' 6' ' ' LYS . 45.0 t -62.67 -43.56 98.7 Favored 'Isoleucine or valine' 0 N--CA 1.501 2.099 0 O-C-N 121.43 -0.794 . . . . 0.0 109.067 179.205 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 80' ' ' MET . . . . . . . . . . . . . 13.6 ttm -65.58 -36.11 82.79 Favored 'General case' 0 N--CA 1.494 1.753 0 O-C-N 121.542 -0.724 . . . . 0.0 109.355 178.593 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 81' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -58.43 -53.11 61.98 Favored 'General case' 0 N--CA 1.497 1.899 0 O-C-N 121.531 -0.731 . . . . 0.0 110.115 179.403 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 82' ' ' VAL . . . . . 0.424 HG13 ' N ' ' A' ' 83' ' ' ARG . 14.2 p -69.88 -26.51 30.37 Favored 'Isoleucine or valine' 0 N--CA 1.499 2.002 0 O-C-N 121.242 -0.911 . . . . 0.0 110.289 179.213 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 83' ' ' ARG . . . . . 0.424 ' N ' HG13 ' A' ' 82' ' ' VAL . 27.2 mtt-85 -69.41 -45.18 69.82 Favored 'General case' 0 N--CA 1.498 1.967 0 O-C-N 121.282 -0.886 . . . . 0.0 110.111 179.387 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 84' ' ' CYS . . . . . 0.457 ' HB3' ' HA ' ' B' ' 149' ' ' SER . 86.3 m -98.69 27.08 5.09 Favored 'General case' 0 N--CA 1.498 1.928 0 O-C-N 121.392 -0.818 . . . . 0.0 110.584 179.593 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 85' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -76.75 -25.69 53.74 Favored 'General case' 0 N--CA 1.498 1.939 0 O-C-N 121.252 -0.905 . . . . 0.0 110.59 179.646 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 86' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER 59.72 37.48 22.18 Favored 'General case' 0 N--CA 1.502 2.144 0 O-C-N 121.583 -0.698 . . . . 0.0 111.038 179.778 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 87' ' ' ASP . . . . . . . . . . . . . 17.9 t70 -89.97 139.47 30.57 Favored 'General case' 0 N--CA 1.496 1.863 0 O-C-N 121.296 -0.878 . . . . 0.0 110.149 179.677 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 88' ' ' ASP . . . . . . . . . . . . . 11.4 m-20 -109.7 74.23 0.88 Allowed 'General case' 0 N--CA 1.497 1.908 0 O-C-N 121.408 -0.807 . . . . 0.0 110.489 -179.55 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 89' ' ' SER . . . . . . . . . . . . . 28.0 m . . . . . 0 N--CA 1.498 1.951 0 O-C-N 121.171 -0.956 . . . . 0.0 110.337 179.663 . . . . . . . . 0 0 . 1 . 013 nuclear orig full ' B' B ' 144' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.497 1.885 0 CA-C-O 120.946 0.403 . . . . 0.0 110.228 . . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' B' B ' 145' ' ' ARG . . . . . . . . . . . . . 0.2 OUTLIER -142.16 -61.78 0.45 Allowed 'General case' 0 N--CA 1.497 1.878 0 O-C-N 121.404 -0.81 . . . . 0.0 110.623 -179.798 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' B' B ' 146' ' ' VAL . . . . . . . . . . . . . 4.8 t 52.6 44.45 0.37 Allowed 'Isoleucine or valine' 0 N--CA 1.503 2.21 0 CA-C-O 121.378 0.609 . . . . 0.0 110.799 179.922 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' B' B ' 147' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -130.2 121.07 25.52 Favored 'General case' 0 N--CA 1.495 1.81 0 O-C-N 121.184 -0.947 . . . . 0.0 109.977 179.664 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' B' B ' 148' ' ' ILE . . . . . . . . . . . . . 0.9 OUTLIER -133.36 138.59 50.9 Favored 'Isoleucine or valine' 0 N--CA 1.496 1.871 0 O-C-N 121.271 -0.893 . . . . 0.0 110.772 -179.342 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' B' B ' 149' ' ' SER . . . . . 0.457 ' HA ' ' HB3' ' A' ' 84' ' ' CYS . 86.3 p -105.9 169.3 8.56 Favored 'General case' 0 N--CA 1.496 1.86 0 O-C-N 121.581 -0.699 . . . . 0.0 110.096 179.434 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' B' B ' 150' ' ' ALA . . . . . . . . . . . . . . . -74.65 -42.3 58.77 Favored 'General case' 0 N--CA 1.497 1.907 0 O-C-N 121.302 -0.874 . . . . 0.0 110.871 -179.731 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' B' B ' 151' ' ' ASP . . . . . . . . . . . . . 31.2 t70 -61.39 -52.62 63.86 Favored 'General case' 0 N--CA 1.498 1.97 0 O-C-N 121.462 -0.773 . . . . 0.0 110.882 -179.732 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' B' B ' 152' ' ' ALA . . . . . . . . . . . . . . . -52.33 -45.22 65.56 Favored 'General case' 0 N--CA 1.504 2.232 0 O-C-N 121.3 -0.875 . . . . 0.0 111.047 -179.918 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' B' B ' 153' ' ' MET . . . . . 0.56 ' HG2' HD13 ' B' ' 157' ' ' LEU . 1.3 ttt -73.16 -44.05 60.59 Favored 'General case' 0 N--CA 1.499 1.985 0 O-C-N 121.281 -0.887 . . . . 0.0 110.655 179.984 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' B' B ' 154' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -59.4 -37.97 79.36 Favored 'General case' 0 N--CA 1.501 2.113 0 O-C-N 121.467 -0.771 . . . . 0.0 110.457 179.792 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' B' B ' 155' ' ' GLN . . . . . . . . . . . . . 47.5 mt-30 -67.11 -38.4 85.57 Favored 'General case' 0 N--CA 1.499 1.998 0 O-C-N 121.539 -0.726 . . . . 0.0 110.908 179.859 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' B' B ' 156' ' ' ALA . . . . . . . . . . . . . . . -79.03 -34.39 43.94 Favored 'General case' 0 N--CA 1.498 1.951 0 O-C-N 121.321 -0.862 . . . . 0.0 110.971 -179.713 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' B' B ' 157' ' ' LEU . . . . . 0.56 HD13 ' HG2' ' B' ' 153' ' ' MET . 17.6 mt -75.27 -42.03 55.88 Favored 'General case' 0 N--CA 1.499 1.978 0 O-C-N 121.244 -0.91 . . . . 0.0 111.211 -179.497 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' B' B ' 158' ' ' LEU . . . . . . . . . . . . . 95.9 mt -93.24 165.9 12.58 Favored 'General case' 0 N--CA 1.499 2.005 0 O-C-N 121.137 -0.977 . . . . 0.0 110.941 -179.366 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' B' B ' 159' ' ' GLY . . . . . . . . . . . . . . . 100.79 -58.61 0.69 Allowed Glycine 0 N--CA 1.496 2.645 0 N-CA-C 109.749 -1.341 . . . . 0.0 109.749 179.894 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' B' B ' 160' ' ' ALA . . . . . . . . . . . . . . . -110.69 -48.84 3.1 Favored 'General case' 0 N--CA 1.498 1.965 0 O-C-N 121.473 -1.016 . . . . 0.0 110.875 -179.694 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' B' B ' 161' ' ' ARG . . . . . 0.538 ' HD3' HG12 ' A' ' 26' ' ' ILE . 0.0 OUTLIER -70.5 -42.9 70.71 Favored 'General case' 0 N--CA 1.5 2.042 0 O-C-N 121.24 -0.913 . . . . 0.0 110.474 -179.953 . . . . . . . . 3 3 . 1 . 013 nuclear orig full ' B' B ' 162' ' ' ALA . . . . . . . . . . . . . . . -144.07 -174.64 4.33 Favored 'General case' 0 N--CA 1.498 1.957 0 O-C-N 121.453 -0.779 . . . . 0.0 110.433 -179.936 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' B' B ' 163' ' ' LYS . . . . . . . . . . . . . 6.6 mtmt . . . . . 0 N--CA 1.498 1.951 0 CA-C-O 117.833 -1.08 . . . . 0.0 110.092 179.517 . . . . . . . . 0 0 . 1 . 013 nuclear orig full ' A' A ' 90' ' ' ' CA' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 013 nuclear orig full ' A' A ' 91' ' ' SXK . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 014 nuclear orig full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.496 1.87 0 CA-C-O 121.269 0.557 . . . . 0.0 109.928 . . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 2' ' ' ASP . . . . . . . . . . . . . 8.0 m-20 -134.52 -152.08 0.46 Allowed 'General case' 0 N--CA 1.494 1.77 0 O-C-N 121.396 -0.815 . . . . 0.0 109.942 -179.45 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 3' ' ' ASP . . . . . . . . . . . . . 30.3 m-20 55.08 31.98 17.34 Favored 'General case' 0 N--CA 1.503 2.205 0 O-C-N 121.562 -0.711 . . . . 0.0 111.436 179.379 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 4' ' ' ILE . . . . . . . . . . . . . 4.9 mt -68.61 -54.35 21.7 Favored 'Isoleucine or valine' 0 N--CA 1.499 1.988 0 O-C-N 121.229 -0.919 . . . . 0.0 110.589 -179.797 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 5' ' ' TYR . . . . . . . . . . . . . 1.6 m-85 -63.93 -29.78 70.92 Favored 'General case' 0 N--CA 1.502 2.142 0 O-C-N 121.26 -0.9 . . . . 0.0 110.703 179.691 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 27.7 ttpt -65.11 -36.86 85.63 Favored 'General case' 0 N--CA 1.497 1.907 0 O-C-N 121.24 -0.913 . . . . 0.0 110.057 179.182 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 7' ' ' ALA . . . . . . . . . . . . . . . -58.13 -38.66 76.96 Favored 'General case' 0 N--CA 1.497 1.882 0 O-C-N 121.6 -0.688 . . . . 0.0 110.13 179.505 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 8' ' ' ALA . . . . . . . . . . . . . . . -66.42 -44.03 84.07 Favored 'General case' 0 N--CA 1.497 1.906 0 O-C-N 121.507 -0.746 . . . . 0.0 110.182 179.454 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 9' ' ' VAL . . . . . . . . . . . . . 19.6 t -64.89 -44.01 96.25 Favored 'Isoleucine or valine' 0 N--CA 1.5 2.051 0 O-C-N 121.352 -0.843 . . . . 0.0 110.015 179.362 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 10' ' ' GLU . . . . . . . . . . . . . 31.1 mm-40 -74.09 -19.66 60.52 Favored 'General case' 0 N--CA 1.496 1.849 0 O-C-N 121.346 -0.846 . . . . 0.0 110.356 179.42 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 11' ' ' GLN . . . . . . . . . . . . . 0.2 OUTLIER -58.98 -49.38 78.12 Favored 'General case' 0 N--CA 1.498 1.947 0 O-C-N 121.412 -0.805 . . . . 0.0 109.906 179.425 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 12' ' ' LEU . . . . . 0.426 HD13 ' HG3' ' A' ' 17' ' ' LYS . 0.9 OUTLIER -72.18 134.45 45.69 Favored 'General case' 0 N--CA 1.495 1.812 0 O-C-N 121.314 -0.866 . . . . 0.0 109.003 178.953 . . . . . . . . 3 3 . 1 . 014 nuclear orig full ' A' A ' 13' ' ' THR . . . . . 0.601 HG23 ' HB2' ' A' ' 15' ' ' GLU . 13.3 t -60.76 166.16 3.5 Favored 'General case' 0 N--CA 1.501 2.116 0 O-C-N 121.277 -0.889 . . . . 0.0 112.12 -178.009 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 14' ' ' GLU . . . . . 0.547 ' HA ' ' HD3' ' A' ' 17' ' ' LYS . 4.5 tp10 -61.51 -26.21 67.77 Favored 'General case' 0 N--CA 1.493 1.695 0 CA-C-N 116.213 -0.449 . . . . 0.0 110.921 -179.538 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 15' ' ' GLU . . . . . 0.601 ' HB2' HG23 ' A' ' 13' ' ' THR . 1.4 mp0 -57.54 -44.06 84.86 Favored 'General case' 0 N--CA 1.498 1.973 0 O-C-N 121.279 -0.888 . . . . 0.0 109.068 179.049 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 16' ' ' GLN . . . . . . . . . . . . . 44.1 mt-30 -68.82 -38.46 79.88 Favored 'General case' 0 N--CA 1.497 1.889 0 CA-C-O 121.743 0.782 . . . . 0.0 109.033 178.168 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 17' ' ' LYS . . . . . 0.547 ' HD3' ' HA ' ' A' ' 14' ' ' GLU . 0.0 OUTLIER -61.84 -29.54 70.24 Favored 'General case' 0 N--CA 1.497 1.898 0 N-CA-C 109.608 -0.516 . . . . 0.0 109.608 178.734 . . . . . . . . 3 3 . 1 . 014 nuclear orig full ' A' A ' 18' ' ' ASN . . . . . . . . . . . . . 4.6 t-20 -59.45 -43.34 93.19 Favored 'General case' 0 N--CA 1.499 1.976 0 O-C-N 121.592 -0.693 . . . . 0.0 110.154 179.357 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 19' ' ' GLU . . . . . 0.521 ' HB3' ' HE3' ' B' ' 154' ' ' MET . 1.2 mp0 -56.82 -41.86 78.56 Favored 'General case' 0 N--CA 1.497 1.911 0 O-C-N 121.381 -0.825 . . . . 0.0 109.499 179.138 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 20' ' ' PHE . . . . . . . . . . . . . 14.9 m-85 -70.19 -37.4 75.11 Favored 'General case' 0 N--CA 1.494 1.757 0 O-C-N 121.445 -0.784 . . . . 0.0 109.32 178.413 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 21' ' ' LYS . . . . . 0.546 ' HG3' ' N ' ' A' ' 22' ' ' ALA . 0.0 OUTLIER -63.82 -31.7 72.97 Favored 'General case' 0 N--CA 1.495 1.806 0 O-C-N 121.489 -0.757 . . . . 0.0 109.188 178.677 . . . . . . . . 3 3 . 1 . 014 nuclear orig full ' A' A ' 22' ' ' ALA . . . . . 0.546 ' N ' ' HG3' ' A' ' 21' ' ' LYS . . . -69.13 -43.58 74.1 Favored 'General case' 0 N--CA 1.495 1.778 0 O-C-N 121.402 -0.811 . . . . 0.0 109.007 178.154 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 23' ' ' ALA . . . . . . . . . . . . . . . -68.84 -43.45 75.45 Favored 'General case' 0 N--CA 1.497 1.885 0 O-C-N 121.558 -0.714 . . . . 0.0 109.369 178.672 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 24' ' ' PHE . . . . . . . . . . . . . 20.1 t80 -60.53 -37.63 81.82 Favored 'General case' 0 N--CA 1.497 1.876 0 O-C-N 121.64 -0.662 . . . . 0.0 109.851 179.027 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 25' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -54.1 -45.59 71.86 Favored 'General case' 0 N--CA 1.5 2.038 0 O-C-N 121.675 -0.641 . . . . 0.0 110.769 179.547 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 26' ' ' ILE . . . . . . . . . . . . . 2.3 mt -87.07 -9.84 11.07 Favored 'Isoleucine or valine' 0 N--CA 1.499 2.01 0 O-C-N 121.304 -0.872 . . . . 0.0 110.485 179.844 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 27' ' ' PHE . . . . . . . . . . . . . 0.1 OUTLIER -73.83 -32.24 63.59 Favored 'General case' 0 N--CA 1.496 1.857 0 O-C-N 121.145 -0.972 . . . . 0.0 109.994 179.386 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 28' ' ' VAL . . . . . . . . . . . . . 15.7 m -100.23 48.56 0.12 Allowed 'Isoleucine or valine' 0 N--CA 1.499 1.989 0 O-C-N 121.52 -0.738 . . . . 0.0 110.246 179.55 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 29' ' ' LEU . . . . . . . . . . . . . 7.0 mt -67.1 -48.51 67.94 Favored 'General case' 0 N--CA 1.5 2.069 0 O-C-N 121.287 -0.883 . . . . 0.0 109.911 179.653 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 30' ' ' GLY . . . . . . . . . . . . . . . -109.24 28.63 10.69 Favored Glycine 0 N--CA 1.495 2.578 0 N-CA-C 109.392 -1.483 . . . . 0.0 109.392 179.117 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 31' ' ' ALA . . . . . . . . . . . . . . . -103.65 90.79 3.77 Favored 'General case' 0 N--CA 1.493 1.723 0 O-C-N 121.308 -1.113 . . . . 0.0 110.053 179.953 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 32' ' ' GLU . . . . . . . . . . . . . 3.3 mp0 -81.86 3.33 26.53 Favored 'General case' 0 N--CA 1.498 1.958 0 O-C-N 121.313 -0.867 . . . . 0.0 111.013 -179.991 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 5.9 p-10 -78.74 -25.95 44.6 Favored 'General case' 0 N--CA 1.497 1.888 0 O-C-N 121.217 -0.927 . . . . 0.0 110.862 179.585 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 34' ' ' GLY . . . . . . . . . . . . . . . 124.83 -22.77 6.37 Favored Glycine 0 N--CA 1.498 2.789 0 C-N-CA 120.058 -1.067 . . . . 0.0 110.804 179.493 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 35' ' ' CYS . . . . . 0.494 ' HB3' ' HA ' ' A' ' 73' ' ' ASP . 0.1 OUTLIER -140.92 -168.59 2.63 Favored 'General case' 0 N--CA 1.498 1.931 0 O-C-N 121.028 -1.278 . . . . 0.0 110.426 -179.706 . . . . . . . . 3 3 . 1 . 014 nuclear orig full ' A' A ' 36' ' ' ILE . . . . . . . . . . . . . 38.2 mt -75.87 122.49 29.98 Favored 'Isoleucine or valine' 0 N--CA 1.497 1.922 0 O-C-N 121.115 -0.99 . . . . 0.0 110.537 -179.478 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 37' ' ' SER . . . . . . . . . . . . . 41.6 t -92.5 159.84 15.33 Favored 'General case' 0 N--CA 1.495 1.787 0 O-C-N 121.58 -0.7 . . . . 0.0 110.041 179.516 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 38' ' ' THR . . . . . 0.507 HG22 ' HA ' ' A' ' 58' ' ' GLN . 11.4 p -63.2 -37.21 86.32 Favored 'General case' 0 N--CA 1.501 2.106 0 O-C-N 121.337 -0.852 . . . . 0.0 110.556 179.954 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 39' ' ' LYS . . . . . . . . . . . . . 2.4 tttp -59.35 -42.79 92.35 Favored 'General case' 0 N--CA 1.498 1.969 0 O-C-N 121.357 -0.839 . . . . 0.0 109.903 179.322 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 1.6 mm-40 -69.1 -42.88 75.52 Favored 'General case' 0 N--CA 1.497 1.913 0 O-C-N 121.525 -0.735 . . . . 0.0 109.92 179.28 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 41' ' ' LEU . . . . . 0.565 ' CD2' ' HAK' ' A' ' 91' ' ' SXK . 0.1 OUTLIER -60.34 -63.94 1.13 Allowed 'General case' 0 N--CA 1.499 1.997 0 O-C-N 121.655 -0.653 . . . . 0.0 110.23 179.647 . . . . . . . . 3 3 . 1 . 014 nuclear orig full ' A' A ' 42' ' ' GLY . . . . . . . . . . . . . . . -48.02 -42.11 22.72 Favored Glycine 0 N--CA 1.502 3.098 0 N-CA-C 110.098 -1.201 . . . . 0.0 110.098 179.655 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 43' ' ' LYS . . . . . . . . . . . . . 66.3 tttt -62.93 -38.05 89.49 Favored 'General case' 0 N--CA 1.501 2.103 0 O-C-N 121.301 -1.117 . . . . 0.0 110.356 179.184 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 44' ' ' VAL . . . . . . . . . . . . . 5.3 t -66.91 -26.62 37.33 Favored 'Isoleucine or valine' 0 N--CA 1.502 2.127 0 O-C-N 121.469 -0.769 . . . . 0.0 110.752 179.589 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 45' ' ' MET . . . . . . . . . . . . . 4.9 mmt -58.79 -29.52 66.9 Favored 'General case' 0 N--CA 1.503 2.222 0 O-C-N 121.192 -0.942 . . . . 0.0 111.455 -179.82 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 46' ' ' ARG . . . . . . . . . . . . . 18.0 ttp180 -56.01 -38.24 70.24 Favored 'General case' 0 N--CA 1.503 2.181 0 O-C-N 121.212 -0.93 . . . . 0.0 110.931 -179.91 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 47' ' ' MET . . . . . . . . . . . . . 14.5 ttp -89.13 4.76 47.41 Favored 'General case' 0 N--CA 1.501 2.087 0 O-C-N 121.27 -0.894 . . . . 0.0 111.148 179.716 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 48' ' ' LEU . . . . . 0.42 HD12 ' HB3' ' B' ' 152' ' ' ALA . 11.9 tp -117.14 -53.73 2.45 Favored 'General case' 0 N--CA 1.494 1.768 0 O-C-N 120.978 -1.076 . . . . 0.0 110.33 -179.824 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 49' ' ' GLY . . . . . 0.453 ' O ' ' HB2' ' A' ' 50' ' ' GLN . . . 170.51 119.4 0.5 Allowed Glycine 0 N--CA 1.493 2.466 0 N-CA-C 109.69 -1.364 . . . . 0.0 109.69 -179.976 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 50' ' ' GLN . . . . . 0.453 ' HB2' ' O ' ' A' ' 49' ' ' GLY . 64.3 mt-30 60.29 -177.7 0.1 Allowed 'General case' 0 N--CA 1.505 2.292 0 O-C-N 121.913 -0.757 . . . . 0.0 111.251 -179.97 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 51' ' ' ASN . . . . . . . . . . . . . 8.7 t-20 -159.35 105.37 1.51 Allowed Pre-proline 0 N--CA 1.496 1.858 0 O-C-N 121.231 -0.918 . . . . 0.0 110.274 -179.769 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 52' ' ' PRO . . . . . 0.493 ' HG2' HD12 ' A' ' 57' ' ' LEU . 52.6 Cg_endo -78.57 165.8 24.63 Favored 'Trans proline' 0 C--N 1.314 -1.252 0 O-C-N 123.819 1.431 . . . . 0.0 110.287 179.98 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 53' ' ' THR . . . . . 0.551 ' HB ' ' HD2' ' A' ' 54' ' ' PRO . 41.5 p -73.76 166.78 41.2 Favored Pre-proline 0 N--CA 1.5 2.042 0 O-C-N 121.103 -0.998 . . . . 0.0 110.448 179.938 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 54' ' ' PRO . . . . . 0.551 ' HD2' ' HB ' ' A' ' 53' ' ' THR . 39.6 Cg_endo -65.52 -40.87 16.8 Favored 'Trans proline' 0 N--CA 1.493 1.452 0 O-C-N 123.707 1.372 . . . . 0.0 111.051 -179.78 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 55' ' ' GLU . . . . . . . . . . . . . 27.3 mm-40 -69.43 -30.3 68.2 Favored 'General case' 0 N--CA 1.496 1.846 0 O-C-N 121.393 -0.817 . . . . 0.0 110.075 179.41 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 56' ' ' GLU . . . . . 0.4 ' HB2' ' OG1' ' A' ' 53' ' ' THR . 1.4 tt0 -54.86 -50.45 68.65 Favored 'General case' 0 N--CA 1.498 1.957 0 O-C-N 121.455 -0.778 . . . . 0.0 110.248 179.643 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 57' ' ' LEU . . . . . 0.493 HD12 ' HG2' ' A' ' 52' ' ' PRO . 1.2 mt -77.58 -22.66 50.6 Favored 'General case' 0 N--CA 1.495 1.796 0 O-C-N 121.36 -0.838 . . . . 0.0 110.825 179.754 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 58' ' ' GLN . . . . . 0.551 ' HG3' ' N ' ' A' ' 59' ' ' GLU . 0.0 OUTLIER -60.61 -34.62 74.5 Favored 'General case' 0 N--CA 1.499 2.008 0 O-C-N 120.978 -1.076 . . . . 0.0 109.297 179.289 . . . . . . . . 3 3 . 1 . 014 nuclear orig full ' A' A ' 59' ' ' GLU . . . . . 0.551 ' N ' ' HG3' ' A' ' 58' ' ' GLN . 12.9 mm-40 -79.77 -33.76 40.36 Favored 'General case' 0 N--CA 1.493 1.695 0 O-C-N 121.289 -0.882 . . . . 0.0 108.697 177.91 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 60' ' ' MET . . . . . 0.52 ' HE2' HALA ' A' ' 91' ' ' SXK . 16.3 ttm -67.91 -41.42 82.69 Favored 'General case' 0 N--CA 1.495 1.808 0 O-C-N 121.714 -0.616 . . . . 0.0 109.836 178.681 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 61' ' ' ILE . . . . . 0.518 HD11 ' HA ' ' A' ' 71' ' ' THR . 3.2 tt -68.04 -36.96 77.39 Favored 'Isoleucine or valine' 0 N--CA 1.495 1.824 0 O-C-N 121.561 -0.712 . . . . 0.0 109.839 179.53 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 62' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -68.68 -32.34 72.1 Favored 'General case' 0 N--CA 1.498 1.934 0 O-C-N 121.374 -0.829 . . . . 0.0 110.233 179.009 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 63' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER -59.88 -44.27 94.3 Favored 'General case' 0 N--CA 1.498 1.962 0 O-C-N 121.363 -0.836 . . . . 0.0 110.16 179.534 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 64' ' ' VAL . . . . . 0.467 HG21 ' HD2' ' A' ' 83' ' ' ARG . 11.9 p -103.86 24.32 1.83 Allowed 'Isoleucine or valine' 0 N--CA 1.496 1.846 0 O-C-N 121.432 -0.793 . . . . 0.0 110.768 179.839 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 65' ' ' ASP . . . . . . . . . . . . . 2.7 t70 -84.41 153.62 23.3 Favored 'General case' 0 N--CA 1.495 1.803 0 O-C-N 120.971 -1.081 . . . . 0.0 110.256 179.756 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 66' ' ' GLU . . . . . . . . . . . . . 32.4 mt-10 -121.11 11.15 10.86 Favored 'General case' 0 N--CA 1.495 1.787 0 O-C-N 121.423 -0.798 . . . . 0.0 111.828 -179.263 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 67' ' ' ASP . . . . . . . . . . . . . 1.1 p30 -146.84 0.51 0.75 Allowed 'General case' 0 N--CA 1.502 2.16 0 O-C-N 120.753 -1.217 . . . . 0.0 113.205 -179.692 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 68' ' ' GLY . . . . . . . . . . . . . . . 89.02 -24.63 12.29 Favored Glycine 0 N--CA 1.497 2.702 0 O-C-N 120.576 -1.328 . . . . 0.0 111.1 179.14 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 69' ' ' SER . . . . . . . . . . . . . 4.2 p -54.45 -29.75 50.66 Favored 'General case' 0 N--CA 1.503 2.181 0 O-C-N 121.107 -1.231 . . . . 0.0 110.403 179.943 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 70' ' ' GLY . . . . . . . . . . . . . . . 71.32 41.89 58.16 Favored Glycine 0 N--CA 1.497 2.712 0 N-CA-C 109.419 -1.472 . . . . 0.0 109.419 -179.761 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 71' ' ' THR . . . . . 0.518 ' HA ' HD11 ' A' ' 61' ' ' ILE . 0.2 OUTLIER -142.67 139.04 31.04 Favored 'General case' 0 N--CA 1.498 1.932 0 O-C-N 121.513 -0.992 . . . . 0.0 109.017 179.85 . . . . . . . . 3 3 . 1 . 014 nuclear orig full ' A' A ' 72' ' ' VAL . . . . . 0.409 HG22 HG13 ' A' ' 61' ' ' ILE . 38.5 t -75.41 111.44 11.71 Favored 'Isoleucine or valine' 0 N--CA 1.499 1.991 0 O-C-N 121.337 -0.852 . . . . 0.0 111.178 -178.899 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 73' ' ' ASP . . . . . 0.494 ' HA ' ' HB3' ' A' ' 35' ' ' CYS . 8.6 m-20 -87.53 -173.01 4.15 Favored 'General case' 0 N--CA 1.494 1.728 0 O-C-N 121.711 -0.618 . . . . 0.0 109.405 178.941 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 74' ' ' PHE . . . . . . . . . . . . . 87.2 t80 -61.95 -48.47 80.26 Favored 'General case' 0 N--CA 1.5 2.054 0 O-C-N 121.071 -1.018 . . . . 0.0 110.237 179.804 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 75' ' ' ASP . . . . . . . . . . . . . 0.1 OUTLIER -69.36 -45.11 70.15 Favored 'General case' 0 N--CA 1.496 1.852 0 O-C-N 121.457 -0.777 . . . . 0.0 110.355 179.786 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 76' ' ' GLU . . . . . . . . . . . . . 3.2 mt-10 -59.6 -34.73 73.12 Favored 'General case' 0 N--CA 1.499 1.998 0 O-C-N 121.433 -0.792 . . . . 0.0 110.073 179.38 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 77' ' ' PHE . . . . . 0.459 ' CZ ' ' HE3' ' A' ' 81' ' ' MET . 48.2 t80 -62.25 -43.96 97.63 Favored 'General case' 0 N--CA 1.496 1.86 0 O-C-N 121.48 -0.763 . . . . 0.0 109.644 178.866 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 78' ' ' LEU . . . . . . . . . . . . . 67.5 mt -66.39 -40.94 89.96 Favored 'General case' 0 N--CA 1.499 1.986 0 O-C-N 121.516 -0.74 . . . . 0.0 109.742 179.11 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 79' ' ' VAL . . . . . . . . . . . . . 5.2 t -62.98 -35.0 69.58 Favored 'Isoleucine or valine' 0 N--CA 1.501 2.082 0 O-C-N 121.502 -0.749 . . . . 0.0 110.11 179.355 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 80' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -73.58 -31.85 63.82 Favored 'General case' 0 N--CA 1.497 1.891 0 O-C-N 121.308 -0.87 . . . . 0.0 110.341 179.647 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 81' ' ' MET . . . . . 0.459 ' HE3' ' CZ ' ' A' ' 77' ' ' PHE . 12.0 mmt -63.54 -50.5 69.32 Favored 'General case' 0 N--CA 1.498 1.965 0 O-C-N 121.419 -0.801 . . . . 0.0 110.465 179.857 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 82' ' ' VAL . . . . . . . . . . . . . 10.9 p -66.87 -29.14 45.33 Favored 'Isoleucine or valine' 0 N--CA 1.498 1.953 0 O-C-N 121.368 -0.833 . . . . 0.0 110.29 179.606 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 83' ' ' ARG . . . . . 0.467 ' HD2' HG21 ' A' ' 64' ' ' VAL . 3.0 mtt85 -56.92 -41.16 77.68 Favored 'General case' 0 N--CA 1.501 2.103 0 O-C-N 121.307 -0.87 . . . . 0.0 109.777 178.99 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 84' ' ' CYS . . . . . . . . . . . . . 84.4 m -85.45 -33.9 21.78 Favored 'General case' 0 N--CA 1.497 1.893 0 O-C-N 121.477 -0.764 . . . . 0.0 109.584 178.857 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 85' ' ' MET . . . . . . . . . . . . . 36.2 ttp -88.7 83.95 6.72 Favored 'General case' 0 N--CA 1.496 1.864 0 O-C-N 121.46 -0.775 . . . . 0.0 109.88 179.403 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 86' ' ' LYS . . . . . . . . . . . . . 1.6 mttt -110.28 137.1 48.46 Favored 'General case' 0 N--CA 1.499 1.994 0 O-C-N 121.23 -0.919 . . . . 0.0 110.89 -179.695 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 87' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -109.88 55.27 0.64 Allowed 'General case' 0 N--CA 1.497 1.888 0 O-C-N 121.51 -0.744 . . . . 0.0 109.786 179.125 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 88' ' ' ASP . . . . . . . . . . . . . 2.2 m-20 -78.63 125.67 29.68 Favored 'General case' 0 N--CA 1.498 1.957 0 O-C-N 121.217 -0.927 . . . . 0.0 110.647 -179.45 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 89' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER . . . . . 0 N--CA 1.498 1.932 0 CA-C-O 118.126 -0.94 . . . . 0.0 110.272 179.858 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B ' 144' ' ' ARG . . . . . . . . . . . . . 17.9 ptt180 . . . . . 0 N--CA 1.498 1.941 0 CA-C-O 121.193 0.521 . . . . 0.0 110.527 . . . . . . . . . 0 0 . 1 . 014 nuclear orig full ' B' B ' 145' ' ' ARG . . . . . . . . . . . . . 27.4 mtt85 51.01 50.88 18.23 Favored 'General case' 0 N--CA 1.504 2.245 0 O-C-N 121.364 -0.835 . . . . 0.0 110.698 -179.917 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B ' 146' ' ' VAL . . . . . 0.572 HG13 ' CD1' ' B' ' 148' ' ' ILE . 9.9 p -114.98 149.43 17.2 Favored 'Isoleucine or valine' 0 N--CA 1.498 1.954 0 O-C-N 121.194 -0.941 . . . . 0.0 110.607 -179.698 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' B' B ' 147' ' ' ARG . . . . . . . . . . . . . 3.9 mtm180 -111.88 119.61 39.15 Favored 'General case' 0 N--CA 1.498 1.961 0 O-C-N 121.242 -0.911 . . . . 0.0 110.917 -179.675 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B ' 148' ' ' ILE . . . . . 0.572 ' CD1' HG13 ' B' ' 146' ' ' VAL . 2.2 mp -116.83 -43.45 3.26 Favored 'Isoleucine or valine' 0 N--CA 1.498 1.968 0 O-C-N 121.521 -0.737 . . . . 0.0 110.131 179.571 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' B' B ' 149' ' ' SER . . . . . . . . . . . . . 8.8 t 59.69 -160.21 0.29 Allowed 'General case' 0 N--CA 1.502 2.159 0 O-C-N 121.519 -0.738 . . . . 0.0 110.766 179.899 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B ' 150' ' ' ALA . . . . . . . . . . . . . . . -111.36 -43.64 3.67 Favored 'General case' 0 N--CA 1.496 1.84 0 O-C-N 121.259 -0.9 . . . . 0.0 110.403 -179.974 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B ' 151' ' ' ASP . . . . . . . . . . . . . 8.0 p-10 -58.09 -42.87 86.57 Favored 'General case' 0 N--CA 1.499 1.993 0 O-C-N 121.541 -0.725 . . . . 0.0 111.287 -179.771 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B ' 152' ' ' ALA . . . . . 0.42 ' HB3' HD12 ' A' ' 48' ' ' LEU . . . -58.49 -50.02 75.25 Favored 'General case' 0 N--CA 1.499 2.009 0 O-C-N 121.149 -0.969 . . . . 0.0 110.239 179.8 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' B' B ' 153' ' ' MET . . . . . 0.513 ' HE3' HG23 ' B' ' 148' ' ' ILE . 1.5 ttt -68.33 -36.58 79.49 Favored 'General case' 0 N--CA 1.497 1.905 0 O-C-N 121.431 -0.793 . . . . 0.0 109.908 179.233 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' B' B ' 154' ' ' MET . . . . . 0.521 ' HE3' ' HB3' ' A' ' 19' ' ' GLU . 4.1 mtt -61.5 -47.83 83.83 Favored 'General case' 0 N--CA 1.497 1.912 0 O-C-N 121.501 -0.75 . . . . 0.0 110.063 179.523 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' B' B ' 155' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -63.33 -28.51 70.06 Favored 'General case' 0 N--CA 1.499 1.99 0 O-C-N 121.462 -0.774 . . . . 0.0 110.962 179.739 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' B' B ' 156' ' ' ALA . . . . . . . . . . . . . . . -89.66 -22.23 22.37 Favored 'General case' 0 N--CA 1.501 2.078 0 O-C-N 121.236 -0.915 . . . . 0.0 111.724 -179.439 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B ' 157' ' ' LEU . . . . . . . . . . . . . 9.3 mt -99.12 -43.56 6.6 Favored 'General case' 0 N--CA 1.499 2.012 0 O-C-N 120.893 -1.129 . . . . 0.0 111.203 -179.486 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B ' 158' ' ' LEU . . . . . . . . . . . . . 5.9 mp -76.35 107.19 8.43 Favored 'General case' 0 N--CA 1.499 1.999 0 O-C-N 121.201 -0.937 . . . . 0.0 110.49 -179.66 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B ' 159' ' ' GLY . . . . . . . . . . . . . . . 90.13 -60.14 3.43 Favored Glycine 0 N--CA 1.495 2.629 0 N-CA-C 109.856 -1.298 . . . . 0.0 109.856 179.918 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B ' 160' ' ' ALA . . . . . . . . . . . . . . . -55.47 -54.16 47.25 Favored 'General case' 0 N--CA 1.499 1.993 0 O-C-N 121.747 -0.855 . . . . 0.0 110.972 -179.697 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B ' 161' ' ' ARG . . . . . . . . . . . . . 7.0 ttt-85 -108.8 50.98 0.76 Allowed 'General case' 0 N--CA 1.497 1.876 0 O-C-N 121.232 -0.917 . . . . 0.0 110.066 179.485 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B ' 162' ' ' ALA . . . . . . . . . . . . . . . -132.08 62.8 1.63 Allowed 'General case' 0 N--CA 1.495 1.817 0 O-C-N 121.335 -0.853 . . . . 0.0 110.341 -179.831 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B ' 163' ' ' LYS . . . . . . . . . . . . . 0.5 OUTLIER . . . . . 0 N--CA 1.496 1.871 0 O-C-N 121.265 -0.897 . . . . 0.0 110.648 -179.795 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 90' ' ' ' CA' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 014 nuclear orig full ' A' A ' 91' ' ' SXK . . . . . 0.565 ' HAK' ' CD2' ' A' ' 41' ' ' LEU . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 3.0 ptt? . . . . . 0 N--CA 1.499 1.978 0 CA-C-O 121.009 0.433 . . . . 0.0 110.408 . . . . . . . . . 0 0 . 1 . 015 nuclear orig full ' A' A ' 2' ' ' ASP . . . . . . . . . . . . . 1.2 t70 -100.82 63.36 1.04 Allowed 'General case' 0 N--CA 1.495 1.781 0 O-C-N 121.352 -0.843 . . . . 0.0 110.501 -179.919 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 3' ' ' ASP . . . . . . . . . . . . . 2.0 m-20 -98.09 51.32 1.03 Allowed 'General case' 0 N--CA 1.495 1.803 0 O-C-N 121.238 -0.914 . . . . 0.0 109.955 179.642 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 4' ' ' ILE . . . . . . . . . . . . . 2.7 mp -88.65 -49.11 14.48 Favored 'Isoleucine or valine' 0 N--CA 1.497 1.919 0 O-C-N 121.349 -0.844 . . . . 0.0 110.417 -179.777 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 5' ' ' TYR . . . . . . . . . . . . . 12.2 m-85 -62.3 -40.56 96.69 Favored 'General case' 0 N--CA 1.499 2.013 0 O-C-N 121.303 -0.873 . . . . 0.0 110.306 179.842 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 9.7 ttmt -69.95 -37.59 75.88 Favored 'General case' 0 N--CA 1.496 1.846 0 O-C-N 121.4 -0.813 . . . . 0.0 110.061 179.326 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 7' ' ' ALA . . . . . . . . . . . . . . . -51.81 -49.57 62.52 Favored 'General case' 0 N--CA 1.5 2.049 0 O-C-N 121.577 -0.702 . . . . 0.0 110.258 179.632 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 8' ' ' ALA . . . . . . . . . . . . . . . -61.0 -42.89 99.3 Favored 'General case' 0 N--CA 1.497 1.92 0 O-C-N 121.501 -0.749 . . . . 0.0 109.977 179.23 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 9' ' ' VAL . . . . . 0.439 ' HA ' HD11 ' A' ' 12' ' ' LEU . 38.3 t -60.07 -38.19 75.89 Favored 'Isoleucine or valine' 0 N--CA 1.501 2.123 0 O-C-N 121.48 -0.763 . . . . 0.0 110.135 179.414 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 10' ' ' GLU . . . . . . . . . . . . . 36.8 mt-10 -81.57 -31.66 32.51 Favored 'General case' 0 N--CA 1.497 1.877 0 O-C-N 121.51 -0.744 . . . . 0.0 110.192 179.633 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 11' ' ' GLN . . . . . 0.448 ' NE2' ' HB3' ' A' ' 89' ' ' SER . 41.0 mt-30 -63.04 -32.03 73.3 Favored 'General case' 0 N--CA 1.5 2.063 0 O-C-N 121.588 -0.695 . . . . 0.0 111.027 179.923 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 12' ' ' LEU . . . . . 0.439 HD11 ' HA ' ' A' ' 9' ' ' VAL . 30.5 mt -54.54 139.49 37.8 Favored 'General case' 0 N--CA 1.501 2.112 0 O-C-N 121.292 -0.88 . . . . 0.0 110.397 179.85 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 13' ' ' THR . . . . . . . . . . . . . 72.1 p -77.55 165.01 24.86 Favored 'General case' 0 N--CA 1.499 1.979 0 O-C-N 121.216 -0.927 . . . . 0.0 110.025 179.643 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 14' ' ' GLU . . . . . 0.509 ' HA ' ' HD3' ' A' ' 17' ' ' LYS . 0.5 OUTLIER -55.22 -27.51 46.62 Favored 'General case' 0 N--CA 1.493 1.697 0 O-C-N 121.507 -0.746 . . . . 0.0 110.788 -179.6 . . . . . . . . 3 3 . 1 . 015 nuclear orig full ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 1.5 mp0 -61.31 -47.49 85.69 Favored 'General case' 0 N--CA 1.496 1.848 0 O-C-N 121.351 -0.843 . . . . 0.0 109.329 178.828 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 16' ' ' GLN . . . . . . . . . . . . . 1.2 mt-30 -67.02 -41.65 86.26 Favored 'General case' 0 N--CA 1.498 1.953 0 CA-C-O 121.581 0.705 . . . . 0.0 109.614 178.784 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 17' ' ' LYS . . . . . 0.509 ' HD3' ' HA ' ' A' ' 14' ' ' GLU . 0.2 OUTLIER -59.42 -45.14 92.37 Favored 'General case' 0 N--CA 1.499 1.999 0 CA-C-O 121.119 0.485 . . . . 0.0 109.786 179.202 . . . . . . . . 3 3 . 1 . 015 nuclear orig full ' A' A ' 18' ' ' ASN . . . . . . . . . . . . . 0.8 OUTLIER -69.35 -41.08 77.08 Favored 'General case' 0 N--CA 1.496 1.863 0 O-C-N 121.593 -0.692 . . . . 0.0 109.945 179.316 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 0.3 OUTLIER -60.39 -45.49 93.37 Favored 'General case' 0 N--CA 1.5 2.036 0 O-C-N 121.416 -0.802 . . . . 0.0 109.694 179.083 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 20' ' ' PHE . . . . . 0.436 ' CE1' ' HG2' ' A' ' 81' ' ' MET . 8.4 m-85 -64.73 -35.29 80.59 Favored 'General case' 0 N--CA 1.497 1.882 0 O-C-N 121.531 -0.731 . . . . 0.0 109.77 178.94 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 21' ' ' LYS . . . . . 0.474 ' HG3' ' N ' ' A' ' 22' ' ' ALA . 0.0 OUTLIER -60.82 -39.89 90.69 Favored 'General case' 0 N--CA 1.497 1.885 0 O-C-N 121.439 -0.788 . . . . 0.0 109.6 179.173 . . . . . . . . 3 3 . 1 . 015 nuclear orig full ' A' A ' 22' ' ' ALA . . . . . 0.474 ' N ' ' HG3' ' A' ' 21' ' ' LYS . . . -62.99 -46.84 85.78 Favored 'General case' 0 N--CA 1.498 1.943 0 O-C-N 121.386 -0.821 . . . . 0.0 109.816 179.136 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 23' ' ' ALA . . . . . . . . . . . . . . . -66.81 -39.3 87.66 Favored 'General case' 0 N--CA 1.497 1.891 0 O-C-N 121.497 -0.752 . . . . 0.0 110.145 179.259 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 24' ' ' PHE . . . . . . . . . . . . . 73.1 t80 -68.41 -39.83 81.49 Favored 'General case' 0 N--CA 1.498 1.941 0 O-C-N 121.516 -0.74 . . . . 0.0 110.297 179.607 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 25' ' ' ASP . . . . . . . . . . . . . 0.9 OUTLIER -54.24 -43.51 70.95 Favored 'General case' 0 N--CA 1.498 1.974 0 O-C-N 121.5 -0.75 . . . . 0.0 110.047 179.733 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 26' ' ' ILE . . . . . . . . . . . . . 12.9 mt -74.57 -28.07 21.75 Favored 'Isoleucine or valine' 0 N--CA 1.498 1.929 0 O-C-N 121.424 -0.797 . . . . 0.0 109.478 178.564 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 27' ' ' PHE . . . . . . . . . . . . . 0.2 OUTLIER -73.36 -10.54 59.85 Favored 'General case' 0 N--CA 1.498 1.953 0 O-C-N 121.285 -0.884 . . . . 0.0 111.239 179.452 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 28' ' ' VAL . . . . . . . . . . . . . 21.2 m -125.26 3.17 4.57 Favored 'Isoleucine or valine' 0 N--CA 1.501 2.103 0 O-C-N 121.036 -1.04 . . . . 0.0 111.25 179.841 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 29' ' ' LEU . . . . . . . . . . . . . 2.1 pp -65.64 -32.49 74.09 Favored 'General case' 0 N--CA 1.5 2.033 0 O-C-N 120.913 -1.117 . . . . 0.0 110.154 179.666 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 30' ' ' GLY . . . . . . . . . . . . . . . -114.58 28.05 8.44 Favored Glycine 0 N--CA 1.495 2.628 0 N-CA-C 109.283 -1.527 . . . . 0.0 109.283 178.939 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 31' ' ' ALA . . . . . . . . . . . . . . . -124.17 -127.73 0.25 Allowed 'General case' 0 N--CA 1.493 1.725 0 O-C-N 121.516 -0.99 . . . . 0.0 109.668 -179.994 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 32' ' ' GLU . . . . . . . . . . . . . 2.8 mp0 -96.94 -176.09 3.46 Favored 'General case' 0 N--CA 1.497 1.887 0 O-C-N 121.011 -1.056 . . . . 0.0 109.82 179.499 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 3.8 m-20 -68.44 83.33 0.26 Allowed 'General case' 0 N--CA 1.5 2.045 0 O-C-N 121.33 -0.856 . . . . 0.0 110.449 -179.946 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 34' ' ' GLY . . . . . . . . . . . . . . . 73.49 35.16 56.26 Favored Glycine 0 N--CA 1.495 2.608 0 N-CA-C 109.649 -1.38 . . . . 0.0 109.649 -179.448 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 35' ' ' CYS . . . . . . . . . . . . . 1.1 m -146.9 160.22 42.59 Favored 'General case' 0 N--CA 1.497 1.895 0 O-C-N 121.374 -1.074 . . . . 0.0 110.777 -179.692 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 36' ' ' ILE . . . . . . . . . . . . . 4.1 mt -129.12 126.12 63.72 Favored 'Isoleucine or valine' 0 N--CA 1.498 1.954 0 O-C-N 121.506 -0.746 . . . . 0.0 110.33 -179.983 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 37' ' ' SER . . . . . . . . . . . . . 1.1 t -125.1 66.33 1.12 Allowed 'General case' 0 N--CA 1.496 1.867 0 O-C-N 121.406 -0.809 . . . . 0.0 110.265 179.755 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 38' ' ' THR . . . . . 0.404 ' HA ' ' HB3' ' A' ' 41' ' ' LEU . 1.2 p 66.25 -43.59 0.4 Allowed 'General case' 0 N--CA 1.518 2.958 0 N-CA-C 112.866 0.691 . . . . 0.0 112.866 179.69 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 39' ' ' LYS . . . . . . . . . . . . . 3.7 ttpp -46.59 -64.84 0.66 Allowed 'General case' 0 N--CA 1.505 2.31 0 O-C-N 121.045 -1.035 . . . . 0.0 111.826 -178.941 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER -71.44 -32.0 67.84 Favored 'General case' 0 N--CA 1.5 2.033 0 O-C-N 121.076 -1.015 . . . . 0.0 110.245 179.916 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 41' ' ' LEU . . . . . 0.454 HD22 ' HAK' ' A' ' 91' ' ' SXK . 4.8 tp -59.08 -50.95 72.13 Favored 'General case' 0 N--CA 1.497 1.919 0 O-C-N 121.5 -0.75 . . . . 0.0 110.377 179.737 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 42' ' ' GLY . . . . . . . . . . . . . . . -59.93 -38.06 93.56 Favored Glycine 0 N--CA 1.493 2.475 0 N-CA-C 110.033 -1.227 . . . . 0.0 110.033 -179.922 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 43' ' ' LYS . . . . . . . . . . . . . 1.9 ttpt -54.23 -44.32 71.61 Favored 'General case' 0 N--CA 1.5 2.036 0 O-C-N 121.439 -1.036 . . . . 0.0 109.832 179.251 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 44' ' ' VAL . . . . . . . . . . . . . 92.7 t -76.31 -39.46 34.58 Favored 'Isoleucine or valine' 0 N--CA 1.496 1.851 0 O-C-N 121.521 -0.737 . . . . 0.0 109.788 179.153 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 45' ' ' MET . . . . . 0.477 ' HE2' HG13 ' B' ' 148' ' ' ILE . 8.7 mmt -61.3 -36.74 80.91 Favored 'General case' 0 N--CA 1.501 2.089 0 O-C-N 121.393 -0.817 . . . . 0.0 109.944 179.222 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 46' ' ' ARG . . . . . . . . . . . . . 0.9 OUTLIER -64.02 -34.44 78.01 Favored 'General case' 0 N--CA 1.5 2.037 0 O-C-N 121.487 -0.758 . . . . 0.0 109.949 179.122 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 47' ' ' MET . . . . . . . . . . . . . 3.1 ttp -77.48 -35.16 53.95 Favored 'General case' 0 N--CA 1.496 1.852 0 O-C-N 121.484 -0.76 . . . . 0.0 109.777 179.401 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 48' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -136.04 89.89 2.53 Favored 'General case' 0 N--CA 1.495 1.794 0 O-C-N 121.407 -0.808 . . . . 0.0 109.57 179.295 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 49' ' ' GLY . . . . . 0.451 ' C ' ' HG3' ' A' ' 50' ' ' GLN . . . 147.36 -114.63 0.72 Allowed Glycine 0 N--CA 1.497 2.701 0 N-CA-C 109.617 -1.393 . . . . 0.0 109.617 -179.503 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 50' ' ' GLN . . . . . 0.451 ' HG3' ' C ' ' A' ' 49' ' ' GLY . 0.0 OUTLIER -149.21 -52.93 0.16 Allowed 'General case' 0 N--CA 1.502 2.163 0 O-C-N 121.575 -0.956 . . . . 0.0 109.818 179.914 . . . . . . . . 3 3 . 1 . 015 nuclear orig full ' A' A ' 51' ' ' ASN . . . . . . . . . . . . . 45.3 t30 54.72 78.75 0.37 Allowed Pre-proline 0 N--CA 1.502 2.134 0 O-C-N 121.8 -0.562 . . . . 0.0 112.11 179.317 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 52' ' ' PRO . . . . . . . . . . . . . 44.8 Cg_endo -78.64 -61.55 0.03 OUTLIER 'Trans proline' 0 C--N 1.315 -1.224 0 O-C-N 123.601 1.316 . . . . 0.0 110.0 178.573 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 53' ' ' THR . . . . . . . . . . . . . 3.3 p -134.67 162.29 58.58 Favored Pre-proline 0 N--CA 1.492 1.639 0 O-C-N 121.297 -0.877 . . . . 0.0 109.623 179.611 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 54' ' ' PRO . . . . . . . . . . . . . 43.4 Cg_endo -68.42 -31.06 28.59 Favored 'Trans proline' 0 N--CA 1.491 1.381 0 O-C-N 123.498 1.262 . . . . 0.0 110.515 179.555 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 55' ' ' GLU . . . . . . . . . . . . . 28.9 mp0 -67.39 -29.4 68.9 Favored 'General case' 0 N--CA 1.496 1.853 0 O-C-N 121.548 -0.72 . . . . 0.0 110.227 179.381 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -60.57 -32.74 71.82 Favored 'General case' 0 N--CA 1.499 2.015 0 O-C-N 121.519 -0.738 . . . . 0.0 111.45 -179.754 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 57' ' ' LEU . . . . . 0.451 ' HB3' HD23 ' A' ' 41' ' ' LEU . 9.0 mt -89.17 -12.65 40.36 Favored 'General case' 0 N--CA 1.496 1.85 0 O-C-N 121.043 -1.036 . . . . 0.0 111.413 -179.408 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 58' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -66.3 -47.95 71.94 Favored 'General case' 0 N--CA 1.492 1.662 0 O-C-N 120.912 -1.118 . . . . 0.0 108.69 179.234 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 59' ' ' GLU . . . . . . . . . . . . . 8.5 pt-20 -61.15 -31.38 71.1 Favored 'General case' 0 N--CA 1.495 1.819 0 O-C-N 121.548 -0.72 . . . . 0.0 109.601 178.69 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 60' ' ' MET . . . . . 0.423 ' HB2' ' O ' ' A' ' 57' ' ' LEU . 1.9 mmm -61.08 -42.14 97.95 Favored 'General case' 0 N--CA 1.497 1.878 0 O-C-N 121.5 -0.75 . . . . 0.0 109.663 178.811 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 61' ' ' ILE . . . . . 0.527 HG12 HG22 ' A' ' 72' ' ' VAL . 10.9 mt -72.75 -45.42 57.01 Favored 'Isoleucine or valine' 0 N--CA 1.497 1.89 0 O-C-N 121.355 -0.841 . . . . 0.0 109.658 178.982 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 62' ' ' ASP . . . . . . . . . . . . . 10.4 m-20 -54.11 -35.09 61.77 Favored 'General case' 0 N--CA 1.499 1.989 0 O-C-N 121.675 -0.641 . . . . 0.0 111.064 -179.735 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 63' ' ' GLU . . . . . . . . . . . . . 3.5 tm-20 -58.47 -39.93 81.3 Favored 'General case' 0 N--CA 1.501 2.089 0 O-C-N 121.217 -0.927 . . . . 0.0 110.068 179.459 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 64' ' ' VAL . . . . . 0.408 HG23 ' HB3' ' A' ' 80' ' ' MET . 23.1 m -107.23 23.81 3.04 Favored 'Isoleucine or valine' 0 N--CA 1.497 1.913 0 O-C-N 121.404 -0.81 . . . . 0.0 110.709 179.5 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 65' ' ' ASP . . . . . . . . . . . . . 11.3 t0 -98.2 97.15 8.6 Favored 'General case' 0 N--CA 1.495 1.806 0 O-C-N 121.104 -0.998 . . . . 0.0 110.074 179.648 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 66' ' ' GLU . . . . . . . . . . . . . 3.3 mp0 -91.88 28.67 1.75 Allowed 'General case' 0 N--CA 1.495 1.803 0 O-C-N 121.416 -0.802 . . . . 0.0 109.264 178.818 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 67' ' ' ASP . . . . . . . . . . . . . 1.0 OUTLIER -107.61 -29.58 9.09 Favored 'General case' 0 N--CA 1.492 1.65 0 O-C-N 121.593 -0.692 . . . . 0.0 110.361 -179.477 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 68' ' ' GLY . . . . . . . . . . . . . . . 80.08 19.39 69.91 Favored Glycine 0 N--CA 1.492 2.398 0 N-CA-C 108.215 -1.954 . . . . 0.0 108.215 -177.548 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 69' ' ' SER . . . . . . . . . . . . . 59.9 p -109.81 -44.9 3.73 Favored 'General case' 0 N--CA 1.493 1.704 0 O-C-N 121.609 -0.936 . . . . 0.0 110.393 -179.592 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 70' ' ' GLY . . . . . . . . . . . . . . . 118.06 -40.21 2.38 Favored Glycine 0 N--CA 1.499 2.89 0 C-N-CA 119.927 -1.13 . . . . 0.0 110.881 179.518 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 71' ' ' THR . . . . . . . . . . . . . 4.7 m -76.45 144.21 40.05 Favored 'General case' 0 N--CA 1.505 2.276 0 O-C-N 121.002 -1.293 . . . . 0.0 110.342 -179.686 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 72' ' ' VAL . . . . . 0.527 HG22 HG12 ' A' ' 61' ' ' ILE . 0.7 OUTLIER -98.69 136.93 27.76 Favored 'Isoleucine or valine' 0 N--CA 1.497 1.888 0 O-C-N 121.496 -0.753 . . . . 0.0 110.373 179.919 . . . . . . . . 3 3 . 1 . 015 nuclear orig full ' A' A ' 73' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER -113.81 -165.37 1.0 Allowed 'General case' 0 N--CA 1.496 1.874 0 O-C-N 121.371 -0.831 . . . . 0.0 110.05 179.814 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 74' ' ' PHE . . . . . . . . . . . . . 23.6 t80 -64.37 -44.85 90.09 Favored 'General case' 0 N--CA 1.499 1.984 0 O-C-N 121.174 -0.953 . . . . 0.0 110.475 179.893 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 75' ' ' ASP . . . . . . . . . . . . . 30.2 t70 -57.72 -51.9 67.64 Favored 'General case' 0 N--CA 1.497 1.909 0 O-C-N 121.412 -0.805 . . . . 0.0 109.881 179.447 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 76' ' ' GLU . . . . . . . . . . . . . 35.0 mt-10 -60.49 -37.09 79.95 Favored 'General case' 0 N--CA 1.499 1.989 0 O-C-N 121.576 -0.702 . . . . 0.0 109.771 178.9 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 77' ' ' PHE . . . . . 0.497 ' HA ' ' CE ' ' A' ' 80' ' ' MET . 2.4 t80 -57.63 -36.64 72.08 Favored 'General case' 0 N--CA 1.496 1.849 0 O-C-N 121.691 -0.63 . . . . 0.0 110.279 179.362 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 78' ' ' LEU . . . . . . . . . . . . . 12.5 mt -75.29 -37.12 61.04 Favored 'General case' 0 N--CA 1.496 1.84 0 O-C-N 121.512 -0.742 . . . . 0.0 110.943 -179.945 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 79' ' ' VAL . . . . . 0.443 ' O ' HG21 ' A' ' 82' ' ' VAL . 66.1 t -62.11 -49.26 84.81 Favored 'Isoleucine or valine' 0 N--CA 1.503 2.196 0 O-C-N 121.23 -0.919 . . . . 0.0 111.21 -179.504 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 80' ' ' MET . . . . . 0.497 ' CE ' ' HA ' ' A' ' 77' ' ' PHE . 16.2 ptt? -69.67 -24.27 63.58 Favored 'General case' 0 N--CA 1.502 2.147 0 O-C-N 120.872 -1.143 . . . . 0.0 110.727 -179.806 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 81' ' ' MET . . . . . 0.436 ' HG2' ' CE1' ' A' ' 20' ' ' PHE . 24.9 tpp -73.89 -50.46 20.12 Favored 'General case' 0 N--CA 1.494 1.757 0 O-C-N 121.098 -1.002 . . . . 0.0 109.825 179.2 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 82' ' ' VAL . . . . . 0.443 HG21 ' O ' ' A' ' 79' ' ' VAL . 30.1 m -62.25 -26.08 39.33 Favored 'Isoleucine or valine' 0 N--CA 1.503 2.19 0 O-C-N 121.174 -0.954 . . . . 0.0 109.846 178.905 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 83' ' ' ARG . . . . . 0.459 ' HD2' ' HA ' ' A' ' 80' ' ' MET . 19.6 mtt180 -66.1 -52.32 49.72 Favored 'General case' 0 N--CA 1.496 1.858 0 O-C-N 121.283 -0.886 . . . . 0.0 108.936 178.601 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 84' ' ' CYS . . . . . . . . . . . . . 37.7 t -64.74 -23.36 67.22 Favored 'General case' 0 N--CA 1.499 2.009 0 O-C-N 121.648 -0.658 . . . . 0.0 110.397 178.964 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 85' ' ' MET . . . . . 0.466 ' O ' ' HB2' ' A' ' 86' ' ' LYS . 9.5 mtt -66.37 -16.98 64.5 Favored 'General case' 0 N--CA 1.499 1.991 0 O-C-N 121.301 -0.874 . . . . 0.0 110.647 179.257 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 86' ' ' LYS . . . . . 0.466 ' HB2' ' O ' ' A' ' 85' ' ' MET . 18.3 mtmm 67.44 -72.82 0.09 Allowed 'General case' 0 N--CA 1.505 2.277 0 O-C-N 121.849 -0.532 . . . . 0.0 110.837 -179.991 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 87' ' ' ASP . . . . . . . . . . . . . 4.8 t70 -123.27 126.53 47.09 Favored 'General case' 0 N--CA 1.495 1.776 0 O-C-N 121.114 -0.991 . . . . 0.0 110.599 179.959 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 88' ' ' ASP . . . . . . . . . . . . . 12.9 t70 -157.19 152.51 26.33 Favored 'General case' 0 N--CA 1.496 1.85 0 O-C-N 121.436 -0.79 . . . . 0.0 110.288 179.884 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 89' ' ' SER . . . . . 0.448 ' HB3' ' NE2' ' A' ' 11' ' ' GLN . 16.5 m . . . . . 0 N--CA 1.503 2.178 0 CA-C-O 118.016 -0.993 . . . . 0.0 110.822 179.933 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' B' B ' 144' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.496 1.839 0 CA-C-O 121.157 0.503 . . . . 0.0 110.487 . . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' B' B ' 145' ' ' ARG . . . . . . . . . . . . . 0.3 OUTLIER -137.53 119.83 15.76 Favored 'General case' 0 N--CA 1.495 1.792 0 O-C-N 121.467 -0.771 . . . . 0.0 110.096 179.875 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' B' B ' 146' ' ' VAL . . . . . . . . . . . . . 3.3 p -92.26 164.76 2.03 Favored 'Isoleucine or valine' 0 N--CA 1.498 1.936 0 O-C-N 121.44 -0.788 . . . . 0.0 110.667 -179.937 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' B' B ' 147' ' ' ARG . . . . . . . . . . . . . 3.2 mpt_? -120.02 -53.72 2.15 Favored 'General case' 0 N--CA 1.498 1.963 0 O-C-N 121.493 -0.755 . . . . 0.0 110.375 -179.777 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' B' B ' 148' ' ' ILE . . . . . 0.477 HG13 ' HE2' ' A' ' 45' ' ' MET . 30.1 mm 60.01 81.28 0.06 OUTLIER 'Isoleucine or valine' 0 N--CA 1.502 2.134 0 CA-C-O 121.386 0.613 . . . . 0.0 110.646 -179.926 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' B' B ' 149' ' ' SER . . . . . . . . . . . . . 30.1 t -78.86 137.47 37.69 Favored 'General case' 0 N--CA 1.499 1.994 0 O-C-N 121.248 -0.907 . . . . 0.0 110.477 179.691 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' B' B ' 150' ' ' ALA . . . . . . . . . . . . . . . -58.24 -41.86 85.08 Favored 'General case' 0 N--CA 1.499 2.002 0 O-C-N 121.556 -0.715 . . . . 0.0 110.582 179.765 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' B' B ' 151' ' ' ASP . . . . . . . . . . . . . 20.7 t70 -67.16 -47.14 71.89 Favored 'General case' 0 N--CA 1.497 1.909 0 O-C-N 121.317 -0.864 . . . . 0.0 110.308 179.677 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' B' B ' 152' ' ' ALA . . . . . . . . . . . . . . . -60.01 -47.36 86.17 Favored 'General case' 0 N--CA 1.499 1.978 0 O-C-N 121.511 -0.743 . . . . 0.0 110.731 -179.94 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' B' B ' 153' ' ' MET . . . . . . . . . . . . . 0.1 OUTLIER -64.74 -40.05 94.65 Favored 'General case' 0 N--CA 1.498 1.932 0 O-C-N 121.328 -0.858 . . . . 0.0 110.239 179.769 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' B' B ' 154' ' ' MET . . . . . . . . . . . . . 3.1 tpp -63.18 -47.69 81.55 Favored 'General case' 0 N--CA 1.499 1.976 0 O-C-N 121.434 -0.791 . . . . 0.0 110.16 179.501 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' B' B ' 155' ' ' GLN . . . . . . . . . . . . . 0.8 OUTLIER -68.7 -36.95 79.14 Favored 'General case' 0 N--CA 1.5 2.032 0 O-C-N 121.388 -0.82 . . . . 0.0 110.494 179.573 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' B' B ' 156' ' ' ALA . . . . . . . . . . . . . . . -69.65 -29.79 67.34 Favored 'General case' 0 N--CA 1.499 2.005 0 O-C-N 121.306 -0.871 . . . . 0.0 110.934 179.881 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' B' B ' 157' ' ' LEU . . . . . . . . . . . . . 4.8 tp -84.9 -33.99 22.65 Favored 'General case' 0 N--CA 1.497 1.877 0 O-C-N 121.319 -0.863 . . . . 0.0 110.501 179.981 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' B' B ' 158' ' ' LEU . . . . . 0.448 HD23 ' N ' ' B' ' 158' ' ' LEU . 4.2 mm? -95.53 47.19 1.11 Allowed 'General case' 0 N--CA 1.496 1.862 0 O-C-N 121.297 -0.877 . . . . 0.0 110.308 -179.748 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' B' B ' 159' ' ' GLY . . . . . . . . . . . . . . . 155.75 -149.48 20.56 Favored Glycine 0 N--CA 1.495 2.574 0 N-CA-C 109.674 -1.371 . . . . 0.0 109.674 179.866 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' B' B ' 160' ' ' ALA . . . . . . . . . . . . . . . 50.43 -98.21 0.06 Allowed 'General case' 0 N--CA 1.5 2.073 0 O-C-N 121.823 -0.81 . . . . 0.0 110.706 -179.888 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' B' B ' 161' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -154.35 53.48 0.68 Allowed 'General case' 0 N--CA 1.495 1.818 0 O-C-N 121.017 -1.052 . . . . 0.0 110.187 179.587 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' B' B ' 162' ' ' ALA . . . . . . . . . . . . . . . -99.89 -58.84 1.83 Allowed 'General case' 0 N--CA 1.494 1.734 0 O-C-N 121.245 -0.909 . . . . 0.0 109.514 179.394 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' B' B ' 163' ' ' LYS . . . . . 0.463 ' HA ' ' CE ' ' B' ' 163' ' ' LYS . 0.0 OUTLIER . . . . . 0 N--CA 1.494 1.737 0 CA-C-O 118.205 -0.902 . . . . 0.0 110.227 179.374 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 90' ' ' ' CA' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 015 nuclear orig full ' A' A ' 91' ' ' SXK . . . . . 0.454 ' HAK' HD22 ' A' ' 41' ' ' LEU . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 6.1 ptt? . . . . . 0 N--CA 1.5 2.041 0 CA-C-O 121.429 0.633 . . . . 0.0 110.248 . . . . . . . . . 0 0 . 1 . 016 nuclear orig full ' A' A ' 2' ' ' ASP . . . . . . . . . . . . . 0.0 OUTLIER -150.11 -68.63 0.2 Allowed 'General case' 0 N--CA 1.497 1.875 0 O-C-N 121.36 -0.838 . . . . 0.0 109.637 -179.717 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 3' ' ' ASP . . . . . . . . . . . . . 10.3 m-20 46.95 58.79 4.45 Favored 'General case' 0 N--CA 1.502 2.164 0 O-C-N 121.734 -0.604 . . . . 0.0 111.576 178.547 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 4' ' ' ILE . . . . . . . . . . . . . 9.5 mt -72.89 -48.82 43.35 Favored 'Isoleucine or valine' 0 N--CA 1.499 1.977 0 O-C-N 121.046 -1.034 . . . . 0.0 109.945 179.981 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 5' ' ' TYR . . . . . 0.405 ' HB3' ' CG2' ' A' ' 79' ' ' VAL . 0.9 OUTLIER -66.92 -39.54 87.4 Favored 'General case' 0 N--CA 1.496 1.831 0 O-C-N 121.369 -0.832 . . . . 0.0 109.563 179.125 . . . . . . . . 3 3 . 1 . 016 nuclear orig full ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 0.4 OUTLIER -68.07 -32.73 73.27 Favored 'General case' 0 N--CA 1.495 1.818 0 O-C-N 121.562 -0.712 . . . . 0.0 109.81 178.946 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 7' ' ' ALA . . . . . . . . . . . . . . . -63.4 -34.65 78.2 Favored 'General case' 0 N--CA 1.499 1.975 0 O-C-N 121.233 -0.917 . . . . 0.0 109.483 178.728 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 8' ' ' ALA . . . . . . . . . . . . . . . -66.02 -28.05 68.58 Favored 'General case' 0 N--CA 1.495 1.808 0 O-C-N 121.496 -0.753 . . . . 0.0 110.229 178.892 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 9' ' ' VAL . . . . . . . . . . . . . 68.6 t -64.52 -32.75 59.09 Favored 'Isoleucine or valine' 0 N--CA 1.5 2.069 0 O-C-N 121.318 -0.864 . . . . 0.0 110.338 179.475 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 10' ' ' GLU . . . . . . . . . . . . . 15.4 mt-10 -65.58 -25.45 67.41 Favored 'General case' 0 N--CA 1.499 2.01 0 O-C-N 121.301 -0.874 . . . . 0.0 110.665 179.871 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 11' ' ' GLN . . . . . . . . . . . . . 0.3 OUTLIER -65.45 -24.47 67.18 Favored 'General case' 0 N--CA 1.5 2.065 0 O-C-N 121.407 -0.808 . . . . 0.0 110.991 179.635 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 12' ' ' LEU . . . . . . . . . . . . . 10.2 mt -61.47 135.83 57.81 Favored 'General case' 0 N--CA 1.499 2.023 0 O-C-N 121.256 -0.902 . . . . 0.0 110.45 -179.935 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 13' ' ' THR . . . . . . . . . . . . . 27.9 p -77.97 165.02 24.57 Favored 'General case' 0 N--CA 1.498 1.966 0 O-C-N 121.275 -0.891 . . . . 0.0 110.357 179.623 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 14' ' ' GLU . . . . . . . . . . . . . 0.6 OUTLIER -56.52 -31.49 64.17 Favored 'General case' 0 N--CA 1.494 1.739 0 O-C-N 121.678 -0.639 . . . . 0.0 110.407 -179.879 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 1.4 mp0 -62.07 -52.79 62.47 Favored 'General case' 0 N--CA 1.498 1.933 0 O-C-N 121.467 -0.771 . . . . 0.0 109.761 179.306 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 16' ' ' GLN . . . . . . . . . . . . . 38.9 mt-30 -65.02 -33.18 75.44 Favored 'General case' 0 N--CA 1.497 1.888 0 O-C-N 121.627 -0.671 . . . . 0.0 110.111 179.448 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 17' ' ' LYS . . . . . . . . . . . . . 15.4 mttp -63.56 -49.0 75.15 Favored 'General case' 0 N--CA 1.497 1.904 0 N-CA-C 109.47 -0.567 . . . . 0.0 109.47 179.009 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 18' ' ' ASN . . . . . 0.494 ' HA ' ' HG2' ' A' ' 21' ' ' LYS . 41.7 t30 -71.47 -32.21 68.02 Favored 'General case' 0 N--CA 1.497 1.894 0 O-C-N 121.537 -0.727 . . . . 0.0 109.225 178.398 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 2.4 tt0 -66.73 -41.78 87.33 Favored 'General case' 0 N--CA 1.496 1.848 0 O-C-N 121.539 -0.726 . . . . 0.0 109.425 178.925 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 20' ' ' PHE . . . . . . . . . . . . . 3.0 m-85 -70.68 -34.72 72.3 Favored 'General case' 0 N--CA 1.497 1.877 0 O-C-N 121.497 -0.752 . . . . 0.0 110.301 179.477 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 21' ' ' LYS . . . . . 0.581 ' HG3' ' N ' ' A' ' 22' ' ' ALA . 0.0 OUTLIER -64.47 -28.03 69.39 Favored 'General case' 0 N--CA 1.497 1.921 0 O-C-N 121.33 -0.856 . . . . 0.0 110.158 179.524 . . . . . . . . 3 3 . 1 . 016 nuclear orig full ' A' A ' 22' ' ' ALA . . . . . 0.581 ' N ' ' HG3' ' A' ' 21' ' ' LYS . . . -65.44 -44.49 87.13 Favored 'General case' 0 N--CA 1.498 1.963 0 O-C-N 121.143 -0.973 . . . . 0.0 108.96 178.401 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 23' ' ' ALA . . . . . . . . . . . . . . . -71.71 -40.44 69.48 Favored 'General case' 0 N--CA 1.493 1.7 0 N-CA-C 109.086 -0.709 . . . . 0.0 109.086 178.33 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 24' ' ' PHE . . . . . . . . . . . . . 65.2 t80 -59.37 -43.63 92.83 Favored 'General case' 0 N--CA 1.499 1.999 0 O-C-N 121.65 -0.656 . . . . 0.0 110.511 179.448 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 25' ' ' ASP . . . . . . . . . . . . . 16.3 m-20 -61.15 -45.51 94.34 Favored 'General case' 0 N--CA 1.499 2.004 0 O-C-N 121.4 -0.813 . . . . 0.0 110.67 179.997 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 26' ' ' ILE . . . . . . . . . . . . . 54.4 mt -73.56 -21.25 18.46 Favored 'Isoleucine or valine' 0 N--CA 1.501 2.081 0 O-C-N 121.419 -0.801 . . . . 0.0 110.96 179.971 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 27' ' ' PHE . . . . . . . . . . . . . 0.2 OUTLIER -70.29 -11.24 60.77 Favored 'General case' 0 N--CA 1.502 2.15 0 O-C-N 120.991 -1.068 . . . . 0.0 111.878 -179.691 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 28' ' ' VAL . . . . . . . . . . . . . 6.8 m -127.63 -46.83 1.2 Allowed 'Isoleucine or valine' 0 N--CA 1.499 1.984 0 O-C-N 120.949 -1.094 . . . . 0.0 111.049 179.859 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 29' ' ' LEU . . . . . . . . . . . . . 12.7 mt 47.78 39.53 10.63 Favored 'General case' 0 N--CA 1.504 2.238 0 O-C-N 121.364 -0.835 . . . . 0.0 110.629 -179.7 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 30' ' ' GLY . . . . . . . . . . . . . . . 85.13 39.96 8.24 Favored Glycine 0 N--CA 1.494 2.535 0 N-CA-C 109.588 -1.405 . . . . 0.0 109.588 -179.322 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 31' ' ' ALA . . . . . . . . . . . . . . . -56.39 -64.47 0.86 Allowed 'General case' 0 N--CA 1.501 2.107 0 O-C-N 121.535 -0.979 . . . . 0.0 110.456 -179.881 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 32' ' ' GLU . . . . . . . . . . . . . 1.1 mt-10 -129.47 -52.23 1.17 Allowed 'General case' 0 N--CA 1.495 1.813 0 O-C-N 121.618 -0.677 . . . . 0.0 109.495 179.559 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 0.0 OUTLIER -145.95 -54.83 0.28 Allowed 'General case' 0 N--CA 1.496 1.838 0 O-C-N 121.614 -0.678 . . . . 0.0 109.661 179.662 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 34' ' ' GLY . . . . . . . . . . . . . . . -179.93 38.86 0.07 OUTLIER Glycine 0 N--CA 1.495 2.603 0 N-CA-C 109.682 -1.367 . . . . 0.0 109.682 179.497 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 35' ' ' CYS . . . . . 0.407 ' HB2' HG21 ' A' ' 71' ' ' THR . 68.1 m -149.26 163.61 37.18 Favored 'General case' 0 N--CA 1.497 1.875 0 O-C-N 121.333 -1.098 . . . . 0.0 110.514 -179.617 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 36' ' ' ILE . . . . . . . . . . . . . 55.7 mt -97.16 135.31 31.8 Favored 'Isoleucine or valine' 0 N--CA 1.498 1.931 0 O-C-N 121.374 -0.829 . . . . 0.0 109.869 179.502 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 37' ' ' SER . . . . . . . . . . . . . 7.5 p -115.12 -177.77 3.21 Favored 'General case' 0 N--CA 1.496 1.857 0 O-C-N 121.288 -0.883 . . . . 0.0 110.442 179.821 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 38' ' ' THR . . . . . . . . . . . . . 42.9 p -65.38 -37.45 87.03 Favored 'General case' 0 N--CA 1.502 2.125 0 O-C-N 121.498 -0.752 . . . . 0.0 110.463 179.754 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 39' ' ' LYS . . . . . . . . . . . . . 2.6 mtmp? -63.0 -36.95 85.28 Favored 'General case' 0 N--CA 1.501 2.082 0 O-C-N 121.521 -0.737 . . . . 0.0 110.055 179.598 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 1.1 mp0 -76.45 -26.82 55.84 Favored 'General case' 0 N--CA 1.496 1.845 0 O-C-N 121.545 -0.722 . . . . 0.0 110.664 -179.902 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 41' ' ' LEU . . . . . 0.4 HD21 ' CD2' ' A' ' 57' ' ' LEU . 4.9 tp -69.56 -49.94 49.49 Favored 'General case' 0 N--CA 1.498 1.972 0 O-C-N 121.1 -1.0 . . . . 0.0 110.135 179.591 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 42' ' ' GLY . . . . . 0.554 ' HA2' ' HB2' ' A' ' 45' ' ' MET . . . -55.02 -32.53 56.63 Favored Glycine 0 N--CA 1.497 2.734 0 N-CA-C 110.798 -0.921 . . . . 0.0 110.798 -179.423 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 43' ' ' LYS . . . . . . . . . . . . . 5.4 mttt -54.27 -47.96 71.73 Favored 'General case' 0 N--CA 1.501 2.081 0 O-C-N 121.419 -1.047 . . . . 0.0 110.378 179.822 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 44' ' ' VAL . . . . . . . . . . . . . 61.9 t -82.26 -28.26 9.13 Favored 'Isoleucine or valine' 0 N--CA 1.5 2.04 0 O-C-N 121.287 -0.883 . . . . 0.0 110.064 179.367 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 45' ' ' MET . . . . . 0.554 ' HB2' ' HA2' ' A' ' 42' ' ' GLY . 0.5 OUTLIER -56.95 -31.05 64.59 Favored 'General case' 0 N--CA 1.502 2.156 0 O-C-N 121.308 -0.87 . . . . 0.0 110.991 179.612 . . . . . . . . 3 3 . 1 . 016 nuclear orig full ' A' A ' 46' ' ' ARG . . . . . 0.564 ' HA ' ' HG3' ' A' ' 50' ' ' GLN . 7.0 mmm180 -53.5 -27.47 25.67 Favored 'General case' 0 N--CA 1.505 2.296 0 O-C-N 121.35 -0.844 . . . . 0.0 111.729 -179.586 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 47' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -81.6 -39.73 24.07 Favored 'General case' 0 N--CA 1.496 1.871 0 O-C-N 121.101 -0.999 . . . . 0.0 110.812 -179.825 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 48' ' ' LEU . . . . . . . . . . . . . 1.1 mt -153.31 104.8 2.81 Favored 'General case' 0 N--CA 1.491 1.613 0 O-C-N 121.264 -0.897 . . . . 0.0 110.17 -179.83 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 49' ' ' GLY . . . . . 0.493 ' O ' ' HB2' ' A' ' 50' ' ' GLN . . . 124.48 -67.13 0.52 Allowed Glycine 0 N--CA 1.498 2.833 0 N-CA-C 109.677 -1.369 . . . . 0.0 109.677 -179.996 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 50' ' ' GLN . . . . . 0.564 ' HG3' ' HA ' ' A' ' 46' ' ' ARG . 0.5 OUTLIER 66.53 131.56 0.02 OUTLIER 'General case' 0 N--CA 1.504 2.244 0 CA-C-O 121.582 0.706 . . . . 0.0 111.186 179.935 . . . . . . . . 3 3 . 1 . 016 nuclear orig full ' A' A ' 51' ' ' ASN . . . . . . . . . . . . . 14.6 p-10 -97.82 114.82 65.52 Favored Pre-proline 0 N--CA 1.493 1.719 0 O-C-N 121.279 -0.888 . . . . 0.0 109.653 179.367 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 52' ' ' PRO . . . . . . . . . . . . . 43.0 Cg_endo -69.29 -39.16 7.78 Favored 'Trans proline' 0 C--N 1.313 -1.334 0 O-C-N 123.613 1.323 . . . . 0.0 111.084 -179.419 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 53' ' ' THR . . . . . 0.423 ' CG2' ' HD2' ' A' ' 54' ' ' PRO . 0.2 OUTLIER -126.37 152.88 74.61 Favored Pre-proline 0 N--CA 1.497 1.92 0 O-C-N 121.406 -0.808 . . . . 0.0 109.956 -179.962 . . . . . . . . 3 3 . 1 . 016 nuclear orig full ' A' A ' 54' ' ' PRO . . . . . 0.423 ' HD2' ' CG2' ' A' ' 53' ' ' THR . 42.6 Cg_endo -70.82 -44.85 1.18 Allowed 'Trans proline' 0 C--N 1.314 -1.262 0 O-C-N 123.793 1.417 . . . . 0.0 110.392 179.761 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 55' ' ' GLU . . . . . . . . . . . . . 0.9 OUTLIER -68.98 -19.85 64.16 Favored 'General case' 0 N--CA 1.497 1.881 0 O-C-N 121.441 -0.787 . . . . 0.0 110.33 179.151 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 0.6 OUTLIER -56.99 -41.61 78.73 Favored 'General case' 0 N--CA 1.498 1.939 0 O-C-N 121.361 -0.837 . . . . 0.0 110.269 179.592 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 57' ' ' LEU . . . . . 0.4 ' CD2' HD21 ' A' ' 41' ' ' LEU . 19.7 mt -78.49 -23.54 46.33 Favored 'General case' 0 N--CA 1.495 1.816 0 O-C-N 121.444 -0.785 . . . . 0.0 110.183 179.51 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 58' ' ' GLN . . . . . 0.54 ' HG3' ' N ' ' A' ' 59' ' ' GLU . 0.0 OUTLIER -59.41 -31.82 69.61 Favored 'General case' 0 N--CA 1.497 1.914 0 O-C-N 121.193 -0.942 . . . . 0.0 109.165 179.13 . . . . . . . . 3 3 . 1 . 016 nuclear orig full ' A' A ' 59' ' ' GLU . . . . . 0.54 ' N ' ' HG3' ' A' ' 58' ' ' GLN . 0.8 OUTLIER -72.62 -41.71 65.26 Favored 'General case' 0 N--CA 1.491 1.603 0 N-CA-C 108.508 -0.923 . . . . 0.0 108.508 177.85 . . . . . . . . 3 3 . 1 . 016 nuclear orig full ' A' A ' 60' ' ' MET . . . . . . . . . . . . . 2.3 mtp -60.57 -38.56 84.98 Favored 'General case' 0 N--CA 1.495 1.806 0 O-C-N 121.77 -0.581 . . . . 0.0 109.853 178.513 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 61' ' ' ILE . . . . . 0.567 HG13 HG21 ' A' ' 72' ' ' VAL . 3.5 tt -73.17 -33.13 41.01 Favored 'Isoleucine or valine' 0 N--CA 1.497 1.921 0 O-C-N 121.397 -0.814 . . . . 0.0 110.492 179.659 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 62' ' ' ASP . . . . . 0.514 ' N ' HG23 ' A' ' 61' ' ' ILE . 0.3 OUTLIER -74.9 -29.86 61.11 Favored 'General case' 0 N--CA 1.498 1.941 0 O-C-N 121.334 -0.854 . . . . 0.0 110.501 179.552 . . . . . . . . 3 3 . 1 . 016 nuclear orig full ' A' A ' 63' ' ' GLU . . . . . . . . . . . . . 26.7 mt-10 -61.14 -26.23 67.55 Favored 'General case' 0 N--CA 1.502 2.155 0 O-C-N 121.381 -0.824 . . . . 0.0 110.939 179.72 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 64' ' ' VAL . . . . . 0.437 HG11 ' HA ' ' A' ' 80' ' ' MET . 14.0 m -112.35 -12.55 11.61 Favored 'Isoleucine or valine' 0 N--CA 1.501 2.078 0 O-C-N 121.42 -0.8 . . . . 0.0 111.195 -179.665 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 65' ' ' ASP . . . . . . . . . . . . . 22.3 t70 -60.17 150.69 29.09 Favored 'General case' 0 N--CA 1.498 1.946 0 O-C-N 121.362 -0.836 . . . . 0.0 110.701 -179.8 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 66' ' ' GLU . . . . . . . . . . . . . 2.1 tt0 -140.07 18.12 2.45 Favored 'General case' 0 N--CA 1.494 1.772 0 O-C-N 121.45 -0.782 . . . . 0.0 111.522 -179.482 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 67' ' ' ASP . . . . . . . . . . . . . 5.9 p30 -140.17 1.22 1.8 Allowed 'General case' 0 N--CA 1.503 2.178 0 O-C-N 120.776 -1.202 . . . . 0.0 112.546 -179.787 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 68' ' ' GLY . . . . . . . . . . . . . . . 86.04 -16.04 45.12 Favored Glycine 0 N--CA 1.496 2.644 0 O-C-N 120.649 -1.282 . . . . 0.0 110.657 179.956 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 69' ' ' SER . . . . . . . . . . . . . 1.1 p -66.96 -27.29 67.33 Favored 'General case' 0 N--CA 1.498 1.934 0 O-C-N 121.013 -1.287 . . . . 0.0 110.224 179.693 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 70' ' ' GLY . . . . . . . . . . . . . . . 87.17 -57.73 4.56 Favored Glycine 0 N--CA 1.499 2.834 0 N-CA-C 110.289 -1.124 . . . . 0.0 110.289 179.441 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 71' ' ' THR . . . . . 0.407 HG21 ' HB2' ' A' ' 35' ' ' CYS . 1.0 OUTLIER -47.99 137.94 9.63 Favored 'General case' 0 N--CA 1.506 2.339 0 O-C-N 121.585 -0.95 . . . . 0.0 110.506 -179.7 . . . . . . . . 3 3 . 1 . 016 nuclear orig full ' A' A ' 72' ' ' VAL . . . . . 0.567 HG21 HG13 ' A' ' 61' ' ' ILE . 0.9 OUTLIER -75.91 125.55 35.7 Favored 'Isoleucine or valine' 0 N--CA 1.499 2.0 0 CA-C-O 121.7 0.762 . . . . 0.0 111.631 -178.787 . . . . . . . . 3 3 . 1 . 016 nuclear orig full ' A' A ' 73' ' ' ASP . . . . . . . . . . . . . 1.0 OUTLIER -97.1 -170.55 2.05 Favored 'General case' 0 N--CA 1.495 1.797 0 N-CA-C 109.172 -0.677 . . . . 0.0 109.172 178.724 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 74' ' ' PHE . . . . . . . . . . . . . 28.3 t80 -67.0 -47.72 70.64 Favored 'General case' 0 N--CA 1.499 2.024 0 O-C-N 120.826 -1.171 . . . . 0.0 110.263 179.64 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 75' ' ' ASP . . . . . . . . . . . . . 10.6 t70 -63.64 -44.5 93.68 Favored 'General case' 0 N--CA 1.498 1.967 0 O-C-N 121.412 -0.805 . . . . 0.0 110.146 179.406 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 76' ' ' GLU . . . . . 0.539 ' HA ' HG11 ' A' ' 79' ' ' VAL . 95.5 mt-10 -65.77 -35.12 79.82 Favored 'General case' 0 N--CA 1.498 1.929 0 O-C-N 121.464 -0.772 . . . . 0.0 110.277 179.843 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 77' ' ' PHE . . . . . . . . . . . . . 71.2 t80 -67.19 -38.55 85.57 Favored 'General case' 0 N--CA 1.494 1.755 0 O-C-N 121.112 -0.993 . . . . 0.0 109.496 178.978 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 78' ' ' LEU . . . . . . . . . . . . . 41.3 mt -66.29 -43.82 85.27 Favored 'General case' 0 N--CA 1.498 1.955 0 O-C-N 121.542 -0.724 . . . . 0.0 110.38 179.46 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 79' ' ' VAL . . . . . 0.539 HG11 ' HA ' ' A' ' 76' ' ' GLU . 7.6 p -69.34 -15.64 19.78 Favored 'Isoleucine or valine' 0 N--CA 1.502 2.165 0 O-C-N 121.185 -0.947 . . . . 0.0 110.314 179.119 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 80' ' ' MET . . . . . 0.437 ' HA ' HG11 ' A' ' 64' ' ' VAL . 15.8 ttp -76.73 -37.43 56.01 Favored 'General case' 0 N--CA 1.493 1.71 0 O-C-N 121.116 -0.99 . . . . 0.0 109.383 178.849 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 81' ' ' MET . . . . . . . . . . . . . 3.8 mmm -69.23 -45.44 69.77 Favored 'General case' 0 N--CA 1.499 2.008 0 O-C-N 121.473 -0.767 . . . . 0.0 110.343 179.696 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 82' ' ' VAL . . . . . 0.47 ' HA ' ' HE3' ' A' ' 85' ' ' MET . 35.6 m -59.51 -28.72 40.66 Favored 'Isoleucine or valine' 0 N--CA 1.505 2.316 0 O-C-N 121.388 -0.82 . . . . 0.0 110.844 -179.985 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 83' ' ' ARG . . . . . . . . . . . . . 4.0 mtp-105 -57.86 -37.07 73.24 Favored 'General case' 0 N--CA 1.502 2.132 0 O-C-N 121.131 -0.981 . . . . 0.0 109.61 178.817 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 84' ' ' CYS . . . . . . . . . . . . . 9.9 t -83.25 -28.54 29.11 Favored 'General case' 0 N--CA 1.495 1.783 0 O-C-N 121.625 -0.672 . . . . 0.0 109.833 178.868 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 85' ' ' MET . . . . . 0.47 ' HE3' ' HA ' ' A' ' 82' ' ' VAL . 66.9 mtm -83.56 53.82 2.65 Favored 'General case' 0 N--CA 1.497 1.887 0 O-C-N 121.431 -0.793 . . . . 0.0 110.876 179.887 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 86' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER 54.57 51.17 14.48 Favored 'General case' 0 N--CA 1.502 2.129 0 O-C-N 121.59 -0.694 . . . . 0.0 111.748 179.223 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 87' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER 61.02 -80.51 0.02 OUTLIER 'General case' 0 N--CA 1.505 2.286 0 O-C-N 121.724 -0.61 . . . . 0.0 111.479 179.213 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 88' ' ' ASP . . . . . . . . . . . . . 1.9 t70 -97.91 155.76 16.92 Favored 'General case' 0 N--CA 1.495 1.8 0 O-C-N 120.989 -1.069 . . . . 0.0 110.682 -179.784 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 89' ' ' SER . . . . . . . . . . . . . 0.6 OUTLIER . . . . . 0 N--CA 1.497 1.887 0 CA-C-O 118.251 -0.88 . . . . 0.0 110.198 179.767 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' B' B ' 144' ' ' ARG . . . . . . . . . . . . . 2.5 ttp180 . . . . . 0 N--CA 1.496 1.855 0 CA-C-O 121.084 0.469 . . . . 0.0 110.259 . . . . . . . . . 0 0 . 1 . 016 nuclear orig full ' B' B ' 145' ' ' ARG . . . . . . . . . . . . . 2.7 ptm180 -82.44 -176.81 6.42 Favored 'General case' 0 N--CA 1.498 1.958 0 O-C-N 121.346 -0.846 . . . . 0.0 110.412 179.751 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' B' B ' 146' ' ' VAL . . . . . . . . . . . . . 22.4 m -110.61 149.72 13.38 Favored 'Isoleucine or valine' 0 N--CA 1.499 1.998 0 O-C-N 121.345 -0.847 . . . . 0.0 110.625 179.984 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' B' B ' 147' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -129.75 110.77 12.02 Favored 'General case' 0 N--CA 1.498 1.953 0 O-C-N 121.579 -0.701 . . . . 0.0 109.843 179.83 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' B' B ' 148' ' ' ILE . . . . . . . . . . . . . 1.4 tp -103.44 -4.95 9.4 Favored 'Isoleucine or valine' 0 N--CA 1.498 1.937 0 O-C-N 121.403 -0.81 . . . . 0.0 111.755 -179.134 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' B' B ' 149' ' ' SER . . . . . . . . . . . . . 20.1 t 59.63 93.68 0.04 OUTLIER 'General case' 0 N--CA 1.505 2.324 0 O-C-N 121.423 -0.798 . . . . 0.0 110.934 179.939 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' B' B ' 150' ' ' ALA . . . . . . . . . . . . . . . -57.57 -42.71 83.65 Favored 'General case' 0 N--CA 1.5 2.045 0 O-C-N 121.5 -0.75 . . . . 0.0 110.93 179.952 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' B' B ' 151' ' ' ASP . . . . . . . . . . . . . 5.4 m-20 -62.73 -49.81 73.58 Favored 'General case' 0 N--CA 1.5 2.041 0 O-C-N 121.4 -0.812 . . . . 0.0 110.644 -179.973 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' B' B ' 152' ' ' ALA . . . . . . . . . . . . . . . -63.35 -44.93 93.44 Favored 'General case' 0 N--CA 1.497 1.918 0 O-C-N 121.379 -0.826 . . . . 0.0 110.149 179.631 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' B' B ' 153' ' ' MET . . . . . . . . . . . . . 0.2 OUTLIER -63.62 -44.66 93.29 Favored 'General case' 0 N--CA 1.497 1.877 0 O-C-N 121.512 -0.743 . . . . 0.0 109.991 179.361 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' B' B ' 154' ' ' MET . . . . . 0.432 ' HG2' HD13 ' B' ' 158' ' ' LEU . 3.8 ttm -60.25 -44.26 95.42 Favored 'General case' 0 N--CA 1.497 1.916 0 O-C-N 121.419 -0.801 . . . . 0.0 110.014 179.308 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' B' B ' 155' ' ' GLN . . . . . . . . . . . . . 1.0 OUTLIER -62.5 -33.14 74.29 Favored 'General case' 0 N--CA 1.498 1.975 0 O-C-N 121.511 -0.743 . . . . 0.0 110.221 179.299 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' B' B ' 156' ' ' ALA . . . . . . . . . . . . . . . -71.78 -26.68 62.52 Favored 'General case' 0 N--CA 1.497 1.889 0 O-C-N 121.523 -0.736 . . . . 0.0 110.723 179.511 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' B' B ' 157' ' ' LEU . . . . . . . . . . . . . 13.9 mt -92.87 -41.97 9.77 Favored 'General case' 0 N--CA 1.495 1.82 0 O-C-N 121.273 -0.892 . . . . 0.0 111.326 -179.338 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' B' B ' 158' ' ' LEU . . . . . 0.432 HD13 ' HG2' ' B' ' 154' ' ' MET . 66.0 mt -97.36 2.21 50.29 Favored 'General case' 0 N--CA 1.5 2.06 0 O-C-N 121.198 -0.939 . . . . 0.0 111.597 -179.393 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' B' B ' 159' ' ' GLY . . . . . . . . . . . . . . . -139.59 42.34 1.24 Allowed Glycine 0 N--CA 1.496 2.689 0 N-CA-C 110.02 -1.232 . . . . 0.0 110.02 -179.973 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' B' B ' 160' ' ' ALA . . . . . . . . . . . . . . . -165.4 -60.74 0.03 OUTLIER 'General case' 0 N--CA 1.496 1.857 0 O-C-N 121.41 -1.053 . . . . 0.0 110.081 179.841 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' B' B ' 161' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -106.38 -23.87 12.4 Favored 'General case' 0 N--CA 1.498 1.937 0 O-C-N 121.604 -0.685 . . . . 0.0 111.105 179.878 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' B' B ' 162' ' ' ALA . . . . . . . . . . . . . . . -140.9 -172.14 3.4 Favored 'General case' 0 N--CA 1.496 1.83 0 O-C-N 121.126 -0.983 . . . . 0.0 110.008 179.7 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' B' B ' 163' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.497 1.921 0 O-C-N 121.361 -0.837 . . . . 0.0 110.654 179.898 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 90' ' ' ' CA' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 016 nuclear orig full ' A' A ' 91' ' ' SXK . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 017 nuclear orig full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 0.1 OUTLIER . . . . . 0 N--CA 1.496 1.872 0 CA-C-O 121.045 0.45 . . . . 0.0 109.875 . . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 2' ' ' ASP . . . . . . . . . . . . . 0.7 OUTLIER -163.45 -113.55 0.01 OUTLIER 'General case' 0 N--CA 1.495 1.825 0 O-C-N 121.45 -0.781 . . . . 0.0 110.443 -179.265 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 3' ' ' ASP . . . . . . . . . . . . . 1.3 m-20 -95.27 27.92 3.09 Favored 'General case' 0 N--CA 1.499 2.0 0 O-C-N 120.809 -1.182 . . . . 0.0 110.904 -179.94 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 4' ' ' ILE . . . . . . . . . . . . . 15.4 mt -62.3 -53.37 48.3 Favored 'Isoleucine or valine' 0 N--CA 1.501 2.095 0 O-C-N 121.176 -0.952 . . . . 0.0 110.51 -179.865 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 5' ' ' TYR . . . . . 0.544 ' CE1' ' HG2' ' A' ' 83' ' ' ARG . 6.3 m-85 -70.86 -34.76 71.97 Favored 'General case' 0 N--CA 1.498 1.932 0 O-C-N 121.351 -0.843 . . . . 0.0 110.686 -179.987 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -68.57 -30.41 69.18 Favored 'General case' 0 N--CA 1.498 1.969 0 O-C-N 121.251 -0.906 . . . . 0.0 110.53 179.614 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 7' ' ' ALA . . . . . . . . . . . . . . . -55.12 -36.27 65.55 Favored 'General case' 0 N--CA 1.5 2.033 0 O-C-N 121.236 -0.915 . . . . 0.0 109.784 179.146 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 8' ' ' ALA . . . . . . . . . . . . . . . -65.24 -35.3 80.62 Favored 'General case' 0 N--CA 1.496 1.842 0 O-C-N 121.586 -0.697 . . . . 0.0 109.778 178.768 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 9' ' ' VAL . . . . . . . . . . . . . 43.7 t -62.62 -32.96 57.23 Favored 'Isoleucine or valine' 0 N--CA 1.502 2.128 0 O-C-N 121.456 -0.777 . . . . 0.0 109.523 178.827 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 10' ' ' GLU . . . . . . . . . . . . . 9.3 mt-10 -88.57 -5.84 57.93 Favored 'General case' 0 N--CA 1.498 1.943 0 O-C-N 121.408 -0.808 . . . . 0.0 110.732 179.273 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 11' ' ' GLN . . . . . . . . . . . . . 1.4 mt-30 -87.97 -29.6 20.66 Favored 'General case' 0 N--CA 1.496 1.865 0 O-C-N 121.105 -0.997 . . . . 0.0 111.063 -179.809 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 12' ' ' LEU . . . . . 0.401 ' HB2' ' CB ' ' A' ' 16' ' ' GLN . 3.7 pp -66.98 153.11 44.43 Favored 'General case' 0 N--CA 1.5 2.065 0 O-C-N 121.104 -0.997 . . . . 0.0 110.739 -179.71 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 13' ' ' THR . . . . . . . . . . . . . 22.2 p -99.48 -177.55 3.62 Favored 'General case' 0 N--CA 1.501 2.105 0 O-C-N 121.416 -0.803 . . . . 0.0 111.368 -179.147 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 14' ' ' GLU . . . . . 0.418 ' O ' ' HB2' ' A' ' 18' ' ' ASN . 12.8 tp10 -53.86 -39.32 65.56 Favored 'General case' 0 N--CA 1.492 1.669 0 O-C-N 121.912 -0.492 . . . . 0.0 110.697 -179.683 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 1.5 mp0 -54.53 -36.95 64.82 Favored 'General case' 0 N--CA 1.5 2.055 0 O-C-N 121.463 -0.773 . . . . 0.0 110.783 179.766 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 16' ' ' GLN . . . . . 0.401 ' CB ' ' HB2' ' A' ' 12' ' ' LEU . 0.8 OUTLIER -72.18 -63.84 1.06 Allowed 'General case' 0 N--CA 1.497 1.897 0 O-C-N 121.292 -0.88 . . . . 0.0 111.146 -179.716 . . . . . . . . 3 3 . 1 . 017 nuclear orig full ' A' A ' 17' ' ' LYS . . . . . 0.405 ' HG3' ' O ' ' A' ' 14' ' ' GLU . 5.3 ptmt -54.81 -32.54 60.47 Favored 'General case' 0 N--CA 1.503 2.194 0 O-C-N 121.839 -0.538 . . . . 0.0 111.347 -179.456 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 18' ' ' ASN . . . . . 0.418 ' HB2' ' O ' ' A' ' 14' ' ' GLU . 7.6 t-20 -70.02 -49.45 51.19 Favored 'General case' 0 N--CA 1.494 1.775 0 O-C-N 121.269 -0.894 . . . . 0.0 110.308 179.999 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 0.3 OUTLIER -62.91 -43.48 98.69 Favored 'General case' 0 N--CA 1.497 1.922 0 O-C-N 121.3 -0.875 . . . . 0.0 109.545 179.187 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 20' ' ' PHE . . . . . . . . . . . . . 12.7 m-85 -59.41 -33.79 71.66 Favored 'General case' 0 N--CA 1.497 1.918 0 O-C-N 121.447 -0.783 . . . . 0.0 109.769 178.941 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 21' ' ' LYS . . . . . 0.511 ' HG3' ' N ' ' A' ' 22' ' ' ALA . 0.0 OUTLIER -65.65 -41.78 92.16 Favored 'General case' 0 N--CA 1.496 1.832 0 O-C-N 121.538 -0.726 . . . . 0.0 109.233 178.629 . . . . . . . . 3 3 . 1 . 017 nuclear orig full ' A' A ' 22' ' ' ALA . . . . . 0.511 ' N ' ' HG3' ' A' ' 21' ' ' LYS . . . -69.69 -45.45 68.27 Favored 'General case' 0 N--CA 1.496 1.828 0 O-C-N 121.286 -0.884 . . . . 0.0 109.589 179.181 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 23' ' ' ALA . . . . . . . . . . . . . . . -63.35 -49.73 72.74 Favored 'General case' 0 N--CA 1.497 1.897 0 O-C-N 121.648 -0.658 . . . . 0.0 110.455 179.412 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 24' ' ' PHE . . . . . 0.422 ' CD2' HD12 ' A' ' 36' ' ' ILE . 27.4 t80 -55.92 -43.55 77.45 Favored 'General case' 0 N--CA 1.5 2.069 0 O-C-N 121.507 -0.746 . . . . 0.0 110.47 179.724 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 25' ' ' ASP . . . . . . . . . . . . . 20.2 t70 -62.79 -52.14 64.36 Favored 'General case' 0 N--CA 1.496 1.841 0 O-C-N 121.625 -0.672 . . . . 0.0 110.387 179.815 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 26' ' ' ILE . . . . . . . . . . . . . 1.9 mt -64.55 -28.29 44.52 Favored 'Isoleucine or valine' 0 N--CA 1.498 1.963 0 O-C-N 121.334 -0.854 . . . . 0.0 110.495 179.584 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 27' ' ' PHE . . . . . . . . . . . . . 0.1 OUTLIER -63.9 -42.86 97.32 Favored 'General case' 0 N--CA 1.498 1.947 0 O-C-N 121.194 -0.942 . . . . 0.0 110.511 179.68 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 28' ' ' VAL . . . . . . . . . . . . . 19.5 m -91.38 -35.7 7.32 Favored 'Isoleucine or valine' 0 N--CA 1.499 2.004 0 O-C-N 121.317 -0.864 . . . . 0.0 110.772 -179.975 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 29' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER 57.24 -87.64 0.02 OUTLIER 'General case' 0 N--CA 1.501 2.082 0 O-C-N 121.672 -0.643 . . . . 0.0 110.631 -179.63 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 30' ' ' GLY . . . . . . . . . . . . . . . -89.73 -16.99 55.68 Favored Glycine 0 N--CA 1.496 2.656 0 N-CA-C 110.14 -1.184 . . . . 0.0 110.14 179.421 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 31' ' ' ALA . . . . . . . . . . . . . . . -92.16 46.53 1.27 Allowed 'General case' 0 N--CA 1.499 1.984 0 O-C-N 121.095 -1.238 . . . . 0.0 110.322 179.747 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 32' ' ' GLU . . . . . . . . . . . . . 3.1 tt0 -63.56 -43.85 95.85 Favored 'General case' 0 N--CA 1.499 2.016 0 O-C-N 121.228 -0.92 . . . . 0.0 110.68 -179.824 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 19.9 t70 -70.26 -42.36 72.26 Favored 'General case' 0 N--CA 1.496 1.855 0 O-C-N 121.476 -0.765 . . . . 0.0 110.414 179.818 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 34' ' ' GLY . . . . . 0.442 ' O ' ' HB2' ' A' ' 35' ' ' CYS . . . -72.51 -14.83 77.43 Favored Glycine 0 N--CA 1.497 2.709 0 N-CA-C 110.674 -0.97 . . . . 0.0 110.674 179.867 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 35' ' ' CYS . . . . . 0.442 ' HB2' ' O ' ' A' ' 34' ' ' GLY . 12.7 m 60.45 -171.06 0.14 Allowed 'General case' 0 N--CA 1.502 2.139 0 O-C-N 121.467 -1.019 . . . . 0.0 111.08 -179.867 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 36' ' ' ILE . . . . . 0.422 HD12 ' CD2' ' A' ' 24' ' ' PHE . 65.2 mt -79.36 123.26 36.05 Favored 'Isoleucine or valine' 0 N--CA 1.499 2.009 0 O-C-N 121.191 -0.943 . . . . 0.0 111.059 -179.175 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 37' ' ' SER . . . . . . . . . . . . . 18.3 t -125.08 -178.84 4.32 Favored 'General case' 0 N--CA 1.494 1.762 0 O-C-N 121.632 -0.667 . . . . 0.0 109.613 178.948 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 38' ' ' THR . . . . . . . . . . . . . 3.2 p -61.55 -36.34 80.34 Favored 'General case' 0 N--CA 1.501 2.117 0 O-C-N 121.324 -0.86 . . . . 0.0 110.597 179.709 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 39' ' ' LYS . . . . . . . . . . . . . 4.1 tptt -68.3 -34.28 75.86 Favored 'General case' 0 N--CA 1.498 1.951 0 O-C-N 121.529 -0.732 . . . . 0.0 110.804 179.843 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 40' ' ' GLU . . . . . 0.551 ' HA ' ' HD2' ' A' ' 43' ' ' LYS . 25.7 mm-40 -83.58 -24.14 31.65 Favored 'General case' 0 N--CA 1.499 1.978 0 O-C-N 121.299 -0.876 . . . . 0.0 111.083 -179.643 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 41' ' ' LEU . . . . . 0.437 ' CD1' ' C ' ' A' ' 41' ' ' LEU . 3.4 tm? -70.22 -64.66 0.85 Allowed 'General case' 0 N--CA 1.499 1.99 0 O-C-N 121.135 -0.978 . . . . 0.0 109.711 179.519 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 42' ' ' GLY . . . . . . . . . . . . . . . -47.59 -31.85 7.44 Favored Glycine 0 N--CA 1.501 3.025 0 N-CA-C 110.621 -0.992 . . . . 0.0 110.621 179.836 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 43' ' ' LYS . . . . . 0.551 ' HD2' ' HA ' ' A' ' 40' ' ' GLU . 11.1 mttp -49.22 -49.29 43.73 Favored 'General case' 0 N--CA 1.503 2.187 0 O-C-N 121.572 -0.958 . . . . 0.0 110.91 179.602 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 44' ' ' VAL . . . . . . . . . . . . . 33.6 m -81.76 -22.02 10.16 Favored 'Isoleucine or valine' 0 N--CA 1.503 2.204 0 O-C-N 121.322 -0.862 . . . . 0.0 111.204 -179.878 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 45' ' ' MET . . . . . 0.549 ' HE1' HG12 ' B' ' 148' ' ' ILE . 19.6 mmt -59.27 -38.74 80.87 Favored 'General case' 0 N--CA 1.502 2.13 0 O-C-N 121.121 -0.987 . . . . 0.0 110.258 179.672 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 46' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -57.7 -41.91 82.65 Favored 'General case' 0 N--CA 1.498 1.939 0 O-C-N 121.572 -0.705 . . . . 0.0 110.454 179.704 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 47' ' ' MET . . . . . . . . . . . . . 29.9 ttp -68.23 -36.05 78.88 Favored 'General case' 0 N--CA 1.498 1.937 0 O-C-N 121.494 -0.754 . . . . 0.0 110.562 179.693 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 48' ' ' LEU . . . . . . . . . . . . . 6.2 tp -75.02 -44.74 46.29 Favored 'General case' 0 N--CA 1.492 1.669 0 O-C-N 121.357 -0.839 . . . . 0.0 110.298 179.951 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 49' ' ' GLY . . . . . . . . . . . . . . . -155.28 -76.77 0.02 OUTLIER Glycine 0 N--CA 1.495 2.613 0 N-CA-C 110.024 -1.23 . . . . 0.0 110.024 179.918 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 50' ' ' GLN . . . . . . . . . . . . . 36.9 mt-30 -137.54 171.63 14.17 Favored 'General case' 0 N--CA 1.499 1.975 0 O-C-N 121.409 -1.053 . . . . 0.0 110.584 -179.833 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 51' ' ' ASN . . . . . . . . . . . . . 1.3 t30 -106.66 105.74 55.76 Favored Pre-proline 0 N--CA 1.499 1.993 0 O-C-N 121.225 -0.922 . . . . 0.0 111.266 -179.556 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 52' ' ' PRO . . . . . 0.554 ' HG2' HD11 ' A' ' 57' ' ' LEU . 46.8 Cg_endo -77.34 166.23 26.44 Favored 'Trans proline' 0 C--N 1.315 -1.225 0 O-C-N 123.668 1.352 . . . . 0.0 110.242 178.799 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 53' ' ' THR . . . . . . . . . . . . . 65.4 p -79.16 159.23 73.38 Favored Pre-proline 0 N--CA 1.5 2.044 0 O-C-N 121.198 -0.939 . . . . 0.0 110.833 -179.527 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 54' ' ' PRO . . . . . . . . . . . . . 41.6 Cg_endo -67.18 -38.7 15.0 Favored 'Trans proline' 0 N--CA 1.49 1.287 0 O-C-N 123.818 1.43 . . . . 0.0 110.817 179.793 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 55' ' ' GLU . . . . . 0.408 ' O ' ' HB2' ' A' ' 58' ' ' GLN . 0.1 OUTLIER -58.88 -39.61 81.91 Favored 'General case' 0 N--CA 1.498 1.933 0 O-C-N 121.394 -0.816 . . . . 0.0 110.107 179.505 . . . . . . . . 3 3 . 1 . 017 nuclear orig full ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 5.8 mt-10 -66.58 -37.94 86.0 Favored 'General case' 0 N--CA 1.497 1.876 0 O-C-N 121.38 -0.825 . . . . 0.0 110.302 179.307 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 57' ' ' LEU . . . . . 0.554 HD11 ' HG2' ' A' ' 52' ' ' PRO . 9.0 mt -81.51 -9.79 59.62 Favored 'General case' 0 N--CA 1.499 1.993 0 O-C-N 121.332 -0.855 . . . . 0.0 111.25 179.958 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 58' ' ' GLN . . . . . 0.408 ' HB2' ' O ' ' A' ' 55' ' ' GLU . 9.7 mm100 -57.36 -52.1 66.7 Favored 'General case' 0 N--CA 1.5 2.062 0 O-C-N 120.997 -1.064 . . . . 0.0 110.113 -179.892 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 59' ' ' GLU . . . . . . . . . . . . . 10.9 tp10 -53.07 -40.11 63.79 Favored 'General case' 0 N--CA 1.498 1.936 0 O-C-N 121.623 -0.673 . . . . 0.0 110.362 179.461 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 60' ' ' MET . . . . . 0.401 ' HE1' HD23 ' A' ' 57' ' ' LEU . 0.4 OUTLIER -53.37 -34.44 57.64 Favored 'General case' 0 N--CA 1.501 2.082 0 O-C-N 121.415 -0.803 . . . . 0.0 110.376 179.389 . . . . . . . . 3 3 . 1 . 017 nuclear orig full ' A' A ' 61' ' ' ILE . . . . . 0.617 HG22 HG22 ' A' ' 72' ' ' VAL . 15.1 mt -91.97 -44.27 14.19 Favored 'Isoleucine or valine' 0 N--CA 1.497 1.921 0 O-C-N 121.407 -0.808 . . . . 0.0 110.124 179.196 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 62' ' ' ASP . . . . . . . . . . . . . 71.8 m-20 -57.12 -33.17 67.07 Favored 'General case' 0 N--CA 1.5 2.026 0 O-C-N 121.465 -0.772 . . . . 0.0 111.04 -179.607 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 63' ' ' GLU . . . . . . . . . . . . . 1.9 tt0 -66.91 -26.85 67.06 Favored 'General case' 0 N--CA 1.5 2.044 0 O-C-N 121.186 -0.946 . . . . 0.0 111.035 179.809 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 64' ' ' VAL . . . . . . . . . . . . . 24.5 m -117.14 9.96 7.22 Favored 'Isoleucine or valine' 0 N--CA 1.503 2.178 0 O-C-N 121.148 -0.97 . . . . 0.0 111.481 -179.882 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 65' ' ' ASP . . . . . . . . . . . . . 19.0 t70 -80.3 138.23 36.72 Favored 'General case' 0 N--CA 1.498 1.935 0 O-C-N 120.897 -1.127 . . . . 0.0 110.154 179.897 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 66' ' ' GLU . . . . . . . . . . . . . 21.2 mt-10 -128.77 24.07 5.74 Favored 'General case' 0 N--CA 1.497 1.914 0 O-C-N 121.376 -0.827 . . . . 0.0 111.642 -179.132 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 67' ' ' ASP . . . . . . . . . . . . . 42.6 p-10 -141.22 -0.3 1.45 Allowed 'General case' 0 N--CA 1.501 2.109 0 O-C-N 120.767 -1.208 . . . . 0.0 112.865 -179.91 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 68' ' ' GLY . . . . . . . . . . . . . . . 86.97 -21.27 20.68 Favored Glycine 0 N--CA 1.496 2.698 0 O-C-N 120.705 -1.247 . . . . 0.0 110.687 179.653 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 69' ' ' SER . . . . . . . . . . . . . 1.7 p -59.52 -27.99 66.68 Favored 'General case' 0 N--CA 1.499 1.987 0 O-C-N 121.253 -1.145 . . . . 0.0 110.482 179.83 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 70' ' ' GLY . . . . . . . . . . . . . . . 71.44 30.21 67.12 Favored Glycine 0 N--CA 1.498 2.817 0 N-CA-C 110.195 -1.162 . . . . 0.0 110.195 -179.981 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 71' ' ' THR . . . . . . . . . . . . . 5.3 m -134.54 142.93 47.14 Favored 'General case' 0 N--CA 1.499 1.999 0 O-C-N 121.407 -1.055 . . . . 0.0 108.929 179.489 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 72' ' ' VAL . . . . . 0.617 HG22 HG22 ' A' ' 61' ' ' ILE . 17.0 t -75.92 113.49 14.91 Favored 'Isoleucine or valine' 0 N--CA 1.498 1.944 0 O-C-N 121.192 -0.943 . . . . 0.0 111.198 -179.002 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 73' ' ' ASP . . . . . . . . . . . . . 17.0 m-20 -88.48 -178.69 5.91 Favored 'General case' 0 N--CA 1.494 1.772 0 N-CA-C 108.7 -0.852 . . . . 0.0 108.7 178.409 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 74' ' ' PHE . . . . . . . . . . . . . 49.1 t80 -63.91 -42.18 97.47 Favored 'General case' 0 N--CA 1.499 2.015 0 O-C-N 120.905 -1.122 . . . . 0.0 109.828 179.266 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 75' ' ' ASP . . . . . . . . . . . . . 1.0 OUTLIER -66.54 -47.13 73.83 Favored 'General case' 0 N--CA 1.496 1.862 0 O-C-N 121.511 -0.743 . . . . 0.0 110.228 179.435 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 76' ' ' GLU . . . . . . . . . . . . . 72.4 mt-10 -63.95 -38.01 89.53 Favored 'General case' 0 N--CA 1.499 1.986 0 O-C-N 121.453 -0.779 . . . . 0.0 109.755 179.238 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 77' ' ' PHE . . . . . . . . . . . . . 75.7 t80 -57.11 -40.6 77.39 Favored 'General case' 0 N--CA 1.495 1.785 0 O-C-N 121.673 -0.642 . . . . 0.0 109.628 179.118 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 78' ' ' LEU . . . . . . . . . . . . . 43.2 mt -63.15 -43.68 97.64 Favored 'General case' 0 N--CA 1.498 1.945 0 O-C-N 121.396 -0.815 . . . . 0.0 109.476 178.802 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 79' ' ' VAL . . . . . . . . . . . . . 73.2 t -61.27 -39.53 82.93 Favored 'Isoleucine or valine' 0 N--CA 1.501 2.101 0 O-C-N 121.616 -0.677 . . . . 0.0 109.473 178.948 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 80' ' ' MET . . . . . . . . . . . . . 11.8 ttp -67.16 -35.19 79.16 Favored 'General case' 0 N--CA 1.496 1.866 0 O-C-N 121.486 -0.759 . . . . 0.0 110.096 179.168 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 81' ' ' MET . . . . . . . . . . . . . 11.3 mmt -70.49 -51.78 26.64 Favored 'General case' 0 N--CA 1.497 1.892 0 O-C-N 121.486 -0.758 . . . . 0.0 110.767 -179.915 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 82' ' ' VAL . . . . . 0.409 HG21 ' N ' ' A' ' 83' ' ' ARG . 34.2 m -62.61 -24.53 35.65 Favored 'Isoleucine or valine' 0 N--CA 1.501 2.1 0 O-C-N 121.141 -0.975 . . . . 0.0 110.655 -179.982 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 83' ' ' ARG . . . . . 0.544 ' HG2' ' CE1' ' A' ' 5' ' ' TYR . 11.3 mtt180 -62.45 -31.48 72.2 Favored 'General case' 0 N--CA 1.499 1.99 0 O-C-N 121.232 -0.917 . . . . 0.0 110.206 179.145 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 84' ' ' CYS . . . . . . . . . . . . . 3.3 t -86.58 -30.88 21.52 Favored 'General case' 0 N--CA 1.494 1.765 0 O-C-N 121.479 -0.763 . . . . 0.0 109.474 178.651 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 85' ' ' MET . . . . . . . . . . . . . 30.9 mtm -74.52 -32.15 62.4 Favored 'General case' 0 N--CA 1.499 2.001 0 O-C-N 121.486 -0.759 . . . . 0.0 111.247 -179.96 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 86' ' ' LYS . . . . . 0.467 ' O ' ' HB3' ' A' ' 87' ' ' ASP . 0.1 OUTLIER -62.89 -25.69 68.43 Favored 'General case' 0 N--CA 1.502 2.169 0 O-C-N 121.219 -0.925 . . . . 0.0 111.185 -179.562 . . . . . . . . 3 3 . 1 . 017 nuclear orig full ' A' A ' 87' ' ' ASP . . . . . 0.467 ' HB3' ' O ' ' A' ' 86' ' ' LYS . 31.6 t70 64.53 -69.53 0.09 Allowed 'General case' 0 N--CA 1.505 2.275 0 O-C-N 121.854 -0.529 . . . . 0.0 111.623 179.657 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 88' ' ' ASP . . . . . 0.46 ' CB ' ' O ' ' A' ' 87' ' ' ASP . 1.7 t70 75.13 -63.65 0.41 Allowed 'General case' 0 N--CA 1.505 2.304 0 O-C-N 121.76 -0.588 . . . . 0.0 110.629 -179.46 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 89' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER . . . . . 0 N--CA 1.497 1.914 0 CA-C-O 117.902 -1.047 . . . . 0.0 110.447 179.929 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' B' B ' 144' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.496 1.861 0 CA-C-O 121.089 0.471 . . . . 0.0 110.472 . . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' B' B ' 145' ' ' ARG . . . . . . . . . . . . . 1.1 ttp180 -146.46 142.16 27.84 Favored 'General case' 0 N--CA 1.494 1.759 0 O-C-N 121.412 -0.805 . . . . 0.0 110.311 -179.867 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' B' B ' 146' ' ' VAL . . . . . . . . . . . . . 14.5 p -120.59 138.37 51.31 Favored 'Isoleucine or valine' 0 N--CA 1.496 1.828 0 O-C-N 121.481 -0.762 . . . . 0.0 110.434 -179.852 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' B' B ' 147' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -133.57 143.12 48.49 Favored 'General case' 0 N--CA 1.495 1.787 0 O-C-N 121.42 -0.8 . . . . 0.0 110.651 -179.739 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' B' B ' 148' ' ' ILE . . . . . 0.549 HG12 ' HE1' ' A' ' 45' ' ' MET . 1.2 mp -123.92 138.66 52.86 Favored 'Isoleucine or valine' 0 N--CA 1.495 1.794 0 O-C-N 121.597 -0.689 . . . . 0.0 109.774 -179.957 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' B' B ' 149' ' ' SER . . . . . . . . . . . . . 45.5 t -104.38 167.43 9.75 Favored 'General case' 0 N--CA 1.493 1.692 0 O-C-N 121.614 -0.679 . . . . 0.0 110.227 179.762 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' B' B ' 150' ' ' ALA . . . . . . . . . . . . . . . -55.67 -38.37 69.52 Favored 'General case' 0 N--CA 1.497 1.906 0 O-C-N 121.678 -0.638 . . . . 0.0 110.591 179.836 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' B' B ' 151' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -65.35 -46.28 80.83 Favored 'General case' 0 N--CA 1.497 1.908 0 O-C-N 121.329 -0.857 . . . . 0.0 110.445 179.695 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' B' B ' 152' ' ' ALA . . . . . . . . . . . . . . . -51.0 -48.32 61.42 Favored 'General case' 0 N--CA 1.501 2.081 0 O-C-N 121.486 -0.759 . . . . 0.0 110.644 179.943 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' B' B ' 153' ' ' MET . . . . . 0.455 ' HE3' HG23 ' B' ' 148' ' ' ILE . 11.6 mmt -63.17 -42.9 99.49 Favored 'General case' 0 N--CA 1.498 1.973 0 O-C-N 121.357 -0.839 . . . . 0.0 110.099 179.468 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' B' B ' 154' ' ' MET . . . . . . . . . . . . . 13.2 mtt -64.55 -37.04 86.17 Favored 'General case' 0 N--CA 1.498 1.959 0 O-C-N 121.493 -0.755 . . . . 0.0 110.499 179.586 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' B' B ' 155' ' ' GLN . . . . . . . . . . . . . 0.3 OUTLIER -58.02 -33.98 69.55 Favored 'General case' 0 N--CA 1.502 2.166 0 O-C-N 121.419 -0.801 . . . . 0.0 111.533 -179.67 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' B' B ' 156' ' ' ALA . . . . . . . . . . . . . . . -100.8 -44.23 5.85 Favored 'General case' 0 N--CA 1.501 2.094 0 O-C-N 121.159 -0.963 . . . . 0.0 111.162 -179.598 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' B' B ' 157' ' ' LEU . . . . . . . . . . . . . 10.0 mt -75.78 -37.88 58.79 Favored 'General case' 0 N--CA 1.501 2.101 0 O-C-N 121.27 -0.894 . . . . 0.0 111.018 -179.493 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' B' B ' 158' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -113.54 32.82 5.53 Favored 'General case' 0 N--CA 1.498 1.929 0 O-C-N 121.257 -0.902 . . . . 0.0 110.375 179.877 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' B' B ' 159' ' ' GLY . . . . . . . . . . . . . . . -168.77 -175.72 38.43 Favored Glycine 0 N--CA 1.495 2.587 0 N-CA-C 110.181 -1.168 . . . . 0.0 110.181 -179.806 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' B' B ' 160' ' ' ALA . . . . . . . . . . . . . . . 59.54 -86.22 0.02 OUTLIER 'General case' 0 N--CA 1.503 2.196 0 O-C-N 121.864 -0.786 . . . . 0.0 110.967 -179.962 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' B' B ' 161' ' ' ARG . . . . . . . . . . . . . 2.5 tpm_? -100.57 -45.22 5.59 Favored 'General case' 0 N--CA 1.497 1.907 0 O-C-N 121.134 -0.979 . . . . 0.0 110.132 179.672 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' B' B ' 162' ' ' ALA . . . . . . . . . . . . . . . -96.49 179.36 5.04 Favored 'General case' 0 N--CA 1.494 1.738 0 O-C-N 121.632 -0.667 . . . . 0.0 109.992 179.816 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' B' B ' 163' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER . . . . . 0 N--CA 1.496 1.871 0 CA-C-O 117.798 -1.096 . . . . 0.0 110.876 -179.642 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 90' ' ' ' CA' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 017 nuclear orig full ' A' A ' 91' ' ' SXK . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 018 nuclear orig full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.497 1.899 0 N-CA-C 109.913 -0.403 . . . . 0.0 109.913 . . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 2' ' ' ASP . . . . . . . . . . . . . 14.2 t70 -129.74 142.75 50.65 Favored 'General case' 0 N--CA 1.494 1.744 0 O-C-N 121.312 -0.867 . . . . 0.0 110.837 -179.786 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 3' ' ' ASP . . . . . 0.434 ' HA ' ' HD2' ' A' ' 6' ' ' LYS . 1.1 m-20 -121.86 6.18 9.89 Favored 'General case' 0 N--CA 1.495 1.807 0 O-C-N 121.65 -0.656 . . . . 0.0 110.717 179.361 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 4' ' ' ILE . . . . . . . . . . . . . 2.7 mp -90.38 -40.55 12.89 Favored 'Isoleucine or valine' 0 N--CA 1.496 1.86 0 O-C-N 121.18 -0.95 . . . . 0.0 110.02 179.769 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 5' ' ' TYR . . . . . . . . . . . . . 5.8 m-85 -57.63 -30.01 65.03 Favored 'General case' 0 N--CA 1.5 2.048 0 O-C-N 121.306 -0.872 . . . . 0.0 110.082 179.384 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 6' ' ' LYS . . . . . 0.456 ' O ' HG12 ' A' ' 9' ' ' VAL . 14.8 mttt -61.15 -43.53 98.74 Favored 'General case' 0 N--CA 1.499 1.997 0 O-C-N 121.385 -0.822 . . . . 0.0 109.716 178.986 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 7' ' ' ALA . . . . . . . . . . . . . . . -55.32 -32.67 62.66 Favored 'General case' 0 N--CA 1.499 2.007 0 O-C-N 121.342 -0.849 . . . . 0.0 110.238 179.099 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 8' ' ' ALA . . . . . . . . . . . . . . . -71.32 -37.52 71.75 Favored 'General case' 0 N--CA 1.499 1.985 0 O-C-N 121.433 -0.792 . . . . 0.0 110.424 179.39 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 9' ' ' VAL . . . . . 0.564 HG22 ' HB ' ' A' ' 79' ' ' VAL . 0.3 OUTLIER -77.4 -23.1 14.37 Favored 'Isoleucine or valine' 0 N--CA 1.499 2.008 0 O-C-N 121.503 -0.748 . . . . 0.0 111.169 -179.66 . . . . . . . . 3 3 . 1 . 018 nuclear orig full ' A' A ' 10' ' ' GLU . . . . . . . . . . . . . 28.1 mt-10 -92.89 -26.26 17.7 Favored 'General case' 0 N--CA 1.495 1.811 0 O-C-N 121.238 -0.914 . . . . 0.0 111.918 -179.233 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 11' ' ' GLN . . . . . . . . . . . . . 2.8 mt-30 -119.35 64.06 0.79 Allowed 'General case' 0 N--CA 1.499 2.009 0 O-C-N 120.825 -1.172 . . . . 0.0 112.239 -178.825 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 12' ' ' LEU . . . . . 0.542 HD11 ' HA ' ' A' ' 9' ' ' VAL . 0.5 OUTLIER -90.36 164.15 14.44 Favored 'General case' 0 N--CA 1.501 2.11 0 O-C-N 120.933 -1.105 . . . . 0.0 109.796 178.422 . . . . . . . . 3 3 . 1 . 018 nuclear orig full ' A' A ' 13' ' ' THR . . . . . . . . . . . . . 39.4 p -79.47 162.46 25.43 Favored 'General case' 0 N--CA 1.499 1.999 0 O-C-N 121.005 -1.06 . . . . 0.0 109.379 178.658 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 14' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER -55.92 -33.21 64.47 Favored 'General case' 0 N--CA 1.493 1.693 0 O-C-N 121.389 -0.819 . . . . 0.0 110.709 -179.349 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 1.8 mp0 -73.71 -55.81 5.79 Favored 'General case' 0 N--CA 1.498 1.961 0 O-C-N 121.29 -0.881 . . . . 0.0 109.935 179.349 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 16' ' ' GLN . . . . . . . . . . . . . 2.1 mp0 -57.03 -53.59 56.33 Favored 'General case' 0 N--CA 1.503 2.177 0 O-C-N 121.425 -0.797 . . . . 0.0 110.891 -179.827 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 17' ' ' LYS . . . . . 0.489 ' HD3' ' HB2' ' A' ' 12' ' ' LEU . 2.6 ttpm? -57.65 -42.73 84.07 Favored 'General case' 0 N--CA 1.499 2.021 0 CA-C-N 116.228 -0.442 . . . . 0.0 110.96 -179.95 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 18' ' ' ASN . . . . . . . . . . . . . 14.7 t30 -70.62 -42.51 70.81 Favored 'General case' 0 N--CA 1.497 1.921 0 O-C-N 121.288 -0.882 . . . . 0.0 110.66 -179.993 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -56.96 -47.55 80.45 Favored 'General case' 0 N--CA 1.499 2.018 0 O-C-N 121.369 -0.832 . . . . 0.0 110.608 -179.657 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 20' ' ' PHE . . . . . . . . . . . . . 23.3 m-85 -64.7 -37.82 88.88 Favored 'General case' 0 N--CA 1.501 2.095 0 O-C-N 121.051 -1.03 . . . . 0.0 109.863 179.363 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 21' ' ' LYS . . . . . . . . . . . . . 17.3 tptp -62.7 -41.74 99.28 Favored 'General case' 0 N--CA 1.499 1.993 0 O-C-N 121.525 -0.734 . . . . 0.0 109.908 179.228 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 22' ' ' ALA . . . . . . . . . . . . . . . -77.73 -42.62 33.66 Favored 'General case' 0 N--CA 1.496 1.863 0 O-C-N 121.488 -0.757 . . . . 0.0 110.084 179.506 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 23' ' ' ALA . . . . . . . . . . . . . . . -62.71 -42.86 99.86 Favored 'General case' 0 N--CA 1.497 1.903 0 O-C-N 121.463 -0.773 . . . . 0.0 110.461 179.717 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 24' ' ' PHE . . . . . 0.463 ' CE1' HG13 ' A' ' 36' ' ' ILE . 79.7 t80 -62.96 -42.82 99.93 Favored 'General case' 0 N--CA 1.496 1.865 0 O-C-N 121.393 -0.817 . . . . 0.0 110.476 179.854 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 25' ' ' ASP . . . . . . . . . . . . . 0.7 OUTLIER -58.14 -45.38 87.48 Favored 'General case' 0 N--CA 1.499 2.02 0 O-C-N 121.44 -0.787 . . . . 0.0 110.253 179.784 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 26' ' ' ILE . . . . . . . . . . . . . 21.1 mt -68.19 -28.39 40.68 Favored 'Isoleucine or valine' 0 N--CA 1.497 1.912 0 O-C-N 121.42 -0.8 . . . . 0.0 109.611 178.956 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 27' ' ' PHE . . . . . . . . . . . . . 0.1 OUTLIER -73.11 -42.56 62.81 Favored 'General case' 0 N--CA 1.498 1.95 0 O-C-N 121.405 -0.809 . . . . 0.0 111.108 179.871 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 28' ' ' VAL . . . . . 0.405 ' CG1' HG13 ' A' ' 36' ' ' ILE . 18.7 m -92.26 38.33 0.09 OUTLIER 'Isoleucine or valine' 0 N--CA 1.506 2.337 0 O-C-N 121.238 -0.914 . . . . 0.0 111.503 -179.471 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 29' ' ' LEU . . . . . . . . . . . . . 4.7 mt -69.3 -36.75 77.34 Favored 'General case' 0 N--CA 1.498 1.932 0 O-C-N 120.954 -1.091 . . . . 0.0 109.878 179.042 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 30' ' ' GLY . . . . . . . . . . . . . . . -102.67 38.32 3.26 Favored Glycine 0 N--CA 1.494 2.514 0 N-CA-C 109.372 -1.491 . . . . 0.0 109.372 179.018 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 31' ' ' ALA . . . . . . . . . . . . . . . -129.58 -171.82 2.6 Favored 'General case' 0 N--CA 1.496 1.853 0 O-C-N 121.575 -0.956 . . . . 0.0 110.371 -179.992 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 32' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER -136.47 153.93 50.9 Favored 'General case' 0 N--CA 1.492 1.65 0 O-C-N 121.284 -0.885 . . . . 0.0 109.736 179.888 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER 62.81 14.81 7.66 Favored 'General case' 0 N--CA 1.502 2.163 0 O-C-N 121.598 -0.689 . . . . 0.0 111.772 -179.727 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 34' ' ' GLY . . . . . . . . . . . . . . . 60.81 57.17 20.2 Favored Glycine 0 N--CA 1.496 2.668 0 N-CA-C 110.308 -1.117 . . . . 0.0 110.308 179.36 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 35' ' ' CYS . . . . . . . . . . . . . 3.3 t -135.25 127.89 30.86 Favored 'General case' 0 N--CA 1.497 1.906 0 O-C-N 121.475 -1.015 . . . . 0.0 110.093 179.7 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 36' ' ' ILE . . . . . 0.463 HG13 ' CE1' ' A' ' 24' ' ' PHE . 14.8 mt -76.51 132.37 33.11 Favored 'Isoleucine or valine' 0 N--CA 1.5 2.048 0 O-C-N 121.235 -0.916 . . . . 0.0 110.367 -179.775 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 37' ' ' SER . . . . . . . . . . . . . 22.9 t -117.14 173.36 6.71 Favored 'General case' 0 N--CA 1.496 1.848 0 O-C-N 121.601 -0.687 . . . . 0.0 109.804 179.126 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 38' ' ' THR . . . . . 0.495 ' HB ' ' O ' ' A' ' 54' ' ' PRO . 23.3 p -61.04 -45.8 93.31 Favored 'General case' 0 N--CA 1.502 2.153 0 O-C-N 121.215 -0.928 . . . . 0.0 110.613 -180.0 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 39' ' ' LYS . . . . . . . . . . . . . 9.6 tmtt? -59.64 -35.18 73.89 Favored 'General case' 0 N--CA 1.499 1.976 0 O-C-N 121.596 -0.69 . . . . 0.0 110.557 179.728 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 9.3 mm-40 -69.58 -36.68 76.48 Favored 'General case' 0 N--CA 1.497 1.899 0 O-C-N 121.363 -0.836 . . . . 0.0 110.579 -179.968 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 41' ' ' LEU . . . . . 0.491 HD13 ' HG3' ' A' ' 45' ' ' MET . 6.8 tp -67.59 -45.16 76.32 Favored 'General case' 0 N--CA 1.497 1.922 0 O-C-N 121.028 -1.045 . . . . 0.0 109.053 178.748 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 42' ' ' GLY . . . . . . . . . . . . . . . -57.73 -34.3 70.21 Favored Glycine 0 N--CA 1.491 2.316 0 N-CA-C 110.073 -1.211 . . . . 0.0 110.073 179.862 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 43' ' ' LYS . . . . . . . . . . . . . 15.2 ttpt -54.0 -37.96 64.57 Favored 'General case' 0 N--CA 1.501 2.11 0 O-C-N 121.472 -1.017 . . . . 0.0 109.773 179.057 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 44' ' ' VAL . . . . . . . . . . . . . 98.0 t -84.55 -41.24 15.92 Favored 'Isoleucine or valine' 0 N--CA 1.499 2.017 0 O-C-N 121.395 -0.816 . . . . 0.0 109.699 179.097 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 45' ' ' MET . . . . . 0.491 ' HG3' HD13 ' A' ' 41' ' ' LEU . 2.6 mtt -64.31 -22.67 67.03 Favored 'General case' 0 N--CA 1.502 2.149 0 O-C-N 121.485 -0.759 . . . . 0.0 110.992 179.564 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 46' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -49.6 -40.96 40.75 Favored 'General case' 0 N--CA 1.501 2.079 0 O-C-N 121.364 -0.835 . . . . 0.0 111.555 -179.642 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 47' ' ' MET . . . . . . . . . . . . . 2.7 ptt? -94.39 4.23 54.13 Favored 'General case' 0 N--CA 1.5 2.037 0 O-C-N 121.26 -0.9 . . . . 0.0 111.741 -179.646 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 48' ' ' LEU . . . . . . . . . . . . . 43.0 tp -132.84 -64.07 0.76 Allowed 'General case' 0 N--CA 1.493 1.723 0 O-C-N 120.803 -1.185 . . . . 0.0 111.045 -179.466 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 49' ' ' GLY . . . . . 0.468 ' O ' ' HB2' ' A' ' 50' ' ' GLN . . . -96.96 19.24 55.58 Favored Glycine 0 N--CA 1.498 2.772 0 C-N-CA 120.405 -0.903 . . . . 0.0 111.115 -179.464 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 50' ' ' GLN . . . . . 0.468 ' HB2' ' O ' ' A' ' 49' ' ' GLY . 36.1 mt-30 65.19 -68.4 0.11 Allowed 'General case' 0 N--CA 1.507 2.407 0 CA-C-N 118.254 1.027 . . . . 0.0 111.469 179.661 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 51' ' ' ASN . . . . . 0.425 ' OD1' HD23 ' A' ' 57' ' ' LEU . 0.9 OUTLIER 63.49 94.28 0.05 OUTLIER Pre-proline 0 N--CA 1.504 2.227 0 O-C-N 121.492 -0.755 . . . . 0.0 110.956 -179.759 . . . . . . . . 3 3 . 1 . 018 nuclear orig full ' A' A ' 52' ' ' PRO . . . . . . . . . . . . . 49.2 Cg_endo -75.41 -42.96 0.4 Allowed 'Trans proline' 0 N--CA 1.49 1.274 0 O-C-N 123.747 1.393 . . . . 0.0 111.212 179.819 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 53' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -143.54 153.94 59.23 Favored Pre-proline 0 N--CA 1.501 2.086 0 O-C-N 121.198 -0.939 . . . . 0.0 110.622 -179.875 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 54' ' ' PRO . . . . . 0.495 ' O ' ' HB ' ' A' ' 38' ' ' THR . 44.2 Cg_endo -69.9 -42.08 3.56 Favored 'Trans proline' 0 C--N 1.312 -1.382 0 O-C-N 124.111 1.585 . . . . 0.0 110.774 179.431 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 55' ' ' GLU . . . . . . . . . . . . . 3.0 mp0 -55.04 -28.6 53.43 Favored 'General case' 0 N--CA 1.504 2.24 0 O-C-N 121.312 -0.867 . . . . 0.0 111.045 179.997 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 22.5 tt0 -65.74 -29.96 70.55 Favored 'General case' 0 N--CA 1.496 1.836 0 O-C-N 121.317 -0.865 . . . . 0.0 111.206 179.91 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 57' ' ' LEU . . . . . 0.456 ' N ' ' CD2' ' A' ' 57' ' ' LEU . 3.1 mm? -84.51 -12.95 53.26 Favored 'General case' 0 N--CA 1.5 2.035 0 O-C-N 120.949 -1.095 . . . . 0.0 111.58 -179.459 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 58' ' ' GLN . . . . . 0.549 ' O ' HG21 ' A' ' 61' ' ' ILE . 0.0 OUTLIER -57.2 -30.57 64.67 Favored 'General case' 0 N--CA 1.502 2.132 0 O-C-N 121.126 -0.984 . . . . 0.0 109.525 179.545 . . . . . . . . 3 3 . 1 . 018 nuclear orig full ' A' A ' 59' ' ' GLU . . . . . . . . . . . . . 0.7 OUTLIER -61.9 -37.46 84.69 Favored 'General case' 0 N--CA 1.498 1.966 0 O-C-N 121.058 -1.027 . . . . 0.0 109.013 178.214 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 60' ' ' MET . . . . . . . . . . . . . 0.7 OUTLIER -72.55 -40.54 66.63 Favored 'General case' 0 N--CA 1.495 1.786 0 O-C-N 121.798 -0.564 . . . . 0.0 110.509 179.49 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 61' ' ' ILE . . . . . 0.565 HG13 HG22 ' A' ' 72' ' ' VAL . 15.2 tt -76.23 -38.32 33.63 Favored 'Isoleucine or valine' 0 N--CA 1.498 1.954 0 O-C-N 121.245 -0.909 . . . . 0.0 111.019 -179.75 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 62' ' ' ASP . . . . . . . . . . . . . 0.7 OUTLIER -66.84 -35.23 79.58 Favored 'General case' 0 N--CA 1.499 2.023 0 O-C-N 121.148 -0.97 . . . . 0.0 110.433 179.928 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 63' ' ' GLU . . . . . . . . . . . . . 1.2 tt0 -56.84 -34.27 67.59 Favored 'General case' 0 N--CA 1.499 1.982 0 O-C-N 121.535 -0.728 . . . . 0.0 110.452 179.412 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 64' ' ' VAL . . . . . . . . . . . . . 27.5 t -101.63 -20.64 5.47 Favored 'Isoleucine or valine' 0 N--CA 1.496 1.872 0 O-C-N 121.311 -0.868 . . . . 0.0 110.651 179.632 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 65' ' ' ASP . . . . . . . . . . . . . 30.0 t70 -58.55 -70.93 0.13 Allowed 'General case' 0 N--CA 1.5 2.071 0 O-C-N 121.359 -0.838 . . . . 0.0 110.778 -179.641 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 66' ' ' GLU . . . . . . . . . . . . . 15.8 mm-40 49.18 30.61 3.12 Favored 'General case' 0 N--CA 1.504 2.23 0 O-C-N 121.489 -0.757 . . . . 0.0 110.293 -179.209 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 67' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -105.05 -29.15 10.61 Favored 'General case' 0 N--CA 1.492 1.633 0 O-C-N 121.604 -0.685 . . . . 0.0 110.549 -179.45 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 68' ' ' GLY . . . . . . . . . . . . . . . 110.92 -11.68 29.56 Favored Glycine 0 N--CA 1.495 2.569 0 N-CA-C 109.406 -1.477 . . . . 0.0 109.406 -178.729 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 69' ' ' SER . . . . . . . . . . . . . 89.7 p -102.32 -42.89 5.85 Favored 'General case' 0 N--CA 1.495 1.818 0 O-C-N 121.468 -1.019 . . . . 0.0 111.015 -179.847 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 70' ' ' GLY . . . . . . . . . . . . . . . 95.31 38.14 4.88 Favored Glycine 0 N--CA 1.496 2.657 0 N-CA-C 108.417 -1.873 . . . . 0.0 108.417 -178.954 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 71' ' ' THR . . . . . . . . . . . . . 8.1 p -142.6 134.31 26.77 Favored 'General case' 0 N--CA 1.492 1.648 0 O-C-N 121.763 -0.845 . . . . 0.0 109.954 -179.086 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 72' ' ' VAL . . . . . 0.565 HG22 HG13 ' A' ' 61' ' ' ILE . 2.9 t -103.05 113.56 40.16 Favored 'Isoleucine or valine' 0 N--CA 1.494 1.733 0 O-C-N 121.386 -0.821 . . . . 0.0 110.59 -179.859 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 73' ' ' ASP . . . . . . . . . . . . . 1.6 p-10 -87.15 -159.32 0.5 Allowed 'General case' 0 N--CA 1.496 1.83 0 O-C-N 121.493 -0.754 . . . . 0.0 110.042 179.581 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 74' ' ' PHE . . . . . . . . . . . . . 46.7 t80 -61.67 -51.87 66.64 Favored 'General case' 0 N--CA 1.496 1.866 0 O-C-N 121.303 -0.873 . . . . 0.0 110.323 179.812 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 75' ' ' ASP . . . . . 0.419 ' HA ' HD22 ' A' ' 78' ' ' LEU . 0.3 OUTLIER -61.61 -47.31 86.01 Favored 'General case' 0 N--CA 1.496 1.87 0 O-C-N 121.518 -0.738 . . . . 0.0 110.675 -179.935 . . . . . . . . 3 3 . 1 . 018 nuclear orig full ' A' A ' 76' ' ' GLU . . . . . . . . . . . . . 14.2 mt-10 -63.58 -33.53 75.81 Favored 'General case' 0 N--CA 1.499 2.004 0 O-C-N 121.327 -0.858 . . . . 0.0 110.433 179.586 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 77' ' ' PHE . . . . . . . . . . . . . 33.6 t80 -76.68 -46.2 26.59 Favored 'General case' 0 N--CA 1.497 1.886 0 O-C-N 121.173 -0.954 . . . . 0.0 110.033 179.358 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 78' ' ' LEU . . . . . 0.483 ' HG ' ' N ' ' A' ' 79' ' ' VAL . 0.1 OUTLIER -66.44 -36.14 82.05 Favored 'General case' 0 N--CA 1.498 1.946 0 O-C-N 121.429 -0.794 . . . . 0.0 110.429 -179.791 . . . . . . . . 3 3 . 1 . 018 nuclear orig full ' A' A ' 79' ' ' VAL . . . . . 0.564 ' HB ' HG22 ' A' ' 9' ' ' VAL . 4.3 p -71.78 -33.91 49.97 Favored 'Isoleucine or valine' 0 N--CA 1.499 2.015 0 O-C-N 120.951 -1.093 . . . . 0.0 109.206 178.684 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 80' ' ' MET . . . . . . . . . . . . . 56.2 ttp -61.24 -33.53 73.67 Favored 'General case' 0 N--CA 1.496 1.829 0 O-C-N 121.545 -0.722 . . . . 0.0 109.198 178.415 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 81' ' ' MET . . . . . . . . . . . . . 9.1 mmt -62.96 -42.85 99.95 Favored 'General case' 0 N--CA 1.494 1.763 0 O-C-N 121.667 -0.646 . . . . 0.0 109.544 178.881 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 82' ' ' VAL . . . . . . . . . . . . . 71.9 t -60.69 -38.85 79.76 Favored 'Isoleucine or valine' 0 N--CA 1.5 2.06 0 O-C-N 121.478 -0.764 . . . . 0.0 109.363 178.832 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 83' ' ' ARG . . . . . . . . . . . . . 20.1 mtp180 -62.79 -37.06 85.18 Favored 'General case' 0 N--CA 1.498 1.965 0 O-C-N 121.372 -0.83 . . . . 0.0 109.383 178.62 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 84' ' ' CYS . . . . . 0.62 ' SG ' ' HAF' ' A' ' 91' ' ' SXK . 66.7 m -78.86 -24.88 44.04 Favored 'General case' 0 N--CA 1.496 1.863 0 O-C-N 121.577 -0.702 . . . . 0.0 110.311 179.226 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 85' ' ' MET . . . . . . . . . . . . . 2.5 mtp -80.0 51.82 1.41 Allowed 'General case' 0 N--CA 1.499 2.012 0 O-C-N 121.28 -0.888 . . . . 0.0 109.7 179.156 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 86' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -165.51 128.53 2.16 Favored 'General case' 0 N--CA 1.493 1.716 0 O-C-N 121.282 -0.886 . . . . 0.0 109.924 -179.482 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 87' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -112.93 -61.81 1.68 Allowed 'General case' 0 N--CA 1.495 1.807 0 O-C-N 121.446 -0.784 . . . . 0.0 111.022 -179.505 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 88' ' ' ASP . . . . . . . . . . . . . 21.5 t70 -94.35 -63.14 1.22 Allowed 'General case' 0 N--CA 1.499 1.978 0 O-C-N 121.195 -0.94 . . . . 0.0 110.623 -179.805 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 89' ' ' SER . . . . . . . . . . . . . 7.7 t . . . . . 0 N--CA 1.495 1.814 0 CA-C-O 117.805 -1.093 . . . . 0.0 110.251 179.948 . . . . . . . . 0 0 . 1 . 018 nuclear orig full ' B' B ' 144' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER . . . . . 0 N--CA 1.499 1.997 0 CA-C-O 121.272 0.558 . . . . 0.0 110.401 . . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' B' B ' 145' ' ' ARG . . . . . . . . . . . . . 4.1 tpt85 -158.76 -58.52 0.07 Allowed 'General case' 0 N--CA 1.498 1.929 0 O-C-N 121.241 -0.912 . . . . 0.0 111.173 -179.901 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' B' B ' 146' ' ' VAL . . . . . 0.464 ' CG2' ' HAG' ' A' ' 91' ' ' SXK . 28.3 m -77.61 -13.79 14.16 Favored 'Isoleucine or valine' 0 N--CA 1.505 2.316 0 O-C-N 121.263 -0.898 . . . . 0.0 112.234 -178.821 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' B' B ' 147' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER 56.69 40.35 29.26 Favored 'General case' 0 N--CA 1.504 2.231 0 O-C-N 121.149 -0.969 . . . . 0.0 111.039 -179.872 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' B' B ' 148' ' ' ILE . . . . . 0.418 ' HB ' ' CAG' ' A' ' 91' ' ' SXK . 0.4 OUTLIER -77.85 135.94 25.23 Favored 'Isoleucine or valine' 0 N--CA 1.501 2.075 0 O-C-N 121.278 -0.889 . . . . 0.0 110.039 179.801 . . . . . . . . 3 3 . 1 . 018 nuclear orig full ' B' B ' 149' ' ' SER . . . . . . . . . . . . . 40.8 t -107.1 172.57 6.75 Favored 'General case' 0 N--CA 1.5 2.042 0 O-C-N 121.204 -0.935 . . . . 0.0 111.163 -179.255 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' B' B ' 150' ' ' ALA . . . . . . . . . . . . . . . -55.75 -50.58 70.0 Favored 'General case' 0 N--CA 1.499 2.019 0 O-C-N 121.72 -0.612 . . . . 0.0 111.084 -179.792 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' B' B ' 151' ' ' ASP . . . . . . . . . . . . . 4.7 p-10 -56.97 -37.28 71.39 Favored 'General case' 0 N--CA 1.501 2.083 0 O-C-N 121.392 -0.817 . . . . 0.0 110.696 179.893 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' B' B ' 152' ' ' ALA . . . . . . . . . . . . . . . -70.44 -45.29 66.12 Favored 'General case' 0 N--CA 1.495 1.803 0 O-C-N 121.321 -0.862 . . . . 0.0 109.636 179.304 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' B' B ' 153' ' ' MET . . . . . 0.588 ' HG3' ' HAJ' ' A' ' 91' ' ' SXK . 1.1 mmt -62.74 -40.95 98.83 Favored 'General case' 0 N--CA 1.496 1.86 0 O-C-N 121.613 -0.68 . . . . 0.0 110.137 179.364 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' B' B ' 154' ' ' MET . . . . . . . . . . . . . 9.9 mmt -61.86 -47.94 82.77 Favored 'General case' 0 N--CA 1.499 1.993 0 O-C-N 121.358 -0.839 . . . . 0.0 109.956 179.458 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' B' B ' 155' ' ' GLN . . . . . . . . . . . . . 13.9 mt-30 -68.72 -29.69 68.16 Favored 'General case' 0 N--CA 1.498 1.973 0 O-C-N 121.338 -0.851 . . . . 0.0 110.505 179.334 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' B' B ' 156' ' ' ALA . . . . . . . . . . . . . . . -80.39 -20.32 44.28 Favored 'General case' 0 N--CA 1.498 1.973 0 O-C-N 121.243 -0.911 . . . . 0.0 111.082 179.867 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' B' B ' 157' ' ' LEU . . . . . . . . . . . . . 13.6 tp -96.59 -49.18 5.22 Favored 'General case' 0 N--CA 1.497 1.907 0 O-C-N 121.041 -1.037 . . . . 0.0 111.017 -179.685 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' B' B ' 158' ' ' LEU . . . . . . . . . . . . . 19.0 mt -96.64 -29.56 13.76 Favored 'General case' 0 N--CA 1.5 2.069 0 O-C-N 121.15 -0.969 . . . . 0.0 111.587 -179.24 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' B' B ' 159' ' ' GLY . . . . . . . . . . . . . . . -84.91 -31.82 22.62 Favored Glycine 0 N--CA 1.498 2.829 0 O-C-N 121.153 -0.967 . . . . 0.0 110.886 -179.24 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' B' B ' 160' ' ' ALA . . . . . . . . . . . . . . . -83.32 78.79 9.57 Favored 'General case' 0 N--CA 1.497 1.921 0 O-C-N 121.139 -1.212 . . . . 0.0 111.214 -179.167 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' B' B ' 161' ' ' ARG . . . . . . . . . . . . . 0.3 OUTLIER 46.48 74.2 0.15 Allowed 'General case' 0 N--CA 1.504 2.238 0 O-C-N 121.582 -0.699 . . . . 0.0 111.544 179.338 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' B' B ' 162' ' ' ALA . . . . . 0.402 ' O ' ' HB3' ' B' ' 163' ' ' LYS . . . -89.66 133.45 34.64 Favored 'General case' 0 N--CA 1.496 1.83 0 O-C-N 121.139 -0.976 . . . . 0.0 109.726 179.126 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' B' B ' 163' ' ' LYS . . . . . 0.402 ' HB3' ' O ' ' B' ' 162' ' ' ALA . 0.0 OUTLIER . . . . . 0 N--CA 1.505 2.295 0 CA-C-O 118.776 -0.63 . . . . 0.0 110.598 -179.603 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 90' ' ' ' CA' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 018 nuclear orig full ' A' A ' 91' ' ' SXK . . . . . 0.62 ' HAF' ' SG ' ' A' ' 84' ' ' CYS . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 1.7 tpp . . . . . 0 N--CA 1.498 1.938 0 CA-C-O 120.858 0.361 . . . . 0.0 110.244 . . . . . . . . . 0 0 . 1 . 019 nuclear orig full ' A' A ' 2' ' ' ASP . . . . . . . . . . . . . 4.4 t70 -97.61 62.06 1.65 Allowed 'General case' 0 N--CA 1.495 1.805 0 O-C-N 121.333 -0.855 . . . . 0.0 109.787 179.584 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 3' ' ' ASP . . . . . . . . . . . . . 8.0 m-20 -90.0 -34.99 15.78 Favored 'General case' 0 N--CA 1.495 1.788 0 O-C-N 121.36 -0.837 . . . . 0.0 110.632 -179.453 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 4' ' ' ILE . . . . . . . . . . . . . 72.3 mt -57.88 -49.5 80.88 Favored 'Isoleucine or valine' 0 N--CA 1.502 2.17 0 O-C-N 121.347 -0.845 . . . . 0.0 110.371 179.842 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 5' ' ' TYR . . . . . . . . . . . . . 44.1 m-85 -66.26 -42.22 88.81 Favored 'General case' 0 N--CA 1.501 2.122 0 O-C-N 121.244 -0.91 . . . . 0.0 110.525 179.931 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 6' ' ' LYS . . . . . 0.493 ' HB3' ' HE3' ' A' ' 6' ' ' LYS . 15.9 mtpp -65.3 -32.18 73.7 Favored 'General case' 0 N--CA 1.493 1.683 0 O-C-N 121.332 -0.855 . . . . 0.0 110.415 179.99 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 7' ' ' ALA . . . . . . . . . . . . . . . -51.65 -42.91 62.42 Favored 'General case' 0 N--CA 1.498 1.954 0 O-C-N 121.253 -0.904 . . . . 0.0 109.306 178.803 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 8' ' ' ALA . . . . . 0.446 ' HB2' HG22 ' A' ' 82' ' ' VAL . . . -70.23 -42.24 72.5 Favored 'General case' 0 N--CA 1.495 1.812 0 O-C-N 121.503 -0.748 . . . . 0.0 109.158 178.218 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 9' ' ' VAL . . . . . . . . . . . . . 69.7 t -61.52 -40.53 86.79 Favored 'Isoleucine or valine' 0 N--CA 1.5 2.034 0 O-C-N 121.704 -0.623 . . . . 0.0 110.103 179.15 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 10' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER -69.16 -28.83 66.77 Favored 'General case' 0 N--CA 1.497 1.912 0 O-C-N 121.512 -0.743 . . . . 0.0 110.587 179.7 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 11' ' ' GLN . . . . . . . . . . . . . 0.1 OUTLIER -92.42 41.61 1.08 Allowed 'General case' 0 N--CA 1.496 1.836 0 O-C-N 121.279 -0.888 . . . . 0.0 110.946 -179.754 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 12' ' ' LEU . . . . . . . . . . . . . 10.7 mt -106.8 123.82 48.71 Favored 'General case' 0 N--CA 1.497 1.904 0 O-C-N 121.134 -0.979 . . . . 0.0 110.177 179.516 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 13' ' ' THR . . . . . . . . . . . . . 0.3 OUTLIER -79.69 164.49 23.7 Favored 'General case' 0 N--CA 1.498 1.927 0 O-C-N 121.193 -0.942 . . . . 0.0 110.07 179.621 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 14' ' ' GLU . . . . . . . . . . . . . 0.2 OUTLIER -52.54 -30.75 32.2 Favored 'General case' 0 N--CA 1.497 1.879 0 O-C-N 121.625 -0.672 . . . . 0.0 111.196 -179.281 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 1.5 mp0 -59.65 -51.23 70.71 Favored 'General case' 0 N--CA 1.497 1.892 0 O-C-N 121.449 -0.782 . . . . 0.0 109.838 179.483 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 16' ' ' GLN . . . . . . . . . . . . . 3.0 mp0 -79.99 -26.79 39.77 Favored 'General case' 0 N--CA 1.5 2.03 0 O-C-N 121.452 -0.78 . . . . 0.0 110.12 179.148 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 17' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -69.15 -42.57 75.76 Favored 'General case' 0 N--CA 1.496 1.867 0 O-C-N 121.628 -0.67 . . . . 0.0 110.097 179.707 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 18' ' ' ASN . . . . . 0.457 ' HA ' ' HG2' ' A' ' 21' ' ' LYS . 12.2 t30 -56.9 -39.69 74.89 Favored 'General case' 0 N--CA 1.499 2.002 0 O-C-N 121.6 -0.688 . . . . 0.0 110.761 179.923 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 4.4 mt-10 -54.88 -48.51 72.9 Favored 'General case' 0 N--CA 1.499 2.011 0 O-C-N 121.33 -0.856 . . . . 0.0 109.987 179.553 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 20' ' ' PHE . . . . . . . . . . . . . 43.9 m-85 -77.65 -33.58 53.41 Favored 'General case' 0 N--CA 1.497 1.919 0 O-C-N 121.436 -0.79 . . . . 0.0 110.282 179.516 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 21' ' ' LYS . . . . . 0.519 ' HE3' ' HA ' ' A' ' 22' ' ' ALA . 0.0 OUTLIER -64.21 -34.31 77.79 Favored 'General case' 0 N--CA 1.496 1.858 0 O-C-N 121.183 -0.948 . . . . 0.0 109.508 179.02 . . . . . . . . 3 3 . 1 . 019 nuclear orig full ' A' A ' 22' ' ' ALA . . . . . 0.519 ' HA ' ' HE3' ' A' ' 21' ' ' LYS . . . -76.02 -41.52 50.74 Favored 'General case' 0 N--CA 1.496 1.873 0 O-C-N 121.556 -0.715 . . . . 0.0 109.153 178.434 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 23' ' ' ALA . . . . . 0.477 ' O ' ' HB2' ' A' ' 27' ' ' PHE . . . -73.3 -7.27 50.83 Favored 'General case' 0 N--CA 1.494 1.732 0 O-C-N 121.679 -0.638 . . . . 0.0 110.75 178.975 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 24' ' ' PHE . . . . . . . . . . . . . 38.5 t80 -107.92 -49.32 3.23 Favored 'General case' 0 N--CA 1.495 1.793 0 O-C-N 121.181 -0.949 . . . . 0.0 110.795 -179.574 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 25' ' ' ASP . . . . . . . . . . . . . 0.1 OUTLIER -61.38 -41.84 97.75 Favored 'General case' 0 N--CA 1.5 2.065 0 O-C-N 121.307 -0.871 . . . . 0.0 110.891 -179.389 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 26' ' ' ILE . . . . . . . . . . . . . 37.4 mt -76.62 -27.05 16.83 Favored 'Isoleucine or valine' 0 N--CA 1.499 1.977 0 O-C-N 121.152 -0.968 . . . . 0.0 109.798 179.037 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 27' ' ' PHE . . . . . 0.568 ' HA ' HD22 ' B' ' 157' ' ' LEU . 1.7 t80 -59.08 -50.6 73.45 Favored 'General case' 0 N--CA 1.497 1.894 0 O-C-N 121.638 -0.664 . . . . 0.0 110.421 179.484 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 28' ' ' VAL . . . . . . . . . . . . . 18.6 m -91.04 -35.4 7.12 Favored 'Isoleucine or valine' 0 N--CA 1.497 1.906 0 O-C-N 121.555 -0.716 . . . . 0.0 111.254 -179.288 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 29' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER 46.48 43.66 12.31 Favored 'General case' 0 N--CA 1.497 1.919 0 O-C-N 121.45 -0.781 . . . . 0.0 110.218 -179.654 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 30' ' ' GLY . . . . . . . . . . . . . . . 106.06 -62.04 0.33 Allowed Glycine 0 N--CA 1.494 2.503 0 N-CA-C 108.794 -1.722 . . . . 0.0 108.794 -178.768 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 31' ' ' ALA . . . . . . . . . . . . . . . 47.88 56.64 6.95 Favored 'General case' 0 N--CA 1.501 2.121 0 O-C-N 121.81 -0.817 . . . . 0.0 111.13 179.531 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 32' ' ' GLU . . . . . . . . . . . . . 2.8 mm-40 51.33 32.47 8.44 Favored 'General case' 0 N--CA 1.502 2.13 0 O-C-N 121.644 -0.66 . . . . 0.0 110.979 179.938 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 1.2 t70 55.17 53.52 10.02 Favored 'General case' 0 N--CA 1.499 2.017 0 O-C-N 121.49 -0.756 . . . . 0.0 110.696 -179.848 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 34' ' ' GLY . . . . . . . . . . . . . . . -145.46 31.29 1.68 Allowed Glycine 0 N--CA 1.499 2.839 0 C-N-CA 119.883 -1.151 . . . . 0.0 111.146 -179.762 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 35' ' ' CYS . . . . . . . . . . . . . 96.7 m 48.62 -151.59 0.13 Allowed 'General case' 0 N--CA 1.508 2.456 0 O-C-N 121.373 -1.075 . . . . 0.0 111.302 179.353 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 36' ' ' ILE . . . . . . . . . . . . . 30.5 mt -80.95 105.56 11.0 Favored 'Isoleucine or valine' 0 N--CA 1.5 2.054 0 O-C-N 120.792 -1.193 . . . . 0.0 110.141 -179.893 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 37' ' ' SER . . . . . . . . . . . . . 5.7 t -100.57 175.71 5.58 Favored 'General case' 0 N--CA 1.496 1.835 0 O-C-N 121.429 -0.794 . . . . 0.0 110.098 179.595 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 38' ' ' THR . . . . . . . . . . . . . 33.6 p -61.81 -38.8 89.49 Favored 'General case' 0 N--CA 1.501 2.1 0 O-C-N 121.231 -0.918 . . . . 0.0 110.041 179.553 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 39' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -65.64 -40.29 92.36 Favored 'General case' 0 N--CA 1.499 2.005 0 O-C-N 121.674 -0.641 . . . . 0.0 110.379 179.535 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 2.3 mp0 -65.42 -48.8 71.57 Favored 'General case' 0 N--CA 1.499 2.014 0 O-C-N 121.434 -0.791 . . . . 0.0 110.399 179.896 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 41' ' ' LEU . . . . . 0.439 HD23 ' HAK' ' A' ' 91' ' ' SXK . 7.7 tp -61.69 -47.44 85.31 Favored 'General case' 0 N--CA 1.499 1.983 0 O-C-N 121.481 -0.762 . . . . 0.0 110.323 179.898 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 42' ' ' GLY . . . . . . . . . . . . . . . -58.16 -40.06 93.16 Favored Glycine 0 N--CA 1.493 2.472 0 N-CA-C 110.155 -1.178 . . . . 0.0 110.155 -179.712 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 43' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -56.42 -45.21 80.82 Favored 'General case' 0 N--CA 1.5 2.066 0 O-C-N 121.439 -1.036 . . . . 0.0 109.97 179.426 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 44' ' ' VAL . . . . . . . . . . . . . 72.1 t -67.84 -42.69 86.14 Favored 'Isoleucine or valine' 0 N--CA 1.498 1.94 0 O-C-N 121.42 -0.8 . . . . 0.0 109.557 179.154 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 45' ' ' MET . . . . . 0.4 ' HE2' HD11 ' A' ' 41' ' ' LEU . 0.9 OUTLIER -60.04 -39.27 85.35 Favored 'General case' 0 N--CA 1.499 2.012 0 O-C-N 121.431 -0.793 . . . . 0.0 109.59 178.805 . . . . . . . . 3 3 . 1 . 019 nuclear orig full ' A' A ' 46' ' ' ARG . . . . . . . . . . . . . 0.3 OUTLIER -61.49 -37.49 83.87 Favored 'General case' 0 N--CA 1.496 1.832 0 O-C-N 121.65 -0.656 . . . . 0.0 109.706 178.859 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 47' ' ' MET . . . . . . . . . . . . . 18.1 ttp -67.02 -38.65 86.33 Favored 'General case' 0 N--CA 1.496 1.863 0 O-C-N 121.711 -0.618 . . . . 0.0 110.032 179.153 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 48' ' ' LEU . . . . . . . . . . . . . 5.9 tp -68.9 -36.79 78.45 Favored 'General case' 0 N--CA 1.493 1.677 0 O-C-N 121.4 -0.812 . . . . 0.0 110.307 179.691 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 49' ' ' GLY . . . . . . . . . . . . . . . 131.98 -39.61 1.74 Allowed Glycine 0 N--CA 1.494 2.561 0 N-CA-C 110.023 -1.231 . . . . 0.0 110.023 179.925 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 50' ' ' GLN . . . . . . . . . . . . . 7.8 mt-30 -88.16 107.51 18.81 Favored 'General case' 0 N--CA 1.497 1.922 0 O-C-N 121.274 -1.133 . . . . 0.0 110.626 -179.741 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 51' ' ' ASN . . . . . . . . . . . . . 24.4 t-20 -156.79 100.76 1.99 Allowed Pre-proline 0 N--CA 1.499 1.999 0 O-C-N 121.412 -0.805 . . . . 0.0 110.196 179.81 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 52' ' ' PRO . . . . . . . . . . . . . 49.0 Cg_endo -79.53 -89.2 0.0 OUTLIER 'Trans proline' 0 C--N 1.317 -1.131 0 O-C-N 123.839 1.441 . . . . 0.0 111.178 -179.999 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 53' ' ' THR . . . . . . . . . . . . . 4.6 p -127.95 165.83 27.77 Favored Pre-proline 0 N--CA 1.496 1.846 0 O-C-N 120.945 -1.097 . . . . 0.0 110.791 -179.233 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 54' ' ' PRO . . . . . . . . . . . . . 42.7 Cg_endo -68.79 -31.76 24.64 Favored 'Trans proline' 0 N--CA 1.491 1.335 0 O-C-N 123.704 1.371 . . . . 0.0 110.939 179.495 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 55' ' ' GLU . . . . . . . . . . . . . 1.9 mp0 -67.4 -29.45 68.97 Favored 'General case' 0 N--CA 1.499 1.994 0 O-C-N 121.22 -0.925 . . . . 0.0 110.075 179.271 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 4.6 tm-20 -56.82 -35.99 69.44 Favored 'General case' 0 N--CA 1.499 1.979 0 O-C-N 121.53 -0.732 . . . . 0.0 110.663 179.587 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 57' ' ' LEU . . . . . 0.426 ' O ' ' HB2' ' A' ' 60' ' ' MET . 0.7 OUTLIER -69.58 -29.26 66.77 Favored 'General case' 0 N--CA 1.499 1.98 0 O-C-N 121.33 -0.856 . . . . 0.0 110.87 179.983 . . . . . . . . 3 3 . 1 . 019 nuclear orig full ' A' A ' 58' ' ' GLN . . . . . 0.42 ' O ' HG22 ' A' ' 61' ' ' ILE . 0.0 OUTLIER -56.86 -49.74 74.57 Favored 'General case' 0 N--CA 1.498 1.941 0 O-C-N 121.051 -1.031 . . . . 0.0 109.451 179.642 . . . . . . . . 3 3 . 1 . 019 nuclear orig full ' A' A ' 59' ' ' GLU . . . . . . . . . . . . . 0.7 OUTLIER -64.65 -38.1 89.85 Favored 'General case' 0 N--CA 1.495 1.805 0 N-CA-C 108.418 -0.956 . . . . 0.0 108.418 177.971 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 60' ' ' MET . . . . . 0.443 ' HE3' HG12 ' B' ' 146' ' ' VAL . 7.5 mmm -58.8 -39.1 80.15 Favored 'General case' 0 N--CA 1.496 1.838 0 O-C-N 121.795 -0.566 . . . . 0.0 110.096 178.772 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 61' ' ' ILE . . . . . 0.65 HD13 ' HA ' ' A' ' 71' ' ' THR . 5.1 tt -76.72 -26.9 16.59 Favored 'Isoleucine or valine' 0 N--CA 1.498 1.943 0 O-C-N 121.435 -0.791 . . . . 0.0 110.575 179.729 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 62' ' ' ASP . . . . . 0.541 ' N ' HG22 ' A' ' 61' ' ' ILE . 1.8 t70 -62.32 -25.22 67.76 Favored 'General case' 0 N--CA 1.498 1.948 0 O-C-N 121.417 -0.802 . . . . 0.0 110.487 179.683 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 63' ' ' GLU . . . . . . . . . . . . . 16.2 tt0 -47.28 -42.39 20.79 Favored 'General case' 0 N--CA 1.501 2.097 0 O-C-N 121.613 -0.68 . . . . 0.0 110.961 179.459 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 64' ' ' VAL . . . . . . . . . . . . . 27.5 m -127.45 30.14 1.81 Allowed 'Isoleucine or valine' 0 N--CA 1.498 1.96 0 O-C-N 121.342 -0.849 . . . . 0.0 110.85 179.929 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 65' ' ' ASP . . . . . . . . . . . . . 19.3 t70 -119.9 -97.82 0.46 Allowed 'General case' 0 N--CA 1.495 1.78 0 O-C-N 121.173 -0.955 . . . . 0.0 110.062 179.589 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 66' ' ' GLU . . . . . . . . . . . . . 1.4 mm-40 47.24 35.34 3.66 Favored 'General case' 0 N--CA 1.502 2.126 0 O-C-N 121.354 -0.841 . . . . 0.0 110.967 -179.903 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 67' ' ' ASP . . . . . . . . . . . . . 4.4 p-10 -114.09 7.45 16.71 Favored 'General case' 0 N--CA 1.497 1.884 0 O-C-N 121.213 -0.93 . . . . 0.0 111.367 -179.691 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 68' ' ' GLY . . . . . . . . . . . . . . . 98.34 -27.1 21.0 Favored Glycine 0 N--CA 1.497 2.759 0 N-CA-C 110.45 -1.06 . . . . 0.0 110.45 179.888 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 69' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -80.34 -42.36 23.08 Favored 'General case' 0 N--CA 1.498 1.951 0 O-C-N 121.22 -1.165 . . . . 0.0 111.01 -179.612 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 70' ' ' GLY . . . . . . . . . . . . . . . 81.13 6.77 89.16 Favored Glycine 0 N--CA 1.499 2.854 0 C-N-CA 120.205 -0.997 . . . . 0.0 110.871 179.959 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 71' ' ' THR . . . . . 0.65 ' HA ' HD13 ' A' ' 61' ' ' ILE . 2.7 m -124.33 140.53 52.87 Favored 'General case' 0 N--CA 1.498 1.955 0 O-C-N 121.09 -1.241 . . . . 0.0 109.842 179.697 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 72' ' ' VAL . . . . . . . . . . . . . 3.0 t -92.35 123.63 44.52 Favored 'Isoleucine or valine' 0 N--CA 1.495 1.791 0 O-C-N 121.426 -0.796 . . . . 0.0 110.723 -179.633 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 73' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER -97.28 -163.5 1.05 Allowed 'General case' 0 N--CA 1.494 1.736 0 O-C-N 121.525 -0.735 . . . . 0.0 109.671 179.28 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 74' ' ' PHE . . . . . . . . . . . . . 11.1 t80 -64.97 -45.49 85.47 Favored 'General case' 0 N--CA 1.499 2.023 0 O-C-N 121.067 -1.02 . . . . 0.0 110.475 179.771 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 75' ' ' ASP . . . . . . . . . . . . . 16.3 t70 -59.85 -50.76 72.54 Favored 'General case' 0 N--CA 1.498 1.974 0 O-C-N 121.358 -0.839 . . . . 0.0 109.978 179.389 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 76' ' ' GLU . . . . . . . . . . . . . 43.5 mt-10 -62.18 -40.7 96.91 Favored 'General case' 0 N--CA 1.498 1.943 0 O-C-N 121.515 -0.741 . . . . 0.0 109.553 179.167 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 77' ' ' PHE . . . . . 0.423 ' CZ ' ' HE2' ' A' ' 81' ' ' MET . 71.8 t80 -60.83 -44.19 97.27 Favored 'General case' 0 N--CA 1.496 1.872 0 O-C-N 121.617 -0.677 . . . . 0.0 109.703 178.712 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 78' ' ' LEU . . . . . . . . . . . . . 52.6 mt -65.98 -43.62 87.29 Favored 'General case' 0 N--CA 1.5 2.046 0 O-C-N 121.567 -0.708 . . . . 0.0 110.087 179.389 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 79' ' ' VAL . . . . . . . . . . . . . 45.2 t -60.2 -44.68 95.94 Favored 'Isoleucine or valine' 0 N--CA 1.497 1.891 0 O-C-N 121.61 -0.681 . . . . 0.0 109.393 179.374 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 80' ' ' MET . . . . . 0.517 ' SD ' ' HAI' ' A' ' 91' ' ' SXK . 2.3 ttp -62.78 -39.77 95.26 Favored 'General case' 0 N--CA 1.495 1.812 0 O-C-N 121.517 -0.74 . . . . 0.0 110.013 178.923 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 81' ' ' MET . . . . . 0.423 ' HE2' ' CZ ' ' A' ' 77' ' ' PHE . 11.2 mmt -62.33 -44.29 96.84 Favored 'General case' 0 N--CA 1.498 1.948 0 O-C-N 121.57 -0.706 . . . . 0.0 110.743 179.946 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 82' ' ' VAL . . . . . 0.519 HG12 ' N ' ' A' ' 83' ' ' ARG . 2.4 p -70.21 -26.57 29.69 Favored 'Isoleucine or valine' 0 N--CA 1.5 2.05 0 O-C-N 121.169 -0.957 . . . . 0.0 110.292 179.514 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 83' ' ' ARG . . . . . 0.519 ' N ' HG12 ' A' ' 82' ' ' VAL . 4.0 mtp180 -74.6 -33.68 62.68 Favored 'General case' 0 N--CA 1.495 1.795 0 O-C-N 121.222 -0.924 . . . . 0.0 109.444 178.742 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 84' ' ' CYS . . . . . 0.71 ' HA ' ' HB2' ' A' ' 88' ' ' ASP . 0.1 OUTLIER -71.59 -11.52 60.89 Favored 'General case' 0 N--CA 1.496 1.869 0 O-C-N 121.703 -0.623 . . . . 0.0 110.921 179.323 . . . . . . . . 3 3 . 1 . 019 nuclear orig full ' A' A ' 85' ' ' MET . . . . . . . . . . . . . 12.2 tpp -58.19 -22.02 49.96 Favored 'General case' 0 N--CA 1.5 2.029 0 O-C-N 121.315 -0.865 . . . . 0.0 111.563 -179.953 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 86' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -90.95 43.53 1.15 Allowed 'General case' 0 N--CA 1.5 2.039 0 O-C-N 120.994 -1.066 . . . . 0.0 110.7 179.962 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 87' ' ' ASP . . . . . . . . . . . . . 1.1 t70 55.35 30.8 15.5 Favored 'General case' 0 N--CA 1.501 2.096 0 O-C-N 121.407 -0.808 . . . . 0.0 111.652 179.607 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 88' ' ' ASP . . . . . 0.71 ' HB2' ' HA ' ' A' ' 84' ' ' CYS . 0.9 OUTLIER -67.63 -39.06 84.69 Favored 'General case' 0 N--CA 1.498 1.949 0 O-C-N 120.911 -1.118 . . . . 0.0 109.923 179.339 . . . . . . . . 3 3 . 1 . 019 nuclear orig full ' A' A ' 89' ' ' SER . . . . . 0.426 ' HA ' ' HD3' ' B' ' 147' ' ' ARG . 0.2 OUTLIER . . . . . 0 N--CA 1.496 1.834 0 CA-C-O 118.363 -0.827 . . . . 0.0 110.538 179.434 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' B' B ' 144' ' ' ARG . . . . . . . . . . . . . 6.2 mpt_? . . . . . 0 N--CA 1.497 1.878 0 CA-C-O 120.867 0.365 . . . . 0.0 110.151 . . . . . . . . . 0 0 . 1 . 019 nuclear orig full ' B' B ' 145' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER 60.64 -158.89 0.32 Allowed 'General case' 0 N--CA 1.502 2.151 0 O-C-N 121.67 -0.644 . . . . 0.0 110.683 -179.848 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' B' B ' 146' ' ' VAL . . . . . 0.443 HG12 ' HE3' ' A' ' 60' ' ' MET . 91.6 t -114.94 -77.08 0.45 Allowed 'Isoleucine or valine' 0 N--CA 1.498 1.965 0 O-C-N 121.088 -1.008 . . . . 0.0 110.472 -179.571 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' B' B ' 147' ' ' ARG . . . . . 0.426 ' HD3' ' HA ' ' A' ' 89' ' ' SER . 0.0 OUTLIER 54.57 83.07 0.08 Allowed 'General case' 0 N--CA 1.505 2.278 0 O-C-N 121.519 -0.738 . . . . 0.0 110.824 -179.927 . . . . . . . . 3 3 . 1 . 019 nuclear orig full ' B' B ' 148' ' ' ILE . . . . . 0.41 ' HA ' HD11 ' B' ' 148' ' ' ILE . 36.7 mm -111.91 110.21 31.38 Favored 'Isoleucine or valine' 0 N--CA 1.495 1.823 0 O-C-N 121.294 -0.879 . . . . 0.0 110.426 -179.879 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' B' B ' 149' ' ' SER . . . . . . . . . . . . . 89.0 p -96.99 158.9 15.2 Favored 'General case' 0 N--CA 1.496 1.839 0 O-C-N 121.383 -0.823 . . . . 0.0 110.391 179.696 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' B' B ' 150' ' ' ALA . . . . . . . . . . . . . . . -58.85 -50.09 75.28 Favored 'General case' 0 N--CA 1.498 1.974 0 O-C-N 121.482 -0.761 . . . . 0.0 111.104 -179.652 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' B' B ' 151' ' ' ASP . . . . . . . . . . . . . 7.2 p-10 -60.62 -35.75 76.92 Favored 'General case' 0 N--CA 1.502 2.137 0 O-C-N 121.371 -0.83 . . . . 0.0 111.252 -179.804 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' B' B ' 152' ' ' ALA . . . . . . . . . . . . . . . -74.36 -38.82 63.1 Favored 'General case' 0 N--CA 1.496 1.825 0 O-C-N 121.131 -0.981 . . . . 0.0 110.252 179.645 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' B' B ' 153' ' ' MET . . . . . 0.407 ' HG2' HG22 ' B' ' 148' ' ' ILE . 0.4 OUTLIER -64.66 -47.97 76.49 Favored 'General case' 0 N--CA 1.498 1.962 0 O-C-N 121.41 -0.806 . . . . 0.0 110.608 179.973 . . . . . . . . 3 3 . 1 . 019 nuclear orig full ' B' B ' 154' ' ' MET . . . . . 0.414 ' HG3' ' N ' ' B' ' 155' ' ' GLN . 17.2 ptp -63.84 -30.25 71.36 Favored 'General case' 0 N--CA 1.5 2.04 0 O-C-N 121.167 -0.958 . . . . 0.0 110.298 179.57 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' B' B ' 155' ' ' GLN . . . . . 0.414 ' N ' ' HG3' ' B' ' 154' ' ' MET . 0.2 OUTLIER -65.54 -35.79 81.88 Favored 'General case' 0 N--CA 1.498 1.961 0 O-C-N 121.327 -0.858 . . . . 0.0 110.201 179.074 . . . . . . . . 3 3 . 1 . 019 nuclear orig full ' B' B ' 156' ' ' ALA . . . . . . . . . . . . . . . -87.28 -43.77 11.92 Favored 'General case' 0 N--CA 1.495 1.799 0 O-C-N 121.431 -0.793 . . . . 0.0 110.143 179.719 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' B' B ' 157' ' ' LEU . . . . . 0.568 HD22 ' HA ' ' A' ' 27' ' ' PHE . 0.9 OUTLIER -64.67 -48.65 73.96 Favored 'General case' 0 N--CA 1.498 1.972 0 O-C-N 121.614 -0.679 . . . . 0.0 110.481 179.969 . . . . . . . . 3 3 . 1 . 019 nuclear orig full ' B' B ' 158' ' ' LEU . . . . . . . . . . . . . 6.3 mt -101.28 27.16 6.4 Favored 'General case' 0 N--CA 1.498 1.947 0 O-C-N 121.161 -0.962 . . . . 0.0 110.856 -179.988 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' B' B ' 159' ' ' GLY . . . . . . . . . . . . . . . -122.75 -49.14 0.24 Allowed Glycine 0 N--CA 1.497 2.748 0 N-CA-C 109.205 -1.558 . . . . 0.0 109.205 179.293 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' B' B ' 160' ' ' ALA . . . . . . . . . . . . . . . -85.18 -43.23 14.01 Favored 'General case' 0 N--CA 1.497 1.88 0 O-C-N 121.418 -1.048 . . . . 0.0 109.808 179.258 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' B' B ' 161' ' ' ARG . . . . . . . . . . . . . 0.9 OUTLIER -78.31 -54.12 6.55 Favored 'General case' 0 N--CA 1.497 1.889 0 O-C-N 121.289 -0.882 . . . . 0.0 109.631 179.349 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' B' B ' 162' ' ' ALA . . . . . . . . . . . . . . . -97.87 133.29 42.56 Favored 'General case' 0 N--CA 1.494 1.762 0 O-C-N 121.402 -0.811 . . . . 0.0 109.62 179.242 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' B' B ' 163' ' ' LYS . . . . . 0.429 ' HE2' ' HA ' ' B' ' 163' ' ' LYS . 0.0 OUTLIER . . . . . 0 N--CA 1.495 1.812 0 CA-C-O 117.763 -1.113 . . . . 0.0 110.725 -179.921 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 90' ' ' ' CA' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 019 nuclear orig full ' A' A ' 91' ' ' SXK . . . . . 0.517 ' HAI' ' SD ' ' A' ' 80' ' ' MET . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 9.9 tpt . . . . . 0 N--CA 1.496 1.849 0 CA-C-O 120.987 0.422 . . . . 0.0 110.279 . . . . . . . . . 0 0 . 1 . 020 nuclear orig full ' A' A ' 2' ' ' ASP . . . . . . . . . . . . . 1.6 p30 -157.71 168.31 27.59 Favored 'General case' 0 N--CA 1.498 1.969 0 O-C-N 121.463 -0.773 . . . . 0.0 110.574 -179.743 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 3' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER -111.52 95.61 5.61 Favored 'General case' 0 N--CA 1.498 1.946 0 O-C-N 121.315 -0.866 . . . . 0.0 110.798 -179.823 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 4' ' ' ILE . . . . . . . . . . . . . 1.8 pp -82.27 -28.75 9.17 Favored 'Isoleucine or valine' 0 N--CA 1.499 2.009 0 O-C-N 121.272 -0.892 . . . . 0.0 110.626 179.674 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 5' ' ' TYR . . . . . 0.4 ' CE1' ' HG2' ' A' ' 83' ' ' ARG . 16.5 m-85 -72.07 -42.55 66.08 Favored 'General case' 0 N--CA 1.496 1.872 0 O-C-N 121.252 -0.905 . . . . 0.0 109.767 179.407 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -66.5 -44.13 83.44 Favored 'General case' 0 N--CA 1.495 1.791 0 O-C-N 121.541 -0.724 . . . . 0.0 109.771 179.121 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 7' ' ' ALA . . . . . . . . . . . . . . . -52.42 -41.26 63.06 Favored 'General case' 0 N--CA 1.498 1.973 0 O-C-N 121.464 -0.773 . . . . 0.0 109.936 179.12 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 8' ' ' ALA . . . . . . . . . . . . . . . -60.12 -33.07 71.63 Favored 'General case' 0 N--CA 1.498 1.948 0 O-C-N 121.515 -0.741 . . . . 0.0 110.633 179.203 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 9' ' ' VAL . . . . . . . . . . . . . 84.5 t -84.61 -37.46 12.64 Favored 'Isoleucine or valine' 0 N--CA 1.498 1.958 0 O-C-N 121.459 -0.776 . . . . 0.0 110.566 179.996 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 10' ' ' GLU . . . . . . . . . . . . . 0.5 OUTLIER -67.98 -26.31 65.86 Favored 'General case' 0 N--CA 1.499 2.022 0 O-C-N 121.431 -0.793 . . . . 0.0 112.447 -178.73 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 11' ' ' GLN . . . . . . . . . . . . . 0.8 OUTLIER -134.13 65.82 1.56 Allowed 'General case' 0 N--CA 1.498 1.974 0 O-C-N 120.638 -1.289 . . . . 0.0 112.18 -179.346 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 12' ' ' LEU . . . . . 0.529 HD13 ' HB2' ' A' ' 17' ' ' LYS . 4.4 pp -110.41 160.17 16.82 Favored 'General case' 0 N--CA 1.499 2.01 0 O-C-N 121.236 -0.915 . . . . 0.0 109.317 177.854 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 13' ' ' THR . . . . . . . . . . . . . 60.5 p -73.91 157.05 36.97 Favored 'General case' 0 N--CA 1.505 2.276 0 O-C-N 121.084 -1.01 . . . . 0.0 111.456 -178.627 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 14' ' ' GLU . . . . . . . . . . . . . 3.0 tp10 -53.18 -34.82 58.59 Favored 'General case' 0 N--CA 1.495 1.801 0 O-C-N 121.828 -0.545 . . . . 0.0 110.338 179.848 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 1.2 mp0 -63.29 -43.88 96.64 Favored 'General case' 0 N--CA 1.496 1.829 0 O-C-N 121.601 -0.687 . . . . 0.0 109.59 179.389 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 16' ' ' GLN . . . . . . . . . . . . . 0.1 OUTLIER -58.52 -37.88 76.56 Favored 'General case' 0 N--CA 1.498 1.931 0 CA-C-O 121.587 0.708 . . . . 0.0 110.144 179.269 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 17' ' ' LYS . . . . . 0.529 ' HB2' HD13 ' A' ' 12' ' ' LEU . 1.3 ttpt -77.8 -33.72 52.41 Favored 'General case' 0 N--CA 1.493 1.709 0 O-C-N 121.5 -0.75 . . . . 0.0 109.986 179.173 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 18' ' ' ASN . . . . . . . . . . . . . 52.5 m-20 -68.42 -46.31 70.25 Favored 'General case' 0 N--CA 1.498 1.973 0 O-C-N 121.417 -0.802 . . . . 0.0 110.847 179.92 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 12.6 pt-20 -60.61 -35.84 77.12 Favored 'General case' 0 N--CA 1.502 2.131 0 O-C-N 121.173 -0.954 . . . . 0.0 110.121 179.856 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 20' ' ' PHE . . . . . . . . . . . . . 18.4 m-30 -77.12 -32.18 56.28 Favored 'General case' 0 N--CA 1.496 1.847 0 O-C-N 121.317 -0.864 . . . . 0.0 109.927 178.923 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 21' ' ' LYS . . . . . . . . . . . . . 2.9 tptp -60.97 -46.95 88.67 Favored 'General case' 0 N--CA 1.498 1.956 0 O-C-N 121.484 -0.76 . . . . 0.0 109.649 178.961 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 22' ' ' ALA . . . . . . . . . . . . . . . -61.73 -50.23 73.24 Favored 'General case' 0 N--CA 1.499 1.989 0 O-C-N 121.395 -0.816 . . . . 0.0 109.869 179.324 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 23' ' ' ALA . . . . . . . . . . . . . . . -59.04 -40.44 85.05 Favored 'General case' 0 N--CA 1.498 1.929 0 O-C-N 121.557 -0.715 . . . . 0.0 109.647 178.94 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 24' ' ' PHE . . . . . . . . . . . . . 73.9 t80 -64.55 -43.8 92.78 Favored 'General case' 0 N--CA 1.498 1.946 0 O-C-N 121.788 -0.57 . . . . 0.0 109.89 179.212 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 25' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER -56.6 -45.47 81.42 Favored 'General case' 0 N--CA 1.499 2.013 0 O-C-N 121.475 -0.766 . . . . 0.0 110.496 179.573 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 26' ' ' ILE . . . . . 0.433 ' HB ' HD13 ' B' ' 157' ' ' LEU . 6.6 mt -70.56 -31.75 47.41 Favored 'Isoleucine or valine' 0 N--CA 1.498 1.966 0 O-C-N 121.168 -0.957 . . . . 0.0 109.518 179.143 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 27' ' ' PHE . . . . . . . . . . . . . 0.2 OUTLIER -74.46 -22.5 59.08 Favored 'General case' 0 N--CA 1.496 1.845 0 O-C-N 121.102 -0.999 . . . . 0.0 110.774 179.186 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 28' ' ' VAL . . . . . 0.421 HG11 HG13 ' A' ' 36' ' ' ILE . 10.6 m -107.36 10.6 9.13 Favored 'Isoleucine or valine' 0 N--CA 1.501 2.076 0 O-C-N 121.153 -0.967 . . . . 0.0 111.902 -179.354 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 29' ' ' LEU . . . . . . . . . . . . . 4.6 pp -57.13 136.85 56.4 Favored 'General case' 0 N--CA 1.504 2.242 0 O-C-N 120.77 -1.206 . . . . 0.0 109.398 179.379 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 30' ' ' GLY . . . . . . . . . . . . . . . 90.39 -49.6 3.22 Favored Glycine 0 N--CA 1.495 2.628 0 N-CA-C 108.093 -2.003 . . . . 0.0 108.093 -177.838 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 31' ' ' ALA . . . . . . . . . . . . . . . -88.42 67.48 8.61 Favored 'General case' 0 N--CA 1.491 1.616 0 O-C-N 121.617 -0.931 . . . . 0.0 108.727 178.481 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 32' ' ' GLU . . . . . . . . . . . . . 1.3 mp0 -61.71 -10.87 9.69 Favored 'General case' 0 N--CA 1.501 2.122 0 O-C-N 121.565 -0.71 . . . . 0.0 112.146 -178.898 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 15.7 t70 -52.8 -35.39 56.76 Favored 'General case' 0 N--CA 1.501 2.09 0 O-C-N 121.148 -0.97 . . . . 0.0 110.516 179.484 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 34' ' ' GLY . . . . . . . . . . . . . . . 107.53 34.16 2.94 Favored Glycine 0 N--CA 1.497 2.746 0 N-CA-C 110.267 -1.133 . . . . 0.0 110.267 179.521 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 35' ' ' CYS . . . . . . . . . . . . . 28.3 p -144.36 156.8 44.4 Favored 'General case' 0 N--CA 1.495 1.79 0 O-C-N 121.275 -1.132 . . . . 0.0 110.203 179.697 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 36' ' ' ILE . . . . . 0.421 HG13 HG11 ' A' ' 28' ' ' VAL . 17.9 mt -121.42 118.59 56.46 Favored 'Isoleucine or valine' 0 N--CA 1.494 1.752 0 O-C-N 121.383 -0.823 . . . . 0.0 109.987 -179.965 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 37' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -101.07 163.19 12.4 Favored 'General case' 0 N--CA 1.493 1.72 0 O-C-N 121.558 -0.714 . . . . 0.0 109.637 179.167 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 38' ' ' THR . . . . . 0.428 ' CG2' ' HA ' ' A' ' 58' ' ' GLN . 77.7 p -64.27 -32.76 74.47 Favored 'General case' 0 N--CA 1.5 2.045 0 O-C-N 121.31 -0.869 . . . . 0.0 110.595 -179.829 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 39' ' ' LYS . . . . . 0.47 ' HA ' ' CB ' ' A' ' 54' ' ' PRO . 11.6 mttp -60.88 -34.33 74.46 Favored 'General case' 0 N--CA 1.496 1.864 0 O-C-N 121.518 -0.739 . . . . 0.0 109.465 178.777 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 1.2 mp0 -83.42 -30.55 27.23 Favored 'General case' 0 N--CA 1.497 1.921 0 O-C-N 121.485 -0.76 . . . . 0.0 109.604 178.471 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 41' ' ' LEU . . . . . 0.552 HD23 ' HB3' ' A' ' 57' ' ' LEU . 6.4 tp -62.46 -39.83 94.67 Favored 'General case' 0 N--CA 1.497 1.877 0 O-C-N 121.412 -0.805 . . . . 0.0 110.412 179.574 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 42' ' ' GLY . . . . . 0.508 ' HA2' ' HB2' ' A' ' 45' ' ' MET . . . -53.92 -36.18 55.17 Favored Glycine 0 N--CA 1.495 2.616 0 N-CA-C 110.831 -0.908 . . . . 0.0 110.831 -179.049 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 43' ' ' LYS . . . . . . . . . . . . . 1.6 mtmt -55.21 -34.13 63.65 Favored 'General case' 0 N--CA 1.502 2.145 0 O-C-N 121.381 -1.07 . . . . 0.0 110.561 179.711 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 44' ' ' VAL . . . . . . . . . . . . . 42.1 t -93.07 -36.72 7.74 Favored 'Isoleucine or valine' 0 N--CA 1.498 1.936 0 O-C-N 121.334 -0.854 . . . . 0.0 109.6 178.921 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 45' ' ' MET . . . . . 0.508 ' HB2' ' HA2' ' A' ' 42' ' ' GLY . 0.3 OUTLIER -58.29 -38.08 76.3 Favored 'General case' 0 N--CA 1.5 2.036 0 O-C-N 121.47 -0.769 . . . . 0.0 110.777 179.646 . . . . . . . . 3 3 . 1 . 020 nuclear orig full ' A' A ' 46' ' ' ARG . . . . . 0.461 ' HA ' ' C ' ' A' ' 50' ' ' GLN . 16.6 ptt180 -63.44 -23.68 67.5 Favored 'General case' 0 N--CA 1.499 2.012 0 O-C-N 121.304 -0.872 . . . . 0.0 110.911 179.97 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 47' ' ' MET . . . . . . . . . . . . . 7.1 ttp -82.14 1.18 37.41 Favored 'General case' 0 N--CA 1.495 1.798 0 O-C-N 121.397 -0.815 . . . . 0.0 110.731 179.389 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 48' ' ' LEU . . . . . . . . . . . . . 45.1 mt -131.16 -50.7 1.02 Allowed 'General case' 0 N--CA 1.496 1.83 0 O-C-N 121.078 -1.014 . . . . 0.0 111.052 -179.82 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 49' ' ' GLY . . . . . 0.512 ' O ' ' HB2' ' A' ' 50' ' ' GLN . . . -125.52 38.04 2.37 Favored Glycine 0 N--CA 1.498 2.772 0 C-N-CA 119.866 -1.159 . . . . 0.0 110.987 -179.14 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 50' ' ' GLN . . . . . 0.512 ' HB2' ' O ' ' A' ' 49' ' ' GLY . 10.9 mt-30 67.12 -50.06 0.48 Allowed 'General case' 0 N--CA 1.512 2.636 0 CA-C-N 117.913 0.857 . . . . 0.0 112.498 179.122 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 51' ' ' ASN . . . . . 0.456 ' HB3' ' O ' ' A' ' 50' ' ' GLN . 8.3 t30 64.94 101.24 0.04 OUTLIER Pre-proline 0 N--CA 1.504 2.258 0 O-C-N 121.414 -0.804 . . . . 0.0 110.542 -179.185 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 52' ' ' PRO . . . . . . . . . . . . . 44.3 Cg_endo -74.64 -52.87 0.11 Allowed 'Trans proline' 0 C--N 1.312 -1.352 0 O-C-N 123.938 1.494 . . . . 0.0 111.464 -179.642 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 53' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -149.31 153.04 36.96 Favored Pre-proline 0 N--CA 1.5 2.048 0 O-C-N 121.131 -0.981 . . . . 0.0 111.073 -179.63 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 54' ' ' PRO . . . . . 0.47 ' CB ' ' HA ' ' A' ' 39' ' ' LYS . 46.4 Cg_endo -71.75 -36.28 6.55 Favored 'Trans proline' 0 C--N 1.313 -1.331 0 O-C-N 124.205 1.634 . . . . 0.0 110.69 179.563 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 55' ' ' GLU . . . . . 0.452 ' O ' ' HB3' ' A' ' 58' ' ' GLN . 0.7 OUTLIER -65.11 -27.78 68.98 Favored 'General case' 0 N--CA 1.5 2.063 0 O-C-N 121.338 -0.851 . . . . 0.0 110.959 179.931 . . . . . . . . 3 3 . 1 . 020 nuclear orig full ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 24.0 tt0 -66.8 -30.12 70.24 Favored 'General case' 0 N--CA 1.498 1.93 0 O-C-N 121.119 -0.988 . . . . 0.0 110.275 179.28 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 57' ' ' LEU . . . . . 0.552 ' HB3' HD23 ' A' ' 41' ' ' LEU . 29.7 mt -80.31 -9.54 59.74 Favored 'General case' 0 N--CA 1.496 1.843 0 O-C-N 121.253 -0.904 . . . . 0.0 111.414 -179.889 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 58' ' ' GLN . . . . . 0.452 ' HB3' ' O ' ' A' ' 55' ' ' GLU . 0.0 OUTLIER -56.74 -42.11 78.69 Favored 'General case' 0 N--CA 1.5 2.052 0 O-C-N 121.032 -1.042 . . . . 0.0 110.142 -179.819 . . . . . . . . 3 3 . 1 . 020 nuclear orig full ' A' A ' 59' ' ' GLU . . . . . . . . . . . . . 7.8 tt0 -59.2 -35.94 74.49 Favored 'General case' 0 N--CA 1.498 1.963 0 O-C-N 121.37 -0.831 . . . . 0.0 110.035 179.175 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 60' ' ' MET . . . . . . . . . . . . . 2.5 tpp -59.18 -46.2 89.04 Favored 'General case' 0 N--CA 1.498 1.95 0 O-C-N 121.584 -0.698 . . . . 0.0 109.989 179.304 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 61' ' ' ILE . . . . . 0.41 HG12 ' CG2' ' A' ' 72' ' ' VAL . 1.9 mt -72.65 -41.1 62.81 Favored 'Isoleucine or valine' 0 N--CA 1.497 1.884 0 O-C-N 121.352 -0.843 . . . . 0.0 109.716 179.276 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 62' ' ' ASP . . . . . . . . . . . . . 75.1 m-20 -53.62 -31.11 45.83 Favored 'General case' 0 N--CA 1.501 2.098 0 O-C-N 121.476 -0.765 . . . . 0.0 110.956 179.566 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 63' ' ' GLU . . . . . . . . . . . . . 0.3 OUTLIER -68.27 -25.54 65.22 Favored 'General case' 0 N--CA 1.5 2.028 0 O-C-N 121.359 -0.838 . . . . 0.0 111.254 179.958 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 64' ' ' VAL . . . . . . . . . . . . . 20.1 t -121.76 6.34 5.89 Favored 'Isoleucine or valine' 0 N--CA 1.501 2.098 0 O-C-N 121.162 -0.962 . . . . 0.0 111.436 -179.328 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 65' ' ' ASP . . . . . . . . . . . . . 5.6 t70 -98.35 73.94 2.16 Favored 'General case' 0 N--CA 1.496 1.833 0 O-C-N 120.706 -1.246 . . . . 0.0 110.459 179.87 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 66' ' ' GLU . . . . . . . . . . . . . 4.6 mp0 -88.56 55.91 3.58 Favored 'General case' 0 N--CA 1.496 1.832 0 O-C-N 121.239 -0.913 . . . . 0.0 108.978 179.23 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 67' ' ' ASP . . . . . . . . . . . . . 2.1 t70 -126.58 -59.33 1.29 Allowed 'General case' 0 N--CA 1.493 1.71 0 O-C-N 121.6 -0.688 . . . . 0.0 110.944 -178.759 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 68' ' ' GLY . . . . . . . . . . . . . . . 143.09 -40.18 1.26 Allowed Glycine 0 N--CA 1.494 2.518 0 N-CA-C 109.715 -1.354 . . . . 0.0 109.715 -179.434 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 69' ' ' SER . . . . . . . . . . . . . 59.6 p -63.89 -29.0 70.22 Favored 'General case' 0 N--CA 1.5 2.031 0 O-C-N 121.404 -1.057 . . . . 0.0 111.206 -179.9 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 70' ' ' GLY . . . . . . . . . . . . . . . 86.72 -12.91 60.14 Favored Glycine 0 N--CA 1.497 2.717 0 C-N-CA 119.875 -1.155 . . . . 0.0 110.569 -179.806 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 71' ' ' THR . . . . . . . . . . . . . 3.5 m -101.09 138.0 38.71 Favored 'General case' 0 N--CA 1.497 1.91 0 O-C-N 121.028 -1.278 . . . . 0.0 109.681 179.694 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 72' ' ' VAL . . . . . 0.41 ' CG2' HG12 ' A' ' 61' ' ' ILE . 8.1 t -82.36 125.63 39.88 Favored 'Isoleucine or valine' 0 N--CA 1.496 1.861 0 O-C-N 121.704 -0.622 . . . . 0.0 110.793 -179.634 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 73' ' ' ASP . . . . . . . . . . . . . 0.8 OUTLIER -99.75 -163.17 1.01 Allowed 'General case' 0 N--CA 1.494 1.757 0 O-C-N 121.41 -0.806 . . . . 0.0 109.564 179.206 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 74' ' ' PHE . . . . . . . . . . . . . 65.4 t80 -63.16 -45.78 90.23 Favored 'General case' 0 N--CA 1.5 2.039 0 O-C-N 121.161 -0.962 . . . . 0.0 110.361 179.827 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 75' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -62.22 -51.72 66.65 Favored 'General case' 0 N--CA 1.499 1.979 0 O-C-N 121.373 -0.83 . . . . 0.0 110.616 179.897 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 76' ' ' GLU . . . . . 0.407 ' O ' HG11 ' A' ' 79' ' ' VAL . 55.5 mt-10 -64.88 -23.22 67.17 Favored 'General case' 0 N--CA 1.501 2.076 0 O-C-N 121.326 -0.859 . . . . 0.0 110.085 179.449 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 77' ' ' PHE . . . . . . . . . . . . . 88.4 t80 -79.34 -35.31 41.22 Favored 'General case' 0 N--CA 1.496 1.868 0 O-C-N 121.3 -0.875 . . . . 0.0 109.677 178.872 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 78' ' ' LEU . . . . . . . . . . . . . 65.5 mt -62.41 -50.42 71.58 Favored 'General case' 0 N--CA 1.498 1.944 0 O-C-N 121.412 -0.805 . . . . 0.0 109.984 179.454 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 79' ' ' VAL . . . . . 0.407 HG11 ' O ' ' A' ' 76' ' ' GLU . 7.4 p -62.74 -31.91 53.86 Favored 'Isoleucine or valine' 0 N--CA 1.5 2.065 0 O-C-N 121.369 -0.832 . . . . 0.0 109.797 179.066 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 80' ' ' MET . . . . . . . . . . . . . 5.2 ttp -65.71 -38.94 90.58 Favored 'General case' 0 N--CA 1.496 1.839 0 O-C-N 121.255 -0.903 . . . . 0.0 109.47 178.633 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 81' ' ' MET . . . . . . . . . . . . . 7.6 mmt -62.08 -41.62 98.36 Favored 'General case' 0 N--CA 1.497 1.881 0 O-C-N 121.501 -0.749 . . . . 0.0 110.036 179.261 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 82' ' ' VAL . . . . . . . . . . . . . 30.6 t -61.41 -35.85 69.21 Favored 'Isoleucine or valine' 0 N--CA 1.5 2.04 0 O-C-N 121.245 -0.909 . . . . 0.0 109.21 178.79 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 83' ' ' ARG . . . . . 0.4 ' HG2' ' CE1' ' A' ' 5' ' ' TYR . 8.5 mtt180 -68.18 -26.1 65.57 Favored 'General case' 0 N--CA 1.498 1.938 0 O-C-N 121.422 -0.799 . . . . 0.0 109.761 178.496 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 84' ' ' CYS . . . . . 0.466 ' HB3' ' HA ' ' B' ' 149' ' ' SER . 73.2 m -85.25 11.6 9.69 Favored 'General case' 0 N--CA 1.499 2.009 0 O-C-N 121.364 -0.835 . . . . 0.0 111.097 179.468 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 85' ' ' MET . . . . . . . . . . . . . 2.6 tpp -88.82 8.08 30.86 Favored 'General case' 0 N--CA 1.499 2.008 0 O-C-N 121.043 -1.036 . . . . 0.0 111.071 179.782 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 86' ' ' LYS . . . . . . . . . . . . . 1.0 OUTLIER 70.4 -65.73 0.31 Allowed 'General case' 0 N--CA 1.504 2.272 0 O-C-N 121.558 -0.714 . . . . 0.0 111.72 179.708 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 87' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER -137.6 -159.41 0.95 Allowed 'General case' 0 N--CA 1.5 2.037 0 O-C-N 121.032 -1.043 . . . . 0.0 111.031 -179.348 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 88' ' ' ASP . . . . . . . . . . . . . 8.7 t70 70.32 -69.41 0.18 Allowed 'General case' 0 N--CA 1.504 2.267 0 O-C-N 121.976 -0.453 . . . . 0.0 111.387 179.993 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 89' ' ' SER . . . . . . . . . . . . . 25.4 p . . . . . 0 N--CA 1.499 1.986 0 O-C-N 121.196 -0.94 . . . . 0.0 111.154 -179.75 . . . . . . . . 0 0 . 1 . 020 nuclear orig full ' B' B ' 144' ' ' ARG . . . . . 0.46 ' O ' ' HB3' ' B' ' 145' ' ' ARG . 2.3 tpt85 . . . . . 0 N--CA 1.499 1.991 0 CA-C-O 120.69 0.281 . . . . 0.0 110.4 . . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' B' B ' 145' ' ' ARG . . . . . 0.46 ' HB3' ' O ' ' B' ' 144' ' ' ARG . 3.0 ttt-85 70.09 150.26 0.09 Allowed 'General case' 0 N--CA 1.504 2.262 0 CA-C-O 121.412 0.625 . . . . 0.0 110.686 -179.688 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' B' B ' 146' ' ' VAL . . . . . 0.49 ' O ' ' HB2' ' B' ' 147' ' ' ARG . 22.8 t -91.85 -47.94 13.93 Favored 'Isoleucine or valine' 0 N--CA 1.499 1.996 0 O-C-N 121.448 -0.782 . . . . 0.0 109.951 -179.667 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' B' B ' 147' ' ' ARG . . . . . 0.49 ' HB2' ' O ' ' B' ' 146' ' ' VAL . 33.5 mtm-85 64.85 -82.34 0.03 OUTLIER 'General case' 0 N--CA 1.503 2.216 0 O-C-N 121.995 -0.44 . . . . 0.0 112.088 179.249 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' B' B ' 148' ' ' ILE . . . . . 0.47 ' O ' ' CG2' ' B' ' 148' ' ' ILE . 0.9 OUTLIER 56.62 90.71 0.04 OUTLIER 'Isoleucine or valine' 0 N--CA 1.505 2.28 0 CA-C-O 122.23 1.014 . . . . 0.0 109.158 -178.61 . . . . . . . . 3 3 . 1 . 020 nuclear orig full ' B' B ' 149' ' ' SER . . . . . 0.466 ' HA ' ' HB3' ' A' ' 84' ' ' CYS . 74.0 p -93.69 164.11 13.27 Favored 'General case' 0 N--CA 1.495 1.789 0 O-C-N 121.1 -1.0 . . . . 0.0 111.068 -178.743 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' B' B ' 150' ' ' ALA . . . . . . . . . . . . . . . -65.49 -49.4 69.18 Favored 'General case' 0 N--CA 1.494 1.772 0 O-C-N 121.704 -0.623 . . . . 0.0 110.766 -179.831 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' B' B ' 151' ' ' ASP . . . . . . . . . . . . . 5.7 p-10 -54.95 -38.84 68.24 Favored 'General case' 0 N--CA 1.502 2.17 0 O-C-N 121.539 -0.726 . . . . 0.0 110.885 179.932 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' B' B ' 152' ' ' ALA . . . . . . . . . . . . . . . -74.64 -44.21 51.56 Favored 'General case' 0 N--CA 1.496 1.851 0 O-C-N 121.296 -0.878 . . . . 0.0 110.43 179.678 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' B' B ' 153' ' ' MET . . . . . . . . . . . . . 2.1 mmt -67.67 -31.73 71.91 Favored 'General case' 0 N--CA 1.498 1.962 0 O-C-N 121.267 -0.896 . . . . 0.0 110.65 179.841 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' B' B ' 154' ' ' MET . . . . . . . . . . . . . 4.4 ttm -57.61 -44.0 85.13 Favored 'General case' 0 N--CA 1.5 2.049 0 O-C-N 121.361 -0.837 . . . . 0.0 110.501 179.876 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' B' B ' 155' ' ' GLN . . . . . . . . . . . . . 1.3 tm0? -66.11 -37.19 85.12 Favored 'General case' 0 N--CA 1.5 2.06 0 O-C-N 121.384 -0.822 . . . . 0.0 110.354 179.631 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' B' B ' 156' ' ' ALA . . . . . . . . . . . . . . . -76.74 -34.29 58.09 Favored 'General case' 0 N--CA 1.499 2.022 0 O-C-N 121.478 -0.764 . . . . 0.0 111.178 -179.753 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' B' B ' 157' ' ' LEU . . . . . 0.439 HD12 ' HA ' ' B' ' 157' ' ' LEU . 3.1 mm? -85.22 -49.68 8.0 Favored 'General case' 0 N--CA 1.5 2.044 0 O-C-N 121.186 -0.946 . . . . 0.0 110.522 -179.565 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' B' B ' 158' ' ' LEU . . . . . . . . . . . . . 3.7 mp -95.88 62.68 2.28 Favored 'General case' 0 N--CA 1.496 1.865 0 O-C-N 121.275 -0.89 . . . . 0.0 110.01 179.967 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' B' B ' 159' ' ' GLY . . . . . . . . . . . . . . . -171.9 -159.79 19.0 Favored Glycine 0 N--CA 1.495 2.589 0 N-CA-C 109.71 -1.356 . . . . 0.0 109.71 -179.988 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' B' B ' 160' ' ' ALA . . . . . . . . . . . . . . . 54.25 -91.35 0.03 OUTLIER 'General case' 0 N--CA 1.503 2.221 0 O-C-N 121.782 -0.834 . . . . 0.0 110.984 -179.903 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' B' B ' 161' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -137.21 31.71 2.64 Favored 'General case' 0 N--CA 1.497 1.89 0 O-C-N 121.052 -1.03 . . . . 0.0 110.553 179.741 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' B' B ' 162' ' ' ALA . . . . . . . . . . . . . . . -155.94 159.35 39.18 Favored 'General case' 0 N--CA 1.497 1.917 0 O-C-N 121.183 -0.948 . . . . 0.0 110.776 -179.846 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' B' B ' 163' ' ' LYS . . . . . . . . . . . . . 0.6 OUTLIER . . . . . 0 N--CA 1.497 1.89 0 CA-C-O 118.238 -0.887 . . . . 0.0 110.394 -179.972 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 90' ' ' ' CA' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 020 nuclear orig full ' A' A ' 91' ' ' SXK . . . . . 0.413 ' HAH' ' CE ' ' A' ' 45' ' ' MET . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 4' ' ' ILE . . . . . . . . . . . . . 2.8 mp . . . . . 0 N--CA 1.496 1.87 0 CA-C-O 121.004 0.43 . . . . 0.0 110.05 . . . . . . . . . 0 0 . 1 . 001 nuclear build core ' A' A ' 5' ' ' TYR . . . . . . . . . . . . . 9.6 m-85 -71.04 -37.85 72.56 Favored 'General case' 0 N--CA 1.496 1.863 0 O-C-N 121.226 -0.921 . . . . 0.0 110.585 179.849 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -70.49 -32.09 69.46 Favored 'General case' 0 N--CA 1.498 1.963 0 O-C-N 121.16 -0.962 . . . . 0.0 110.04 179.336 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 7' ' ' ALA . . . . . . . . . . . . . . . -55.6 -41.38 73.34 Favored 'General case' 0 N--CA 1.497 1.92 0 O-C-N 121.384 -0.823 . . . . 0.0 109.254 178.54 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 8' ' ' ALA . . . . . . . . . . . . . . . -69.94 -37.04 75.75 Favored 'General case' 0 N--CA 1.495 1.78 0 O-C-N 121.705 -0.622 . . . . 0.0 109.423 178.487 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 9' ' ' VAL . . . . . 0.679 HG11 ' CG2' ' A' ' 79' ' ' VAL . 53.3 t -60.58 -45.11 97.74 Favored 'Isoleucine or valine' 0 N--CA 1.5 2.048 0 O-C-N 121.637 -0.664 . . . . 0.0 109.806 179.148 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 10' ' ' GLU . . . . . . . . . . . . . 25.3 mt-10 -66.06 -46.25 78.47 Favored 'General case' 0 N--CA 1.498 1.932 0 O-C-N 121.567 -0.708 . . . . 0.0 110.068 179.602 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 11' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -80.71 -84.76 0.1 Allowed 'General case' 0 N--CA 1.488 1.455 0 O-C-N 121.531 -0.731 . . . . 0.0 109.661 179.655 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 12' ' ' LEU . . . . . 0.623 HD12 ' HA ' ' A' ' 9' ' ' VAL . 0.8 OUTLIER 53.23 -159.59 0.14 Allowed 'General case' 0 N--CA 1.501 2.08 0 O-C-N 121.428 -0.795 . . . . 0.0 111.047 179.472 . . . . . . . . 3 3 . 1 . 001 nuclear build core ' A' A ' 13' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -142.96 154.69 44.3 Favored 'General case' 0 N--CA 1.495 1.824 0 O-C-N 121.301 -0.874 . . . . 0.0 109.913 179.813 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 14' ' ' GLU . . . . . . . . . . . . . 0.7 OUTLIER -54.15 -39.82 66.88 Favored 'General case' 0 N--CA 1.491 1.6 0 O-C-N 121.696 -0.627 . . . . 0.0 111.015 -179.58 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 1.4 mp0 -55.56 -45.4 77.28 Favored 'General case' 0 N--CA 1.498 1.943 0 O-C-N 121.475 -0.766 . . . . 0.0 110.629 179.742 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 16' ' ' GLN . . . . . . . . . . . . . 69.0 mt-30 -86.01 -33.19 21.12 Favored 'General case' 0 N--CA 1.499 1.991 0 O-C-N 121.344 -0.848 . . . . 0.0 110.983 179.929 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 17' ' ' LYS . . . . . . . . . . . . . 0.4 OUTLIER -65.03 -52.88 53.46 Favored 'General case' 0 N--CA 1.5 2.063 0 O-C-N 121.596 -0.69 . . . . 0.0 110.035 -179.963 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 18' ' ' ASN . . . . . . . . . . . . . 1.3 t-20 -62.37 -32.22 72.99 Favored 'General case' 0 N--CA 1.497 1.902 0 O-C-N 121.545 -0.722 . . . . 0.0 109.462 178.9 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 0.7 OUTLIER -61.37 -45.07 95.91 Favored 'General case' 0 N--CA 1.495 1.817 0 O-C-N 121.558 -0.714 . . . . 0.0 109.687 178.966 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 20' ' ' PHE . . . . . . . . . . . . . 13.4 m-85 -62.77 -35.92 81.37 Favored 'General case' 0 N--CA 1.498 1.974 0 O-C-N 121.409 -0.807 . . . . 0.0 109.438 178.873 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 21' ' ' LYS . . . . . . . . . . . . . 9.5 tptp -64.76 -46.22 83.08 Favored 'General case' 0 N--CA 1.498 1.938 0 O-C-N 121.516 -0.74 . . . . 0.0 109.389 178.602 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 22' ' ' ALA . . . . . . . . . . . . . . . -66.8 -31.15 71.59 Favored 'General case' 0 N--CA 1.498 1.949 0 O-C-N 121.599 -0.688 . . . . 0.0 110.202 179.085 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 23' ' ' ALA . . . . . . . . . . . . . . . -87.17 -7.97 57.41 Favored 'General case' 0 N--CA 1.497 1.899 0 O-C-N 121.231 -0.918 . . . . 0.0 110.806 179.448 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 24' ' ' PHE . . . . . 0.414 ' O ' HG12 ' A' ' 28' ' ' VAL . 93.1 t80 -87.6 -49.89 6.87 Favored 'General case' 0 N--CA 1.498 1.937 0 O-C-N 121.236 -0.915 . . . . 0.0 111.631 -179.265 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 25' ' ' ASP . . . . . . . . . . . . . 5.4 p-10 -58.05 -38.45 76.3 Favored 'General case' 0 N--CA 1.503 2.22 0 O-C-N 121.086 -1.009 . . . . 0.0 111.535 -178.817 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 26' ' ' ILE . . . . . 0.438 ' CG2' HD11 ' B' ' 157' ' ' LEU . 34.2 mt -65.84 -35.54 75.38 Favored 'Isoleucine or valine' 0 N--CA 1.5 2.055 0 O-C-N 120.854 -1.154 . . . . 0.0 109.386 178.918 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 27' ' ' PHE . . . . . 0.705 ' CE1' HG21 ' A' ' 44' ' ' VAL . 0.2 OUTLIER -66.13 -48.48 70.7 Favored 'General case' 0 N--CA 1.497 1.912 0 O-C-N 121.346 -0.846 . . . . 0.0 109.292 178.843 . . . . . . . . 3 3 . 1 . 001 nuclear build core ' A' A ' 28' ' ' VAL . . . . . 1.033 HG23 ' HB3' ' A' ' 31' ' ' ALA . 2.2 p -112.18 95.75 4.1 Favored 'Isoleucine or valine' 0 N--CA 1.497 1.882 0 O-C-N 121.678 -0.638 . . . . 0.0 109.658 178.986 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 29' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -96.18 -39.56 9.63 Favored 'General case' 0 N--CA 1.5 2.06 0 O-C-N 121.371 -0.83 . . . . 0.0 109.879 -179.898 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 30' ' ' GLY . . . . . . . . . . . . . . . -135.32 55.86 0.72 Allowed Glycine 0 N--CA 1.494 2.559 0 N-CA-C 109.121 -1.591 . . . . 0.0 109.121 179.615 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 31' ' ' ALA . . . . . 1.033 ' HB3' HG23 ' A' ' 28' ' ' VAL . . . . . . . . 0 N--CA 1.492 1.642 0 O-C-N 121.479 -1.012 . . . . 0.0 110.43 -179.712 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 35' ' ' CYS . . . . . 0.707 ' N ' HG21 ' A' ' 28' ' ' VAL . 84.0 m . . . . . 0 N--CA 1.492 1.644 0 N-CA-C 109.612 -0.514 . . . . 0.0 109.612 . . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 36' ' ' ILE . . . . . 0.557 HG12 ' HB3' ' A' ' 27' ' ' PHE . 87.2 mt -59.2 113.89 0.8 Allowed 'Isoleucine or valine' 0 N--CA 1.498 1.974 0 O-C-N 121.369 -0.832 . . . . 0.0 110.133 -179.724 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 37' ' ' SER . . . . . . . . . . . . . 0.2 OUTLIER -107.47 -172.96 2.17 Favored 'General case' 0 N--CA 1.496 1.854 0 O-C-N 121.581 -0.699 . . . . 0.0 110.373 -179.684 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 38' ' ' THR . . . . . . . . . . . . . 17.6 p -59.23 -42.63 91.49 Favored 'General case' 0 N--CA 1.504 2.228 0 O-C-N 121.338 -0.851 . . . . 0.0 110.831 -179.861 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 39' ' ' LYS . . . . . . . . . . . . . 4.1 ttmt -64.54 -41.44 96.34 Favored 'General case' 0 N--CA 1.5 2.056 0 O-C-N 121.454 -0.779 . . . . 0.0 111.298 -179.602 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 40' ' ' GLU . . . . . 0.547 ' CG ' ' HB2' ' A' ' 31' ' ' ALA . 8.8 mm-40 -67.31 -46.0 74.82 Favored 'General case' 0 N--CA 1.499 2.025 0 O-C-N 121.257 -0.902 . . . . 0.0 109.925 -179.85 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 41' ' ' LEU . . . . . 0.569 ' O ' HD12 ' A' ' 41' ' ' LEU . 3.9 tp -63.58 -40.33 96.69 Favored 'General case' 0 N--CA 1.496 1.838 0 O-C-N 121.344 -0.848 . . . . 0.0 109.561 179.0 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 42' ' ' GLY . . . . . . . . . . . . . . . -60.5 -31.57 74.97 Favored Glycine 0 N--CA 1.494 2.524 0 N-CA-C 110.144 -1.182 . . . . 0.0 110.144 179.576 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 43' ' ' LYS . . . . . . . . . . . . . 0.5 OUTLIER -58.59 -47.97 82.51 Favored 'General case' 0 N--CA 1.5 2.038 0 O-C-N 121.272 -1.134 . . . . 0.0 109.563 179.219 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 44' ' ' VAL . . . . . 0.705 HG21 ' CE1' ' A' ' 27' ' ' PHE . 86.9 t -71.5 -29.78 36.42 Favored 'Isoleucine or valine' 0 N--CA 1.498 1.961 0 O-C-N 121.511 -0.743 . . . . 0.0 109.847 178.889 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 45' ' ' MET . . . . . . . . . . . . . 5.6 mmt -58.9 -39.04 80.31 Favored 'General case' 0 N--CA 1.501 2.079 0 O-C-N 121.344 -0.848 . . . . 0.0 109.861 179.147 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 46' ' ' ARG . . . . . . . . . . . . . 1.6 ttp180 -64.32 -32.41 74.01 Favored 'General case' 0 N--CA 1.496 1.875 0 O-C-N 121.624 -0.673 . . . . 0.0 110.434 179.408 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 47' ' ' MET . . . . . . . . . . . . . 12.0 mmm -61.24 -37.83 84.47 Favored 'General case' 0 N--CA 1.502 2.165 0 O-C-N 121.392 -0.818 . . . . 0.0 110.102 179.524 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 48' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -68.17 -37.98 81.56 Favored 'General case' 0 N--CA 1.497 1.904 0 O-C-N 121.413 -0.805 . . . . 0.0 110.186 179.537 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 49' ' ' GLY . . . . . . . . . . . . . . . 130.77 11.1 2.42 Favored Glycine 0 N--CA 1.497 2.716 0 C-N-CA 120.506 -0.854 . . . . 0.0 111.18 179.537 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 50' ' ' GLN . . . . . . . . . . . . . 0.1 OUTLIER -127.78 138.01 52.6 Favored 'General case' 0 N--CA 1.495 1.789 0 O-C-N 120.887 -1.361 . . . . 0.0 110.524 179.934 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 51' ' ' ASN . . . . . . . . . . . . . 1.4 m120 -122.18 80.32 44.07 Favored Pre-proline 0 N--CA 1.495 1.787 0 O-C-N 121.551 -0.718 . . . . 0.0 109.721 179.713 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 52' ' ' PRO . . . . . . . . . . . . . 49.8 Cg_endo -78.03 168.18 22.39 Favored 'Trans proline' 0 C--N 1.316 -1.136 0 O-C-N 123.885 1.466 . . . . 0.0 111.078 -179.292 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 53' ' ' THR . . . . . 0.561 ' HB ' ' HD2' ' A' ' 54' ' ' PRO . 41.3 p -76.56 168.81 24.8 Favored Pre-proline 0 N--CA 1.498 1.951 0 O-C-N 121.473 -0.767 . . . . 0.0 109.694 179.411 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 54' ' ' PRO . . . . . 0.561 ' HD2' ' HB ' ' A' ' 53' ' ' THR . 40.8 Cg_endo -64.83 -25.62 60.33 Favored 'Trans proline' 0 N--CA 1.491 1.338 0 O-C-N 123.45 1.237 . . . . 0.0 110.888 -179.984 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 55' ' ' GLU . . . . . . . . . . . . . 0.6 OUTLIER -64.79 -39.49 93.68 Favored 'General case' 0 N--CA 1.498 1.962 0 O-C-N 121.437 -0.789 . . . . 0.0 109.974 179.091 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 56' ' ' GLU . . . . . 0.45 ' O ' ' HE3' ' A' ' 60' ' ' MET . 0.6 OUTLIER -54.22 -46.48 72.51 Favored 'General case' 0 N--CA 1.499 1.988 0 O-C-N 121.634 -0.666 . . . . 0.0 109.985 179.526 . . . . . . . . 3 3 . 1 . 001 nuclear build core ' A' A ' 57' ' ' LEU . . . . . 0.62 ' H ' HD22 ' A' ' 57' ' ' LEU . 0.7 OUTLIER -77.83 -28.01 50.1 Favored 'General case' 0 N--CA 1.492 1.673 0 O-C-N 121.334 -0.854 . . . . 0.0 110.245 179.545 . . . . . . . . 3 3 . 1 . 001 nuclear build core ' A' A ' 58' ' ' GLN . . . . . 0.594 ' HG3' ' N ' ' A' ' 59' ' ' GLU . 0.0 OUTLIER -59.76 -34.2 72.68 Favored 'General case' 0 N--CA 1.497 1.884 0 O-C-N 121.08 -1.012 . . . . 0.0 109.077 179.054 . . . . . . . . 3 3 . 1 . 001 nuclear build core ' A' A ' 59' ' ' GLU . . . . . 0.594 ' N ' ' HG3' ' A' ' 58' ' ' GLN . 0.5 OUTLIER -69.63 -37.05 76.65 Favored 'General case' 0 N--CA 1.494 1.763 0 N-CA-C 108.505 -0.924 . . . . 0.0 108.505 177.781 . . . . . . . . 3 3 . 1 . 001 nuclear build core ' A' A ' 60' ' ' MET . . . . . 0.45 ' HE3' ' O ' ' A' ' 56' ' ' GLU . 4.1 mtm -63.1 -44.62 95.16 Favored 'General case' 0 N--CA 1.496 1.867 0 O-C-N 121.809 -0.557 . . . . 0.0 109.835 178.602 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 61' ' ' ILE . . . . . 0.59 HG13 HG23 ' A' ' 72' ' ' VAL . 0.2 OUTLIER -66.93 -33.6 64.45 Favored 'Isoleucine or valine' 0 N--CA 1.498 1.968 0 O-C-N 121.624 -0.673 . . . . 0.0 110.472 179.826 . . . . . . . . 3 3 . 1 . 001 nuclear build core ' A' A ' 62' ' ' ASP . . . . . . . . . . . . . 0.9 OUTLIER -70.2 -35.86 74.22 Favored 'General case' 0 N--CA 1.498 1.947 0 O-C-N 121.27 -0.894 . . . . 0.0 110.276 179.607 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 63' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER -65.78 -35.73 81.54 Favored 'General case' 0 N--CA 1.497 1.912 0 O-C-N 121.355 -0.841 . . . . 0.0 111.174 -179.882 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 64' ' ' VAL . . . . . 0.652 HG11 ' SD ' ' A' ' 80' ' ' MET . 33.4 m -102.54 -15.58 7.8 Favored 'Isoleucine or valine' 0 N--CA 1.502 2.126 0 O-C-N 121.212 -0.93 . . . . 0.0 111.964 -179.359 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 65' ' ' ASP . . . . . . . . . . . . . 21.6 t0 -131.74 140.74 49.34 Favored 'General case' 0 N--CA 1.498 1.956 0 O-C-N 120.843 -1.16 . . . . 0.0 111.6 -179.774 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 66' ' ' GLU . . . . . . . . . . . . . 3.3 tp10 -155.46 40.01 0.4 Allowed 'General case' 0 N--CA 1.492 1.631 0 CA-C-O 121.477 0.656 . . . . 0.0 109.43 179.017 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 67' ' ' ASP . . . . . . . . . . . . . 12.1 p-10 -99.15 4.49 46.85 Favored 'General case' 0 N--CA 1.498 1.962 0 O-C-N 121.437 -0.789 . . . . 0.0 111.536 -179.532 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 68' ' ' GLY . . . . . . . . . . . . . . . 105.8 -32.39 7.45 Favored Glycine 0 N--CA 1.493 2.452 0 N-CA-C 109.543 -1.423 . . . . 0.0 109.543 -179.724 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 69' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER -69.07 -42.8 75.73 Favored 'General case' 0 N--CA 1.495 1.823 0 O-C-N 121.396 -1.061 . . . . 0.0 110.428 179.826 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 70' ' ' GLY . . . . . . . . . . . . . . . 72.78 29.76 64.82 Favored Glycine 0 N--CA 1.496 2.688 0 N-CA-C 109.248 -1.541 . . . . 0.0 109.248 -179.781 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 71' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -136.39 143.07 43.8 Favored 'General case' 0 N--CA 1.492 1.638 0 O-C-N 121.622 -0.928 . . . . 0.0 108.968 179.938 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 72' ' ' VAL . . . . . 0.59 HG23 HG13 ' A' ' 61' ' ' ILE . 3.9 t -75.5 110.63 10.71 Favored 'Isoleucine or valine' 0 N--CA 1.497 1.891 0 O-C-N 121.635 -0.665 . . . . 0.0 110.235 -179.585 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 73' ' ' ASP . . . . . . . . . . . . . 46.0 m-20 -83.03 -174.57 5.37 Favored 'General case' 0 N--CA 1.496 1.848 0 O-C-N 121.596 -0.69 . . . . 0.0 109.431 179.72 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 74' ' ' PHE . . . . . . . . . . . . . 52.2 t80 -60.62 -47.69 85.09 Favored 'General case' 0 N--CA 1.5 2.027 0 O-C-N 121.093 -1.004 . . . . 0.0 109.792 179.701 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 75' ' ' ASP . . . . . 0.572 ' HA ' HD23 ' A' ' 78' ' ' LEU . 23.6 t70 -62.14 -52.33 64.29 Favored 'General case' 0 N--CA 1.494 1.729 0 O-C-N 121.66 -0.65 . . . . 0.0 110.148 179.534 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 76' ' ' GLU . . . . . . . . . . . . . 18.4 mt-10 -57.65 -38.38 74.98 Favored 'General case' 0 N--CA 1.5 2.028 0 O-C-N 121.534 -0.729 . . . . 0.0 110.508 179.631 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 77' ' ' PHE . . . . . . . . . . . . . 58.0 t80 -63.48 -48.15 78.85 Favored 'General case' 0 N--CA 1.496 1.848 0 O-C-N 121.367 -0.833 . . . . 0.0 109.619 179.019 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 78' ' ' LEU . . . . . 0.572 HD23 ' HA ' ' A' ' 75' ' ' ASP . 0.1 OUTLIER -71.13 -30.93 67.11 Favored 'General case' 0 N--CA 1.496 1.867 0 O-C-N 121.45 -0.781 . . . . 0.0 109.734 179.117 . . . . . . . . 3 3 . 1 . 001 nuclear build core ' A' A ' 79' ' ' VAL . . . . . 0.679 ' CG2' HG11 ' A' ' 9' ' ' VAL . 4.8 t -68.4 -39.71 81.23 Favored 'Isoleucine or valine' 0 N--CA 1.501 2.093 0 O-C-N 121.216 -0.927 . . . . 0.0 109.102 178.276 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 80' ' ' MET . . . . . 0.652 ' SD ' HG11 ' A' ' 64' ' ' VAL . 26.0 ttp -68.5 -27.46 66.15 Favored 'General case' 0 N--CA 1.495 1.822 0 O-C-N 121.562 -0.711 . . . . 0.0 109.936 179.057 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 81' ' ' MET . . . . . 0.414 ' O ' ' HB2' ' A' ' 85' ' ' MET . 8.1 mmt -67.01 -55.17 15.58 Favored 'General case' 0 N--CA 1.496 1.845 0 O-C-N 121.467 -0.77 . . . . 0.0 110.793 179.948 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 82' ' ' VAL . . . . . 0.408 HG22 ' O ' ' A' ' 79' ' ' VAL . 20.2 m -59.46 -30.66 44.9 Favored 'Isoleucine or valine' 0 N--CA 1.503 2.177 0 O-C-N 121.424 -0.798 . . . . 0.0 110.681 -179.829 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 83' ' ' ARG . . . . . . . . . . . . . 5.3 mtp-105 -52.6 -47.27 67.05 Favored 'General case' 0 N--CA 1.5 2.047 0 O-C-N 121.468 -0.77 . . . . 0.0 110.297 179.424 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 84' ' ' CYS . . . . . . . . . . . . . 36.1 m -94.3 -4.35 48.88 Favored 'General case' 0 N--CA 1.499 2.0 0 O-C-N 121.426 -0.796 . . . . 0.0 110.465 178.968 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 85' ' ' MET . . . . . 0.414 ' HB2' ' O ' ' A' ' 81' ' ' MET . 3.3 ttm . . . . . 0 N--CA 1.497 1.923 0 O-C-N 121.219 -0.925 . . . . 0.0 111.118 179.503 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' B' B ' 149' ' ' SER . . . . . . . . . . . . . 2.2 t . . . . . 0 N--CA 1.497 1.895 0 N-CA-C 109.563 -0.532 . . . . 0.0 109.563 . . . . . . . . . 0 0 . 1 . 001 nuclear build core ' B' B ' 150' ' ' ALA . . . . . . . . . . . . . . . -57.79 -55.47 34.47 Favored 'General case' 0 N--CA 1.499 2.008 0 O-C-N 121.261 -0.899 . . . . 0.0 110.542 -179.828 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' B' B ' 151' ' ' ASP . . . . . . . . . . . . . 18.5 t70 -65.27 -41.54 94.12 Favored 'General case' 0 N--CA 1.497 1.894 0 O-C-N 121.328 -0.858 . . . . 0.0 110.58 179.752 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' B' B ' 152' ' ' ALA . . . . . . . . . . . . . . . -59.84 -52.37 65.74 Favored 'General case' 0 N--CA 1.499 2.013 0 O-C-N 121.414 -0.804 . . . . 0.0 110.649 179.981 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' B' B ' 153' ' ' MET . . . . . . . . . . . . . 1.3 tpt -63.22 -40.56 97.8 Favored 'General case' 0 N--CA 1.497 1.892 0 O-C-N 121.291 -0.881 . . . . 0.0 110.183 179.779 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' B' B ' 154' ' ' MET . . . . . . . . . . . . . 1.7 mtp -63.34 -43.85 96.53 Favored 'General case' 0 N--CA 1.501 2.118 0 O-C-N 121.346 -0.846 . . . . 0.0 110.121 179.345 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' B' B ' 155' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -60.25 -40.17 89.35 Favored 'General case' 0 N--CA 1.498 1.965 0 O-C-N 121.635 -0.666 . . . . 0.0 110.049 179.493 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' B' B ' 156' ' ' ALA . . . . . . . . . . . . . . . -78.29 -25.11 46.5 Favored 'General case' 0 N--CA 1.495 1.816 0 O-C-N 121.434 -0.791 . . . . 0.0 110.33 179.213 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' B' B ' 157' ' ' LEU . . . . . 0.438 HD11 ' CG2' ' A' ' 26' ' ' ILE . 0.5 OUTLIER -69.65 -50.36 44.84 Favored 'General case' 0 N--CA 1.497 1.921 0 O-C-N 121.349 -0.844 . . . . 0.0 110.503 179.951 . . . . . . . . 3 3 . 1 . 001 nuclear build core ' B' B ' 158' ' ' LEU . . . . . . . . . . . . . 1.6 mt . . . . . 0 N--CA 1.496 1.874 0 O-C-N 121.224 -0.922 . . . . 0.0 110.245 179.713 . . . . . . . . 0 0 . 1 . 002 nuclear build core ' A' A ' 4' ' ' ILE . . . . . 0.426 HG13 ' N ' ' A' ' 5' ' ' TYR . 35.3 pt . . . . . 0 N--CA 1.501 2.094 0 CA-C-O 120.829 0.347 . . . . 0.0 110.615 . . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 5' ' ' TYR . . . . . 0.426 ' N ' HG13 ' A' ' 4' ' ' ILE . 56.8 m-85 -71.1 -21.78 62.18 Favored 'General case' 0 N--CA 1.496 1.834 0 O-C-N 121.297 -0.877 . . . . 0.0 109.749 179.022 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -69.32 -49.64 53.88 Favored 'General case' 0 N--CA 1.494 1.762 0 O-C-N 121.492 -0.755 . . . . 0.0 109.722 178.916 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 7' ' ' ALA . . . . . . . . . . . . . . . -50.56 -38.84 47.4 Favored 'General case' 0 N--CA 1.499 2.017 0 O-C-N 121.572 -0.705 . . . . 0.0 110.345 179.422 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 8' ' ' ALA . . . . . . . . . . . . . . . -59.07 -42.31 90.05 Favored 'General case' 0 N--CA 1.497 1.889 0 O-C-N 121.561 -0.712 . . . . 0.0 109.758 178.978 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 9' ' ' VAL . . . . . 0.616 HG21 ' CG2' ' A' ' 79' ' ' VAL . 55.3 t -66.91 -42.67 89.22 Favored 'Isoleucine or valine' 0 N--CA 1.498 1.967 0 O-C-N 121.602 -0.686 . . . . 0.0 109.552 178.969 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 10' ' ' GLU . . . . . . . . . . . . . 0.9 OUTLIER -57.93 -39.83 78.96 Favored 'General case' 0 N--CA 1.499 1.989 0 O-C-N 121.484 -0.76 . . . . 0.0 110.041 178.949 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 11' ' ' GLN . . . . . . . . . . . . . 5.4 mt-30 -109.1 48.22 0.88 Allowed 'General case' 0 N--CA 1.495 1.786 0 O-C-N 121.486 -0.759 . . . . 0.0 109.926 179.501 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 12' ' ' LEU . . . . . 0.479 HD22 ' HB3' ' A' ' 16' ' ' GLN . 2.8 mt -82.8 158.73 22.66 Favored 'General case' 0 N--CA 1.5 2.027 0 O-C-N 121.309 -0.869 . . . . 0.0 110.636 -179.874 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 13' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -80.15 153.36 28.7 Favored 'General case' 0 N--CA 1.498 1.945 0 O-C-N 121.49 -0.756 . . . . 0.0 110.488 179.876 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 14' ' ' GLU . . . . . . . . . . . . . 12.4 tp10 -58.17 -47.18 84.2 Favored 'General case' 0 N--CA 1.492 1.673 0 C-N-CA 120.106 -0.637 . . . . 0.0 109.966 179.81 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 5.0 tt0 -57.68 -45.51 85.51 Favored 'General case' 0 N--CA 1.499 2.0 0 O-C-N 121.443 -0.786 . . . . 0.0 109.906 179.157 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 16' ' ' GLN . . . . . 0.479 ' HB3' HD22 ' A' ' 12' ' ' LEU . 3.0 mp0 -63.29 -48.41 78.25 Favored 'General case' 0 N--CA 1.496 1.875 0 CA-C-O 121.648 0.737 . . . . 0.0 110.158 179.381 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 17' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -60.97 -49.33 77.87 Favored 'General case' 0 N--CA 1.496 1.871 0 CA-C-N 116.245 -0.434 . . . . 0.0 110.199 179.647 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 18' ' ' ASN . . . . . . . . . . . . . 0.5 OUTLIER -62.12 -39.95 94.25 Favored 'General case' 0 N--CA 1.497 1.896 0 O-C-N 121.504 -0.748 . . . . 0.0 110.129 179.619 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 19' ' ' GLU . . . . . 0.403 ' HB3' ' CE ' ' B' ' 154' ' ' MET . 7.6 mm-40 -63.89 -49.32 73.18 Favored 'General case' 0 N--CA 1.497 1.907 0 O-C-N 121.51 -0.744 . . . . 0.0 110.001 179.529 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 20' ' ' PHE . . . . . 0.4 ' CE1' ' HB3' ' A' ' 81' ' ' MET . 15.6 m-85 -66.49 -35.04 79.28 Favored 'General case' 0 N--CA 1.499 2.0 0 O-C-N 121.365 -0.834 . . . . 0.0 110.235 179.497 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 21' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -58.58 -54.2 49.7 Favored 'General case' 0 N--CA 1.498 1.951 0 O-C-N 121.423 -0.798 . . . . 0.0 109.907 179.434 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 22' ' ' ALA . . . . . . . . . . . . . . . -66.04 -42.07 90.02 Favored 'General case' 0 N--CA 1.496 1.834 0 O-C-N 121.53 -0.732 . . . . 0.0 110.619 179.974 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 23' ' ' ALA . . . . . . . . . . . . . . . -61.99 -40.77 96.78 Favored 'General case' 0 N--CA 1.499 1.994 0 O-C-N 121.324 -0.86 . . . . 0.0 110.105 179.478 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 24' ' ' PHE . . . . . . . . . . . . . 67.9 t80 -60.82 -45.31 94.95 Favored 'General case' 0 N--CA 1.498 1.956 0 O-C-N 121.561 -0.712 . . . . 0.0 110.088 179.392 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 25' ' ' ASP . . . . . . . . . . . . . 3.2 m-20 -60.52 -38.2 83.62 Favored 'General case' 0 N--CA 1.498 1.942 0 O-C-N 121.595 -0.691 . . . . 0.0 110.246 179.694 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 26' ' ' ILE . . . . . 0.574 ' HA ' HD12 ' A' ' 29' ' ' LEU . 57.1 mt -74.68 -26.87 20.13 Favored 'Isoleucine or valine' 0 N--CA 1.5 2.043 0 O-C-N 121.311 -0.868 . . . . 0.0 109.919 179.285 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 27' ' ' PHE . . . . . 0.479 ' CE1' HG21 ' A' ' 44' ' ' VAL . 0.2 OUTLIER -71.4 -37.92 71.5 Favored 'General case' 0 N--CA 1.496 1.866 0 O-C-N 121.288 -0.883 . . . . 0.0 111.245 -179.836 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' A' A ' 28' ' ' VAL . . . . . 0.419 ' H ' HG22 ' A' ' 28' ' ' VAL . 28.1 m -79.71 9.79 0.7 Allowed 'Isoleucine or valine' 0 N--CA 1.503 2.211 0 O-C-N 121.29 -0.881 . . . . 0.0 111.726 -179.518 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 29' ' ' LEU . . . . . 0.574 HD12 ' HA ' ' A' ' 26' ' ' ILE . 2.5 mt -70.63 96.11 1.17 Allowed 'General case' 0 N--CA 1.496 1.834 0 O-C-N 121.001 -1.062 . . . . 0.0 109.737 179.449 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 30' ' ' GLY . . . . . . . . . . . . . . . 143.47 -25.21 2.16 Favored Glycine 0 N--CA 1.493 2.471 0 N-CA-C 109.264 -1.534 . . . . 0.0 109.264 -178.963 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 31' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.494 1.757 0 O-C-N 121.42 -1.047 . . . . 0.0 109.951 179.679 . . . . . . . . 0 0 . 1 . 002 nuclear build core ' A' A ' 35' ' ' CYS . . . . . . . . . . . . . 0.1 OUTLIER . . . . . 0 N--CA 1.498 1.975 0 CA-C-O 121.391 0.615 . . . . 0.0 111.353 . . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 36' ' ' ILE . . . . . 0.566 ' HB ' ' HB ' ' A' ' 72' ' ' VAL . 1.2 mp -113.75 126.74 71.28 Favored 'Isoleucine or valine' 0 N--CA 1.496 1.875 0 O-C-N 121.405 -0.809 . . . . 0.0 109.81 179.253 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 37' ' ' SER . . . . . . . . . . . . . 52.1 p -103.06 -168.34 1.5 Allowed 'General case' 0 N--CA 1.497 1.887 0 O-C-N 121.482 -0.761 . . . . 0.0 110.593 -179.902 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 38' ' ' THR . . . . . . . . . . . . . 30.1 p -65.49 -46.21 80.64 Favored 'General case' 0 N--CA 1.501 2.103 0 O-C-N 121.291 -0.88 . . . . 0.0 110.255 179.675 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 39' ' ' LYS . . . . . . . . . . . . . 10.8 mttm -65.75 -38.34 88.83 Favored 'General case' 0 N--CA 1.499 1.99 0 O-C-N 121.484 -0.76 . . . . 0.0 110.031 179.459 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 40' ' ' GLU . . . . . 0.405 ' HB3' HG23 ' A' ' 36' ' ' ILE . 4.2 tp10 -64.69 -30.74 71.76 Favored 'General case' 0 N--CA 1.496 1.832 0 O-C-N 121.528 -0.732 . . . . 0.0 110.22 179.465 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 41' ' ' LEU . . . . . 0.698 ' CD2' HD22 ' A' ' 57' ' ' LEU . 6.0 tp -85.96 -45.84 11.11 Favored 'General case' 0 N--CA 1.496 1.841 0 O-C-N 121.445 -0.784 . . . . 0.0 110.602 179.615 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 42' ' ' GLY . . . . . . . . . . . . . . . -51.71 -39.12 45.95 Favored Glycine 0 N--CA 1.497 2.754 0 N-CA-C 111.141 -0.783 . . . . 0.0 111.141 -178.939 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 43' ' ' LYS . . . . . . . . . . . . . 2.7 pttm -58.9 -30.83 68.08 Favored 'General case' 0 N--CA 1.5 2.056 0 O-C-N 121.242 -1.152 . . . . 0.0 110.793 -179.975 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 44' ' ' VAL . . . . . 0.479 HG21 ' CE1' ' A' ' 27' ' ' PHE . 93.4 t -86.66 -32.49 6.59 Favored 'Isoleucine or valine' 0 N--CA 1.499 2.002 0 O-C-N 121.232 -0.917 . . . . 0.0 109.658 178.765 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 45' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -57.28 -50.67 72.16 Favored 'General case' 0 N--CA 1.5 2.04 0 O-C-N 121.443 -0.785 . . . . 0.0 110.282 179.8 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 46' ' ' ARG . . . . . 0.417 ' N ' ' HB2' ' A' ' 51' ' ' ASN . 0.0 OUTLIER -69.28 -41.04 77.38 Favored 'General case' 0 N--CA 1.499 1.987 0 O-C-N 121.394 -0.816 . . . . 0.0 109.796 179.393 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' A' A ' 47' ' ' MET . . . . . . . . . . . . . 0.2 OUTLIER -62.2 -37.44 85.3 Favored 'General case' 0 N--CA 1.499 1.988 0 O-C-N 121.574 -0.704 . . . . 0.0 110.112 179.238 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 48' ' ' LEU . . . . . 0.534 HD13 ' HG3' ' B' ' 153' ' ' MET . 0.4 OUTLIER -75.86 -46.75 28.59 Favored 'General case' 0 N--CA 1.493 1.686 0 O-C-N 121.446 -0.784 . . . . 0.0 110.229 179.592 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' A' A ' 49' ' ' GLY . . . . . . . . . . . . . . . -161.8 -82.69 0.04 OUTLIER Glycine 0 N--CA 1.494 2.508 0 N-CA-C 110.237 -1.145 . . . . 0.0 110.237 -179.832 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 50' ' ' GLN . . . . . . . . . . . . . 78.2 mt-30 -127.28 143.07 51.31 Favored 'General case' 0 N--CA 1.497 1.891 0 O-C-N 121.408 -1.054 . . . . 0.0 111.144 -179.361 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 51' ' ' ASN . . . . . 0.417 ' HB2' ' N ' ' A' ' 46' ' ' ARG . 33.1 t30 -116.4 110.97 42.35 Favored Pre-proline 0 N--CA 1.493 1.712 0 O-C-N 121.485 -0.759 . . . . 0.0 109.574 178.859 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 52' ' ' PRO . . . . . . . . . . . . . 44.0 Cg_endo -71.34 -92.62 0.01 OUTLIER 'Trans proline' 0 C--N 1.312 -1.361 0 O-C-N 124.003 1.528 . . . . 0.0 111.014 -179.541 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 53' ' ' THR . . . . . . . . . . . . . 0.6 OUTLIER -144.92 160.38 46.91 Favored Pre-proline 0 N--CA 1.495 1.801 0 O-C-N 120.841 -1.162 . . . . 0.0 110.667 -179.532 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 54' ' ' PRO . . . . . . . . . . . . . 43.5 Cg_endo -69.42 -38.14 8.97 Favored 'Trans proline' 0 N--CA 1.492 1.392 0 O-C-N 124.039 1.547 . . . . 0.0 111.307 179.993 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 55' ' ' GLU . . . . . . . . . . . . . 32.6 mt-10 -61.31 -38.44 86.86 Favored 'General case' 0 N--CA 1.499 1.996 0 O-C-N 121.381 -0.825 . . . . 0.0 110.634 -179.837 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 15.1 mm-40 -62.19 -37.99 87.39 Favored 'General case' 0 N--CA 1.498 1.961 0 O-C-N 121.417 -0.802 . . . . 0.0 110.765 179.736 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 57' ' ' LEU . . . . . 0.698 HD22 ' CD2' ' A' ' 41' ' ' LEU . 74.4 mt -68.65 -31.91 71.38 Favored 'General case' 0 N--CA 1.496 1.871 0 O-C-N 121.228 -0.92 . . . . 0.0 110.405 179.952 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 58' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -55.13 -52.56 62.89 Favored 'General case' 0 N--CA 1.498 1.946 0 O-C-N 121.287 -0.883 . . . . 0.0 109.041 179.024 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 59' ' ' GLU . . . . . . . . . . . . . 1.5 tm-20 -66.37 -35.96 81.67 Favored 'General case' 0 N--CA 1.494 1.744 0 N-CA-C 108.958 -0.756 . . . . 0.0 108.958 178.033 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 60' ' ' MET . . . . . . . . . . . . . 3.0 tpp -55.98 -40.68 73.63 Favored 'General case' 0 N--CA 1.498 1.949 0 O-C-N 121.571 -0.705 . . . . 0.0 109.775 178.715 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 61' ' ' ILE . . . . . 0.464 HG12 ' CG2' ' A' ' 72' ' ' VAL . 69.2 mt -71.19 -50.14 43.64 Favored 'Isoleucine or valine' 0 N--CA 1.498 1.959 0 O-C-N 121.446 -0.784 . . . . 0.0 109.302 178.928 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 62' ' ' ASP . . . . . 0.445 ' HA ' ' CB ' ' A' ' 65' ' ' ASP . 5.1 m-20 -58.9 -26.97 64.79 Favored 'General case' 0 N--CA 1.498 1.965 0 O-C-N 121.704 -0.623 . . . . 0.0 110.865 179.64 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 63' ' ' GLU . . . . . . . . . . . . . 3.0 tt0 -50.94 -39.08 53.98 Favored 'General case' 0 N--CA 1.501 2.076 0 O-C-N 121.347 -0.846 . . . . 0.0 109.981 179.179 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 64' ' ' VAL . . . . . . . . . . . . . 9.8 p -125.83 25.78 2.87 Favored 'Isoleucine or valine' 0 N--CA 1.495 1.824 0 O-C-N 121.587 -0.696 . . . . 0.0 110.393 179.259 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 65' ' ' ASP . . . . . 0.445 ' CB ' ' HA ' ' A' ' 62' ' ' ASP . 9.3 t70 -86.74 116.36 24.79 Favored 'General case' 0 N--CA 1.498 1.934 0 O-C-N 121.099 -1.001 . . . . 0.0 110.397 179.886 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 66' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER -80.07 -20.98 43.91 Favored 'General case' 0 N--CA 1.497 1.895 0 O-C-N 121.505 -0.747 . . . . 0.0 110.627 179.457 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 67' ' ' ASP . . . . . . . . . . . . . 70.0 m-20 -80.52 -15.75 55.93 Favored 'General case' 0 N--CA 1.497 1.918 0 O-C-N 121.18 -0.95 . . . . 0.0 111.729 -179.7 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 68' ' ' GLY . . . . . . . . . . . . . . . 66.66 16.68 66.0 Favored Glycine 0 N--CA 1.494 2.56 0 N-CA-C 108.731 -1.747 . . . . 0.0 108.731 -178.17 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 69' ' ' SER . . . . . . . . . . . . . 88.7 p -94.22 -34.53 12.85 Favored 'General case' 0 N--CA 1.492 1.66 0 O-C-N 121.674 -0.898 . . . . 0.0 109.984 -179.86 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 70' ' ' GLY . . . . . . . . . . . . . . . 94.87 30.34 8.48 Favored Glycine 0 N--CA 1.499 2.877 0 N-CA-C 110.137 -1.185 . . . . 0.0 110.137 179.962 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 71' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -128.75 134.34 48.39 Favored 'General case' 0 N--CA 1.499 2.025 0 O-C-N 121.516 -0.991 . . . . 0.0 108.64 179.346 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 72' ' ' VAL . . . . . 0.566 ' HB ' ' HB ' ' A' ' 36' ' ' ILE . 74.0 t -75.61 113.66 14.75 Favored 'Isoleucine or valine' 0 N--CA 1.5 2.043 0 O-C-N 121.199 -0.938 . . . . 0.0 111.375 -178.87 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 73' ' ' ASP . . . . . . . . . . . . . 3.5 m-20 -96.9 -174.61 3.03 Favored 'General case' 0 N--CA 1.493 1.721 0 O-C-N 121.724 -0.61 . . . . 0.0 109.423 178.788 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 74' ' ' PHE . . . . . . . . . . . . . 27.6 t80 -72.37 -40.51 67.25 Favored 'General case' 0 N--CA 1.498 1.943 0 O-C-N 120.928 -1.107 . . . . 0.0 109.747 179.729 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 75' ' ' ASP . . . . . . . . . . . . . 3.0 p-10 -67.69 -36.37 80.53 Favored 'General case' 0 N--CA 1.494 1.734 0 O-C-N 121.705 -0.622 . . . . 0.0 109.977 179.251 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 76' ' ' GLU . . . . . . . . . . . . . 7.6 mt-10 -73.12 -41.46 63.99 Favored 'General case' 0 N--CA 1.494 1.763 0 O-C-N 121.485 -0.76 . . . . 0.0 109.826 179.247 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 77' ' ' PHE . . . . . 0.446 ' O ' ' HG2' ' A' ' 81' ' ' MET . 61.3 t80 -57.76 -49.92 74.98 Favored 'General case' 0 N--CA 1.498 1.963 0 O-C-N 121.669 -0.644 . . . . 0.0 110.653 179.803 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 78' ' ' LEU . . . . . . . . . . . . . 46.6 mt -54.42 -45.98 73.1 Favored 'General case' 0 N--CA 1.501 2.079 0 O-C-N 121.363 -0.836 . . . . 0.0 110.372 179.928 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 79' ' ' VAL . . . . . 0.616 ' CG2' HG21 ' A' ' 9' ' ' VAL . 75.5 t -66.33 -37.99 80.87 Favored 'Isoleucine or valine' 0 N--CA 1.5 2.035 0 O-C-N 121.51 -0.744 . . . . 0.0 109.773 179.196 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 80' ' ' MET . . . . . 0.527 ' HA ' ' HG2' ' A' ' 83' ' ' ARG . 25.8 ttp -65.74 -41.84 91.67 Favored 'General case' 0 N--CA 1.495 1.786 0 O-C-N 121.53 -0.731 . . . . 0.0 110.837 179.93 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 81' ' ' MET . . . . . 0.446 ' HG2' ' O ' ' A' ' 77' ' ' PHE . 22.8 mmm -66.06 -49.87 66.13 Favored 'General case' 0 N--CA 1.497 1.923 0 O-C-N 121.286 -0.884 . . . . 0.0 111.121 -179.351 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 82' ' ' VAL . . . . . 0.45 ' HA ' ' HE2' ' A' ' 85' ' ' MET . 34.9 m -64.4 -35.19 73.59 Favored 'Isoleucine or valine' 0 N--CA 1.503 2.215 0 O-C-N 121.135 -0.978 . . . . 0.0 111.197 -179.418 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 83' ' ' ARG . . . . . 0.527 ' HG2' ' HA ' ' A' ' 80' ' ' MET . 0.0 OUTLIER -79.33 -21.11 46.32 Favored 'General case' 0 N--CA 1.499 1.996 0 O-C-N 121.094 -1.004 . . . . 0.0 110.642 179.564 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' A' A ' 84' ' ' CYS . . . . . 0.485 ' N ' ' HG3' ' A' ' 83' ' ' ARG . 41.3 t -78.72 -25.17 44.58 Favored 'General case' 0 N--CA 1.498 1.967 0 O-C-N 121.103 -0.998 . . . . 0.0 110.614 179.74 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 85' ' ' MET . . . . . 0.45 ' HE2' ' HA ' ' A' ' 82' ' ' VAL . 7.6 mtm . . . . . 0 N--CA 1.501 2.111 0 O-C-N 121.449 -0.782 . . . . 0.0 110.988 -179.882 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' B' B ' 149' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER . . . . . 0 N--CA 1.504 2.257 0 CA-C-O 121.474 0.654 . . . . 0.0 111.132 . . . . . . . . . 1 1 . 1 . 002 nuclear build core ' B' B ' 150' ' ' ALA . . . . . . . . . . . . . . . -56.89 -41.76 78.64 Favored 'General case' 0 N--CA 1.5 2.045 0 O-C-N 121.298 -0.876 . . . . 0.0 110.283 179.632 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' B' B ' 151' ' ' ASP . . . . . . . . . . . . . 7.9 p-10 -61.56 -38.72 88.51 Favored 'General case' 0 N--CA 1.498 1.944 0 O-C-N 121.505 -0.747 . . . . 0.0 110.444 179.438 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' B' B ' 152' ' ' ALA . . . . . . . . . . . . . . . -67.02 -48.32 68.76 Favored 'General case' 0 N--CA 1.497 1.886 0 O-C-N 121.312 -0.868 . . . . 0.0 109.703 179.392 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' B' B ' 153' ' ' MET . . . . . 0.534 ' HG3' HD13 ' A' ' 48' ' ' LEU . 1.6 ttt -64.23 -36.85 85.42 Favored 'General case' 0 N--CA 1.498 1.927 0 O-C-N 121.545 -0.722 . . . . 0.0 110.155 179.221 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' B' B ' 154' ' ' MET . . . . . 0.403 ' CE ' ' HB3' ' A' ' 19' ' ' GLU . 15.8 mtp -58.82 -48.3 81.79 Favored 'General case' 0 N--CA 1.499 1.977 0 O-C-N 121.571 -0.706 . . . . 0.0 110.092 179.449 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' B' B ' 155' ' ' GLN . . . . . . . . . . . . . 19.1 mt-30 -71.97 -33.33 68.07 Favored 'General case' 0 N--CA 1.498 1.95 0 O-C-N 121.479 -0.763 . . . . 0.0 110.387 179.46 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' B' B ' 156' ' ' ALA . . . . . . . . . . . . . . . -62.98 -42.72 99.91 Favored 'General case' 0 N--CA 1.496 1.848 0 O-C-N 121.42 -0.8 . . . . 0.0 110.497 -179.889 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' B' B ' 157' ' ' LEU . . . . . . . . . . . . . 0.8 OUTLIER -86.4 -54.03 4.66 Favored 'General case' 0 N--CA 1.497 1.9 0 O-C-N 121.356 -0.84 . . . . 0.0 110.298 179.803 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' B' B ' 158' ' ' LEU . . . . . . . . . . . . . 4.8 mt . . . . . 0 N--CA 1.495 1.803 0 O-C-N 121.368 -0.833 . . . . 0.0 109.907 179.751 . . . . . . . . 0 0 . 1 . 003 nuclear build core ' A' A ' 4' ' ' ILE . . . . . . . . . . . . . 49.4 mt . . . . . 0 N--CA 1.504 2.252 0 N-CA-C 111.899 0.333 . . . . 0.0 111.899 . . . . . . . . . 0 0 . 1 . 003 nuclear build core ' A' A ' 5' ' ' TYR . . . . . 0.489 ' CE1' ' HA ' ' A' ' 83' ' ' ARG . 31.7 m-85 -60.53 -32.66 71.68 Favored 'General case' 0 N--CA 1.502 2.147 0 O-C-N 121.053 -1.03 . . . . 0.0 111.246 -179.501 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -62.68 -38.93 92.3 Favored 'General case' 0 N--CA 1.498 1.941 0 O-C-N 121.117 -0.989 . . . . 0.0 109.741 178.811 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 7' ' ' ALA . . . . . . . . . . . . . . . -59.73 -38.49 81.86 Favored 'General case' 0 N--CA 1.497 1.909 0 O-C-N 121.544 -0.722 . . . . 0.0 110.251 179.13 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 8' ' ' ALA . . . . . 0.702 ' HB1' HG21 ' A' ' 82' ' ' VAL . . . -60.34 -33.93 73.11 Favored 'General case' 0 N--CA 1.498 1.928 0 O-C-N 121.364 -0.835 . . . . 0.0 110.308 179.232 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 9' ' ' VAL . . . . . 0.44 HG21 ' HB ' ' A' ' 79' ' ' VAL . 93.3 t -65.96 -34.88 73.22 Favored 'Isoleucine or valine' 0 N--CA 1.5 2.046 0 O-C-N 121.403 -0.81 . . . . 0.0 109.745 179.3 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 10' ' ' GLU . . . . . . . . . . . . . 22.7 mt-10 -62.98 -31.68 72.85 Favored 'General case' 0 N--CA 1.498 1.93 0 O-C-N 121.376 -0.828 . . . . 0.0 109.951 178.951 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 11' ' ' GLN . . . . . . . . . . . . . 1.0 OUTLIER -67.1 -28.63 68.33 Favored 'General case' 0 N--CA 1.499 1.978 0 O-C-N 121.413 -0.804 . . . . 0.0 110.247 179.202 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 12' ' ' LEU . . . . . 0.486 HD22 ' HB3' ' A' ' 16' ' ' GLN . 81.0 mt -77.11 98.56 5.08 Favored 'General case' 0 N--CA 1.496 1.838 0 O-C-N 121.227 -0.92 . . . . 0.0 109.797 179.661 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 13' ' ' THR . . . . . . . . . . . . . 11.6 p -77.31 -176.2 4.04 Favored 'General case' 0 N--CA 1.498 1.964 0 O-C-N 121.438 -0.789 . . . . 0.0 110.874 -179.588 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 14' ' ' GLU . . . . . 0.419 ' HA ' ' HB2' ' A' ' 17' ' ' LYS . 0.5 OUTLIER -50.54 -36.32 33.72 Favored 'General case' 0 N--CA 1.496 1.828 0 O-C-N 121.734 -0.604 . . . . 0.0 111.299 -178.848 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 1.9 mp0 -60.82 -46.62 89.83 Favored 'General case' 0 N--CA 1.5 2.033 0 O-C-N 121.422 -0.799 . . . . 0.0 109.972 179.516 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 16' ' ' GLN . . . . . 0.486 ' HB3' HD22 ' A' ' 12' ' ' LEU . 1.1 mp0 -75.96 -35.73 59.55 Favored 'General case' 0 N--CA 1.497 1.913 0 O-C-N 121.567 -0.708 . . . . 0.0 109.986 179.208 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 17' ' ' LYS . . . . . 0.419 ' HB2' ' HA ' ' A' ' 14' ' ' GLU . 14.0 mmtt -62.92 -41.45 99.48 Favored 'General case' 0 N--CA 1.495 1.812 0 O-C-N 121.925 -0.484 . . . . 0.0 109.811 179.271 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 18' ' ' ASN . . . . . . . . . . . . . 9.4 t30 -62.46 -40.46 96.7 Favored 'General case' 0 N--CA 1.496 1.863 0 O-C-N 121.598 -0.689 . . . . 0.0 110.399 179.587 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 19' ' ' GLU . . . . . 0.514 ' HB3' ' HE3' ' B' ' 154' ' ' MET . 4.5 mm-40 -61.0 -42.87 99.28 Favored 'General case' 0 N--CA 1.501 2.085 0 O-C-N 121.438 -0.789 . . . . 0.0 110.129 179.503 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 20' ' ' PHE . . . . . . . . . . . . . 5.7 m-85 -77.41 -36.42 53.33 Favored 'General case' 0 N--CA 1.499 2.008 0 O-C-N 121.326 -0.859 . . . . 0.0 109.978 179.221 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 21' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -57.79 -48.65 79.08 Favored 'General case' 0 N--CA 1.499 1.993 0 O-C-N 121.645 -0.659 . . . . 0.0 110.15 179.408 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 22' ' ' ALA . . . . . . . . . . . . . . . -59.98 -43.97 94.8 Favored 'General case' 0 N--CA 1.497 1.881 0 O-C-N 121.605 -0.685 . . . . 0.0 110.036 179.597 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 23' ' ' ALA . . . . . . . . . . . . . . . -66.67 -35.44 80.17 Favored 'General case' 0 N--CA 1.497 1.902 0 O-C-N 121.334 -0.854 . . . . 0.0 109.142 178.597 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 24' ' ' PHE . . . . . 0.568 ' CE1' HD12 ' A' ' 36' ' ' ILE . 56.5 t80 -62.4 -34.51 76.87 Favored 'General case' 0 N--CA 1.497 1.876 0 O-C-N 121.737 -0.602 . . . . 0.0 110.173 179.029 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 25' ' ' ASP . . . . . . . . . . . . . 16.5 m-20 -58.45 -52.62 64.85 Favored 'General case' 0 N--CA 1.5 2.026 0 O-C-N 121.523 -0.736 . . . . 0.0 110.503 179.675 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 26' ' ' ILE . . . . . 0.502 HD13 ' O ' ' B' ' 157' ' ' LEU . 3.2 mt -63.38 -37.75 80.36 Favored 'Isoleucine or valine' 0 N--CA 1.498 1.966 0 O-C-N 121.393 -0.817 . . . . 0.0 109.678 179.527 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 27' ' ' PHE . . . . . 0.696 ' HB3' HD11 ' A' ' 36' ' ' ILE . 0.1 OUTLIER -61.62 -34.43 75.65 Favored 'General case' 0 N--CA 1.498 1.932 0 O-C-N 121.603 -0.685 . . . . 0.0 110.672 179.632 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' A' A ' 28' ' ' VAL . . . . . 0.704 HG12 HG13 ' A' ' 36' ' ' ILE . 16.0 m -101.93 -6.39 9.2 Favored 'Isoleucine or valine' 0 N--CA 1.502 2.169 0 O-C-N 121.166 -0.959 . . . . 0.0 111.527 -179.879 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 29' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -52.73 -56.97 11.76 Favored 'General case' 0 N--CA 1.501 2.112 0 O-C-N 121.129 -0.982 . . . . 0.0 110.886 -179.671 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 30' ' ' GLY . . . . . . . . . . . . . . . -105.28 51.4 0.77 Allowed Glycine 0 N--CA 1.494 2.525 0 N-CA-C 108.851 -1.7 . . . . 0.0 108.851 179.381 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 31' ' ' ALA . . . . . 0.546 ' HA ' ' HG2' ' A' ' 40' ' ' GLU . . . . . . . . 0 N--CA 1.495 1.775 0 O-C-N 121.37 -1.076 . . . . 0.0 111.562 -179.235 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 35' ' ' CYS . . . . . . . . . . . . . 94.9 m . . . . . 0 N--CA 1.499 1.998 0 CA-C-O 121.092 0.472 . . . . 0.0 110.652 . . . . . . . . . 0 0 . 1 . 003 nuclear build core ' A' A ' 36' ' ' ILE . . . . . 0.704 HG13 HG12 ' A' ' 28' ' ' VAL . 4.7 mt -68.91 112.23 3.55 Favored 'Isoleucine or valine' 0 N--CA 1.499 1.999 0 O-C-N 121.339 -0.851 . . . . 0.0 110.27 -179.82 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 37' ' ' SER . . . . . . . . . . . . . 18.6 t -101.03 -174.61 2.65 Favored 'General case' 0 N--CA 1.495 1.823 0 O-C-N 121.517 -0.739 . . . . 0.0 109.825 179.558 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 38' ' ' THR . . . . . . . . . . . . . 8.3 p -60.55 -53.33 58.8 Favored 'General case' 0 N--CA 1.504 2.239 0 O-C-N 121.345 -0.847 . . . . 0.0 111.303 -179.447 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 39' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -59.14 -39.63 82.99 Favored 'General case' 0 N--CA 1.502 2.153 0 O-C-N 121.422 -0.799 . . . . 0.0 111.512 -179.22 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 40' ' ' GLU . . . . . 0.546 ' HG2' ' HA ' ' A' ' 31' ' ' ALA . 1.1 mp0 -63.09 -46.18 88.6 Favored 'General case' 0 N--CA 1.502 2.127 0 O-C-N 121.064 -1.023 . . . . 0.0 110.346 179.652 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 41' ' ' LEU . . . . . 0.475 HD12 ' HG3' ' A' ' 45' ' ' MET . 0.1 OUTLIER -58.71 -61.02 2.92 Favored 'General case' 0 N--CA 1.499 1.983 0 O-C-N 121.544 -0.723 . . . . 0.0 109.693 179.192 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' A' A ' 42' ' ' GLY . . . . . . . . . . . . . . . -48.99 -33.33 13.32 Favored Glycine 0 N--CA 1.5 2.907 0 N-CA-C 111.036 -0.826 . . . . 0.0 111.036 179.938 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 43' ' ' LYS . . . . . . . . . . . . . 2.4 tmtt? -56.7 -42.36 79.0 Favored 'General case' 0 N--CA 1.504 2.243 0 O-C-N 121.224 -1.162 . . . . 0.0 110.322 179.912 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 44' ' ' VAL . . . . . . . . . . . . . 76.8 t -76.84 -33.84 21.88 Favored 'Isoleucine or valine' 0 N--CA 1.494 1.762 0 O-C-N 121.296 -0.877 . . . . 0.0 109.265 179.191 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 45' ' ' MET . . . . . 0.519 ' SD ' ' HG3' ' A' ' 52' ' ' PRO . 1.2 mtt -57.73 -55.28 36.97 Favored 'General case' 0 N--CA 1.497 1.913 0 O-C-N 121.514 -0.741 . . . . 0.0 109.825 179.103 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 46' ' ' ARG . . . . . . . . . . . . . 15.4 ptp180 -61.45 -34.22 75.05 Favored 'General case' 0 N--CA 1.502 2.163 0 O-C-N 121.343 -0.848 . . . . 0.0 110.279 179.279 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 47' ' ' MET . . . . . . . . . . . . . 16.5 ttp -61.31 -32.9 72.76 Favored 'General case' 0 N--CA 1.499 2.007 0 O-C-N 121.281 -0.887 . . . . 0.0 109.388 178.557 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 48' ' ' LEU . . . . . . . . . . . . . 8.2 tp -85.06 -42.46 14.81 Favored 'General case' 0 N--CA 1.492 1.649 0 O-C-N 121.617 -0.677 . . . . 0.0 110.003 179.164 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 49' ' ' GLY . . . . . . . . . . . . . . . 169.9 -65.8 0.17 Allowed Glycine 0 N--CA 1.497 2.705 0 C-N-CA 119.759 -1.21 . . . . 0.0 110.896 179.882 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 50' ' ' GLN . . . . . . . . . . . . . 1.2 mt-30 -59.59 136.52 58.01 Favored 'General case' 0 N--CA 1.504 2.236 0 O-C-N 121.356 -1.085 . . . . 0.0 111.165 -179.03 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 51' ' ' ASN . . . . . . . . . . . . . 2.2 m-80 -118.74 77.98 15.22 Favored Pre-proline 0 N--CA 1.498 1.937 0 O-C-N 121.282 -0.887 . . . . 0.0 110.693 -179.97 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 52' ' ' PRO . . . . . 0.519 ' HG3' ' SD ' ' A' ' 45' ' ' MET . 54.2 Cg_endo -81.94 163.68 18.06 Favored 'Trans proline' 0 C--N 1.313 -1.294 0 O-C-N 123.814 1.428 . . . . 0.0 110.809 179.768 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 53' ' ' THR . . . . . 0.514 ' O ' HD12 ' A' ' 57' ' ' LEU . 34.2 p -95.25 161.98 26.26 Favored Pre-proline 0 N--CA 1.496 1.854 0 O-C-N 121.325 -0.859 . . . . 0.0 109.826 179.245 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 54' ' ' PRO . . . . . . . . . . . . . 38.9 Cg_endo -65.85 -32.73 45.23 Favored 'Trans proline' 0 C--N 1.312 -1.362 0 O-C-N 123.703 1.37 . . . . 0.0 110.255 179.355 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 55' ' ' GLU . . . . . . . . . . . . . 12.2 mp0 -66.73 -38.47 86.74 Favored 'General case' 0 N--CA 1.496 1.834 0 O-C-N 121.401 -0.812 . . . . 0.0 109.425 178.558 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 0.3 OUTLIER -74.14 -40.78 62.39 Favored 'General case' 0 N--CA 1.495 1.804 0 O-C-N 121.568 -0.707 . . . . 0.0 110.078 179.298 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 57' ' ' LEU . . . . . 0.552 ' HA ' ' HG3' ' A' ' 60' ' ' MET . 6.7 mt -62.39 -20.25 64.26 Favored 'General case' 0 N--CA 1.5 2.037 0 O-C-N 121.259 -0.9 . . . . 0.0 110.93 179.69 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 58' ' ' GLN . . . . . 0.576 ' HG3' ' N ' ' A' ' 59' ' ' GLU . 0.0 OUTLIER -59.81 -37.55 79.47 Favored 'General case' 0 N--CA 1.496 1.865 0 O-C-N 121.05 -1.031 . . . . 0.0 109.095 179.131 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' A' A ' 59' ' ' GLU . . . . . 0.576 ' N ' ' HG3' ' A' ' 58' ' ' GLN . 0.4 OUTLIER -73.56 -35.81 65.53 Favored 'General case' 0 N--CA 1.497 1.879 0 N-CA-C 108.9 -0.778 . . . . 0.0 108.9 178.128 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' A' A ' 60' ' ' MET . . . . . 0.552 ' HG3' ' HA ' ' A' ' 57' ' ' LEU . 1.6 mmm -58.92 -42.64 90.2 Favored 'General case' 0 N--CA 1.497 1.881 0 O-C-N 121.708 -0.62 . . . . 0.0 109.679 179.04 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 61' ' ' ILE . . . . . 0.568 HG23 HG23 ' A' ' 72' ' ' VAL . 3.2 mt -76.86 -42.29 32.87 Favored 'Isoleucine or valine' 0 N--CA 1.497 1.923 0 O-C-N 121.511 -0.743 . . . . 0.0 109.913 179.226 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 62' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -58.9 -31.5 68.67 Favored 'General case' 0 N--CA 1.502 2.141 0 O-C-N 121.438 -0.789 . . . . 0.0 110.909 179.943 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 63' ' ' GLU . . . . . . . . . . . . . 2.7 tt0 -53.54 -34.73 59.27 Favored 'General case' 0 N--CA 1.5 2.035 0 O-C-N 121.7 -0.625 . . . . 0.0 111.099 179.893 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 64' ' ' VAL . . . . . 0.512 HG21 HG13 ' A' ' 79' ' ' VAL . 9.8 p -118.46 16.87 7.04 Favored 'Isoleucine or valine' 0 N--CA 1.497 1.888 0 O-C-N 121.25 -0.906 . . . . 0.0 111.16 179.999 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 65' ' ' ASP . . . . . . . . . . . . . 25.7 t70 -92.6 -88.43 0.21 Allowed 'General case' 0 N--CA 1.498 1.934 0 O-C-N 120.902 -1.124 . . . . 0.0 110.091 179.673 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 66' ' ' GLU . . . . . . . . . . . . . 3.3 mt-10 47.84 38.67 9.26 Favored 'General case' 0 N--CA 1.504 2.24 0 O-C-N 121.374 -0.828 . . . . 0.0 111.326 179.654 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 67' ' ' ASP . . . . . . . . . . . . . 0.8 OUTLIER -114.77 -32.74 5.72 Favored 'General case' 0 N--CA 1.5 2.058 0 O-C-N 121.062 -1.024 . . . . 0.0 111.455 -179.774 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 68' ' ' GLY . . . . . . . . . . . . . . . 140.13 -30.87 2.31 Favored Glycine 0 N--CA 1.497 2.703 0 C-N-CA 120.006 -1.092 . . . . 0.0 110.658 179.923 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 69' ' ' SER . . . . . . . . . . . . . 11.4 p -93.55 -29.68 15.38 Favored 'General case' 0 N--CA 1.499 2.006 0 O-C-N 121.189 -1.183 . . . . 0.0 111.847 -179.358 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 70' ' ' GLY . . . . . . . . . . . . . . . 89.2 -42.62 3.03 Favored Glycine 0 N--CA 1.498 2.824 0 C-N-CA 119.614 -1.279 . . . . 0.0 109.919 -179.383 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 71' ' ' THR . . . . . . . . . . . . . 26.7 m -71.41 153.25 42.42 Favored 'General case' 0 N--CA 1.502 2.128 0 O-C-N 121.373 -1.075 . . . . 0.0 110.38 179.966 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 72' ' ' VAL . . . . . 0.568 HG23 HG23 ' A' ' 61' ' ' ILE . 1.7 t -77.22 138.11 21.13 Favored 'Isoleucine or valine' 0 N--CA 1.501 2.11 0 O-C-N 121.29 -0.881 . . . . 0.0 111.016 -179.579 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 73' ' ' ASP . . . . . . . . . . . . . 5.0 m-20 -104.0 -162.0 0.87 Allowed 'General case' 0 N--CA 1.5 2.042 0 O-C-N 121.597 -0.689 . . . . 0.0 109.858 179.291 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 74' ' ' PHE . . . . . . . . . . . . . 16.9 t80 -78.66 -65.21 1.02 Allowed 'General case' 0 N--CA 1.502 2.16 0 O-C-N 120.927 -1.108 . . . . 0.0 110.015 179.642 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 75' ' ' ASP . . . . . 0.754 ' HA ' HD12 ' A' ' 78' ' ' LEU . 0.6 OUTLIER -60.17 -31.43 70.1 Favored 'General case' 0 N--CA 1.498 1.933 0 O-C-N 121.327 -0.858 . . . . 0.0 109.73 179.34 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' A' A ' 76' ' ' GLU . . . . . 0.646 ' O ' HG12 ' A' ' 79' ' ' VAL . 3.8 tt0 -65.73 -36.37 83.39 Favored 'General case' 0 N--CA 1.498 1.971 0 O-C-N 121.365 -0.834 . . . . 0.0 108.793 178.07 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 77' ' ' PHE . . . . . 0.428 ' O ' ' HG2' ' A' ' 81' ' ' MET . 19.1 t80 -69.97 -37.98 75.94 Favored 'General case' 0 N--CA 1.494 1.732 0 N-CA-C 108.907 -0.775 . . . . 0.0 108.907 178.301 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 78' ' ' LEU . . . . . 0.754 HD12 ' HA ' ' A' ' 75' ' ' ASP . 17.4 mt -58.88 -44.51 91.12 Favored 'General case' 0 N--CA 1.498 1.954 0 O-C-N 121.581 -0.699 . . . . 0.0 110.292 179.308 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 79' ' ' VAL . . . . . 0.646 HG12 ' O ' ' A' ' 76' ' ' GLU . 9.0 p -72.74 -18.88 18.76 Favored 'Isoleucine or valine' 0 N--CA 1.5 2.034 0 O-C-N 121.334 -0.854 . . . . 0.0 110.211 178.803 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 80' ' ' MET . . . . . 0.411 ' SD ' HG11 ' A' ' 64' ' ' VAL . 13.6 ttt -76.58 -39.03 53.89 Favored 'General case' 0 N--CA 1.497 1.91 0 O-C-N 121.226 -0.921 . . . . 0.0 109.783 179.035 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 81' ' ' MET . . . . . 0.428 ' HG2' ' O ' ' A' ' 77' ' ' PHE . 55.3 mmm -60.69 -45.64 93.4 Favored 'General case' 0 N--CA 1.497 1.91 0 O-C-N 121.441 -0.787 . . . . 0.0 110.209 179.479 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 82' ' ' VAL . . . . . 0.702 HG21 ' HB1' ' A' ' 8' ' ' ALA . 1.8 p -69.91 -30.6 44.93 Favored 'Isoleucine or valine' 0 N--CA 1.496 1.826 0 O-C-N 121.364 -0.835 . . . . 0.0 110.111 179.558 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 83' ' ' ARG . . . . . 0.489 ' HA ' ' CE1' ' A' ' 5' ' ' TYR . 4.0 mtt-85 -65.5 -44.44 87.01 Favored 'General case' 0 N--CA 1.496 1.871 0 O-C-N 121.278 -0.888 . . . . 0.0 109.369 178.811 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 84' ' ' CYS . . . . . . . . . . . . . 23.9 t -72.63 -38.23 67.8 Favored 'General case' 0 N--CA 1.495 1.816 0 O-C-N 121.619 -0.676 . . . . 0.0 109.788 178.795 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 85' ' ' MET . . . . . . . . . . . . . 4.0 ttm . . . . . 0 N--CA 1.498 1.96 0 O-C-N 121.506 -0.746 . . . . 0.0 110.514 179.453 . . . . . . . . 0 0 . 1 . 003 nuclear build core ' B' B ' 149' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER . . . . . 0 N--CA 1.496 1.826 0 CA-C-O 121.087 0.47 . . . . 0.0 110.443 . . . . . . . . . 1 1 . 1 . 003 nuclear build core ' B' B ' 150' ' ' ALA . . . . . . . . . . . . . . . -57.72 -45.57 85.58 Favored 'General case' 0 N--CA 1.499 1.993 0 O-C-N 121.577 -0.702 . . . . 0.0 110.742 -179.915 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' B' B ' 151' ' ' ASP . . . . . . . . . . . . . 6.9 p-10 -67.64 -37.53 82.57 Favored 'General case' 0 N--CA 1.499 2.007 0 O-C-N 121.511 -0.743 . . . . 0.0 110.414 179.703 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' B' B ' 152' ' ' ALA . . . . . . . . . . . . . . . -62.55 -47.56 83.33 Favored 'General case' 0 N--CA 1.498 1.945 0 O-C-N 121.345 -0.847 . . . . 0.0 109.875 179.367 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' B' B ' 153' ' ' MET . . . . . . . . . . . . . 5.1 mtt -66.16 -39.9 90.14 Favored 'General case' 0 N--CA 1.496 1.846 0 O-C-N 121.692 -0.63 . . . . 0.0 110.029 179.254 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' B' B ' 154' ' ' MET . . . . . 0.514 ' HE3' ' HB3' ' A' ' 19' ' ' GLU . 0.3 OUTLIER -63.01 -51.88 65.11 Favored 'General case' 0 N--CA 1.496 1.83 0 O-C-N 121.622 -0.674 . . . . 0.0 110.314 179.815 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' B' B ' 155' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -64.15 -40.95 97.24 Favored 'General case' 0 N--CA 1.497 1.909 0 O-C-N 121.367 -0.833 . . . . 0.0 110.196 179.377 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' B' B ' 156' ' ' ALA . . . . . . . . . . . . . . . -62.43 -37.76 87.08 Favored 'General case' 0 N--CA 1.499 1.993 0 O-C-N 121.349 -0.844 . . . . 0.0 110.514 179.526 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' B' B ' 157' ' ' LEU . . . . . 0.502 ' O ' HD13 ' A' ' 26' ' ' ILE . 0.3 OUTLIER -89.13 -1.71 58.21 Favored 'General case' 0 N--CA 1.5 2.03 0 O-C-N 121.205 -0.934 . . . . 0.0 111.284 179.722 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' B' B ' 158' ' ' LEU . . . . . . . . . . . . . 1.5 mt . . . . . 0 N--CA 1.5 2.037 0 O-C-N 120.943 -1.098 . . . . 0.0 110.541 179.985 . . . . . . . . 0 0 . 1 . 004 nuclear build core ' A' A ' 4' ' ' ILE . . . . . . . . . . . . . 16.7 mt . . . . . 0 N--CA 1.497 1.889 0 CA-C-O 120.774 0.321 . . . . 0.0 110.595 . . . . . . . . . 0 0 . 1 . 004 nuclear build core ' A' A ' 5' ' ' TYR . . . . . 0.434 ' CE1' ' HD3' ' A' ' 83' ' ' ARG . 72.2 m-85 -59.05 -42.97 91.59 Favored 'General case' 0 N--CA 1.5 2.062 0 O-C-N 121.428 -0.795 . . . . 0.0 110.148 -179.919 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -62.52 -41.22 98.71 Favored 'General case' 0 N--CA 1.497 1.921 0 O-C-N 121.363 -0.836 . . . . 0.0 108.995 178.586 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 7' ' ' ALA . . . . . . . . . . . . . . . -63.6 -38.19 90.19 Favored 'General case' 0 N--CA 1.496 1.838 0 O-C-N 121.562 -0.711 . . . . 0.0 109.94 178.752 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 8' ' ' ALA . . . . . . . . . . . . . . . -58.67 -35.08 72.02 Favored 'General case' 0 N--CA 1.499 1.993 0 O-C-N 121.405 -0.809 . . . . 0.0 109.887 179.193 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 9' ' ' VAL . . . . . 0.58 ' HA ' HD12 ' A' ' 12' ' ' LEU . 40.9 t -61.27 -41.59 90.26 Favored 'Isoleucine or valine' 0 N--CA 1.498 1.946 0 O-C-N 121.495 -0.753 . . . . 0.0 109.493 178.908 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 10' ' ' GLU . . . . . . . . . . . . . 10.1 mt-10 -69.37 -26.91 64.9 Favored 'General case' 0 N--CA 1.498 1.972 0 O-C-N 121.55 -0.719 . . . . 0.0 110.224 179.082 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 11' ' ' GLN . . . . . . . . . . . . . 8.9 mt-30 -73.55 -36.2 65.6 Favored 'General case' 0 N--CA 1.499 2.013 0 O-C-N 121.403 -0.811 . . . . 0.0 110.694 179.91 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 12' ' ' LEU . . . . . 0.58 HD12 ' HA ' ' A' ' 9' ' ' VAL . 18.9 mt -58.5 136.75 57.61 Favored 'General case' 0 N--CA 1.496 1.87 0 O-C-N 121.51 -0.744 . . . . 0.0 110.619 -179.673 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 13' ' ' THR . . . . . . . . . . . . . 82.7 p -81.65 171.98 13.97 Favored 'General case' 0 N--CA 1.499 1.977 0 O-C-N 121.348 -0.845 . . . . 0.0 110.359 179.971 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 14' ' ' GLU . . . . . . . . . . . . . 1.0 OUTLIER -57.27 -34.34 68.54 Favored 'General case' 0 N--CA 1.491 1.583 0 O-C-N 121.511 -0.743 . . . . 0.0 109.981 179.84 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 1.4 mp0 -57.7 -55.48 34.32 Favored 'General case' 0 N--CA 1.497 1.885 0 O-C-N 121.652 -0.655 . . . . 0.0 109.745 179.273 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 16' ' ' GLN . . . . . 0.471 ' HA ' ' HB2' ' A' ' 19' ' ' GLU . 1.7 mt-30 -65.6 -37.77 87.57 Favored 'General case' 0 N--CA 1.498 1.967 0 O-C-N 121.494 -0.754 . . . . 0.0 110.178 179.345 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 17' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -58.91 -49.14 78.9 Favored 'General case' 0 N--CA 1.496 1.872 0 N-CA-C 109.333 -0.618 . . . . 0.0 109.333 179.009 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 18' ' ' ASN . . . . . . . . . . . . . 2.1 t30 -71.05 -34.37 71.19 Favored 'General case' 0 N--CA 1.494 1.762 0 O-C-N 121.62 -0.675 . . . . 0.0 109.449 178.861 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 19' ' ' GLU . . . . . 0.471 ' HB2' ' HA ' ' A' ' 16' ' ' GLN . 7.7 mt-10 -56.63 -48.03 78.4 Favored 'General case' 0 N--CA 1.5 2.062 0 O-C-N 121.567 -0.708 . . . . 0.0 110.064 178.991 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 20' ' ' PHE . . . . . . . . . . . . . 18.4 m-85 -66.8 -38.24 86.11 Favored 'General case' 0 N--CA 1.498 1.937 0 O-C-N 121.537 -0.727 . . . . 0.0 110.211 179.586 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 21' ' ' LYS . . . . . . . . . . . . . 14.2 tptt -56.7 -53.04 62.32 Favored 'General case' 0 N--CA 1.5 2.074 0 O-C-N 121.455 -0.778 . . . . 0.0 109.895 179.522 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 22' ' ' ALA . . . . . . . . . . . . . . . -60.1 -45.95 91.22 Favored 'General case' 0 N--CA 1.499 1.989 0 O-C-N 121.518 -0.739 . . . . 0.0 110.046 179.513 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 23' ' ' ALA . . . . . . . . . . . . . . . -61.73 -37.56 84.67 Favored 'General case' 0 N--CA 1.496 1.871 0 O-C-N 121.583 -0.698 . . . . 0.0 109.867 179.131 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 24' ' ' PHE . . . . . 0.529 ' O ' HG12 ' A' ' 28' ' ' VAL . 25.6 t80 -62.72 -45.39 92.96 Favored 'General case' 0 N--CA 1.495 1.823 0 O-C-N 121.565 -0.709 . . . . 0.0 109.971 179.328 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 25' ' ' ASP . . . . . . . . . . . . . 18.7 m-20 -56.37 -43.75 79.47 Favored 'General case' 0 N--CA 1.498 1.962 0 O-C-N 121.562 -0.711 . . . . 0.0 109.973 179.468 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 26' ' ' ILE . . . . . . . . . . . . . 41.0 mt -71.68 -32.24 44.68 Favored 'Isoleucine or valine' 0 N--CA 1.498 1.974 0 O-C-N 121.523 -0.736 . . . . 0.0 109.825 179.14 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 27' ' ' PHE . . . . . 0.758 ' HE2' HD11 ' B' ' 157' ' ' LEU . 0.2 OUTLIER -63.11 -43.56 98.11 Favored 'General case' 0 N--CA 1.498 1.947 0 O-C-N 121.511 -0.743 . . . . 0.0 110.421 179.727 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' A' A ' 28' ' ' VAL . . . . . 0.761 HG23 ' HB2' ' A' ' 31' ' ' ALA . 5.7 p -110.02 63.6 0.17 Allowed 'Isoleucine or valine' 0 N--CA 1.498 1.951 0 O-C-N 121.283 -0.885 . . . . 0.0 110.952 -179.956 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 29' ' ' LEU . . . . . . . . . . . . . 28.0 mt -80.0 77.17 6.7 Favored 'General case' 0 N--CA 1.499 2.007 0 N-CA-C 107.618 -1.253 . . . . 0.0 107.618 177.87 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 30' ' ' GLY . . . . . . . . . . . . . . . 97.48 -55.43 1.23 Allowed Glycine 0 N--CA 1.491 2.337 0 N-CA-C 107.185 -2.366 . . . . 0.0 107.185 -176.963 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 31' ' ' ALA . . . . . 0.761 ' HB2' HG23 ' A' ' 28' ' ' VAL . . . . . . . . 0 N--CA 1.5 2.043 0 CA-C-O 121.556 0.693 . . . . 0.0 111.946 178.367 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 35' ' ' CYS . . . . . . . . . . . . . 1.2 m . . . . . 0 N--CA 1.495 1.786 0 N-CA-C 109.464 -0.569 . . . . 0.0 109.464 . . . . . . . . . 0 0 . 1 . 004 nuclear build core ' A' A ' 36' ' ' ILE . . . . . 0.456 ' HB ' ' HB ' ' A' ' 72' ' ' VAL . 2.5 mp -91.84 98.87 8.87 Favored 'Isoleucine or valine' 0 N--CA 1.495 1.795 0 O-C-N 121.023 -1.048 . . . . 0.0 110.168 179.823 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 37' ' ' SER . . . . . . . . . . . . . 10.1 p -94.0 -165.75 1.38 Allowed 'General case' 0 N--CA 1.498 1.935 0 O-C-N 121.396 -0.815 . . . . 0.0 110.132 179.776 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 38' ' ' THR . . . . . . . . . . . . . 17.7 p -58.93 -39.28 81.12 Favored 'General case' 0 N--CA 1.502 2.138 0 O-C-N 121.284 -0.885 . . . . 0.0 110.527 179.727 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 39' ' ' LYS . . . . . . . . . . . . . 32.7 mttt -67.62 -45.82 74.29 Favored 'General case' 0 N--CA 1.499 1.975 0 O-C-N 121.43 -0.794 . . . . 0.0 110.071 179.567 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 2.4 mp0 -65.21 -40.35 94.04 Favored 'General case' 0 N--CA 1.502 2.129 0 O-C-N 121.383 -0.823 . . . . 0.0 109.93 179.408 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 41' ' ' LEU . . . . . 0.415 HD13 ' HA ' ' A' ' 41' ' ' LEU . 0.1 OUTLIER -67.68 -59.27 3.46 Favored 'General case' 0 N--CA 1.496 1.843 0 O-C-N 121.556 -0.715 . . . . 0.0 109.645 179.343 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' A' A ' 42' ' ' GLY . . . . . 0.56 ' HA2' ' HB2' ' A' ' 45' ' ' MET . . . -49.53 -33.48 17.79 Favored Glycine 0 N--CA 1.498 2.819 0 N-CA-C 110.527 -1.029 . . . . 0.0 110.527 179.661 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 43' ' ' LYS . . . . . . . . . . . . . 16.0 ttpt -55.12 -37.39 66.84 Favored 'General case' 0 N--CA 1.502 2.142 0 O-C-N 121.294 -1.121 . . . . 0.0 110.514 179.464 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 44' ' ' VAL . . . . . . . . . . . . . 42.6 t -90.81 -29.92 4.87 Favored 'Isoleucine or valine' 0 N--CA 1.497 1.912 0 O-C-N 121.277 -0.889 . . . . 0.0 109.815 179.165 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 45' ' ' MET . . . . . 0.56 ' HB2' ' HA2' ' A' ' 42' ' ' GLY . 5.4 mmt -57.57 -43.97 84.93 Favored 'General case' 0 N--CA 1.499 2.015 0 O-C-N 121.499 -0.75 . . . . 0.0 111.111 -179.949 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 46' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -53.3 -16.93 1.48 Allowed 'General case' 0 N--CA 1.504 2.261 0 O-C-N 121.35 -0.844 . . . . 0.0 112.298 -179.423 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 47' ' ' MET . . . . . . . . . . . . . 42.7 mtt -82.66 -30.39 29.33 Favored 'General case' 0 N--CA 1.499 2.022 0 O-C-N 120.833 -1.167 . . . . 0.0 111.072 179.717 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 48' ' ' LEU . . . . . . . . . . . . . 5.5 tp -143.43 -48.02 0.3 Allowed 'General case' 0 N--CA 1.495 1.786 0 O-C-N 121.134 -0.979 . . . . 0.0 111.453 -179.177 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 49' ' ' GLY . . . . . 0.414 ' O ' ' HB3' ' A' ' 45' ' ' MET . . . -95.11 102.48 2.86 Favored Glycine 0 N--CA 1.494 2.541 0 N-CA-C 110.09 -1.204 . . . . 0.0 110.09 -179.31 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 50' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -46.19 143.48 2.36 Favored 'General case' 0 N--CA 1.502 2.165 0 O-C-N 121.768 -0.842 . . . . 0.0 111.756 -179.941 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 51' ' ' ASN . . . . . . . . . . . . . 1.6 p-10 -130.59 92.69 34.14 Favored Pre-proline 0 N--CA 1.499 2.005 0 O-C-N 121.51 -0.744 . . . . 0.0 109.686 179.463 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 52' ' ' PRO . . . . . . . . . . . . . 43.6 Cg_endo -70.1 -38.67 6.75 Favored 'Trans proline' 0 N--CA 1.491 1.368 0 O-C-N 123.762 1.401 . . . . 0.0 111.4 -179.385 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 53' ' ' THR . . . . . 0.479 HG23 ' HB2' ' A' ' 56' ' ' GLU . 0.0 OUTLIER -145.16 153.54 52.99 Favored Pre-proline 0 N--CA 1.498 1.946 0 O-C-N 121.21 -0.931 . . . . 0.0 110.429 -179.862 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' A' A ' 54' ' ' PRO . . . . . . . . . . . . . 42.9 Cg_endo -68.59 -32.76 23.76 Favored 'Trans proline' 0 C--N 1.313 -1.332 0 O-C-N 124.126 1.593 . . . . 0.0 110.46 179.665 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 55' ' ' GLU . . . . . 0.449 ' HA ' ' HB2' ' A' ' 58' ' ' GLN . 33.7 mm-40 -61.26 -33.75 74.04 Favored 'General case' 0 N--CA 1.497 1.924 0 O-C-N 121.575 -0.703 . . . . 0.0 110.282 179.462 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 56' ' ' GLU . . . . . 0.479 ' HB2' HG23 ' A' ' 53' ' ' THR . 20.4 tt0 -57.06 -44.17 82.79 Favored 'General case' 0 N--CA 1.498 1.933 0 O-C-N 121.508 -0.745 . . . . 0.0 109.592 179.113 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 57' ' ' LEU . . . . . 0.546 ' H ' HD22 ' A' ' 57' ' ' LEU . 0.8 OUTLIER -77.1 -31.35 55.85 Favored 'General case' 0 N--CA 1.495 1.789 0 O-C-N 121.51 -0.744 . . . . 0.0 109.753 178.954 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' A' A ' 58' ' ' GLN . . . . . 0.449 ' HB2' ' HA ' ' A' ' 55' ' ' GLU . 0.0 OUTLIER -54.47 -49.94 68.92 Favored 'General case' 0 N--CA 1.496 1.842 0 O-C-N 121.341 -0.849 . . . . 0.0 109.014 179.076 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' A' A ' 59' ' ' GLU . . . . . . . . . . . . . 4.2 mt-10 -65.53 -34.69 78.86 Favored 'General case' 0 N--CA 1.496 1.872 0 O-C-N 121.712 -0.617 . . . . 0.0 109.432 178.16 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 60' ' ' MET . . . . . 0.456 ' HB2' ' O ' ' A' ' 57' ' ' LEU . 2.1 mmm -59.99 -47.05 87.43 Favored 'General case' 0 N--CA 1.498 1.931 0 O-C-N 121.649 -0.657 . . . . 0.0 110.071 179.449 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 61' ' ' ILE . . . . . 0.473 HG12 HG23 ' A' ' 72' ' ' VAL . 59.5 mt -72.79 -42.15 61.48 Favored 'Isoleucine or valine' 0 N--CA 1.498 1.962 0 O-C-N 121.332 -0.855 . . . . 0.0 110.046 179.437 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 62' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -57.58 -31.27 66.01 Favored 'General case' 0 N--CA 1.501 2.079 0 O-C-N 121.299 -0.876 . . . . 0.0 110.219 179.174 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 63' ' ' GLU . . . . . . . . . . . . . 1.3 tt0 -66.16 -33.03 74.85 Favored 'General case' 0 N--CA 1.496 1.841 0 O-C-N 121.183 -0.948 . . . . 0.0 109.471 178.697 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 64' ' ' VAL . . . . . 0.573 HG22 ' NH2' ' A' ' 83' ' ' ARG . 51.4 t -84.14 -37.01 12.59 Favored 'Isoleucine or valine' 0 N--CA 1.495 1.784 0 O-C-N 121.571 -0.706 . . . . 0.0 110.471 179.418 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 65' ' ' ASP . . . . . . . . . . . . . 0.0 OUTLIER -128.2 146.16 50.81 Favored 'General case' 0 N--CA 1.496 1.848 0 O-C-N 121.155 -0.966 . . . . 0.0 111.93 -179.39 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 66' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -139.79 46.29 1.88 Allowed 'General case' 0 N--CA 1.491 1.597 0 N-CA-C 108.301 -1.0 . . . . 0.0 108.301 178.331 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 67' ' ' ASP . . . . . . . . . . . . . 0.9 OUTLIER -104.59 43.8 1.07 Allowed 'General case' 0 N--CA 1.498 1.93 0 O-C-N 121.702 -0.624 . . . . 0.0 111.118 -178.844 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 68' ' ' GLY . . . . . . . . . . . . . . . 56.83 43.61 92.22 Favored Glycine 0 N--CA 1.499 2.895 0 N-CA-C 110.415 -1.074 . . . . 0.0 110.415 179.26 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 69' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -146.44 -52.2 0.23 Allowed 'General case' 0 N--CA 1.496 1.826 0 O-C-N 121.338 -1.096 . . . . 0.0 110.359 179.968 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 70' ' ' GLY . . . . . . . . . . . . . . . 69.31 23.91 76.2 Favored Glycine 0 N--CA 1.497 2.707 0 N-CA-C 109.95 -1.26 . . . . 0.0 109.95 -179.807 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 71' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -123.86 138.65 54.46 Favored 'General case' 0 N--CA 1.499 1.994 0 O-C-N 121.42 -1.047 . . . . 0.0 109.107 179.755 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 72' ' ' VAL . . . . . 0.473 HG23 HG12 ' A' ' 61' ' ' ILE . 26.1 t -76.17 126.67 37.11 Favored 'Isoleucine or valine' 0 N--CA 1.499 1.991 0 O-C-N 121.422 -0.798 . . . . 0.0 111.527 -178.985 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 73' ' ' ASP . . . . . 0.422 ' O ' ' HB2' ' A' ' 77' ' ' PHE . 0.2 OUTLIER -110.47 -168.0 1.26 Allowed 'General case' 0 N--CA 1.496 1.835 0 O-C-N 121.471 -0.768 . . . . 0.0 109.042 178.369 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' A' A ' 74' ' ' PHE . . . . . . . . . . . . . 25.8 t80 -66.66 -45.81 77.74 Favored 'General case' 0 N--CA 1.501 2.094 0 O-C-N 120.825 -1.172 . . . . 0.0 110.857 -179.83 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 75' ' ' ASP . . . . . . . . . . . . . 24.8 t70 -60.46 -53.95 51.37 Favored 'General case' 0 N--CA 1.5 2.039 0 O-C-N 121.405 -0.809 . . . . 0.0 110.482 179.867 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 76' ' ' GLU . . . . . . . . . . . . . 25.0 mt-10 -59.67 -40.66 88.51 Favored 'General case' 0 N--CA 1.499 1.99 0 O-C-N 121.484 -0.76 . . . . 0.0 110.252 179.572 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 77' ' ' PHE . . . . . 0.445 ' O ' ' HG2' ' A' ' 81' ' ' MET . 38.3 t80 -60.86 -41.37 95.75 Favored 'General case' 0 N--CA 1.496 1.853 0 O-C-N 121.472 -0.768 . . . . 0.0 110.317 179.718 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 78' ' ' LEU . . . . . 0.424 HD23 ' HA ' ' A' ' 78' ' ' LEU . 38.1 mt -60.28 -49.59 76.99 Favored 'General case' 0 N--CA 1.497 1.892 0 O-C-N 121.338 -0.851 . . . . 0.0 110.749 -179.849 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 79' ' ' VAL . . . . . 0.43 ' O ' ' HG3' ' A' ' 83' ' ' ARG . 3.5 m -73.45 -32.42 36.68 Favored 'Isoleucine or valine' 0 N--CA 1.501 2.092 0 O-C-N 121.119 -0.988 . . . . 0.0 109.782 179.626 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 80' ' ' MET . . . . . . . . . . . . . 9.6 ttt -59.03 -49.52 77.57 Favored 'General case' 0 N--CA 1.498 1.944 0 O-C-N 121.372 -0.83 . . . . 0.0 109.616 179.215 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 81' ' ' MET . . . . . 0.445 ' HG2' ' O ' ' A' ' 77' ' ' PHE . 83.8 mmm -62.64 -33.88 75.93 Favored 'General case' 0 N--CA 1.493 1.681 0 O-C-N 121.57 -0.706 . . . . 0.0 109.512 178.88 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 82' ' ' VAL . . . . . . . . . . . . . 3.2 t -66.34 -36.78 78.19 Favored 'Isoleucine or valine' 0 N--CA 1.497 1.893 0 O-C-N 121.6 -0.687 . . . . 0.0 109.985 179.13 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 83' ' ' ARG . . . . . 0.573 ' NH2' HG22 ' A' ' 64' ' ' VAL . 9.7 mtm180 -58.75 -39.5 81.12 Favored 'General case' 0 N--CA 1.502 2.136 0 O-C-N 121.431 -0.793 . . . . 0.0 110.328 179.511 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 84' ' ' CYS . . . . . . . . . . . . . 25.8 m -92.52 -15.88 26.46 Favored 'General case' 0 N--CA 1.499 1.992 0 O-C-N 121.367 -0.833 . . . . 0.0 111.118 179.71 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 85' ' ' MET . . . . . . . . . . . . . 30.7 ttp . . . . . 0 N--CA 1.498 1.957 0 O-C-N 121.196 -0.94 . . . . 0.0 110.405 -179.866 . . . . . . . . 0 0 . 1 . 004 nuclear build core ' B' B ' 149' ' ' SER . . . . . 0.463 ' HB3' ' HB3' ' B' ' 152' ' ' ALA . 13.3 t . . . . . 0 N--CA 1.497 1.881 0 CA-C-O 121.06 0.457 . . . . 0.0 110.103 . . . . . . . . . 1 1 . 1 . 004 nuclear build core ' B' B ' 150' ' ' ALA . . . . . . . . . . . . . . . -59.03 -40.13 84.07 Favored 'General case' 0 N--CA 1.499 2.017 0 O-C-N 121.442 -0.786 . . . . 0.0 110.721 179.926 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' B' B ' 151' ' ' ASP . . . . . . . . . . . . . 16.9 t70 -75.76 -49.33 18.49 Favored 'General case' 0 N--CA 1.497 1.88 0 O-C-N 121.318 -0.864 . . . . 0.0 110.256 179.648 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' B' B ' 152' ' ' ALA . . . . . 0.463 ' HB3' ' HB3' ' B' ' 149' ' ' SER . . . -58.58 -44.91 89.95 Favored 'General case' 0 N--CA 1.498 1.966 0 O-C-N 121.502 -0.749 . . . . 0.0 110.57 179.896 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' B' B ' 153' ' ' MET . . . . . . . . . . . . . 0.2 OUTLIER -65.83 -37.95 87.59 Favored 'General case' 0 N--CA 1.498 1.97 0 O-C-N 121.299 -0.876 . . . . 0.0 109.789 179.312 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' B' B ' 154' ' ' MET . . . . . . . . . . . . . 19.9 mmm -61.86 -42.27 98.85 Favored 'General case' 0 N--CA 1.497 1.915 0 O-C-N 121.454 -0.779 . . . . 0.0 109.635 178.862 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' B' B ' 155' ' ' GLN . . . . . . . . . . . . . 18.2 tt0 -67.02 -35.72 80.52 Favored 'General case' 0 N--CA 1.497 1.91 0 O-C-N 121.546 -0.721 . . . . 0.0 109.998 178.979 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' B' B ' 156' ' ' ALA . . . . . . . . . . . . . . . -67.72 -42.41 82.0 Favored 'General case' 0 N--CA 1.496 1.835 0 O-C-N 121.496 -0.753 . . . . 0.0 110.121 179.538 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' B' B ' 157' ' ' LEU . . . . . 0.758 HD11 ' HE2' ' A' ' 27' ' ' PHE . 2.4 mt -57.43 -33.76 68.25 Favored 'General case' 0 N--CA 1.499 1.981 0 O-C-N 121.615 -0.678 . . . . 0.0 111.031 179.705 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' B' B ' 158' ' ' LEU . . . . . . . . . . . . . 0.8 OUTLIER . . . . . 0 N--CA 1.495 1.824 0 O-C-N 121.377 -0.827 . . . . 0.0 110.793 -179.592 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 4' ' ' ILE . . . . . 0.436 HG23 ' N ' ' A' ' 5' ' ' TYR . 6.1 tp . . . . . 0 N--CA 1.499 2.008 0 CA-C-O 120.813 0.34 . . . . 0.0 110.516 . . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 5' ' ' TYR . . . . . 0.536 ' O ' HG23 ' A' ' 9' ' ' VAL . 42.1 m-85 -83.82 -32.15 25.47 Favored 'General case' 0 N--CA 1.496 1.868 0 O-C-N 121.33 -0.856 . . . . 0.0 109.289 178.596 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 3.4 ttmt -59.73 -45.73 91.3 Favored 'General case' 0 N--CA 1.499 2.001 0 O-C-N 121.716 -0.615 . . . . 0.0 110.382 179.548 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 7' ' ' ALA . . . . . . . . . . . . . . . -54.25 -42.75 70.28 Favored 'General case' 0 N--CA 1.498 1.949 0 O-C-N 121.666 -0.646 . . . . 0.0 110.113 179.695 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 8' ' ' ALA . . . . . . . . . . . . . . . -66.32 -39.74 89.46 Favored 'General case' 0 N--CA 1.497 1.887 0 O-C-N 121.552 -0.717 . . . . 0.0 110.358 179.374 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 9' ' ' VAL . . . . . 0.672 HG21 HG22 ' A' ' 79' ' ' VAL . 97.7 t -60.89 -41.52 89.13 Favored 'Isoleucine or valine' 0 N--CA 1.502 2.165 0 O-C-N 121.474 -0.766 . . . . 0.0 110.447 179.834 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 10' ' ' GLU . . . . . . . . . . . . . 17.9 mt-10 -79.86 -44.13 21.04 Favored 'General case' 0 N--CA 1.495 1.808 0 O-C-N 121.495 -0.753 . . . . 0.0 111.02 -179.641 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 11' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -89.64 39.15 0.94 Allowed 'General case' 0 N--CA 1.499 1.996 0 O-C-N 121.289 -0.882 . . . . 0.0 111.49 -179.532 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 12' ' ' LEU . . . . . 0.54 ' HB3' ' HD3' ' A' ' 17' ' ' LYS . 0.8 OUTLIER -78.65 138.71 38.44 Favored 'General case' 0 N--CA 1.497 1.899 0 O-C-N 120.916 -1.115 . . . . 0.0 109.783 179.165 . . . . . . . . 3 3 . 1 . 005 nuclear build core ' A' A ' 13' ' ' THR . . . . . 0.409 HG23 ' H ' ' A' ' 16' ' ' GLN . 14.9 t -69.66 164.15 24.02 Favored 'General case' 0 N--CA 1.501 2.079 0 O-C-N 121.264 -0.897 . . . . 0.0 111.396 -179.567 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 14' ' ' GLU . . . . . . . . . . . . . 17.7 tt0 -62.35 -35.89 80.52 Favored 'General case' 0 N--CA 1.495 1.8 0 O-C-N 121.844 -0.535 . . . . 0.0 110.897 -179.422 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 1.3 mp0 -56.89 -41.71 78.55 Favored 'General case' 0 N--CA 1.499 2.024 0 O-C-N 121.415 -0.803 . . . . 0.0 110.776 -179.838 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 16' ' ' GLN . . . . . 0.409 ' H ' HG23 ' A' ' 13' ' ' THR . 81.0 mt-30 -86.35 -44.94 11.67 Favored 'General case' 0 N--CA 1.497 1.907 0 O-C-N 121.333 -0.854 . . . . 0.0 110.796 -179.946 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 17' ' ' LYS . . . . . 0.54 ' HD3' ' HB3' ' A' ' 12' ' ' LEU . 0.2 OUTLIER -59.78 -47.21 86.58 Favored 'General case' 0 N--CA 1.5 2.031 0 O-C-N 121.81 -0.556 . . . . 0.0 110.611 -179.889 . . . . . . . . 3 3 . 1 . 005 nuclear build core ' A' A ' 18' ' ' ASN . . . . . 0.626 ' HA ' ' HG2' ' A' ' 21' ' ' LYS . 32.5 t30 -67.72 -29.49 68.74 Favored 'General case' 0 N--CA 1.495 1.799 0 O-C-N 121.461 -0.775 . . . . 0.0 110.447 179.593 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 12.7 tt0 -73.65 -43.43 59.5 Favored 'General case' 0 N--CA 1.492 1.669 0 O-C-N 121.237 -0.915 . . . . 0.0 109.876 179.444 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 20' ' ' PHE . . . . . . . . . . . . . 16.9 m-85 -73.59 -35.74 65.44 Favored 'General case' 0 N--CA 1.498 1.925 0 O-C-N 121.354 -0.841 . . . . 0.0 110.784 179.869 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 21' ' ' LYS . . . . . 0.626 ' HG2' ' HA ' ' A' ' 18' ' ' ASN . 0.0 OUTLIER -64.13 -30.86 71.9 Favored 'General case' 0 N--CA 1.496 1.868 0 O-C-N 121.14 -0.975 . . . . 0.0 110.207 179.546 . . . . . . . . 3 3 . 1 . 005 nuclear build core ' A' A ' 22' ' ' ALA . . . . . 0.515 ' N ' ' HG3' ' A' ' 21' ' ' LYS . . . -77.15 -31.69 55.76 Favored 'General case' 0 N--CA 1.5 2.034 0 O-C-N 121.401 -0.812 . . . . 0.0 109.603 178.701 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 23' ' ' ALA . . . . . . . . . . . . . . . -85.73 -8.69 58.01 Favored 'General case' 0 N--CA 1.494 1.773 0 O-C-N 121.416 -0.803 . . . . 0.0 110.328 178.96 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 24' ' ' PHE . . . . . . . . . . . . . 73.1 t80 -88.07 -52.05 5.46 Favored 'General case' 0 N--CA 1.494 1.773 0 O-C-N 121.179 -0.951 . . . . 0.0 110.382 -179.823 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 25' ' ' ASP . . . . . . . . . . . . . 3.1 p-10 -60.71 -36.18 78.16 Favored 'General case' 0 N--CA 1.501 2.077 0 O-C-N 121.26 -0.9 . . . . 0.0 110.348 179.85 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 26' ' ' ILE . . . . . 0.458 ' O ' HD12 ' A' ' 29' ' ' LEU . 81.9 mt -70.1 -34.55 59.77 Favored 'Isoleucine or valine' 0 N--CA 1.5 2.039 0 O-C-N 121.063 -1.023 . . . . 0.0 109.34 178.669 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 27' ' ' PHE . . . . . . . . . . . . . 0.3 OUTLIER -62.09 -43.86 97.91 Favored 'General case' 0 N--CA 1.497 1.888 0 O-C-N 121.463 -0.773 . . . . 0.0 110.248 179.244 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 28' ' ' VAL . . . . . . . . . . . . . 32.6 m -84.9 43.67 0.06 OUTLIER 'Isoleucine or valine' 0 N--CA 1.5 2.051 0 O-C-N 121.503 -0.748 . . . . 0.0 111.443 -179.675 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 29' ' ' LEU . . . . . 0.458 HD12 ' O ' ' A' ' 26' ' ' ILE . 0.1 OUTLIER -63.11 -55.12 27.98 Favored 'General case' 0 N--CA 1.499 2.02 0 O-C-N 121.019 -1.05 . . . . 0.0 109.718 179.161 . . . . . . . . 3 3 . 1 . 005 nuclear build core ' A' A ' 30' ' ' GLY . . . . . . . . . . . . . . . -103.1 52.89 0.77 Allowed Glycine 0 N--CA 1.497 2.721 0 N-CA-C 108.601 -1.8 . . . . 0.0 108.601 178.787 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 31' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.496 1.847 0 O-C-N 121.632 -0.922 . . . . 0.0 111.172 -179.269 . . . . . . . . 0 0 . 1 . 005 nuclear build core ' A' A ' 35' ' ' CYS . . . . . 0.413 ' HB3' ' HB ' ' A' ' 71' ' ' THR . 99.6 m . . . . . 0 N--CA 1.499 2.001 0 CA-C-O 121.02 0.438 . . . . 0.0 110.524 . . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 36' ' ' ILE . . . . . 0.423 ' HB ' ' HB ' ' A' ' 72' ' ' VAL . 66.8 mt -67.07 128.57 30.52 Favored 'Isoleucine or valine' 0 N--CA 1.502 2.152 0 O-C-N 121.323 -0.861 . . . . 0.0 110.462 -179.841 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 37' ' ' SER . . . . . . . . . . . . . 9.1 t -103.81 171.25 7.46 Favored 'General case' 0 N--CA 1.498 1.932 0 O-C-N 121.665 -0.647 . . . . 0.0 110.535 179.812 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 38' ' ' THR . . . . . 0.686 HG21 ' HG2' ' A' ' 58' ' ' GLN . 68.9 p -67.94 -48.75 65.06 Favored 'General case' 0 N--CA 1.502 2.143 0 O-C-N 121.278 -0.889 . . . . 0.0 110.4 -179.983 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 39' ' ' LYS . . . . . . . . . . . . . 0.7 OUTLIER -61.2 -37.97 84.89 Favored 'General case' 0 N--CA 1.5 2.063 0 O-C-N 121.295 -0.878 . . . . 0.0 109.316 178.98 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 12.9 tt0 -63.97 -46.52 84.26 Favored 'General case' 0 N--CA 1.495 1.802 0 CA-C-O 121.305 0.574 . . . . 0.0 109.479 178.874 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 41' ' ' LEU . . . . . 0.414 ' C ' ' CD1' ' A' ' 41' ' ' LEU . 0.1 OUTLIER -65.56 -58.02 6.79 Favored 'General case' 0 N--CA 1.494 1.763 0 O-C-N 121.634 -0.666 . . . . 0.0 109.275 178.798 . . . . . . . . 3 3 . 1 . 005 nuclear build core ' A' A ' 42' ' ' GLY . . . . . 0.404 ' O ' ' HB2' ' A' ' 45' ' ' MET . . . -47.27 -33.08 7.42 Favored Glycine 0 N--CA 1.502 3.057 0 N-CA-C 111.259 -0.737 . . . . 0.0 111.259 179.985 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 43' ' ' LYS . . . . . . . . . . . . . 1.8 tmtm? -58.98 -36.6 75.15 Favored 'General case' 0 N--CA 1.502 2.129 0 O-C-N 121.063 -1.257 . . . . 0.0 110.232 179.573 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 44' ' ' VAL . . . . . . . . . . . . . 93.9 t -85.05 -22.06 7.71 Favored 'Isoleucine or valine' 0 N--CA 1.498 1.961 0 O-C-N 121.499 -0.751 . . . . 0.0 109.911 179.335 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 45' ' ' MET . . . . . 0.404 ' HB2' ' O ' ' A' ' 42' ' ' GLY . 6.4 mmt -56.52 -36.9 69.73 Favored 'General case' 0 N--CA 1.499 2.02 0 O-C-N 121.262 -0.899 . . . . 0.0 110.326 179.35 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 46' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -62.21 -33.34 74.37 Favored 'General case' 0 N--CA 1.5 2.036 0 O-C-N 121.326 -0.858 . . . . 0.0 110.298 179.207 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 47' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -63.22 -32.28 73.64 Favored 'General case' 0 N--CA 1.501 2.102 0 O-C-N 121.342 -0.849 . . . . 0.0 110.141 179.332 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 48' ' ' LEU . . . . . . . . . . . . . 8.0 mt -93.2 -43.51 8.8 Favored 'General case' 0 N--CA 1.496 1.855 0 O-C-N 121.405 -0.81 . . . . 0.0 109.631 179.347 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 49' ' ' GLY . . . . . . . . . . . . . . . -143.73 -101.6 0.37 Allowed Glycine 0 N--CA 1.493 2.456 0 N-CA-C 109.082 -1.607 . . . . 0.0 109.082 179.557 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 50' ' ' GLN . . . . . . . . . . . . . 12.8 mt-30 -147.21 170.17 17.81 Favored 'General case' 0 N--CA 1.496 1.872 0 O-C-N 121.403 -1.057 . . . . 0.0 110.54 179.83 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 51' ' ' ASN . . . . . . . . . . . . . 44.7 t30 -138.79 104.76 7.49 Favored Pre-proline 0 N--CA 1.495 1.817 0 O-C-N 121.489 -0.757 . . . . 0.0 109.876 179.894 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 52' ' ' PRO . . . . . . . . . . . . . 48.9 Cg_endo -77.94 -50.74 0.08 OUTLIER 'Trans proline' 0 C--N 1.314 -1.267 0 O-C-N 123.771 1.406 . . . . 0.0 111.108 -179.614 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 53' ' ' THR . . . . . 0.478 ' OG1' ' HD2' ' A' ' 54' ' ' PRO . 0.1 OUTLIER -156.89 159.16 31.45 Favored Pre-proline 0 N--CA 1.498 1.931 0 O-C-N 121.142 -0.974 . . . . 0.0 110.739 -179.448 . . . . . . . . 3 3 . 1 . 005 nuclear build core ' A' A ' 54' ' ' PRO . . . . . 0.478 ' HD2' ' OG1' ' A' ' 53' ' ' THR . 42.5 Cg_endo -67.12 -24.57 44.56 Favored 'Trans proline' 0 N--CA 1.49 1.296 0 O-C-N 123.932 1.49 . . . . 0.0 110.69 179.246 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 55' ' ' GLU . . . . . . . . . . . . . 0.9 OUTLIER -59.31 -36.5 75.74 Favored 'General case' 0 N--CA 1.498 1.958 0 O-C-N 121.319 -0.863 . . . . 0.0 109.971 179.178 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 1.2 mm-40 -59.85 -42.93 94.69 Favored 'General case' 0 N--CA 1.497 1.882 0 O-C-N 121.502 -0.749 . . . . 0.0 109.808 179.103 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 57' ' ' LEU . . . . . 0.562 HD22 ' N ' ' A' ' 57' ' ' LEU . 2.6 mm? -74.05 -28.89 61.63 Favored 'General case' 0 N--CA 1.494 1.761 0 O-C-N 121.367 -0.833 . . . . 0.0 109.769 178.988 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 58' ' ' GLN . . . . . 0.686 ' HG2' HG21 ' A' ' 38' ' ' THR . 0.0 OUTLIER -54.83 -53.36 56.24 Favored 'General case' 0 N--CA 1.5 2.027 0 O-C-N 121.28 -0.887 . . . . 0.0 109.056 179.127 . . . . . . . . 3 3 . 1 . 005 nuclear build core ' A' A ' 59' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER -61.17 -33.71 73.87 Favored 'General case' 0 N--CA 1.495 1.804 0 N-CA-C 108.848 -0.797 . . . . 0.0 108.848 177.966 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 60' ' ' MET . . . . . 0.524 ' HB2' ' HA ' ' A' ' 57' ' ' LEU . 0.0 OUTLIER -64.65 -37.91 89.2 Favored 'General case' 0 N--CA 1.496 1.838 0 O-C-N 121.753 -0.592 . . . . 0.0 110.052 178.752 . . . . . . . . 3 3 . 1 . 005 nuclear build core ' A' A ' 61' ' ' ILE . . . . . 0.673 HG12 HG23 ' A' ' 72' ' ' VAL . 1.0 OUTLIER -74.57 -43.84 47.79 Favored 'Isoleucine or valine' 0 N--CA 1.496 1.835 0 O-C-N 121.308 -0.87 . . . . 0.0 109.573 179.375 . . . . . . . . 3 3 . 1 . 005 nuclear build core ' A' A ' 62' ' ' ASP . . . . . 0.411 ' N ' ' CG2' ' A' ' 61' ' ' ILE . 2.6 m-20 -55.6 -31.67 62.44 Favored 'General case' 0 N--CA 1.5 2.06 0 O-C-N 121.262 -0.899 . . . . 0.0 109.902 178.874 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 63' ' ' GLU . . . . . . . . . . . . . 7.4 tt0 -59.74 -35.07 73.82 Favored 'General case' 0 N--CA 1.497 1.92 0 O-C-N 121.737 -0.602 . . . . 0.0 110.672 179.226 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 64' ' ' VAL . . . . . 0.634 HG11 ' SD ' ' A' ' 80' ' ' MET . 9.9 p -124.11 23.38 3.87 Favored 'Isoleucine or valine' 0 N--CA 1.497 1.885 0 O-C-N 121.216 -0.927 . . . . 0.0 110.842 -179.75 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 65' ' ' ASP . . . . . . . . . . . . . 8.5 t70 -131.36 -82.44 0.52 Allowed 'General case' 0 N--CA 1.497 1.909 0 O-C-N 121.172 -0.955 . . . . 0.0 109.654 -179.918 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 66' ' ' GLU . . . . . . . . . . . . . 0.3 OUTLIER 40.81 48.46 2.71 Favored 'General case' 0 N--CA 1.505 2.315 0 O-C-N 121.42 -0.8 . . . . 0.0 112.366 178.734 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 67' ' ' ASP . . . . . . . . . . . . . 4.3 p-10 -117.46 7.39 12.73 Favored 'General case' 0 N--CA 1.501 2.08 0 O-C-N 120.982 -1.074 . . . . 0.0 111.079 179.532 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 68' ' ' GLY . . . . . . . . . . . . . . . 96.3 -5.46 65.35 Favored Glycine 0 N--CA 1.497 2.764 0 N-CA-C 110.521 -1.032 . . . . 0.0 110.521 -179.856 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 69' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -106.07 -43.82 4.74 Favored 'General case' 0 N--CA 1.496 1.838 0 O-C-N 121.049 -1.265 . . . . 0.0 110.496 -179.825 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 70' ' ' GLY . . . . . . . . . . . . . . . 78.78 19.84 72.25 Favored Glycine 0 N--CA 1.497 2.758 0 N-CA-C 109.527 -1.429 . . . . 0.0 109.527 -179.472 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 71' ' ' THR . . . . . 0.413 ' HB ' ' HB3' ' A' ' 35' ' ' CYS . 0.1 OUTLIER -132.22 124.01 28.11 Favored 'General case' 0 N--CA 1.492 1.643 0 O-C-N 121.601 -0.941 . . . . 0.0 108.652 -179.761 . . . . . . . . 3 3 . 1 . 005 nuclear build core ' A' A ' 72' ' ' VAL . . . . . 0.673 HG23 HG12 ' A' ' 61' ' ' ILE . 4.9 t -75.59 124.54 33.79 Favored 'Isoleucine or valine' 0 N--CA 1.496 1.844 0 O-C-N 121.448 -0.783 . . . . 0.0 111.008 -178.68 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 73' ' ' ASP . . . . . . . . . . . . . 18.0 t70 -95.6 -176.84 3.87 Favored 'General case' 0 N--CA 1.495 1.791 0 O-C-N 121.673 -0.642 . . . . 0.0 109.399 179.145 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 74' ' ' PHE . . . . . . . . . . . . . 28.6 t80 -60.07 -44.62 94.63 Favored 'General case' 0 N--CA 1.498 1.945 0 O-C-N 120.957 -1.09 . . . . 0.0 109.784 179.61 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 75' ' ' ASP . . . . . . . . . . . . . 31.4 t70 -62.71 -48.03 81.02 Favored 'General case' 0 N--CA 1.496 1.864 0 O-C-N 121.543 -0.723 . . . . 0.0 110.287 179.32 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 76' ' ' GLU . . . . . . . . . . . . . 54.0 mt-10 -66.92 -32.67 74.07 Favored 'General case' 0 N--CA 1.498 1.933 0 O-C-N 121.444 -0.785 . . . . 0.0 109.656 179.342 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 77' ' ' PHE . . . . . . . . . . . . . 68.3 t80 -60.74 -39.16 87.64 Favored 'General case' 0 N--CA 1.493 1.708 0 O-C-N 121.513 -0.742 . . . . 0.0 109.44 178.642 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 78' ' ' LEU . . . . . . . . . . . . . 88.9 mt -63.77 -37.94 89.26 Favored 'General case' 0 N--CA 1.498 1.942 0 O-C-N 121.432 -0.792 . . . . 0.0 109.46 178.736 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 79' ' ' VAL . . . . . 0.672 HG22 HG21 ' A' ' 9' ' ' VAL . 85.0 t -64.17 -34.74 70.81 Favored 'Isoleucine or valine' 0 N--CA 1.499 2.014 0 O-C-N 121.36 -0.838 . . . . 0.0 109.13 178.405 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 80' ' ' MET . . . . . 0.634 ' SD ' HG11 ' A' ' 64' ' ' VAL . 1.5 ttt -67.88 -39.48 83.69 Favored 'General case' 0 N--CA 1.496 1.842 0 O-C-N 121.552 -0.718 . . . . 0.0 109.53 178.835 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 81' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -65.95 -50.23 65.12 Favored 'General case' 0 N--CA 1.497 1.913 0 O-C-N 121.562 -0.711 . . . . 0.0 110.684 179.702 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 82' ' ' VAL . . . . . 0.472 HG12 ' O ' ' A' ' 79' ' ' VAL . 9.4 p -62.19 -30.02 47.9 Favored 'Isoleucine or valine' 0 N--CA 1.5 2.035 0 O-C-N 121.25 -0.906 . . . . 0.0 110.189 179.774 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 83' ' ' ARG . . . . . . . . . . . . . 3.2 mtp-105 -69.24 -46.48 67.21 Favored 'General case' 0 N--CA 1.495 1.78 0 O-C-N 121.354 -0.842 . . . . 0.0 109.392 178.724 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 84' ' ' CYS . . . . . . . . . . . . . 88.6 m -66.92 -32.78 74.27 Favored 'General case' 0 N--CA 1.497 1.906 0 O-C-N 121.61 -0.681 . . . . 0.0 110.155 179.254 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 85' ' ' MET . . . . . . . . . . . . . 32.2 mtm . . . . . 0 N--CA 1.5 2.033 0 O-C-N 121.453 -0.779 . . . . 0.0 110.249 179.216 . . . . . . . . 0 0 . 1 . 005 nuclear build core ' B' B ' 149' ' ' SER . . . . . . . . . . . . . 27.5 m . . . . . 0 N--CA 1.498 1.965 0 CA-C-O 121.252 0.548 . . . . 0.0 110.772 . . . . . . . . . 0 0 . 1 . 005 nuclear build core ' B' B ' 150' ' ' ALA . . . . . . . . . . . . . . . -60.47 -50.76 72.29 Favored 'General case' 0 N--CA 1.498 1.958 0 O-C-N 121.573 -0.704 . . . . 0.0 110.549 179.909 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' B' B ' 151' ' ' ASP . . . . . . . . . . . . . 7.5 p-10 -61.54 -34.79 76.16 Favored 'General case' 0 N--CA 1.5 2.029 0 O-C-N 121.453 -0.779 . . . . 0.0 110.68 179.771 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' B' B ' 152' ' ' ALA . . . . . . . . . . . . . . . -68.06 -54.4 18.55 Favored 'General case' 0 N--CA 1.497 1.878 0 O-C-N 121.316 -0.865 . . . . 0.0 110.44 179.995 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' B' B ' 153' ' ' MET . . . . . . . . . . . . . 1.1 tpt -66.16 -31.04 71.65 Favored 'General case' 0 N--CA 1.499 1.991 0 O-C-N 121.317 -0.865 . . . . 0.0 110.346 179.597 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' B' B ' 154' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -64.12 -41.21 97.31 Favored 'General case' 0 N--CA 1.499 2.009 0 O-C-N 121.348 -0.845 . . . . 0.0 110.326 179.486 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' B' B ' 155' ' ' GLN . . . . . . . . . . . . . 33.6 mt-30 -77.94 -31.75 51.16 Favored 'General case' 0 N--CA 1.499 1.98 0 O-C-N 121.346 -0.846 . . . . 0.0 110.83 179.878 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' B' B ' 156' ' ' ALA . . . . . . . . . . . . . . . -54.93 -45.85 74.87 Favored 'General case' 0 N--CA 1.501 2.11 0 O-C-N 121.386 -0.821 . . . . 0.0 110.959 -179.683 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' B' B ' 157' ' ' LEU . . . . . . . . . . . . . 1.2 tp -80.35 -46.35 16.22 Favored 'General case' 0 N--CA 1.496 1.83 0 O-C-N 121.173 -0.955 . . . . 0.0 110.208 179.71 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' B' B ' 158' ' ' LEU . . . . . . . . . . . . . 1.1 mp . . . . . 0 N--CA 1.495 1.816 0 O-C-N 121.34 -0.85 . . . . 0.0 109.308 179.207 . . . . . . . . 0 0 . 1 . 006 nuclear build core ' A' A ' 4' ' ' ILE . . . . . 0.438 HG23 ' N ' ' A' ' 5' ' ' TYR . 1.1 tp . . . . . 0 N--CA 1.499 2.023 0 CA-C-O 120.595 0.236 . . . . 0.0 111.107 . . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 5' ' ' TYR . . . . . 0.552 ' CD2' ' HG2' ' A' ' 83' ' ' ARG . 27.2 m-85 -78.84 -34.03 45.47 Favored 'General case' 0 N--CA 1.497 1.885 0 O-C-N 121.037 -1.039 . . . . 0.0 109.781 179.615 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 11.7 ttpp -61.03 -43.54 98.73 Favored 'General case' 0 N--CA 1.493 1.722 0 O-C-N 121.564 -0.71 . . . . 0.0 109.929 179.159 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 7' ' ' ALA . . . . . . . . . . . . . . . -55.31 -38.94 69.33 Favored 'General case' 0 N--CA 1.5 2.075 0 O-C-N 121.47 -0.769 . . . . 0.0 110.083 179.325 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 8' ' ' ALA . . . . . . . . . . . . . . . -61.0 -39.1 88.42 Favored 'General case' 0 N--CA 1.497 1.915 0 O-C-N 121.481 -0.762 . . . . 0.0 109.614 178.91 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 9' ' ' VAL . . . . . 0.94 ' HA ' HD12 ' A' ' 12' ' ' LEU . 59.1 t -64.27 -39.11 84.35 Favored 'Isoleucine or valine' 0 N--CA 1.499 2.0 0 O-C-N 121.532 -0.73 . . . . 0.0 109.288 178.784 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 10' ' ' GLU . . . . . . . . . . . . . 3.4 mt-10 -64.98 -29.07 69.97 Favored 'General case' 0 N--CA 1.5 2.041 0 O-C-N 121.459 -0.776 . . . . 0.0 109.769 178.675 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 11' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -82.62 -19.05 39.09 Favored 'General case' 0 N--CA 1.498 1.972 0 O-C-N 121.445 -0.784 . . . . 0.0 110.69 179.417 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 12' ' ' LEU . . . . . 0.94 HD12 ' HA ' ' A' ' 9' ' ' VAL . 18.3 mt -62.99 116.14 5.05 Favored 'General case' 0 N--CA 1.497 1.887 0 O-C-N 121.255 -0.903 . . . . 0.0 110.057 179.857 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 13' ' ' THR . . . . . . . . . . . . . 71.3 p -74.62 167.49 21.66 Favored 'General case' 0 N--CA 1.497 1.902 0 O-C-N 121.297 -0.877 . . . . 0.0 109.888 179.75 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 14' ' ' GLU . . . . . . . . . . . . . 9.7 tp10 -58.23 -34.71 70.73 Favored 'General case' 0 N--CA 1.492 1.671 0 O-C-N 121.588 -0.695 . . . . 0.0 110.643 -179.421 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 17.9 tt0 -59.32 -46.39 88.7 Favored 'General case' 0 N--CA 1.498 1.968 0 O-C-N 121.338 -0.851 . . . . 0.0 109.44 178.981 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 16' ' ' GLN . . . . . . . . . . . . . 3.2 mt-30 -65.15 -37.58 87.87 Favored 'General case' 0 N--CA 1.498 1.949 0 O-C-N 121.531 -0.73 . . . . 0.0 109.871 178.826 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 17' ' ' LYS . . . . . 0.474 ' HD2' HD11 ' A' ' 78' ' ' LEU . 15.8 mtmt -60.58 -40.3 91.22 Favored 'General case' 0 N--CA 1.497 1.882 0 N-CA-C 109.163 -0.68 . . . . 0.0 109.163 178.795 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 18' ' ' ASN . . . . . 0.481 ' HA ' ' HB3' ' A' ' 21' ' ' LYS . 8.2 t30 -64.9 -39.32 93.34 Favored 'General case' 0 N--CA 1.497 1.884 0 O-C-N 121.588 -0.695 . . . . 0.0 109.894 179.107 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 14.9 mt-10 -57.49 -42.49 82.8 Favored 'General case' 0 N--CA 1.499 1.988 0 O-C-N 121.46 -0.775 . . . . 0.0 109.224 178.862 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 20' ' ' PHE . . . . . . . . . . . . . 3.8 m-85 -75.5 -30.11 59.74 Favored 'General case' 0 N--CA 1.494 1.76 0 O-C-N 121.581 -0.699 . . . . 0.0 109.49 178.543 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 21' ' ' LYS . . . . . 0.481 ' HB3' ' HA ' ' A' ' 18' ' ' ASN . 0.0 OUTLIER -57.43 -32.55 67.01 Favored 'General case' 0 N--CA 1.498 1.965 0 O-C-N 121.58 -0.7 . . . . 0.0 109.638 179.042 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' A' A ' 22' ' ' ALA . . . . . 0.433 ' N ' ' HG3' ' A' ' 21' ' ' LYS . . . -58.3 -52.98 63.3 Favored 'General case' 0 N--CA 1.497 1.876 0 O-C-N 121.394 -0.816 . . . . 0.0 109.408 178.787 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 23' ' ' ALA . . . . . . . . . . . . . . . -68.89 -35.88 77.38 Favored 'General case' 0 N--CA 1.496 1.865 0 O-C-N 121.602 -0.687 . . . . 0.0 109.548 178.622 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 24' ' ' PHE . . . . . 0.476 ' HB3' ' HA ' ' A' ' 21' ' ' LYS . 70.8 t80 -61.58 -51.06 70.09 Favored 'General case' 0 N--CA 1.497 1.911 0 O-C-N 121.721 -0.612 . . . . 0.0 110.404 179.446 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 25' ' ' ASP . . . . . . . . . . . . . 0.7 OUTLIER -62.33 -44.91 95.4 Favored 'General case' 0 N--CA 1.498 1.964 0 O-C-N 121.562 -0.711 . . . . 0.0 110.241 179.812 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 26' ' ' ILE . . . . . . . . . . . . . 22.1 mt -65.84 -29.53 47.22 Favored 'Isoleucine or valine' 0 N--CA 1.498 1.947 0 O-C-N 121.268 -0.895 . . . . 0.0 109.68 179.009 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 27' ' ' PHE . . . . . 0.406 ' HZ ' ' SD ' ' B' ' 153' ' ' MET . 0.1 OUTLIER -62.14 -42.58 99.39 Favored 'General case' 0 N--CA 1.498 1.945 0 O-C-N 121.372 -0.83 . . . . 0.0 110.13 179.033 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' A' A ' 28' ' ' VAL . . . . . 0.414 ' H ' HG22 ' A' ' 28' ' ' VAL . 34.0 m -88.24 37.01 0.07 OUTLIER 'Isoleucine or valine' 0 N--CA 1.5 2.046 0 O-C-N 121.29 -0.881 . . . . 0.0 111.137 -179.846 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 29' ' ' LEU . . . . . . . . . . . . . 2.7 mt -74.17 -44.89 51.77 Favored 'General case' 0 N--CA 1.498 1.957 0 O-C-N 120.954 -1.091 . . . . 0.0 109.58 178.944 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 30' ' ' GLY . . . . . . . . . . . . . . . -110.46 30.3 8.32 Favored Glycine 0 N--CA 1.494 2.533 0 N-CA-C 109.381 -1.488 . . . . 0.0 109.381 179.071 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 31' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.497 1.901 0 O-C-N 121.363 -1.081 . . . . 0.0 110.585 -179.884 . . . . . . . . 0 0 . 1 . 006 nuclear build core ' A' A ' 35' ' ' CYS . . . . . 0.413 ' SG ' ' HB ' ' A' ' 71' ' ' THR . 30.3 p . . . . . 0 N--CA 1.499 1.989 0 N-CA-C 109.807 -0.442 . . . . 0.0 109.807 . . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 36' ' ' ILE . . . . . 0.67 ' HA ' ' HG2' ' A' ' 40' ' ' GLU . 4.2 mt -81.15 104.07 9.13 Favored 'Isoleucine or valine' 0 N--CA 1.497 1.916 0 O-C-N 120.94 -1.1 . . . . 0.0 110.207 179.833 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 37' ' ' SER . . . . . . . . . . . . . 0.9 OUTLIER -107.95 -170.54 1.7 Allowed 'General case' 0 N--CA 1.494 1.752 0 O-C-N 121.644 -0.66 . . . . 0.0 110.014 179.758 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 38' ' ' THR . . . . . . . . . . . . . 23.9 p -63.45 -37.7 88.3 Favored 'General case' 0 N--CA 1.502 2.175 0 O-C-N 121.23 -0.919 . . . . 0.0 110.54 179.726 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 39' ' ' LYS . . . . . . . . . . . . . 9.8 mtmt -63.47 -47.39 82.01 Favored 'General case' 0 N--CA 1.5 2.032 0 O-C-N 121.557 -0.714 . . . . 0.0 111.173 -179.77 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 40' ' ' GLU . . . . . 0.67 ' HG2' ' HA ' ' A' ' 36' ' ' ILE . 0.0 OUTLIER -60.49 -33.66 72.93 Favored 'General case' 0 N--CA 1.502 2.133 0 O-C-N 121.391 -0.818 . . . . 0.0 111.529 -179.074 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' A' A ' 41' ' ' LEU . . . . . 0.765 HD12 ' HG ' ' A' ' 57' ' ' LEU . 3.1 tm? -69.36 -66.73 0.55 Allowed 'General case' 0 N--CA 1.495 1.782 0 O-C-N 121.32 -0.863 . . . . 0.0 110.18 -179.771 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 42' ' ' GLY . . . . . . . . . . . . . . . -44.84 -42.42 7.77 Favored Glycine 0 N--CA 1.5 2.934 0 N-CA-C 110.61 -0.996 . . . . 0.0 110.61 -179.729 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 43' ' ' LYS . . . . . . . . . . . . . 5.1 mttm -56.96 -49.9 74.28 Favored 'General case' 0 N--CA 1.501 2.077 0 O-C-N 121.476 -1.014 . . . . 0.0 110.348 179.617 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 44' ' ' VAL . . . . . . . . . . . . . 21.3 t -67.42 -36.32 76.11 Favored 'Isoleucine or valine' 0 N--CA 1.5 2.07 0 O-C-N 121.334 -0.854 . . . . 0.0 110.179 179.221 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 45' ' ' MET . . . . . . . . . . . . . 1.2 mtt -63.11 -32.34 73.7 Favored 'General case' 0 N--CA 1.499 2.006 0 O-C-N 121.472 -0.767 . . . . 0.0 111.21 -179.89 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 46' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -47.92 -41.64 25.14 Favored 'General case' 0 N--CA 1.503 2.179 0 O-C-N 121.212 -0.93 . . . . 0.0 111.365 -179.786 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 47' ' ' MET . . . . . . . . . . . . . 13.3 ptt? -90.66 -27.69 18.86 Favored 'General case' 0 N--CA 1.5 2.041 0 O-C-N 121.162 -0.961 . . . . 0.0 110.395 179.384 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 48' ' ' LEU . . . . . . . . . . . . . 14.6 tp -128.86 87.45 2.57 Favored 'General case' 0 N--CA 1.492 1.654 0 O-C-N 121.367 -0.833 . . . . 0.0 109.236 179.423 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 49' ' ' GLY . . . . . . . . . . . . . . . 93.53 70.34 1.12 Allowed Glycine 0 N--CA 1.497 2.758 0 N-CA-C 108.504 -1.838 . . . . 0.0 108.504 -178.767 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 50' ' ' GLN . . . . . . . . . . . . . 3.2 mm-40 -36.93 136.41 0.39 Allowed 'General case' 0 N--CA 1.504 2.272 0 CA-C-O 121.574 0.702 . . . . 0.0 112.865 -178.518 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 51' ' ' ASN . . . . . 0.819 ' OD1' HD21 ' A' ' 57' ' ' LEU . 37.2 t30 -100.75 116.28 64.34 Favored Pre-proline 0 N--CA 1.493 1.725 0 O-C-N 121.843 -0.536 . . . . 0.0 110.048 179.353 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 52' ' ' PRO . . . . . . . . . . . . . 42.8 Cg_endo -73.26 -64.31 0.03 OUTLIER 'Trans proline' 0 C--N 1.311 -1.407 0 O-C-N 123.928 1.488 . . . . 0.0 111.705 -179.829 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 53' ' ' THR . . . . . . . . . . . . . 1.0 OUTLIER -118.25 152.64 50.92 Favored Pre-proline 0 N--CA 1.498 1.964 0 O-C-N 121.111 -0.993 . . . . 0.0 110.942 -179.252 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 54' ' ' PRO . . . . . . . . . . . . . 45.0 Cg_endo -71.69 -37.2 5.51 Favored 'Trans proline' 0 N--CA 1.492 1.401 0 O-C-N 123.941 1.495 . . . . 0.0 111.267 179.983 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 55' ' ' GLU . . . . . . . . . . . . . 2.5 mp0 -62.8 -32.3 73.45 Favored 'General case' 0 N--CA 1.5 2.03 0 O-C-N 121.374 -0.829 . . . . 0.0 110.732 -179.895 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 2.5 tt0 -51.9 -40.25 60.38 Favored 'General case' 0 N--CA 1.499 2.023 0 O-C-N 121.604 -0.685 . . . . 0.0 111.117 -179.997 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 57' ' ' LEU . . . . . 0.819 HD21 ' OD1' ' A' ' 51' ' ' ASN . 0.4 OUTLIER -73.62 -31.51 63.58 Favored 'General case' 0 N--CA 1.499 2.016 0 O-C-N 121.082 -1.012 . . . . 0.0 110.153 179.778 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' A' A ' 58' ' ' GLN . . . . . 0.46 ' O ' HG22 ' A' ' 61' ' ' ILE . 0.0 OUTLIER -58.08 -44.19 87.43 Favored 'General case' 0 N--CA 1.496 1.842 0 O-C-N 121.191 -0.943 . . . . 0.0 108.465 178.951 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' A' A ' 59' ' ' GLU . . . . . . . . . . . . . 2.0 mp0 -61.12 -36.09 78.79 Favored 'General case' 0 N--CA 1.496 1.874 0 O-C-N 121.282 -0.887 . . . . 0.0 108.68 177.831 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 60' ' ' MET . . . . . 0.409 ' HB2' ' O ' ' A' ' 57' ' ' LEU . 0.4 OUTLIER -62.61 -36.89 84.2 Favored 'General case' 0 N--CA 1.497 1.907 0 O-C-N 121.725 -0.609 . . . . 0.0 109.867 178.618 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' A' A ' 61' ' ' ILE . . . . . 0.478 HG13 HG23 ' A' ' 72' ' ' VAL . 0.8 OUTLIER -83.77 -31.78 8.37 Favored 'Isoleucine or valine' 0 N--CA 1.498 1.946 0 O-C-N 121.41 -0.806 . . . . 0.0 111.039 -179.916 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' A' A ' 62' ' ' ASP . . . . . . . . . . . . . 2.7 m-20 -58.04 -47.57 82.72 Favored 'General case' 0 N--CA 1.5 2.065 0 O-C-N 121.289 -0.882 . . . . 0.0 111.233 -179.37 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 63' ' ' GLU . . . . . . . . . . . . . 0.9 OUTLIER -63.5 -36.21 83.02 Favored 'General case' 0 N--CA 1.5 2.028 0 O-C-N 121.274 -0.891 . . . . 0.0 110.799 -179.875 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 64' ' ' VAL . . . . . . . . . . . . . 84.4 t -84.36 -30.44 7.28 Favored 'Isoleucine or valine' 0 N--CA 1.498 1.944 0 O-C-N 121.33 -0.856 . . . . 0.0 111.465 -179.49 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 65' ' ' ASP . . . . . . . . . . . . . 16.9 t70 -133.72 137.78 45.44 Favored 'General case' 0 N--CA 1.497 1.885 0 O-C-N 121.006 -1.058 . . . . 0.0 111.76 -179.368 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 66' ' ' GLU . . . . . . . . . . . . . 0.3 OUTLIER -148.17 45.39 1.07 Allowed 'General case' 0 N--CA 1.495 1.796 0 CA-C-O 121.573 0.701 . . . . 0.0 109.245 178.694 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 67' ' ' ASP . . . . . . . . . . . . . 12.7 p-10 -102.78 13.18 35.03 Favored 'General case' 0 N--CA 1.499 1.992 0 O-C-N 121.448 -0.783 . . . . 0.0 111.567 -179.359 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 68' ' ' GLY . . . . . . . . . . . . . . . 107.79 -51.55 0.71 Allowed Glycine 0 N--CA 1.496 2.657 0 C-N-CA 120.039 -1.077 . . . . 0.0 110.497 179.422 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 69' ' ' SER . . . . . . . . . . . . . 82.3 p -64.07 -55.78 19.68 Favored 'General case' 0 N--CA 1.501 2.11 0 O-C-N 121.241 -1.152 . . . . 0.0 110.876 -179.418 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 70' ' ' GLY . . . . . . . . . . . . . . . 89.75 34.74 8.2 Favored Glycine 0 N--CA 1.495 2.595 0 N-CA-C 108.326 -1.91 . . . . 0.0 108.326 -179.283 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 71' ' ' THR . . . . . 0.413 ' HB ' ' SG ' ' A' ' 35' ' ' CYS . 3.1 p -131.0 143.03 50.41 Favored 'General case' 0 N--CA 1.489 1.49 0 O-C-N 122.029 -0.689 . . . . 0.0 109.694 -179.29 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 72' ' ' VAL . . . . . 0.534 HG11 ' HD1' ' A' ' 77' ' ' PHE . 93.3 t -75.59 107.37 6.32 Favored 'Isoleucine or valine' 0 N--CA 1.496 1.87 0 O-C-N 121.545 -0.722 . . . . 0.0 110.598 -179.724 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 73' ' ' ASP . . . . . 0.405 ' HB2' ' HB2' ' A' ' 76' ' ' GLU . 1.1 m-20 -75.25 -175.34 2.66 Favored 'General case' 0 N--CA 1.497 1.913 0 O-C-N 121.415 -0.803 . . . . 0.0 110.244 179.601 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 74' ' ' PHE . . . . . . . . . . . . . 39.0 t80 -65.16 -58.09 6.88 Favored 'General case' 0 N--CA 1.499 2.002 0 O-C-N 121.194 -0.941 . . . . 0.0 109.779 179.951 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 75' ' ' ASP . . . . . 0.694 ' HA ' HD12 ' A' ' 78' ' ' LEU . 0.5 OUTLIER -65.79 -34.64 78.65 Favored 'General case' 0 N--CA 1.495 1.783 0 O-C-N 121.553 -0.717 . . . . 0.0 109.86 179.174 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' A' A ' 76' ' ' GLU . . . . . 0.405 ' HB2' ' HB2' ' A' ' 73' ' ' ASP . 19.3 mt-10 -63.67 -40.42 96.78 Favored 'General case' 0 N--CA 1.497 1.903 0 O-C-N 121.451 -0.78 . . . . 0.0 109.502 178.715 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 77' ' ' PHE . . . . . 0.534 ' HD1' HG11 ' A' ' 72' ' ' VAL . 57.6 t80 -56.86 -40.46 76.17 Favored 'General case' 0 N--CA 1.498 1.972 0 O-C-N 121.621 -0.674 . . . . 0.0 110.541 179.48 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 78' ' ' LEU . . . . . 0.721 HD22 HD13 ' A' ' 12' ' ' LEU . 27.2 mt -55.45 -40.5 71.65 Favored 'General case' 0 N--CA 1.502 2.16 0 O-C-N 121.463 -0.773 . . . . 0.0 110.63 179.831 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 79' ' ' VAL . . . . . 0.75 HG22 HG21 ' A' ' 9' ' ' VAL . 77.8 t -62.5 -34.85 67.0 Favored 'Isoleucine or valine' 0 N--CA 1.502 2.125 0 O-C-N 121.497 -0.752 . . . . 0.0 110.033 179.496 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 80' ' ' MET . . . . . . . . . . . . . 18.9 ttp -73.58 -35.27 65.4 Favored 'General case' 0 N--CA 1.494 1.732 0 O-C-N 121.342 -0.849 . . . . 0.0 110.305 179.539 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 81' ' ' MET . . . . . 0.46 ' CE ' ' HB2' ' B' ' 150' ' ' ALA . 12.0 mmm -66.62 -46.76 74.8 Favored 'General case' 0 N--CA 1.499 1.979 0 O-C-N 121.424 -0.798 . . . . 0.0 110.715 -179.719 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 82' ' ' VAL . . . . . . . . . . . . . 33.2 m -62.81 -32.64 56.5 Favored 'Isoleucine or valine' 0 N--CA 1.504 2.243 0 O-C-N 121.128 -0.983 . . . . 0.0 110.441 179.88 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 83' ' ' ARG . . . . . 0.552 ' HG2' ' CD2' ' A' ' 5' ' ' TYR . 69.8 mtt180 -66.84 -34.52 77.99 Favored 'General case' 0 N--CA 1.497 1.908 0 O-C-N 121.38 -0.825 . . . . 0.0 109.835 179.132 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 84' ' ' CYS . . . . . . . . . . . . . 79.5 m -77.41 -28.93 52.81 Favored 'General case' 0 N--CA 1.496 1.856 0 O-C-N 121.502 -0.749 . . . . 0.0 109.983 178.914 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 85' ' ' MET . . . . . . . . . . . . . 42.0 mtm . . . . . 0 N--CA 1.497 1.903 0 O-C-N 121.582 -0.699 . . . . 0.0 110.76 179.838 . . . . . . . . 0 0 . 1 . 006 nuclear build core ' B' B ' 149' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER . . . . . 0 N--CA 1.505 2.315 0 CA-C-O 121.41 0.624 . . . . 0.0 111.154 . . . . . . . . . 1 1 . 1 . 006 nuclear build core ' B' B ' 150' ' ' ALA . . . . . 0.46 ' HB2' ' CE ' ' A' ' 81' ' ' MET . . . -55.29 -42.76 74.08 Favored 'General case' 0 N--CA 1.501 2.118 0 O-C-N 121.412 -0.805 . . . . 0.0 110.824 179.955 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' B' B ' 151' ' ' ASP . . . . . . . . . . . . . 4.2 p-10 -53.92 -39.33 65.74 Favored 'General case' 0 N--CA 1.502 2.135 0 O-C-N 121.613 -0.679 . . . . 0.0 110.741 179.743 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' B' B ' 152' ' ' ALA . . . . . . . . . . . . . . . -87.14 -40.1 14.93 Favored 'General case' 0 N--CA 1.496 1.833 0 O-C-N 121.365 -0.834 . . . . 0.0 110.318 179.555 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' B' B ' 153' ' ' MET . . . . . 0.406 ' SD ' ' HZ ' ' A' ' 27' ' ' PHE . 5.7 ttt -60.09 -44.9 94.46 Favored 'General case' 0 N--CA 1.498 1.971 0 O-C-N 121.484 -0.76 . . . . 0.0 110.627 179.875 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' B' B ' 154' ' ' MET . . . . . . . . . . . . . 19.7 ttt -62.46 -43.63 98.34 Favored 'General case' 0 N--CA 1.497 1.917 0 O-C-N 121.474 -0.766 . . . . 0.0 110.428 179.773 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' B' B ' 155' ' ' GLN . . . . . . . . . . . . . 0.6 OUTLIER -65.42 -43.07 91.7 Favored 'General case' 0 N--CA 1.499 2.005 0 O-C-N 121.522 -0.737 . . . . 0.0 110.587 179.771 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' B' B ' 156' ' ' ALA . . . . . . . . . . . . . . . -63.43 -34.86 78.68 Favored 'General case' 0 N--CA 1.499 1.983 0 O-C-N 121.336 -0.853 . . . . 0.0 110.587 179.817 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' B' B ' 157' ' ' LEU . . . . . . . . . . . . . 24.8 tp -80.83 -49.46 11.05 Favored 'General case' 0 N--CA 1.495 1.809 0 O-C-N 121.301 -0.875 . . . . 0.0 110.611 179.849 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' B' B ' 158' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER . . . . . 0 N--CA 1.499 2.009 0 O-C-N 121.287 -0.883 . . . . 0.0 110.069 179.825 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 4' ' ' ILE . . . . . . . . . . . . . 5.3 mt . . . . . 0 N--CA 1.493 1.682 0 N-CA-C 109.294 -0.632 . . . . 0.0 109.294 . . . . . . . . . 0 0 . 1 . 007 nuclear build core ' A' A ' 5' ' ' TYR . . . . . . . . . . . . . 39.7 m-85 -68.77 -36.53 78.44 Favored 'General case' 0 N--CA 1.494 1.758 0 O-C-N 121.605 -0.684 . . . . 0.0 109.454 178.896 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 6' ' ' LYS . . . . . 0.457 ' O ' ' HB ' ' A' ' 9' ' ' VAL . 0.3 OUTLIER -64.99 -42.7 94.28 Favored 'General case' 0 N--CA 1.496 1.846 0 O-C-N 121.451 -0.78 . . . . 0.0 109.031 178.483 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' A' A ' 7' ' ' ALA . . . . . . . . . . . . . . . -61.46 -35.99 79.18 Favored 'General case' 0 N--CA 1.496 1.868 0 O-C-N 121.464 -0.772 . . . . 0.0 109.338 178.306 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 8' ' ' ALA . . . . . . . . . . . . . . . -66.57 -26.39 67.1 Favored 'General case' 0 N--CA 1.498 1.938 0 O-C-N 121.497 -0.752 . . . . 0.0 110.232 179.03 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 9' ' ' VAL . . . . . 0.681 ' HA ' HD12 ' A' ' 12' ' ' LEU . 57.1 t -59.51 -40.27 81.46 Favored 'Isoleucine or valine' 0 N--CA 1.498 1.963 0 O-C-N 121.301 -0.874 . . . . 0.0 109.416 179.036 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 10' ' ' GLU . . . . . . . . . . . . . 0.9 OUTLIER -61.69 -30.28 70.64 Favored 'General case' 0 N--CA 1.496 1.848 0 O-C-N 121.417 -0.802 . . . . 0.0 110.01 178.828 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 11' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -60.04 -33.81 72.55 Favored 'General case' 0 N--CA 1.5 2.035 0 O-C-N 121.407 -0.808 . . . . 0.0 109.388 178.406 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 12' ' ' LEU . . . . . 0.688 ' HB3' ' CB ' ' A' ' 16' ' ' GLN . 19.4 mt -67.62 -23.76 65.39 Favored 'General case' 0 N--CA 1.498 1.959 0 O-C-N 121.687 -0.633 . . . . 0.0 109.703 178.494 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 13' ' ' THR . . . . . 0.646 HG23 ' C ' ' A' ' 12' ' ' LEU . 1.3 p 74.2 165.78 0.29 Allowed 'General case' 0 N--CA 1.51 2.555 0 C-N-CA 123.47 0.708 . . . . 0.0 110.86 -179.594 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 14' ' ' GLU . . . . . . . . . . . . . 1.1 tp10 -57.33 -30.63 64.96 Favored 'General case' 0 N--CA 1.494 1.751 0 O-C-N 121.645 -0.659 . . . . 0.0 110.779 -178.958 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER -57.53 -47.4 82.1 Favored 'General case' 0 N--CA 1.495 1.782 0 O-C-N 121.436 -0.79 . . . . 0.0 109.395 178.803 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 16' ' ' GLN . . . . . 0.688 ' CB ' ' HB3' ' A' ' 12' ' ' LEU . 27.3 mt-30 -72.79 -38.55 67.2 Favored 'General case' 0 N--CA 1.495 1.815 0 O-C-N 121.459 -0.776 . . . . 0.0 110.076 178.951 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 17' ' ' LYS . . . . . 0.407 ' HD2' HG12 ' A' ' 9' ' ' VAL . 0.0 OUTLIER -56.68 -45.99 81.39 Favored 'General case' 0 N--CA 1.498 1.943 0 N-CA-C 109.259 -0.645 . . . . 0.0 109.259 179.132 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' A' A ' 18' ' ' ASN . . . . . . . . . . . . . 21.2 m-80 -71.21 -36.48 71.91 Favored 'General case' 0 N--CA 1.494 1.766 0 O-C-N 121.603 -0.686 . . . . 0.0 109.249 178.281 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 19' ' ' GLU . . . . . 0.471 ' HB2' ' HA ' ' A' ' 16' ' ' GLN . 15.2 mt-10 -62.24 -52.13 64.98 Favored 'General case' 0 N--CA 1.498 1.96 0 O-C-N 121.568 -0.707 . . . . 0.0 109.95 179.108 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 20' ' ' PHE . . . . . 0.482 ' CE1' ' HG2' ' A' ' 81' ' ' MET . 17.7 m-85 -62.51 -40.03 95.42 Favored 'General case' 0 N--CA 1.497 1.921 0 O-C-N 121.497 -0.752 . . . . 0.0 109.841 179.467 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 21' ' ' LYS . . . . . . . . . . . . . 13.8 tptt -59.1 -46.16 89.01 Favored 'General case' 0 N--CA 1.499 1.993 0 O-C-N 121.433 -0.792 . . . . 0.0 109.534 178.93 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 22' ' ' ALA . . . . . . . . . . . . . . . -68.74 -46.42 68.93 Favored 'General case' 0 N--CA 1.496 1.829 0 O-C-N 121.626 -0.671 . . . . 0.0 109.918 179.436 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 23' ' ' ALA . . . . . . . . . . . . . . . -62.53 -34.72 77.47 Favored 'General case' 0 N--CA 1.498 1.963 0 O-C-N 121.432 -0.792 . . . . 0.0 109.538 178.808 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 24' ' ' PHE . . . . . 0.602 ' CE1' HD12 ' A' ' 36' ' ' ILE . 65.5 t80 -60.39 -48.25 82.55 Favored 'General case' 0 N--CA 1.496 1.829 0 N-CA-C 109.138 -0.69 . . . . 0.0 109.138 178.839 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 25' ' ' ASP . . . . . . . . . . . . . 0.9 OUTLIER -64.36 -34.42 78.12 Favored 'General case' 0 N--CA 1.496 1.852 0 O-C-N 121.54 -0.725 . . . . 0.0 109.361 178.663 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 26' ' ' ILE . . . . . 0.921 ' HA ' HD12 ' A' ' 29' ' ' LEU . 15.9 mm -67.06 -34.69 71.4 Favored 'Isoleucine or valine' 0 N--CA 1.498 1.926 0 O-C-N 121.328 -0.857 . . . . 0.0 109.112 178.372 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 27' ' ' PHE . . . . . . . . . . . . . 0.2 OUTLIER -65.4 -34.52 78.5 Favored 'General case' 0 N--CA 1.498 1.966 0 O-C-N 121.569 -0.707 . . . . 0.0 110.587 179.366 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 28' ' ' VAL . . . . . 0.551 ' HA ' ' HB2' ' A' ' 31' ' ' ALA . 32.9 m -93.4 1.5 9.47 Favored 'Isoleucine or valine' 0 N--CA 1.502 2.142 0 O-C-N 121.283 -0.886 . . . . 0.0 112.064 -179.39 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 29' ' ' LEU . . . . . 0.921 HD12 ' HA ' ' A' ' 26' ' ' ILE . 2.3 mt -63.28 -45.92 89.19 Favored 'General case' 0 N--CA 1.501 2.089 0 O-C-N 120.821 -1.174 . . . . 0.0 109.688 179.33 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 30' ' ' GLY . . . . . . . . . . . . . . . -103.66 43.66 1.63 Allowed Glycine 0 N--CA 1.492 2.414 0 N-CA-C 108.561 -1.815 . . . . 0.0 108.561 178.643 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 31' ' ' ALA . . . . . 0.551 ' HB2' ' HA ' ' A' ' 28' ' ' VAL . . . . . . . . 0 N--CA 1.496 1.838 0 O-C-N 121.528 -0.984 . . . . 0.0 111.197 -179.18 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 35' ' ' CYS . . . . . . . . . . . . . 1.3 m . . . . . 0 N--CA 1.497 1.881 0 N-CA-C 109.965 -0.383 . . . . 0.0 109.965 . . . . . . . . . 0 0 . 1 . 007 nuclear build core ' A' A ' 36' ' ' ILE . . . . . 0.602 HD12 ' CE1' ' A' ' 24' ' ' PHE . 96.6 mt -90.27 101.64 12.49 Favored 'Isoleucine or valine' 0 N--CA 1.496 1.829 0 O-C-N 121.117 -0.99 . . . . 0.0 110.57 -179.781 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 37' ' ' SER . . . . . . . . . . . . . 83.8 p -113.55 -179.36 3.62 Favored 'General case' 0 N--CA 1.494 1.733 0 N-CA-C 108.983 -0.747 . . . . 0.0 108.983 178.854 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 38' ' ' THR . . . . . 0.65 HG21 ' HG2' ' A' ' 58' ' ' GLN . 8.6 p -62.6 -41.18 98.82 Favored 'General case' 0 N--CA 1.5 2.041 0 O-C-N 120.963 -1.086 . . . . 0.0 110.056 179.515 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 39' ' ' LYS . . . . . 0.528 ' HA ' ' HB3' ' A' ' 54' ' ' PRO . 1.0 OUTLIER -60.94 -35.16 76.01 Favored 'General case' 0 N--CA 1.501 2.079 0 O-C-N 121.485 -0.759 . . . . 0.0 110.018 179.263 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 1.1 tp10 -83.41 -39.2 20.93 Favored 'General case' 0 N--CA 1.493 1.709 0 O-C-N 121.507 -0.746 . . . . 0.0 109.636 179.041 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 41' ' ' LEU . . . . . 0.485 HD11 ' CG ' ' A' ' 45' ' ' MET . 9.1 tp -62.63 -49.0 76.91 Favored 'General case' 0 N--CA 1.498 1.957 0 O-C-N 121.623 -0.673 . . . . 0.0 110.588 179.72 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 42' ' ' GLY . . . . . . . . . . . . . . . -54.36 -38.41 62.23 Favored Glycine 0 N--CA 1.494 2.549 0 N-CA-C 110.84 -0.904 . . . . 0.0 110.84 -179.038 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 43' ' ' LYS . . . . . . . . . . . . . 0.4 OUTLIER -54.49 -41.48 69.62 Favored 'General case' 0 N--CA 1.503 2.199 0 O-C-N 121.309 -1.112 . . . . 0.0 110.298 179.686 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 44' ' ' VAL . . . . . . . . . . . . . 44.0 t -83.08 -36.65 13.09 Favored 'Isoleucine or valine' 0 N--CA 1.499 2.014 0 O-C-N 121.349 -0.844 . . . . 0.0 109.876 179.21 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 45' ' ' MET . . . . . 0.704 ' HB3' ' HB2' ' A' ' 51' ' ' ASN . 69.4 mmm -61.91 -41.22 97.67 Favored 'General case' 0 N--CA 1.501 2.098 0 O-C-N 121.527 -0.733 . . . . 0.0 110.47 179.815 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 46' ' ' ARG . . . . . . . . . . . . . 8.9 tpt180 -67.34 -36.98 82.52 Favored 'General case' 0 N--CA 1.497 1.885 0 O-C-N 121.304 -0.872 . . . . 0.0 109.592 179.153 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 47' ' ' MET . . . . . . . . . . . . . 43.2 ttp -75.59 -1.97 26.99 Favored 'General case' 0 N--CA 1.499 1.977 0 O-C-N 121.559 -0.713 . . . . 0.0 110.46 178.704 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 48' ' ' LEU . . . . . . . . . . . . . 4.2 tp -119.66 -54.74 2.15 Favored 'General case' 0 N--CA 1.493 1.702 0 O-C-N 121.024 -1.048 . . . . 0.0 109.728 179.95 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 49' ' ' GLY . . . . . . . . . . . . . . . -114.04 -116.62 3.25 Favored Glycine 0 N--CA 1.494 2.515 0 N-CA-C 109.221 -1.552 . . . . 0.0 109.221 179.426 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 50' ' ' GLN . . . . . 0.482 ' O ' ' HD3' ' A' ' 52' ' ' PRO . 0.8 OUTLIER -139.11 13.68 2.63 Favored 'General case' 0 N--CA 1.5 2.067 0 O-C-N 121.375 -1.074 . . . . 0.0 111.933 -179.866 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' A' A ' 51' ' ' ASN . . . . . 0.704 ' HB2' ' HB3' ' A' ' 45' ' ' MET . 8.2 m120 -78.0 108.88 8.35 Favored Pre-proline 0 N--CA 1.505 2.291 0 O-C-N 121.02 -1.05 . . . . 0.0 109.633 179.897 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 52' ' ' PRO . . . . . 0.482 ' HD3' ' O ' ' A' ' 50' ' ' GLN . 45.2 Cg_endo -93.15 -73.6 0.0 OUTLIER 'Trans proline' 0 C--N 1.313 -1.292 0 C-N-CA 121.728 1.619 . . . . 0.0 112.627 -177.983 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 53' ' ' THR . . . . . . . . . . . . . 11.7 p -67.9 142.55 95.61 Favored Pre-proline 0 N--CA 1.499 1.986 0 O-C-N 121.311 -0.868 . . . . 0.0 111.599 -178.298 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 54' ' ' PRO . . . . . 0.528 ' HB3' ' HA ' ' A' ' 39' ' ' LYS . 43.4 Cg_endo -67.41 -32.81 31.38 Favored 'Trans proline' 0 N--CA 1.491 1.359 0 O-C-N 124.285 1.676 . . . . 0.0 110.893 179.577 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 55' ' ' GLU . . . . . . . . . . . . . 1.6 mp0 -57.92 -31.95 67.29 Favored 'General case' 0 N--CA 1.502 2.144 0 O-C-N 121.4 -0.813 . . . . 0.0 109.988 179.508 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 1.0 OUTLIER -62.8 -38.48 90.86 Favored 'General case' 0 N--CA 1.496 1.874 0 O-C-N 121.543 -0.723 . . . . 0.0 110.13 179.408 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 57' ' ' LEU . . . . . 0.523 ' H ' HD22 ' A' ' 57' ' ' LEU . 0.5 OUTLIER -87.5 -12.55 45.6 Favored 'General case' 0 N--CA 1.495 1.801 0 O-C-N 121.291 -0.88 . . . . 0.0 110.66 179.624 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' A' A ' 58' ' ' GLN . . . . . 0.65 ' HG2' HG21 ' A' ' 38' ' ' THR . 0.0 OUTLIER -56.27 -38.09 70.68 Favored 'General case' 0 N--CA 1.502 2.154 0 O-C-N 121.218 -0.926 . . . . 0.0 110.55 179.838 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' A' A ' 59' ' ' GLU . . . . . . . . . . . . . 0.9 OUTLIER -58.95 -32.16 69.36 Favored 'General case' 0 N--CA 1.498 1.951 0 O-C-N 121.018 -1.052 . . . . 0.0 109.439 178.82 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 60' ' ' MET . . . . . 0.439 ' CE ' HD12 ' A' ' 57' ' ' LEU . 40.7 mtm -78.41 -47.47 17.51 Favored 'General case' 0 N--CA 1.495 1.786 0 O-C-N 121.586 -0.696 . . . . 0.0 110.244 179.03 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 61' ' ' ILE . . . . . 0.717 HG13 HG23 ' A' ' 72' ' ' VAL . 11.0 tt -62.36 -41.57 92.21 Favored 'Isoleucine or valine' 0 N--CA 1.501 2.108 0 O-C-N 121.219 -0.926 . . . . 0.0 110.39 179.812 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 62' ' ' ASP . . . . . . . . . . . . . 0.8 OUTLIER -64.77 -36.3 83.88 Favored 'General case' 0 N--CA 1.499 2.015 0 O-C-N 121.249 -0.907 . . . . 0.0 110.159 179.286 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 63' ' ' GLU . . . . . . . . . . . . . 3.1 tt0 -63.0 -28.56 70.18 Favored 'General case' 0 N--CA 1.498 1.954 0 O-C-N 121.48 -0.762 . . . . 0.0 110.435 179.196 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 64' ' ' VAL . . . . . . . . . . . . . 4.0 t -114.95 25.85 4.03 Favored 'Isoleucine or valine' 0 N--CA 1.498 1.971 0 O-C-N 121.203 -0.936 . . . . 0.0 110.567 179.838 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 65' ' ' ASP . . . . . 0.498 ' HB2' ' O ' ' A' ' 61' ' ' ILE . 16.9 t70 -110.64 -73.9 0.67 Allowed 'General case' 0 N--CA 1.5 2.03 0 O-C-N 120.966 -1.084 . . . . 0.0 110.551 179.973 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 66' ' ' GLU . . . . . . . . . . . . . 7.7 tt0 57.92 23.31 9.67 Favored 'General case' 0 N--CA 1.501 2.109 0 O-C-N 121.607 -0.683 . . . . 0.0 110.86 -179.396 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 67' ' ' ASP . . . . . . . . . . . . . 64.9 m-20 -111.85 5.29 18.9 Favored 'General case' 0 N--CA 1.496 1.853 0 O-C-N 121.257 -0.902 . . . . 0.0 110.948 179.669 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 68' ' ' GLY . . . . . . . . . . . . . . . 63.49 38.06 95.74 Favored Glycine 0 N--CA 1.495 2.599 0 N-CA-C 108.703 -1.759 . . . . 0.0 108.703 -178.931 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 69' ' ' SER . . . . . . . . . . . . . 71.0 p -139.11 -53.53 0.57 Allowed 'General case' 0 N--CA 1.495 1.8 0 O-C-N 121.626 -0.926 . . . . 0.0 110.73 -179.1 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 70' ' ' GLY . . . . . . . . . . . . . . . 90.25 45.35 4.43 Favored Glycine 0 N--CA 1.497 2.738 0 N-CA-C 108.639 -1.785 . . . . 0.0 108.639 -179.308 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 71' ' ' THR . . . . . . . . . . . . . 0.9 OUTLIER -140.44 126.1 19.17 Favored 'General case' 0 N--CA 1.493 1.72 0 O-C-N 121.861 -0.788 . . . . 0.0 109.993 -179.154 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 72' ' ' VAL . . . . . 0.717 HG23 HG13 ' A' ' 61' ' ' ILE . 53.9 t -80.66 105.88 11.06 Favored 'Isoleucine or valine' 0 N--CA 1.497 1.879 0 O-C-N 121.535 -0.728 . . . . 0.0 110.567 -179.98 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 73' ' ' ASP . . . . . 0.4 ' O ' ' HB2' ' A' ' 77' ' ' PHE . 1.1 t70 -85.29 -162.9 0.76 Allowed 'General case' 0 N--CA 1.495 1.799 0 O-C-N 121.366 -0.834 . . . . 0.0 109.854 179.287 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 74' ' ' PHE . . . . . . . . . . . . . 25.7 t80 -64.91 -50.86 64.84 Favored 'General case' 0 N--CA 1.499 1.988 0 O-C-N 121.085 -1.009 . . . . 0.0 110.278 -179.917 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 75' ' ' ASP . . . . . . . . . . . . . 25.0 t70 -60.19 -49.61 76.93 Favored 'General case' 0 N--CA 1.497 1.902 0 O-C-N 121.543 -0.723 . . . . 0.0 109.947 179.31 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 76' ' ' GLU . . . . . . . . . . . . . 30.5 mt-10 -60.73 -37.93 83.42 Favored 'General case' 0 N--CA 1.498 1.929 0 O-C-N 121.473 -0.767 . . . . 0.0 110.468 179.633 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 77' ' ' PHE . . . . . 0.4 ' HB2' ' O ' ' A' ' 73' ' ' ASP . 42.6 t80 -59.63 -48.29 82.24 Favored 'General case' 0 N--CA 1.498 1.973 0 O-C-N 121.317 -0.864 . . . . 0.0 110.142 179.445 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 78' ' ' LEU . . . . . . . . . . . . . 16.2 mt -66.84 -37.88 85.32 Favored 'General case' 0 N--CA 1.501 2.09 0 O-C-N 121.41 -0.806 . . . . 0.0 110.023 179.579 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 79' ' ' VAL . . . . . . . . . . . . . 39.2 t -59.71 -36.7 67.27 Favored 'Isoleucine or valine' 0 N--CA 1.499 2.025 0 O-C-N 121.49 -0.756 . . . . 0.0 110.012 179.192 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 80' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -69.99 -40.34 75.35 Favored 'General case' 0 N--CA 1.496 1.849 0 O-C-N 121.359 -0.838 . . . . 0.0 109.868 179.332 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 81' ' ' MET . . . . . 0.482 ' HG2' ' CE1' ' A' ' 20' ' ' PHE . 0.0 OUTLIER -62.53 -48.4 79.71 Favored 'General case' 0 N--CA 1.496 1.848 0 O-C-N 121.557 -0.714 . . . . 0.0 109.976 179.515 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' A' A ' 82' ' ' VAL . . . . . . . . . . . . . 34.3 m -67.44 -28.18 41.27 Favored 'Isoleucine or valine' 0 N--CA 1.499 2.018 0 O-C-N 121.251 -0.905 . . . . 0.0 109.805 179.016 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 83' ' ' ARG . . . . . . . . . . . . . 7.2 mtt85 -61.58 -39.97 93.08 Favored 'General case' 0 N--CA 1.497 1.91 0 O-C-N 121.348 -0.845 . . . . 0.0 109.518 178.779 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 84' ' ' CYS . . . . . . . . . . . . . 5.2 t -62.49 -35.57 79.77 Favored 'General case' 0 N--CA 1.498 1.95 0 O-C-N 121.542 -0.724 . . . . 0.0 110.002 178.882 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 85' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.499 1.982 0 O-C-N 121.408 -0.807 . . . . 0.0 110.353 179.341 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' B' B ' 149' ' ' SER . . . . . . . . . . . . . 34.8 p . . . . . 0 N--CA 1.497 1.91 0 CA-C-O 121.383 0.611 . . . . 0.0 110.957 . . . . . . . . . 0 0 . 1 . 007 nuclear build core ' B' B ' 150' ' ' ALA . . . . . . . . . . . . . . . -67.94 -28.5 67.53 Favored 'General case' 0 N--CA 1.494 1.761 0 O-C-N 121.568 -0.707 . . . . 0.0 110.438 179.482 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' B' B ' 151' ' ' ASP . . . . . . . . . . . . . 22.9 t70 -75.27 -39.43 59.75 Favored 'General case' 0 N--CA 1.499 2.005 0 O-C-N 121.32 -0.863 . . . . 0.0 110.563 179.561 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' B' B ' 152' ' ' ALA . . . . . . . . . . . . . . . -52.47 -36.71 55.48 Favored 'General case' 0 N--CA 1.501 2.117 0 O-C-N 121.508 -0.745 . . . . 0.0 110.992 -179.871 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' B' B ' 153' ' ' MET . . . . . 0.477 ' O ' HD12 ' B' ' 157' ' ' LEU . 0.0 OUTLIER -77.47 -35.77 53.45 Favored 'General case' 0 N--CA 1.495 1.815 0 O-C-N 121.17 -0.956 . . . . 0.0 110.477 179.712 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' B' B ' 154' ' ' MET . . . . . . . . . . . . . 0.7 OUTLIER -62.91 -53.4 54.65 Favored 'General case' 0 N--CA 1.5 2.034 0 O-C-N 121.264 -0.898 . . . . 0.0 110.095 179.685 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' B' B ' 155' ' ' GLN . . . . . . . . . . . . . 2.1 pp0? -62.81 -22.15 66.43 Favored 'General case' 0 N--CA 1.5 2.075 0 O-C-N 121.187 -0.945 . . . . 0.0 110.379 179.101 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' B' B ' 156' ' ' ALA . . . . . . . . . . . . . . . -82.58 -40.96 20.17 Favored 'General case' 0 N--CA 1.495 1.79 0 O-C-N 121.235 -0.916 . . . . 0.0 110.448 179.266 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' B' B ' 157' ' ' LEU . . . . . 0.477 HD12 ' O ' ' B' ' 153' ' ' MET . 2.0 mt -91.69 -59.11 2.21 Favored 'General case' 0 N--CA 1.499 2.008 0 O-C-N 121.29 -0.882 . . . . 0.0 110.408 179.996 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' B' B ' 158' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER . . . . . 0 N--CA 1.499 2.014 0 O-C-N 121.305 -0.872 . . . . 0.0 110.46 179.745 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 4' ' ' ILE . . . . . 0.428 HG23 ' N ' ' A' ' 5' ' ' TYR . 1.7 tt . . . . . 0 N--CA 1.501 2.108 0 N-CA-C 111.615 0.228 . . . . 0.0 111.615 . . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 5' ' ' TYR . . . . . 0.51 ' CG ' ' HG2' ' A' ' 83' ' ' ARG . 57.5 m-85 -76.75 -38.8 53.52 Favored 'General case' 0 N--CA 1.5 2.026 0 O-C-N 121.098 -1.001 . . . . 0.0 110.156 179.989 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 6' ' ' LYS . . . . . 0.445 ' HG2' ' CD ' ' A' ' 10' ' ' GLU . 12.3 ttpp -66.37 -37.81 86.14 Favored 'General case' 0 N--CA 1.494 1.771 0 O-C-N 121.411 -0.806 . . . . 0.0 109.456 178.9 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 7' ' ' ALA . . . . . . . . . . . . . . . -56.17 -43.64 78.56 Favored 'General case' 0 N--CA 1.498 1.971 0 O-C-N 121.534 -0.729 . . . . 0.0 110.209 179.313 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 8' ' ' ALA . . . . . . . . . . . . . . . -61.09 -39.85 91.48 Favored 'General case' 0 N--CA 1.499 2.018 0 O-C-N 121.437 -0.789 . . . . 0.0 109.977 179.149 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 9' ' ' VAL . . . . . 0.807 HG21 ' HA ' ' A' ' 79' ' ' VAL . 53.0 t -75.36 -43.65 42.8 Favored 'Isoleucine or valine' 0 N--CA 1.496 1.864 0 O-C-N 121.483 -0.761 . . . . 0.0 110.32 179.587 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 10' ' ' GLU . . . . . 0.445 ' CD ' ' HG2' ' A' ' 6' ' ' LYS . 58.6 mt-10 -57.8 -36.73 72.6 Favored 'General case' 0 N--CA 1.498 1.935 0 O-C-N 121.437 -0.789 . . . . 0.0 109.701 179.383 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 11' ' ' GLN . . . . . . . . . . . . . 0.2 OUTLIER -108.19 47.83 0.88 Allowed 'General case' 0 N--CA 1.482 1.152 0 O-C-N 121.417 -0.802 . . . . 0.0 109.704 179.363 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 12' ' ' LEU . . . . . . . . . . . . . 1.5 mt -82.03 150.68 27.47 Favored 'General case' 0 N--CA 1.497 1.911 0 O-C-N 121.304 -0.873 . . . . 0.0 110.714 -179.748 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 13' ' ' THR . . . . . . . . . . . . . 45.4 p -83.12 152.69 25.19 Favored 'General case' 0 N--CA 1.498 1.956 0 O-C-N 121.462 -0.774 . . . . 0.0 109.922 179.396 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 14' ' ' GLU . . . . . 0.622 ' HA ' ' HD3' ' A' ' 17' ' ' LYS . 5.0 tp10 -56.71 -32.2 65.26 Favored 'General case' 0 N--CA 1.492 1.666 0 O-C-N 121.554 -0.716 . . . . 0.0 110.767 -179.415 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 1.5 mp0 -60.58 -47.85 84.38 Favored 'General case' 0 N--CA 1.497 1.889 0 O-C-N 121.355 -0.84 . . . . 0.0 109.805 179.351 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 16' ' ' GLN . . . . . 0.446 ' HA ' ' HB3' ' A' ' 19' ' ' GLU . 5.4 mt-30 -77.45 -27.89 52.28 Favored 'General case' 0 N--CA 1.496 1.832 0 O-C-N 121.259 -0.9 . . . . 0.0 110.607 179.347 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 17' ' ' LYS . . . . . 0.622 ' HD3' ' HA ' ' A' ' 14' ' ' GLU . 0.2 OUTLIER -60.53 -46.67 89.31 Favored 'General case' 0 N--CA 1.498 1.965 0 O-C-N 121.513 -0.742 . . . . 0.0 109.547 179.138 . . . . . . . . 3 3 . 1 . 008 nuclear build core ' A' A ' 18' ' ' ASN . . . . . . . . . . . . . 50.5 t30 -72.77 -34.26 66.84 Favored 'General case' 0 N--CA 1.496 1.863 0 O-C-N 121.581 -0.699 . . . . 0.0 109.926 179.061 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 19' ' ' GLU . . . . . 0.446 ' HB3' ' HA ' ' A' ' 16' ' ' GLN . 3.6 tt0 -60.47 -49.15 78.72 Favored 'General case' 0 N--CA 1.497 1.903 0 O-C-N 121.477 -0.764 . . . . 0.0 109.578 179.265 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 20' ' ' PHE . . . . . . . . . . . . . 16.9 m-85 -68.1 -32.36 72.61 Favored 'General case' 0 N--CA 1.499 2.0 0 O-C-N 121.316 -0.865 . . . . 0.0 110.092 179.123 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 21' ' ' LYS . . . . . . . . . . . . . 13.9 tptp -58.42 -45.44 88.46 Favored 'General case' 0 N--CA 1.495 1.822 0 O-C-N 121.604 -0.685 . . . . 0.0 109.611 179.43 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 22' ' ' ALA . . . . . . . . . . . . . . . -59.43 -44.23 92.95 Favored 'General case' 0 N--CA 1.496 1.847 0 O-C-N 121.514 -0.742 . . . . 0.0 110.271 179.373 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 23' ' ' ALA . . . . . . . . . . . . . . . -64.87 -44.48 89.54 Favored 'General case' 0 N--CA 1.501 2.088 0 O-C-N 121.283 -0.886 . . . . 0.0 109.926 179.209 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 24' ' ' PHE . . . . . . . . . . . . . 40.8 t80 -66.75 -38.73 87.22 Favored 'General case' 0 N--CA 1.496 1.835 0 O-C-N 121.609 -0.682 . . . . 0.0 110.303 179.505 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 25' ' ' ASP . . . . . 0.414 ' O ' HG22 ' A' ' 28' ' ' VAL . 9.1 t70 -54.73 -52.36 62.73 Favored 'General case' 0 N--CA 1.501 2.115 0 O-C-N 121.606 -0.684 . . . . 0.0 111.012 -179.805 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 26' ' ' ILE . . . . . 0.424 ' HB ' HD12 ' B' ' 157' ' ' LEU . 19.7 mt -69.8 -27.8 34.61 Favored 'Isoleucine or valine' 0 N--CA 1.498 1.959 0 O-C-N 121.145 -0.972 . . . . 0.0 110.266 179.856 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 27' ' ' PHE . . . . . 0.469 ' CD2' HD21 ' B' ' 157' ' ' LEU . 0.3 OUTLIER -65.23 -32.75 74.58 Favored 'General case' 0 N--CA 1.498 1.956 0 O-C-N 121.244 -0.91 . . . . 0.0 111.05 179.81 . . . . . . . . 3 3 . 1 . 008 nuclear build core ' A' A ' 28' ' ' VAL . . . . . 0.414 HG22 ' O ' ' A' ' 25' ' ' ASP . 33.0 m -91.75 34.02 0.11 Allowed 'Isoleucine or valine' 0 N--CA 1.501 2.12 0 O-C-N 121.121 -0.987 . . . . 0.0 110.816 179.945 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 29' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -67.02 -42.18 85.37 Favored 'General case' 0 N--CA 1.498 1.945 0 O-C-N 121.111 -0.993 . . . . 0.0 110.176 179.459 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 30' ' ' GLY . . . . . . . . . . . . . . . -105.92 40.2 2.58 Favored Glycine 0 N--CA 1.495 2.578 0 N-CA-C 109.488 -1.445 . . . . 0.0 109.488 179.475 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 31' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.496 1.849 0 O-C-N 121.364 -1.08 . . . . 0.0 110.203 -179.982 . . . . . . . . 0 0 . 1 . 008 nuclear build core ' A' A ' 35' ' ' CYS . . . . . . . . . . . . . 58.2 m . . . . . 0 N--CA 1.497 1.889 0 CA-C-O 121.096 0.474 . . . . 0.0 110.339 . . . . . . . . . 0 0 . 1 . 008 nuclear build core ' A' A ' 36' ' ' ILE . . . . . . . . . . . . . 25.9 mt -102.13 129.26 53.79 Favored 'Isoleucine or valine' 0 N--CA 1.496 1.863 0 O-C-N 121.168 -0.957 . . . . 0.0 110.425 -179.685 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 37' ' ' SER . . . . . . . . . . . . . 3.4 t -107.17 163.68 12.8 Favored 'General case' 0 N--CA 1.495 1.795 0 O-C-N 121.484 -0.76 . . . . 0.0 109.722 179.133 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 38' ' ' THR . . . . . 0.725 HG21 ' HA ' ' A' ' 58' ' ' GLN . 77.1 p -63.05 -30.38 71.55 Favored 'General case' 0 N--CA 1.501 2.105 0 O-C-N 121.294 -0.879 . . . . 0.0 110.27 179.64 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 39' ' ' LYS . . . . . . . . . . . . . 1.6 mptp? -58.93 -42.96 91.02 Favored 'General case' 0 N--CA 1.497 1.912 0 O-C-N 121.535 -0.728 . . . . 0.0 109.837 179.343 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 40' ' ' GLU . . . . . 0.402 ' HA ' ' HD2' ' A' ' 43' ' ' LYS . 1.6 mp0 -74.25 -37.22 63.84 Favored 'General case' 0 N--CA 1.498 1.942 0 O-C-N 121.463 -0.773 . . . . 0.0 109.942 179.442 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 41' ' ' LEU . . . . . 0.451 ' HG ' HD13 ' A' ' 57' ' ' LEU . 6.2 tp -60.69 -47.56 85.7 Favored 'General case' 0 N--CA 1.495 1.789 0 O-C-N 121.499 -0.751 . . . . 0.0 109.807 179.499 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 42' ' ' GLY . . . . . . . . . . . . . . . -54.62 -39.84 68.22 Favored Glycine 0 N--CA 1.494 2.536 0 N-CA-C 109.887 -1.285 . . . . 0.0 109.887 179.688 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 43' ' ' LYS . . . . . 0.402 ' HD2' ' HA ' ' A' ' 40' ' ' GLU . 16.0 mttp -58.34 -40.19 81.49 Favored 'General case' 0 N--CA 1.501 2.084 0 O-C-N 121.34 -1.094 . . . . 0.0 110.033 179.171 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 44' ' ' VAL . . . . . . . . . . . . . 45.0 t -75.25 -38.45 41.11 Favored 'Isoleucine or valine' 0 N--CA 1.497 1.901 0 O-C-N 121.36 -0.838 . . . . 0.0 109.39 179.108 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 45' ' ' MET . . . . . 0.401 ' CE ' HD11 ' A' ' 41' ' ' LEU . 1.6 mmt -57.14 -43.29 82.28 Favored 'General case' 0 N--CA 1.498 1.936 0 O-C-N 121.713 -0.617 . . . . 0.0 110.031 179.343 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 46' ' ' ARG . . . . . . . . . . . . . 0.4 OUTLIER -63.12 -39.9 96.04 Favored 'General case' 0 N--CA 1.496 1.853 0 O-C-N 121.571 -0.706 . . . . 0.0 109.783 179.234 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 47' ' ' MET . . . . . . . . . . . . . 6.0 ttp -63.54 -29.35 70.63 Favored 'General case' 0 N--CA 1.497 1.875 0 O-C-N 121.569 -0.707 . . . . 0.0 110.188 179.036 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 48' ' ' LEU . . . . . . . . . . . . . 1.9 tt -72.13 -39.64 68.66 Favored 'General case' 0 N--CA 1.495 1.823 0 O-C-N 121.391 -0.818 . . . . 0.0 110.65 179.618 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 49' ' ' GLY . . . . . . . . . . . . . . . 144.29 -29.85 1.9 Allowed Glycine 0 N--CA 1.499 2.859 0 C-N-CA 120.113 -1.041 . . . . 0.0 110.627 179.982 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 50' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -127.07 129.8 48.69 Favored 'General case' 0 N--CA 1.501 2.082 0 O-C-N 121.21 -1.171 . . . . 0.0 111.166 -179.628 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 51' ' ' ASN . . . . . . . . . . . . . 43.3 t30 -172.15 104.87 0.35 Allowed Pre-proline 0 N--CA 1.496 1.845 0 O-C-N 121.549 -0.719 . . . . 0.0 110.363 179.319 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 52' ' ' PRO . . . . . . . . . . . . . 43.3 Cg_endo -76.95 -71.8 0.01 OUTLIER 'Trans proline' 0 C--N 1.311 -1.396 0 O-C-N 123.859 1.452 . . . . 0.0 110.565 179.562 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 53' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -139.96 150.77 63.47 Favored Pre-proline 0 N--CA 1.501 2.079 0 O-C-N 121.172 -0.955 . . . . 0.0 109.812 179.641 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 54' ' ' PRO . . . . . 0.465 ' O ' ' HB ' ' A' ' 38' ' ' THR . 45.3 Cg_endo -70.4 -48.17 0.63 Allowed 'Trans proline' 0 N--CA 1.491 1.368 0 O-C-N 123.837 1.44 . . . . 0.0 111.208 -179.483 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 55' ' ' GLU . . . . . 0.487 ' O ' ' HB2' ' A' ' 58' ' ' GLN . 11.3 mm-40 -66.63 -20.01 65.9 Favored 'General case' 0 N--CA 1.499 2.013 0 O-C-N 121.19 -0.944 . . . . 0.0 110.855 -179.983 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 7.6 tt0 -61.3 -25.41 67.1 Favored 'General case' 0 N--CA 1.499 1.976 0 O-C-N 121.149 -0.97 . . . . 0.0 110.321 178.981 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 57' ' ' LEU . . . . . 0.451 HD13 ' HG ' ' A' ' 41' ' ' LEU . 4.6 mt -85.78 -9.21 57.44 Favored 'General case' 0 N--CA 1.498 1.939 0 O-C-N 121.39 -0.819 . . . . 0.0 111.672 -179.875 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 58' ' ' GLN . . . . . 0.742 ' O ' HG22 ' A' ' 61' ' ' ILE . 1.7 mm100 -48.69 -53.86 17.1 Favored 'General case' 0 N--CA 1.505 2.302 0 O-C-N 121.136 -0.978 . . . . 0.0 111.38 -179.362 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 59' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -51.27 -33.91 30.55 Favored 'General case' 0 N--CA 1.502 2.153 0 O-C-N 121.299 -0.876 . . . . 0.0 110.881 179.868 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 60' ' ' MET . . . . . . . . . . . . . 1.5 ttp -75.31 -35.36 61.26 Favored 'General case' 0 N--CA 1.496 1.871 0 O-C-N 121.294 -0.879 . . . . 0.0 110.646 179.406 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 61' ' ' ILE . . . . . 0.742 HG22 ' O ' ' A' ' 58' ' ' GLN . 8.6 tt -65.22 -31.75 55.26 Favored 'Isoleucine or valine' 0 N--CA 1.501 2.083 0 O-C-N 121.021 -1.049 . . . . 0.0 110.276 179.62 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 62' ' ' ASP . . . . . . . . . . . . . 22.6 m-20 -76.99 -28.86 55.23 Favored 'General case' 0 N--CA 1.496 1.873 0 O-C-N 121.268 -0.895 . . . . 0.0 109.955 179.066 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 63' ' ' GLU . . . . . . . . . . . . . 6.6 mt-10 -59.11 -49.58 77.33 Favored 'General case' 0 N--CA 1.5 2.063 0 O-C-N 121.518 -0.739 . . . . 0.0 110.411 179.37 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 64' ' ' VAL . . . . . . . . . . . . . 14.6 p -84.33 -10.79 11.67 Favored 'Isoleucine or valine' 0 N--CA 1.497 1.9 0 O-C-N 121.661 -0.65 . . . . 0.0 111.122 -179.679 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 65' ' ' ASP . . . . . . . . . . . . . 24.9 t70 -69.13 133.72 48.39 Favored 'General case' 0 N--CA 1.497 1.887 0 O-C-N 120.945 -1.097 . . . . 0.0 110.032 179.553 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 66' ' ' GLU . . . . . . . . . . . . . 25.4 mt-10 -128.73 25.89 5.63 Favored 'General case' 0 N--CA 1.495 1.823 0 O-C-N 121.322 -0.861 . . . . 0.0 111.219 -179.493 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 67' ' ' ASP . . . . . . . . . . . . . 1.6 p-10 -124.97 -21.2 4.75 Favored 'General case' 0 N--CA 1.498 1.967 0 O-C-N 120.822 -1.174 . . . . 0.0 112.162 -179.878 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 68' ' ' GLY . . . . . . . . . . . . . . . 114.91 -37.13 3.62 Favored Glycine 0 N--CA 1.497 2.762 0 O-C-N 120.825 -1.172 . . . . 0.0 110.466 179.665 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 69' ' ' SER . . . . . . . . . . . . . 38.9 p -58.87 -32.0 69.08 Favored 'General case' 0 N--CA 1.502 2.162 0 O-C-N 121.361 -1.082 . . . . 0.0 110.996 -179.883 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 70' ' ' GLY . . . . . . . . . . . . . . . 93.27 -40.1 2.86 Favored Glycine 0 N--CA 1.499 2.845 0 N-CA-C 110.185 -1.166 . . . . 0.0 110.185 -179.824 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 71' ' ' THR . . . . . . . . . . . . . 14.0 m -64.34 144.69 56.97 Favored 'General case' 0 N--CA 1.501 2.113 0 O-C-N 121.262 -1.14 . . . . 0.0 110.273 -179.841 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 72' ' ' VAL . . . . . 0.666 HG23 ' CG1' ' A' ' 61' ' ' ILE . 2.1 t -77.62 119.36 26.16 Favored 'Isoleucine or valine' 0 N--CA 1.497 1.901 0 O-C-N 121.377 -0.827 . . . . 0.0 110.105 179.867 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 73' ' ' ASP . . . . . . . . . . . . . 45.6 m-20 -92.78 -173.31 3.28 Favored 'General case' 0 N--CA 1.496 1.831 0 O-C-N 121.616 -0.678 . . . . 0.0 109.887 179.839 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 74' ' ' PHE . . . . . . . . . . . . . 26.0 t80 -64.97 -48.45 73.99 Favored 'General case' 0 N--CA 1.495 1.821 0 O-C-N 121.195 -0.94 . . . . 0.0 110.052 179.602 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 75' ' ' ASP . . . . . 0.462 ' HA ' HD12 ' A' ' 78' ' ' LEU . 29.0 t70 -60.45 -49.82 76.02 Favored 'General case' 0 N--CA 1.498 1.927 0 O-C-N 121.579 -0.701 . . . . 0.0 109.97 179.323 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 76' ' ' GLU . . . . . . . . . . . . . 43.8 mt-10 -60.77 -41.6 95.82 Favored 'General case' 0 N--CA 1.498 1.973 0 O-C-N 121.592 -0.693 . . . . 0.0 109.8 179.135 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 77' ' ' PHE . . . . . 0.404 ' O ' ' HG2' ' A' ' 81' ' ' MET . 43.9 t80 -58.99 -45.57 90.31 Favored 'General case' 0 N--CA 1.498 1.945 0 O-C-N 121.575 -0.703 . . . . 0.0 109.528 178.888 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 78' ' ' LEU . . . . . 0.463 ' HB3' HG13 ' A' ' 9' ' ' VAL . 14.2 mt -56.92 -46.47 82.0 Favored 'General case' 0 N--CA 1.498 1.945 0 O-C-N 121.678 -0.639 . . . . 0.0 110.083 179.438 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 79' ' ' VAL . . . . . 0.807 ' HA ' HG21 ' A' ' 9' ' ' VAL . 86.3 t -61.7 -35.16 65.77 Favored 'Isoleucine or valine' 0 N--CA 1.501 2.119 0 O-C-N 121.463 -0.773 . . . . 0.0 109.835 179.453 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 80' ' ' MET . . . . . . . . . . . . . 12.4 ttp -70.66 -37.61 73.7 Favored 'General case' 0 N--CA 1.494 1.738 0 O-C-N 121.507 -0.745 . . . . 0.0 110.532 179.566 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 81' ' ' MET . . . . . 0.404 ' HG2' ' O ' ' A' ' 77' ' ' PHE . 68.4 mmm -62.77 -53.03 60.63 Favored 'General case' 0 N--CA 1.499 1.982 0 O-C-N 121.253 -0.904 . . . . 0.0 110.336 179.929 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 82' ' ' VAL . . . . . 0.426 HG11 HG23 ' A' ' 9' ' ' VAL . 13.4 p -63.26 -29.78 48.1 Favored 'Isoleucine or valine' 0 N--CA 1.501 2.113 0 O-C-N 121.302 -0.874 . . . . 0.0 110.132 179.333 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 83' ' ' ARG . . . . . 0.51 ' HG2' ' CG ' ' A' ' 5' ' ' TYR . 0.0 OUTLIER -62.24 -52.13 64.98 Favored 'General case' 0 N--CA 1.498 1.937 0 O-C-N 121.299 -0.876 . . . . 0.0 110.293 179.32 . . . . . . . . 3 3 . 1 . 008 nuclear build core ' A' A ' 84' ' ' CYS . . . . . . . . . . . . . 0.1 OUTLIER -77.33 -22.79 51.33 Favored 'General case' 0 N--CA 1.498 1.956 0 O-C-N 121.495 -0.753 . . . . 0.0 110.88 179.928 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 85' ' ' MET . . . . . 0.43 ' HB2' ' HB2' ' B' ' 150' ' ' ALA . 22.9 ttp . . . . . 0 N--CA 1.496 1.861 0 O-C-N 121.35 -0.844 . . . . 0.0 110.138 179.665 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' B' B ' 149' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER . . . . . 0 N--CA 1.501 2.112 0 CA-C-O 121.322 0.582 . . . . 0.0 111.188 . . . . . . . . . 1 1 . 1 . 008 nuclear build core ' B' B ' 150' ' ' ALA . . . . . 0.43 ' HB2' ' HB2' ' A' ' 85' ' ' MET . . . -108.68 -59.73 1.84 Allowed 'General case' 0 N--CA 1.495 1.809 0 O-C-N 121.299 -0.876 . . . . 0.0 110.162 179.898 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' B' B ' 151' ' ' ASP . . . . . . . . . . . . . 6.4 p-10 -58.34 -30.9 67.08 Favored 'General case' 0 N--CA 1.5 2.059 0 O-C-N 121.491 -0.755 . . . . 0.0 110.805 179.59 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' B' B ' 152' ' ' ALA . . . . . . . . . . . . . . . -71.81 -47.5 52.84 Favored 'General case' 0 N--CA 1.496 1.845 0 O-C-N 121.343 -0.848 . . . . 0.0 110.169 179.708 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' B' B ' 153' ' ' MET . . . . . . . . . . . . . 7.1 mmt -68.31 -37.43 80.6 Favored 'General case' 0 N--CA 1.499 1.988 0 O-C-N 121.333 -0.854 . . . . 0.0 110.482 179.679 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' B' B ' 154' ' ' MET . . . . . . . . . . . . . 39.7 mtp -58.68 -45.02 90.33 Favored 'General case' 0 N--CA 1.499 2.009 0 O-C-N 121.401 -0.812 . . . . 0.0 110.513 179.836 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' B' B ' 155' ' ' GLN . . . . . . . . . . . . . 6.7 tp-100 -60.37 -42.22 95.34 Favored 'General case' 0 N--CA 1.5 2.068 0 O-C-N 121.422 -0.799 . . . . 0.0 110.503 179.895 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' B' B ' 156' ' ' ALA . . . . . . . . . . . . . . . -66.68 -39.3 88.06 Favored 'General case' 0 N--CA 1.499 1.997 0 O-C-N 121.428 -0.795 . . . . 0.0 110.34 179.608 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' B' B ' 157' ' ' LEU . . . . . 0.469 HD21 ' CD2' ' A' ' 27' ' ' PHE . 0.2 OUTLIER -67.86 -35.93 79.41 Favored 'General case' 0 N--CA 1.499 2.013 0 O-C-N 121.449 -0.782 . . . . 0.0 110.782 179.872 . . . . . . . . 3 3 . 1 . 008 nuclear build core ' B' B ' 158' ' ' LEU . . . . . . . . . . . . . 12.0 mt . . . . . 0 N--CA 1.498 1.97 0 O-C-N 121.326 -0.859 . . . . 0.0 110.777 -179.862 . . . . . . . . 0 0 . 1 . 009 nuclear build core ' A' A ' 4' ' ' ILE . . . . . . . . . . . . . 11.7 mt . . . . . 0 N--CA 1.5 2.035 0 CA-C-O 120.939 0.399 . . . . 0.0 110.147 . . . . . . . . . 0 0 . 1 . 009 nuclear build core ' A' A ' 5' ' ' TYR . . . . . 0.415 ' HE1' ' HG3' ' A' ' 83' ' ' ARG . 13.0 m-85 -60.21 -36.4 77.58 Favored 'General case' 0 N--CA 1.499 2.007 0 O-C-N 121.248 -0.907 . . . . 0.0 110.668 179.778 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 6' ' ' LYS . . . . . 0.453 ' HB3' ' HE3' ' A' ' 6' ' ' LYS . 26.1 ttpp -79.77 -46.46 16.95 Favored 'General case' 0 N--CA 1.494 1.774 0 O-C-N 121.201 -0.937 . . . . 0.0 110.415 179.718 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 7' ' ' ALA . . . . . . . . . . . . . . . -56.55 -46.67 80.58 Favored 'General case' 0 N--CA 1.498 1.937 0 O-C-N 121.45 -0.781 . . . . 0.0 110.309 179.858 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 8' ' ' ALA . . . . . 0.482 ' O ' ' HG ' ' A' ' 12' ' ' LEU . . . -58.33 -44.27 88.59 Favored 'General case' 0 N--CA 1.498 1.959 0 O-C-N 121.286 -0.884 . . . . 0.0 109.532 179.1 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 9' ' ' VAL . . . . . . . . . . . . . 10.9 t -67.19 -40.91 86.12 Favored 'Isoleucine or valine' 0 N--CA 1.497 1.891 0 O-C-N 121.657 -0.652 . . . . 0.0 110.512 179.446 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 10' ' ' GLU . . . . . . . . . . . . . 55.2 mt-10 -67.85 -43.51 79.32 Favored 'General case' 0 N--CA 1.5 2.056 0 O-C-N 121.416 -0.802 . . . . 0.0 111.588 -179.348 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 11' ' ' GLN . . . . . . . . . . . . . 3.1 mp0 -86.24 -80.16 0.24 Allowed 'General case' 0 N--CA 1.496 1.844 0 O-C-N 121.308 -0.87 . . . . 0.0 111.091 -178.786 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 12' ' ' LEU . . . . . 0.482 ' HG ' ' O ' ' A' ' 8' ' ' ALA . 4.8 mt 57.33 -168.45 0.12 Allowed 'General case' 0 N--CA 1.504 2.271 0 O-C-N 121.476 -0.765 . . . . 0.0 109.981 -179.076 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 13' ' ' THR . . . . . 0.442 ' OG1' ' HB2' ' A' ' 16' ' ' GLN . 76.0 p -120.49 159.58 24.89 Favored 'General case' 0 N--CA 1.499 1.995 0 O-C-N 120.867 -1.146 . . . . 0.0 110.078 179.406 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 14' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -53.15 -43.08 66.71 Favored 'General case' 0 N--CA 1.493 1.703 0 C-N-CA 120.278 -0.569 . . . . 0.0 110.441 -179.632 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 1.2 mp0 -65.38 -59.23 4.24 Favored 'General case' 0 N--CA 1.496 1.83 0 O-C-N 121.56 -0.713 . . . . 0.0 110.31 -179.956 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 16' ' ' GLN . . . . . 0.476 ' HB3' HD22 ' A' ' 12' ' ' LEU . 0.9 OUTLIER -50.65 -52.73 36.95 Favored 'General case' 0 N--CA 1.501 2.098 0 O-C-N 121.352 -0.843 . . . . 0.0 111.257 -179.728 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' A' A ' 17' ' ' LYS . . . . . 0.438 ' O ' ' HB3' ' A' ' 21' ' ' LYS . 3.2 tttp -57.92 -41.25 82.3 Favored 'General case' 0 N--CA 1.501 2.09 0 O-C-N 121.827 -0.546 . . . . 0.0 110.7 179.847 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 18' ' ' ASN . . . . . . . . . . . . . 12.8 m-20 -70.95 -48.45 53.36 Favored 'General case' 0 N--CA 1.501 2.079 0 O-C-N 121.259 -0.9 . . . . 0.0 110.207 179.592 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 0.5 OUTLIER -59.12 -46.14 89.09 Favored 'General case' 0 N--CA 1.495 1.8 0 O-C-N 121.611 -0.68 . . . . 0.0 110.436 179.933 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 20' ' ' PHE . . . . . 0.499 ' CE1' ' HG2' ' A' ' 81' ' ' MET . 19.6 m-30 -64.54 -38.0 89.49 Favored 'General case' 0 N--CA 1.498 1.965 0 O-C-N 121.29 -0.881 . . . . 0.0 110.004 179.562 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 21' ' ' LYS . . . . . 0.516 ' HG3' ' N ' ' A' ' 22' ' ' ALA . 0.0 OUTLIER -62.9 -36.68 84.14 Favored 'General case' 0 N--CA 1.5 2.05 0 O-C-N 121.38 -0.825 . . . . 0.0 109.242 178.725 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' A' A ' 22' ' ' ALA . . . . . 0.516 ' N ' ' HG3' ' A' ' 21' ' ' LYS . . . -70.03 -49.39 51.77 Favored 'General case' 0 N--CA 1.494 1.736 0 O-C-N 121.47 -0.769 . . . . 0.0 109.382 178.841 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 23' ' ' ALA . . . . . 0.492 ' HA ' HD11 ' B' ' 157' ' ' LEU . . . -61.74 -41.59 97.86 Favored 'General case' 0 N--CA 1.496 1.835 0 O-C-N 121.685 -0.635 . . . . 0.0 109.848 179.087 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 24' ' ' PHE . . . . . 0.695 ' CE1' HD11 ' A' ' 36' ' ' ILE . 82.7 t80 -61.33 -45.65 93.53 Favored 'General case' 0 N--CA 1.498 1.941 0 O-C-N 121.69 -0.631 . . . . 0.0 110.257 179.582 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 25' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -53.73 -51.47 63.21 Favored 'General case' 0 N--CA 1.498 1.973 0 O-C-N 121.661 -0.649 . . . . 0.0 110.504 179.87 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 26' ' ' ILE . . . . . 0.724 HG21 ' HB2' ' B' ' 157' ' ' LEU . 2.8 mt -69.07 -31.63 51.03 Favored 'Isoleucine or valine' 0 N--CA 1.498 1.975 0 O-C-N 121.221 -0.924 . . . . 0.0 110.148 179.532 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 27' ' ' PHE . . . . . 0.531 ' CZ ' HG21 ' A' ' 44' ' ' VAL . 0.2 OUTLIER -67.15 -43.2 82.92 Favored 'General case' 0 N--CA 1.497 1.898 0 O-C-N 121.126 -0.984 . . . . 0.0 110.259 179.505 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' A' A ' 28' ' ' VAL . . . . . 0.439 HG11 ' CZ ' ' A' ' 24' ' ' PHE . 12.8 m -81.72 -16.69 11.99 Favored 'Isoleucine or valine' 0 N--CA 1.502 2.14 0 O-C-N 121.182 -0.948 . . . . 0.0 110.397 179.322 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 29' ' ' LEU . . . . . . . . . . . . . 1.5 tp -61.13 118.52 6.91 Favored 'General case' 0 N--CA 1.49 1.528 0 N-CA-C 108.354 -0.98 . . . . 0.0 108.354 178.979 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 30' ' ' GLY . . . . . . . . . . . . . . . 99.68 22.97 11.38 Favored Glycine 0 N--CA 1.496 2.683 0 N-CA-C 109.678 -1.369 . . . . 0.0 109.678 -178.206 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 31' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.496 1.857 0 O-C-N 121.349 -1.089 . . . . 0.0 109.516 179.596 . . . . . . . . 0 0 . 1 . 009 nuclear build core ' A' A ' 35' ' ' CYS . . . . . . . . . . . . . 59.1 m . . . . . 0 N--CA 1.504 2.274 0 CA-C-O 120.546 0.212 . . . . 0.0 111.131 . . . . . . . . . 0 0 . 1 . 009 nuclear build core ' A' A ' 36' ' ' ILE . . . . . 0.695 HD11 ' CE1' ' A' ' 24' ' ' PHE . 69.1 mt -129.31 92.52 1.82 Allowed 'Isoleucine or valine' 0 N--CA 1.495 1.804 0 O-C-N 120.99 -1.069 . . . . 0.0 109.987 179.478 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 37' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -95.08 -173.77 3.05 Favored 'General case' 0 N--CA 1.495 1.794 0 O-C-N 121.277 -0.889 . . . . 0.0 109.345 179.283 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 38' ' ' THR . . . . . 0.8 HG21 ' HG2' ' A' ' 58' ' ' GLN . 1.6 p -59.72 -33.52 71.73 Favored 'General case' 0 N--CA 1.499 2.001 0 O-C-N 121.062 -1.024 . . . . 0.0 109.792 179.376 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 39' ' ' LYS . . . . . . . . . . . . . 23.5 ttpp -62.69 -38.6 91.02 Favored 'General case' 0 N--CA 1.499 1.981 0 O-C-N 121.526 -0.734 . . . . 0.0 109.708 178.755 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 0.6 OUTLIER -66.7 -33.6 75.99 Favored 'General case' 0 N--CA 1.498 1.929 0 O-C-N 121.661 -0.65 . . . . 0.0 109.839 179.355 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 41' ' ' LEU . . . . . 0.691 ' C ' HD13 ' A' ' 41' ' ' LEU . 2.8 tm? -66.21 -63.73 1.01 Allowed 'General case' 0 N--CA 1.497 1.875 0 O-C-N 121.385 -0.822 . . . . 0.0 108.946 178.464 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 42' ' ' GLY . . . . . 0.596 ' N ' HD13 ' A' ' 41' ' ' LEU . . . -46.96 -28.03 3.73 Favored Glycine 0 N--CA 1.499 2.876 0 N-CA-C 111.08 -0.808 . . . . 0.0 111.08 179.911 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 43' ' ' LYS . . . . . 0.485 ' HA ' ' HD2' ' A' ' 46' ' ' ARG . 0.0 OUTLIER -49.96 -50.93 45.06 Favored 'General case' 0 N--CA 1.501 2.115 0 O-C-N 121.364 -1.08 . . . . 0.0 110.389 179.733 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' A' A ' 44' ' ' VAL . . . . . 0.649 HG23 ' SD ' ' A' ' 45' ' ' MET . 13.6 m -75.68 -35.89 32.39 Favored 'Isoleucine or valine' 0 N--CA 1.502 2.129 0 O-C-N 121.376 -0.828 . . . . 0.0 109.732 179.106 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 45' ' ' MET . . . . . 0.649 ' SD ' HG23 ' A' ' 44' ' ' VAL . 0.0 OUTLIER -57.27 -30.23 64.51 Favored 'General case' 0 N--CA 1.498 1.927 0 O-C-N 121.215 -0.928 . . . . 0.0 110.757 178.679 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' A' A ' 46' ' ' ARG . . . . . 0.485 ' HD2' ' HA ' ' A' ' 43' ' ' LYS . 43.5 mtt85 -58.46 -47.56 83.61 Favored 'General case' 0 N--CA 1.501 2.107 0 O-C-N 121.276 -0.89 . . . . 0.0 109.547 179.135 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 47' ' ' MET . . . . . . . . . . . . . 45.7 mtm -66.05 -30.42 70.94 Favored 'General case' 0 N--CA 1.499 2.014 0 O-C-N 121.59 -0.694 . . . . 0.0 109.687 178.866 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 48' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -71.63 -46.63 58.52 Favored 'General case' 0 N--CA 1.497 1.887 0 O-C-N 121.538 -0.726 . . . . 0.0 110.186 179.334 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 49' ' ' GLY . . . . . . . . . . . . . . . 117.05 -17.14 12.91 Favored Glycine 0 N--CA 1.497 2.765 0 C-N-CA 120.51 -0.852 . . . . 0.0 111.176 179.543 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 50' ' ' GLN . . . . . . . . . . . . . 2.3 mt-30 -109.83 104.38 13.32 Favored 'General case' 0 N--CA 1.499 2.016 0 O-C-N 120.886 -1.361 . . . . 0.0 111.122 -179.427 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 51' ' ' ASN . . . . . . . . . . . . . 31.7 t30 -154.92 101.58 2.32 Favored Pre-proline 0 N--CA 1.496 1.873 0 O-C-N 121.465 -0.772 . . . . 0.0 110.003 179.283 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 52' ' ' PRO . . . . . . . . . . . . . 50.5 Cg_endo -77.1 -91.46 0.0 OUTLIER 'Trans proline' 0 C--N 1.315 -1.207 0 O-C-N 123.787 1.414 . . . . 0.0 111.268 -179.411 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 53' ' ' THR . . . . . . . . . . . . . 3.1 p -130.91 163.67 47.31 Favored Pre-proline 0 N--CA 1.493 1.691 0 O-C-N 120.93 -1.106 . . . . 0.0 110.774 -179.228 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 54' ' ' PRO . . . . . . . . . . . . . 43.0 Cg_endo -72.48 -33.76 8.31 Favored 'Trans proline' 0 C--N 1.314 -1.28 0 O-C-N 123.955 1.503 . . . . 0.0 110.266 179.487 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 55' ' ' GLU . . . . . . . . . . . . . 3.5 mp0 -61.68 -30.46 70.76 Favored 'General case' 0 N--CA 1.497 1.886 0 O-C-N 121.564 -0.71 . . . . 0.0 110.653 179.751 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 3.0 tt0 -61.17 -39.52 90.45 Favored 'General case' 0 N--CA 1.498 1.941 0 O-C-N 121.384 -0.823 . . . . 0.0 110.639 179.559 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 57' ' ' LEU . . . . . 0.536 HD23 ' CE ' ' A' ' 60' ' ' MET . 1.1 mt -90.25 -9.68 47.1 Favored 'General case' 0 N--CA 1.497 1.911 0 O-C-N 121.249 -0.907 . . . . 0.0 111.379 -179.878 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 58' ' ' GLN . . . . . 0.848 ' O ' HG22 ' A' ' 61' ' ' ILE . 9.8 mm-40 -59.43 -47.06 86.91 Favored 'General case' 0 N--CA 1.501 2.107 0 O-C-N 120.999 -1.063 . . . . 0.0 110.056 179.665 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 59' ' ' GLU . . . . . . . . . . . . . 0.5 OUTLIER -63.95 -32.84 74.52 Favored 'General case' 0 N--CA 1.502 2.157 0 O-C-N 121.07 -1.019 . . . . 0.0 109.89 178.912 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 60' ' ' MET . . . . . 0.536 ' CE ' HD23 ' A' ' 57' ' ' LEU . 4.2 tmm? -65.92 -35.96 82.05 Favored 'General case' 0 N--CA 1.496 1.862 0 O-C-N 121.424 -0.798 . . . . 0.0 110.32 179.428 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 61' ' ' ILE . . . . . 0.848 HG22 ' O ' ' A' ' 58' ' ' GLN . 1.1 tt -63.26 -29.12 46.44 Favored 'Isoleucine or valine' 0 N--CA 1.499 1.992 0 O-C-N 121.326 -0.859 . . . . 0.0 110.708 179.645 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 62' ' ' ASP . . . . . . . . . . . . . 3.7 m-20 -62.21 -45.25 94.18 Favored 'General case' 0 N--CA 1.498 1.933 0 O-C-N 121.185 -0.947 . . . . 0.0 110.145 179.644 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 63' ' ' GLU . . . . . . . . . . . . . 4.0 tm-20 -69.51 -42.61 74.48 Favored 'General case' 0 N--CA 1.498 1.956 0 O-C-N 121.537 -0.727 . . . . 0.0 110.247 179.431 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 64' ' ' VAL . . . . . . . . . . . . . 77.0 t -72.19 -23.96 22.02 Favored 'Isoleucine or valine' 0 N--CA 1.498 1.952 0 O-C-N 121.383 -0.823 . . . . 0.0 110.901 -179.947 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 65' ' ' ASP . . . . . 0.464 ' O ' ' HG2' ' A' ' 66' ' ' GLU . 17.1 t70 -86.93 -68.17 0.77 Allowed 'General case' 0 N--CA 1.497 1.882 0 O-C-N 121.079 -1.013 . . . . 0.0 110.298 -179.878 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 66' ' ' GLU . . . . . 0.464 ' HG2' ' O ' ' A' ' 65' ' ' ASP . 0.4 OUTLIER 44.02 28.76 0.28 Allowed 'General case' 0 N--CA 1.507 2.414 0 N-CA-C 112.615 0.598 . . . . 0.0 112.615 179.903 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' A' A ' 67' ' ' ASP . . . . . . . . . . . . . 0.0 OUTLIER -110.57 -23.53 11.06 Favored 'General case' 0 N--CA 1.498 1.932 0 O-C-N 120.723 -1.236 . . . . 0.0 111.236 179.623 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 68' ' ' GLY . . . . . . . . . . . . . . . 131.22 -50.19 0.9 Allowed Glycine 0 N--CA 1.495 2.59 0 N-CA-C 110.255 -1.138 . . . . 0.0 110.255 -179.981 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 69' ' ' SER . . . . . . . . . . . . . 5.4 p -66.84 -37.2 84.02 Favored 'General case' 0 N--CA 1.499 1.979 0 O-C-N 121.392 -1.063 . . . . 0.0 111.192 -179.491 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 70' ' ' GLY . . . . . . . . . . . . . . . 99.42 -43.73 1.78 Allowed Glycine 0 N--CA 1.496 2.691 0 N-CA-C 110.365 -1.094 . . . . 0.0 110.365 179.781 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 71' ' ' THR . . . . . . . . . . . . . 0.6 OUTLIER -71.82 139.3 48.88 Favored 'General case' 0 N--CA 1.503 2.205 0 O-C-N 121.197 -1.178 . . . . 0.0 110.443 -179.63 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 72' ' ' VAL . . . . . 0.824 HG23 HG13 ' A' ' 61' ' ' ILE . 6.6 t -75.88 131.34 35.11 Favored 'Isoleucine or valine' 0 N--CA 1.498 1.964 0 O-C-N 121.543 -0.723 . . . . 0.0 110.395 179.844 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 73' ' ' ASP . . . . . . . . . . . . . 29.5 m-20 -117.29 -164.11 0.97 Allowed 'General case' 0 N--CA 1.5 2.03 0 O-C-N 121.373 -0.83 . . . . 0.0 110.55 -179.935 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 74' ' ' PHE . . . . . 0.459 ' HA ' ' CE1' ' A' ' 24' ' ' PHE . 87.9 t80 -66.2 -45.83 79.41 Favored 'General case' 0 N--CA 1.502 2.156 0 O-C-N 121.38 -0.825 . . . . 0.0 110.305 179.849 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 75' ' ' ASP . . . . . . . . . . . . . 1.1 m-20 -58.56 -47.8 83.01 Favored 'General case' 0 N--CA 1.497 1.887 0 O-C-N 121.58 -0.7 . . . . 0.0 109.886 179.441 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 76' ' ' GLU . . . . . . . . . . . . . 2.1 mt-10 -67.65 -33.96 76.0 Favored 'General case' 0 N--CA 1.496 1.844 0 O-C-N 121.501 -0.749 . . . . 0.0 109.821 179.044 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 77' ' ' PHE . . . . . . . . . . . . . 47.9 t80 -56.82 -40.27 75.71 Favored 'General case' 0 N--CA 1.5 2.071 0 O-C-N 121.409 -0.807 . . . . 0.0 108.915 178.324 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 78' ' ' LEU . . . . . . . . . . . . . 66.6 mt -69.36 -42.88 74.65 Favored 'General case' 0 N--CA 1.495 1.779 0 N-CA-C 109.041 -0.725 . . . . 0.0 109.041 178.21 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 79' ' ' VAL . . . . . 0.539 HG12 ' HD2' ' A' ' 83' ' ' ARG . 71.9 t -63.71 -34.97 71.18 Favored 'Isoleucine or valine' 0 N--CA 1.501 2.085 0 O-C-N 121.588 -0.695 . . . . 0.0 109.924 178.984 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 80' ' ' MET . . . . . . . . . . . . . 0.5 OUTLIER -69.07 -43.07 75.33 Favored 'General case' 0 N--CA 1.495 1.807 0 O-C-N 121.344 -0.848 . . . . 0.0 109.685 179.223 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 81' ' ' MET . . . . . 0.499 ' HG2' ' CE1' ' A' ' 20' ' ' PHE . 12.9 tpp -65.09 -49.39 70.17 Favored 'General case' 0 N--CA 1.497 1.919 0 O-C-N 121.556 -0.715 . . . . 0.0 109.949 179.556 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 82' ' ' VAL . . . . . 0.44 HG12 ' O ' ' A' ' 79' ' ' VAL . 7.2 p -61.57 -27.95 43.08 Favored 'Isoleucine or valine' 0 N--CA 1.501 2.115 0 O-C-N 121.256 -0.902 . . . . 0.0 109.492 178.549 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 83' ' ' ARG . . . . . 0.539 ' HD2' HG12 ' A' ' 79' ' ' VAL . 1.6 mtt180 -71.65 -39.63 70.2 Favored 'General case' 0 N--CA 1.499 1.989 0 O-C-N 121.427 -0.796 . . . . 0.0 109.54 178.466 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 84' ' ' CYS . . . . . . . . . . . . . 0.0 OUTLIER -69.08 -50.69 46.06 Favored 'General case' 0 N--CA 1.5 2.053 0 O-C-N 121.499 -0.751 . . . . 0.0 110.47 179.872 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 85' ' ' MET . . . . . . . . . . . . . 2.5 ptt? . . . . . 0 N--CA 1.499 2.025 0 O-C-N 121.259 -0.901 . . . . 0.0 111.202 179.85 . . . . . . . . 0 0 . 1 . 009 nuclear build core ' B' B ' 149' ' ' SER . . . . . 0.519 ' HB3' ' HB3' ' B' ' 152' ' ' ALA . 0.1 OUTLIER . . . . . 0 N--CA 1.496 1.867 0 CA-C-O 121.112 0.482 . . . . 0.0 109.994 . . . . . . . . . 2 2 . 1 . 009 nuclear build core ' B' B ' 150' ' ' ALA . . . . . . . . . . . . . . . -58.58 -41.01 84.76 Favored 'General case' 0 N--CA 1.499 1.977 0 O-C-N 121.603 -0.686 . . . . 0.0 110.749 -179.644 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' B' B ' 151' ' ' ASP . . . . . . . . . . . . . 7.2 p-10 -64.3 -38.1 89.84 Favored 'General case' 0 N--CA 1.5 2.03 0 O-C-N 121.46 -0.775 . . . . 0.0 110.599 179.574 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' B' B ' 152' ' ' ALA . . . . . 0.519 ' HB3' ' HB3' ' B' ' 149' ' ' SER . . . -78.06 -46.78 19.93 Favored 'General case' 0 N--CA 1.496 1.852 0 O-C-N 121.368 -0.833 . . . . 0.0 110.295 179.742 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' B' B ' 153' ' ' MET . . . . . . . . . . . . . 8.5 tpp -56.69 -43.7 80.75 Favored 'General case' 0 N--CA 1.499 1.992 0 O-C-N 121.494 -0.754 . . . . 0.0 110.332 179.728 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' B' B ' 154' ' ' MET . . . . . 0.526 ' O ' ' HB2' ' B' ' 158' ' ' LEU . 9.0 mmm -58.01 -52.75 64.21 Favored 'General case' 0 N--CA 1.498 1.946 0 O-C-N 121.442 -0.786 . . . . 0.0 110.448 179.88 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' B' B ' 155' ' ' GLN . . . . . . . . . . . . . 0.9 OUTLIER -62.44 -32.64 73.53 Favored 'General case' 0 N--CA 1.499 1.993 0 O-C-N 121.434 -0.791 . . . . 0.0 111.001 -179.959 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' B' B ' 156' ' ' ALA . . . . . . . . . . . . . . . -55.52 -34.92 65.08 Favored 'General case' 0 N--CA 1.501 2.094 0 O-C-N 121.38 -0.825 . . . . 0.0 111.095 179.954 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' B' B ' 157' ' ' LEU . . . . . 0.724 ' HB2' HG21 ' A' ' 26' ' ' ILE . 1.6 pp -112.43 8.22 19.37 Favored 'General case' 0 N--CA 1.5 2.054 0 O-C-N 121.17 -0.956 . . . . 0.0 111.796 -179.709 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' B' B ' 158' ' ' LEU . . . . . 0.526 ' HB2' ' O ' ' B' ' 154' ' ' MET . 0.0 OUTLIER . . . . . 0 N--CA 1.498 1.968 0 O-C-N 120.922 -1.111 . . . . 0.0 110.682 179.682 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 4' ' ' ILE . . . . . 0.417 HG22 ' HD1' ' A' ' 5' ' ' TYR . 23.6 mm . . . . . 0 N--CA 1.497 1.882 0 N-CA-C 109.661 -0.496 . . . . 0.0 109.661 . . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 5' ' ' TYR . . . . . 0.417 ' HD1' HG22 ' A' ' 4' ' ' ILE . 1.2 m-85 -96.14 -36.85 10.82 Favored 'General case' 0 N--CA 1.494 1.773 0 O-C-N 121.473 -0.767 . . . . 0.0 109.471 179.124 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 2.0 tmmt? -63.22 -28.36 69.98 Favored 'General case' 0 N--CA 1.497 1.893 0 O-C-N 121.433 -0.792 . . . . 0.0 109.819 178.664 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 7' ' ' ALA . . . . . . . . . . . . . . . -53.58 -44.83 69.66 Favored 'General case' 0 N--CA 1.497 1.923 0 O-C-N 121.609 -0.682 . . . . 0.0 109.287 178.948 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 8' ' ' ALA . . . . . . . . . . . . . . . -67.29 -43.65 81.23 Favored 'General case' 0 N--CA 1.495 1.802 0 O-C-N 121.533 -0.729 . . . . 0.0 109.256 178.331 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 9' ' ' VAL . . . . . 0.533 HG13 ' CB ' ' A' ' 78' ' ' LEU . 53.0 t -56.62 -40.42 69.07 Favored 'Isoleucine or valine' 0 N--CA 1.5 2.075 0 O-C-N 121.8 -0.563 . . . . 0.0 110.404 179.585 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 10' ' ' GLU . . . . . . . . . . . . . 0.7 OUTLIER -63.77 -44.41 93.47 Favored 'General case' 0 N--CA 1.496 1.853 0 O-C-N 121.437 -0.789 . . . . 0.0 111.333 -179.604 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 11' ' ' GLN . . . . . . . . . . . . . 4.3 mt-30 -139.69 82.84 1.9 Allowed 'General case' 0 N--CA 1.496 1.839 0 O-C-N 121.138 -0.976 . . . . 0.0 111.184 -179.704 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 12' ' ' LEU . . . . . . . . . . . . . 36.1 mt -70.79 -74.23 0.15 Allowed 'General case' 0 N--CA 1.498 1.956 0 O-C-N 121.197 -0.94 . . . . 0.0 108.792 178.703 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 13' ' ' THR . . . . . 0.507 ' HB ' ' HB2' ' A' ' 16' ' ' GLN . 2.1 m -157.21 156.55 32.75 Favored 'General case' 0 N--CA 1.494 1.731 0 N-CA-C 108.657 -0.868 . . . . 0.0 108.657 178.55 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 14' ' ' GLU . . . . . . . . . . . . . 2.7 tp10 -53.97 -33.06 55.92 Favored 'General case' 0 N--CA 1.494 1.741 0 O-C-N 121.531 -0.73 . . . . 0.0 110.825 -179.394 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 1.7 mp0 -90.72 -44.37 9.52 Favored 'General case' 0 N--CA 1.495 1.78 0 O-C-N 121.316 -0.865 . . . . 0.0 110.649 179.973 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 16' ' ' GLN . . . . . 0.507 ' HB2' ' HB ' ' A' ' 13' ' ' THR . 0.8 OUTLIER -48.24 -59.89 3.07 Favored 'General case' 0 N--CA 1.503 2.194 0 O-C-N 121.503 -0.748 . . . . 0.0 111.123 -179.408 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' A' A ' 17' ' ' LYS . . . . . . . . . . . . . 1.0 OUTLIER -56.91 -39.73 74.99 Favored 'General case' 0 N--CA 1.498 1.962 0 O-C-N 121.891 -0.506 . . . . 0.0 110.375 179.898 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 18' ' ' ASN . . . . . . . . . . . . . 2.1 t-20 -66.56 -39.63 88.6 Favored 'General case' 0 N--CA 1.499 2.022 0 O-C-N 121.302 -0.874 . . . . 0.0 110.129 179.26 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 17.0 mt-10 -62.23 -40.41 96.04 Favored 'General case' 0 N--CA 1.497 1.916 0 O-C-N 121.327 -0.858 . . . . 0.0 109.673 179.078 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 20' ' ' PHE . . . . . . . . . . . . . 33.9 m-85 -66.35 -31.53 72.37 Favored 'General case' 0 N--CA 1.498 1.936 0 O-C-N 121.482 -0.761 . . . . 0.0 109.559 178.728 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 21' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -60.22 -43.69 95.79 Favored 'General case' 0 N--CA 1.497 1.92 0 O-C-N 121.438 -0.789 . . . . 0.0 109.05 178.836 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 22' ' ' ALA . . . . . . . . . . . . . . . -72.18 -39.91 68.31 Favored 'General case' 0 N--CA 1.495 1.804 0 O-C-N 121.637 -0.664 . . . . 0.0 109.394 178.681 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 23' ' ' ALA . . . . . 0.839 ' HB1' HD23 ' B' ' 157' ' ' LEU . . . -65.7 -28.67 69.24 Favored 'General case' 0 N--CA 1.498 1.971 0 O-C-N 121.345 -0.847 . . . . 0.0 109.778 178.821 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 24' ' ' PHE . . . . . 0.651 ' O ' HG22 ' A' ' 28' ' ' VAL . 23.7 t80 -69.53 -34.03 73.65 Favored 'General case' 0 N--CA 1.495 1.787 0 O-C-N 121.581 -0.7 . . . . 0.0 110.188 179.514 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 25' ' ' ASP . . . . . . . . . . . . . 21.5 m-20 -52.26 -53.11 47.99 Favored 'General case' 0 N--CA 1.501 2.12 0 O-C-N 121.367 -0.833 . . . . 0.0 111.024 179.875 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 26' ' ' ILE . . . . . 0.527 ' HA ' HD23 ' A' ' 29' ' ' LEU . 1.1 pt -75.01 -20.46 16.48 Favored 'Isoleucine or valine' 0 N--CA 1.503 2.179 0 O-C-N 121.256 -0.902 . . . . 0.0 111.077 -179.866 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 27' ' ' PHE . . . . . 0.639 ' CZ ' HG21 ' A' ' 44' ' ' VAL . 0.1 OUTLIER -75.83 -17.5 59.81 Favored 'General case' 0 N--CA 1.496 1.848 0 O-C-N 120.933 -1.104 . . . . 0.0 110.196 179.169 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' A' A ' 28' ' ' VAL . . . . . 0.651 HG22 ' O ' ' A' ' 24' ' ' PHE . 20.6 m -129.25 26.27 1.92 Allowed 'Isoleucine or valine' 0 N--CA 1.499 1.997 0 O-C-N 121.305 -0.872 . . . . 0.0 110.74 179.93 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 29' ' ' LEU . . . . . 0.527 HD23 ' HA ' ' A' ' 26' ' ' ILE . 3.5 pp -74.29 -27.32 60.67 Favored 'General case' 0 N--CA 1.501 2.094 0 O-C-N 120.996 -1.065 . . . . 0.0 111.068 -179.854 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 30' ' ' GLY . . . . . . . . . . . . . . . -105.72 42.27 1.95 Allowed Glycine 0 N--CA 1.495 2.607 0 N-CA-C 109.784 -1.326 . . . . 0.0 109.784 179.866 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 31' ' ' ALA . . . . . 0.47 ' HB2' ' HG3' ' A' ' 40' ' ' GLU . . . . . . . . 0 N--CA 1.494 1.756 0 O-C-N 121.395 -1.062 . . . . 0.0 110.426 -179.847 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 35' ' ' CYS . . . . . . . . . . . . . 64.2 m . . . . . 0 N--CA 1.495 1.818 0 CA-C-O 121.135 0.493 . . . . 0.0 110.116 . . . . . . . . . 0 0 . 1 . 010 nuclear build core ' A' A ' 36' ' ' ILE . . . . . . . . . . . . . 78.7 mt -81.34 105.07 10.81 Favored 'Isoleucine or valine' 0 N--CA 1.498 1.946 0 O-C-N 121.142 -0.974 . . . . 0.0 110.21 -179.907 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 37' ' ' SER . . . . . . . . . . . . . 89.2 p -96.14 -177.24 3.92 Favored 'General case' 0 N--CA 1.495 1.809 0 O-C-N 121.502 -0.749 . . . . 0.0 110.237 179.773 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 38' ' ' THR . . . . . 0.448 ' HB ' ' O ' ' A' ' 54' ' ' PRO . 1.8 p -59.38 -43.94 92.83 Favored 'General case' 0 N--CA 1.502 2.129 0 O-C-N 121.438 -0.789 . . . . 0.0 110.459 179.789 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 39' ' ' LYS . . . . . 0.558 ' HA ' ' HB3' ' A' ' 54' ' ' PRO . 0.0 OUTLIER -62.98 -45.52 92.02 Favored 'General case' 0 N--CA 1.496 1.85 0 O-C-N 121.57 -0.706 . . . . 0.0 110.092 179.527 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' A' A ' 40' ' ' GLU . . . . . 0.47 ' HG3' ' HB2' ' A' ' 31' ' ' ALA . 19.0 mm-40 -69.42 -29.03 66.66 Favored 'General case' 0 N--CA 1.498 1.947 0 O-C-N 121.414 -0.804 . . . . 0.0 110.39 179.647 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 41' ' ' LEU . . . . . 0.572 ' O ' HG22 ' A' ' 44' ' ' VAL . 0.1 OUTLIER -73.32 -61.29 1.88 Allowed 'General case' 0 N--CA 1.497 1.904 0 O-C-N 121.253 -0.904 . . . . 0.0 108.833 178.603 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' A' A ' 42' ' ' GLY . . . . . 0.552 ' HA2' ' HB2' ' A' ' 45' ' ' MET . . . -49.53 -30.96 13.75 Favored Glycine 0 N--CA 1.499 2.856 0 N-CA-C 109.933 -1.267 . . . . 0.0 109.933 179.112 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 43' ' ' LYS . . . . . 0.45 ' HB3' ' O ' ' A' ' 40' ' ' GLU . 0.9 OUTLIER -48.98 -48.87 42.9 Favored 'General case' 0 N--CA 1.502 2.145 0 O-C-N 121.623 -0.928 . . . . 0.0 110.653 179.344 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' A' A ' 44' ' ' VAL . . . . . 0.639 HG21 ' CZ ' ' A' ' 27' ' ' PHE . 28.5 m -82.87 -23.86 8.54 Favored 'Isoleucine or valine' 0 N--CA 1.501 2.092 0 O-C-N 121.373 -0.83 . . . . 0.0 110.461 179.563 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 45' ' ' MET . . . . . 0.552 ' HB2' ' HA2' ' A' ' 42' ' ' GLY . 0.0 OUTLIER -65.43 -38.27 89.4 Favored 'General case' 0 N--CA 1.499 1.997 0 O-C-N 121.337 -0.852 . . . . 0.0 110.321 179.404 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' A' A ' 46' ' ' ARG . . . . . 0.456 ' CB ' ' HB3' ' A' ' 51' ' ' ASN . 13.2 ttt180 -62.19 -51.58 67.23 Favored 'General case' 0 N--CA 1.5 2.039 0 O-C-N 121.626 -0.671 . . . . 0.0 110.962 -179.746 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 47' ' ' MET . . . . . 0.413 ' CE ' ' HB1' ' B' ' 156' ' ' ALA . 4.9 ptm -67.25 -28.23 67.88 Favored 'General case' 0 N--CA 1.498 1.971 0 O-C-N 121.296 -0.877 . . . . 0.0 111.186 -179.661 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 48' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -79.83 -46.01 17.69 Favored 'General case' 0 N--CA 1.497 1.879 0 O-C-N 121.051 -1.031 . . . . 0.0 110.708 179.932 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 49' ' ' GLY . . . . . . . . . . . . . . . -147.21 -77.83 0.02 OUTLIER Glycine 0 N--CA 1.496 2.679 0 N-CA-C 110.107 -1.197 . . . . 0.0 110.107 -179.875 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 50' ' ' GLN . . . . . . . . . . . . . 2.4 pp0? -147.98 160.72 42.53 Favored 'General case' 0 N--CA 1.498 1.946 0 O-C-N 121.306 -1.114 . . . . 0.0 111.083 -179.822 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 51' ' ' ASN . . . . . 0.456 ' HB3' ' CB ' ' A' ' 46' ' ' ARG . 24.7 t30 -175.0 93.44 0.29 Allowed Pre-proline 0 N--CA 1.494 1.764 0 O-C-N 121.779 -0.576 . . . . 0.0 109.641 179.467 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 52' ' ' PRO . . . . . . . . . . . . . 42.1 Cg_endo -73.17 -65.95 0.03 OUTLIER 'Trans proline' 0 C--N 1.312 -1.387 0 O-C-N 123.658 1.346 . . . . 0.0 110.187 -179.943 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 53' ' ' THR . . . . . . . . . . . . . 1.8 p -129.94 155.76 80.1 Favored Pre-proline 0 N--CA 1.489 1.512 0 O-C-N 121.4 -0.813 . . . . 0.0 109.579 179.29 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 54' ' ' PRO . . . . . 0.565 ' HA ' HD23 ' A' ' 57' ' ' LEU . 40.4 Cg_endo -66.29 -28.3 47.43 Favored 'Trans proline' 0 C--N 1.31 -1.475 0 O-C-N 123.742 1.39 . . . . 0.0 111.071 -179.982 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 55' ' ' GLU . . . . . . . . . . . . . 1.1 mp0 -60.03 -34.85 73.94 Favored 'General case' 0 N--CA 1.501 2.117 0 O-C-N 121.218 -0.926 . . . . 0.0 110.684 179.559 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 27.1 tt0 -62.52 -21.75 65.77 Favored 'General case' 0 N--CA 1.5 2.059 0 O-C-N 121.404 -0.81 . . . . 0.0 111.529 -179.886 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 57' ' ' LEU . . . . . 0.646 HD22 ' N ' ' A' ' 57' ' ' LEU . 3.4 mm? -79.44 -12.51 59.89 Favored 'General case' 0 N--CA 1.499 2.018 0 O-C-N 121.022 -1.049 . . . . 0.0 111.115 -179.916 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 58' ' ' GLN . . . . . 0.681 ' HA ' HG22 ' A' ' 61' ' ' ILE . 5.0 pt20 -52.65 -35.36 54.75 Favored 'General case' 0 N--CA 1.5 2.041 0 O-C-N 121.072 -1.018 . . . . 0.0 110.445 -179.712 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 59' ' ' GLU . . . . . . . . . . . . . 6.8 mm-40 -56.22 -34.4 66.27 Favored 'General case' 0 N--CA 1.5 2.038 0 O-C-N 121.02 -1.05 . . . . 0.0 109.891 178.834 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 60' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -82.22 -33.17 29.44 Favored 'General case' 0 N--CA 1.495 1.813 0 O-C-N 121.68 -0.637 . . . . 0.0 110.625 179.522 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 61' ' ' ILE . . . . . 0.907 HG13 HG23 ' A' ' 72' ' ' VAL . 3.4 tt -81.4 -31.69 11.57 Favored 'Isoleucine or valine' 0 N--CA 1.498 1.955 0 O-C-N 121.17 -0.956 . . . . 0.0 111.044 -179.505 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 62' ' ' ASP . . . . . . . . . . . . . 6.7 m-20 -69.44 -44.85 70.45 Favored 'General case' 0 N--CA 1.496 1.849 0 O-C-N 121.125 -0.984 . . . . 0.0 111.032 -179.679 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 63' ' ' GLU . . . . . 0.739 ' HG3' HG23 ' A' ' 64' ' ' VAL . 0.6 OUTLIER -62.47 -23.49 66.94 Favored 'General case' 0 N--CA 1.501 2.076 0 O-C-N 121.333 -0.854 . . . . 0.0 111.714 -179.43 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' A' A ' 64' ' ' VAL . . . . . 0.739 HG23 ' HG3' ' A' ' 63' ' ' GLU . 44.2 t -107.85 -24.9 3.83 Favored 'Isoleucine or valine' 0 N--CA 1.501 2.096 0 O-C-N 121.014 -1.054 . . . . 0.0 111.648 -179.235 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 65' ' ' ASP . . . . . . . . . . . . . 22.4 t70 -75.91 -91.39 0.03 OUTLIER 'General case' 0 N--CA 1.5 2.028 0 O-C-N 120.949 -1.094 . . . . 0.0 110.456 -179.627 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 66' ' ' GLU . . . . . . . . . . . . . 3.6 mm-40 49.28 33.37 5.14 Favored 'General case' 0 N--CA 1.502 2.174 0 O-C-N 121.333 -0.854 . . . . 0.0 111.544 179.958 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 67' ' ' ASP . . . . . . . . . . . . . 1.9 p-10 -115.24 -22.7 9.3 Favored 'General case' 0 N--CA 1.499 2.018 0 O-C-N 120.968 -1.082 . . . . 0.0 111.475 -179.932 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 68' ' ' GLY . . . . . . . . . . . . . . . 127.68 -30.78 3.91 Favored Glycine 0 N--CA 1.495 2.592 0 N-CA-C 110.074 -1.21 . . . . 0.0 110.074 -179.849 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 69' ' ' SER . . . . . . . . . . . . . 0.9 OUTLIER -78.24 -35.36 48.38 Favored 'General case' 0 N--CA 1.497 1.916 0 O-C-N 121.289 -1.124 . . . . 0.0 111.033 -179.786 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 70' ' ' GLY . . . . . . . . . . . . . . . 91.26 -50.49 3.04 Favored Glycine 0 N--CA 1.499 2.883 0 N-CA-C 110.197 -1.161 . . . . 0.0 110.197 179.89 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 71' ' ' THR . . . . . . . . . . . . . 54.9 m -79.13 154.58 29.23 Favored 'General case' 0 N--CA 1.502 2.13 0 O-C-N 121.298 -1.119 . . . . 0.0 110.977 -179.417 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 72' ' ' VAL . . . . . 0.907 HG23 HG13 ' A' ' 61' ' ' ILE . 2.4 t -81.57 128.82 38.39 Favored 'Isoleucine or valine' 0 N--CA 1.498 1.974 0 O-C-N 121.727 -0.608 . . . . 0.0 110.453 179.728 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 73' ' ' ASP . . . . . . . . . . . . . 1.4 p30 -102.44 -161.07 0.82 Allowed 'General case' 0 N--CA 1.498 1.927 0 O-C-N 121.574 -0.704 . . . . 0.0 109.881 179.263 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 74' ' ' PHE . . . . . . . . . . . . . 45.5 t80 -67.99 -53.06 28.84 Favored 'General case' 0 N--CA 1.499 1.983 0 O-C-N 121.129 -0.982 . . . . 0.0 110.69 -179.577 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 75' ' ' ASP . . . . . . . . . . . . . 1.0 OUTLIER -59.5 -43.01 93.44 Favored 'General case' 0 N--CA 1.498 1.927 0 O-C-N 121.498 -0.751 . . . . 0.0 110.473 179.91 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 76' ' ' GLU . . . . . 0.455 ' HG2' HG12 ' A' ' 64' ' ' VAL . 1.5 mt-10 -65.13 -42.2 94.08 Favored 'General case' 0 N--CA 1.497 1.917 0 O-C-N 121.498 -0.751 . . . . 0.0 109.961 179.335 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 77' ' ' PHE . . . . . . . . . . . . . 25.4 t80 -59.26 -37.34 77.38 Favored 'General case' 0 N--CA 1.497 1.886 0 O-C-N 121.483 -0.761 . . . . 0.0 109.658 179.155 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 78' ' ' LEU . . . . . 0.533 ' CB ' HG13 ' A' ' 9' ' ' VAL . 41.4 mt -66.36 -34.18 77.39 Favored 'General case' 0 N--CA 1.497 1.893 0 O-C-N 121.411 -0.806 . . . . 0.0 109.914 178.987 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 79' ' ' VAL . . . . . 0.509 HG23 HG11 ' A' ' 9' ' ' VAL . 55.3 t -64.25 -42.93 96.96 Favored 'Isoleucine or valine' 0 N--CA 1.498 1.955 0 O-C-N 121.359 -0.838 . . . . 0.0 109.699 179.056 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 80' ' ' MET . . . . . 0.522 ' HG3' HG21 ' A' ' 64' ' ' VAL . 0.0 OUTLIER -60.48 -34.14 73.62 Favored 'General case' 0 N--CA 1.498 1.937 0 O-C-N 121.4 -0.813 . . . . 0.0 110.034 179.318 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' A' A ' 81' ' ' MET . . . . . . . . . . . . . 8.9 mmt -62.92 -53.44 53.98 Favored 'General case' 0 N--CA 1.498 1.955 0 O-C-N 121.459 -0.776 . . . . 0.0 110.34 179.732 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 82' ' ' VAL . . . . . . . . . . . . . 0.6 OUTLIER -66.7 -24.55 33.01 Favored 'Isoleucine or valine' 0 N--CA 1.503 2.189 0 O-C-N 121.165 -0.959 . . . . 0.0 110.035 179.236 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 83' ' ' ARG . . . . . . . . . . . . . 0.6 OUTLIER -78.38 -35.18 47.64 Favored 'General case' 0 N--CA 1.497 1.921 0 O-C-N 121.248 -0.907 . . . . 0.0 109.613 178.829 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 84' ' ' CYS . . . . . . . . . . . . . 1.0 OUTLIER -70.03 -28.91 65.87 Favored 'General case' 0 N--CA 1.498 1.942 0 O-C-N 121.504 -0.747 . . . . 0.0 110.645 179.531 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 85' ' ' MET . . . . . . . . . . . . . 34.0 mtt . . . . . 0 N--CA 1.502 2.158 0 O-C-N 121.68 -0.637 . . . . 0.0 110.759 179.867 . . . . . . . . 0 0 . 1 . 010 nuclear build core ' B' B ' 149' ' ' SER . . . . . . . . . . . . . 6.5 t . . . . . 0 N--CA 1.498 1.97 0 CA-C-O 121.132 0.491 . . . . 0.0 110.728 . . . . . . . . . 0 0 . 1 . 010 nuclear build core ' B' B ' 150' ' ' ALA . . . . . . . . . . . . . . . -56.35 -43.15 78.82 Favored 'General case' 0 N--CA 1.498 1.944 0 O-C-N 121.494 -0.754 . . . . 0.0 110.543 179.767 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' B' B ' 151' ' ' ASP . . . . . . . . . . . . . 4.8 m-20 -71.11 -48.11 54.15 Favored 'General case' 0 N--CA 1.498 1.95 0 O-C-N 121.406 -0.809 . . . . 0.0 110.28 179.786 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' B' B ' 152' ' ' ALA . . . . . . . . . . . . . . . -60.53 -48.3 82.38 Favored 'General case' 0 N--CA 1.498 1.949 0 O-C-N 121.544 -0.723 . . . . 0.0 110.648 179.88 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' B' B ' 153' ' ' MET . . . . . . . . . . . . . 0.5 OUTLIER -63.25 -37.72 88.35 Favored 'General case' 0 N--CA 1.499 1.985 0 O-C-N 121.364 -0.835 . . . . 0.0 110.195 179.693 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' B' B ' 154' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -65.47 -42.76 91.89 Favored 'General case' 0 N--CA 1.497 1.922 0 O-C-N 121.285 -0.884 . . . . 0.0 110.144 179.461 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' B' B ' 155' ' ' GLN . . . . . . . . . . . . . 14.3 mt-30 -62.92 -42.0 99.65 Favored 'General case' 0 N--CA 1.5 2.053 0 O-C-N 121.54 -0.725 . . . . 0.0 110.32 179.424 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' B' B ' 156' ' ' ALA . . . . . 0.413 ' HB1' ' CE ' ' A' ' 47' ' ' MET . . . -70.0 -36.26 75.0 Favored 'General case' 0 N--CA 1.496 1.858 0 O-C-N 121.438 -0.789 . . . . 0.0 110.171 179.73 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' B' B ' 157' ' ' LEU . . . . . 0.839 HD23 ' HB1' ' A' ' 23' ' ' ALA . 4.1 mp -71.05 -61.74 1.65 Allowed 'General case' 0 N--CA 1.496 1.841 0 O-C-N 121.645 -0.659 . . . . 0.0 110.351 -179.967 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' B' B ' 158' ' ' LEU . . . . . 0.588 HD11 ' HB2' ' A' ' 23' ' ' ALA . 17.5 mt . . . . . 0 N--CA 1.497 1.918 0 O-C-N 121.261 -0.899 . . . . 0.0 109.971 179.821 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 4' ' ' ILE . . . . . . . . . . . . . 11.6 mt . . . . . 0 N--CA 1.503 2.219 0 CA-C-O 120.798 0.333 . . . . 0.0 110.267 . . . . . . . . . 0 0 . 1 . 011 nuclear build core ' A' A ' 5' ' ' TYR . . . . . 0.413 ' CE1' ' HG2' ' A' ' 83' ' ' ARG . 6.8 m-85 -73.52 -34.31 65.18 Favored 'General case' 0 N--CA 1.5 2.051 0 O-C-N 121.288 -0.883 . . . . 0.0 109.967 179.155 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 6' ' ' LYS . . . . . 0.52 ' O ' HG12 ' A' ' 9' ' ' VAL . 0.0 OUTLIER -59.78 -32.34 70.51 Favored 'General case' 0 N--CA 1.497 1.924 0 O-C-N 121.44 -0.787 . . . . 0.0 110.214 179.576 . . . . . . . . 3 3 . 1 . 011 nuclear build core ' A' A ' 7' ' ' ALA . . . . . . . . . . . . . . . -55.88 -34.32 65.39 Favored 'General case' 0 N--CA 1.497 1.912 0 O-C-N 121.282 -0.886 . . . . 0.0 109.693 178.865 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 8' ' ' ALA . . . . . 0.563 ' CB ' HG11 ' A' ' 82' ' ' VAL . . . -71.72 -45.42 61.84 Favored 'General case' 0 N--CA 1.497 1.892 0 O-C-N 121.523 -0.736 . . . . 0.0 110.331 179.375 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 9' ' ' VAL . . . . . 0.633 ' HA ' HD12 ' A' ' 12' ' ' LEU . 0.3 OUTLIER -63.66 -28.98 46.1 Favored 'Isoleucine or valine' 0 N--CA 1.5 2.064 0 O-C-N 121.152 -0.967 . . . . 0.0 109.999 179.398 . . . . . . . . 3 3 . 1 . 011 nuclear build core ' A' A ' 10' ' ' GLU . . . . . . . . . . . . . 1.1 tt0 -73.26 -31.98 64.41 Favored 'General case' 0 N--CA 1.493 1.677 0 O-C-N 121.606 -0.684 . . . . 0.0 110.366 179.299 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 11' ' ' GLN . . . . . . . . . . . . . 27.4 mt-30 -85.22 2.81 42.2 Favored 'General case' 0 N--CA 1.499 2.008 0 O-C-N 121.331 -0.856 . . . . 0.0 111.577 -179.84 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 12' ' ' LEU . . . . . 0.633 HD12 ' HA ' ' A' ' 9' ' ' VAL . 4.5 mt -73.2 136.83 44.75 Favored 'General case' 0 N--CA 1.5 2.033 0 O-C-N 120.877 -1.14 . . . . 0.0 110.197 179.823 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 13' ' ' THR . . . . . . . . . . . . . 3.2 m -92.26 157.6 16.58 Favored 'General case' 0 N--CA 1.503 2.196 0 O-C-N 121.323 -0.861 . . . . 0.0 111.008 -179.602 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 14' ' ' GLU . . . . . . . . . . . . . 8.5 tp10 -51.96 -41.75 62.35 Favored 'General case' 0 N--CA 1.496 1.847 0 O-C-N 121.809 -0.557 . . . . 0.0 110.607 -179.918 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 23.5 mt-10 -58.5 -43.78 89.22 Favored 'General case' 0 N--CA 1.498 1.967 0 O-C-N 121.544 -0.723 . . . . 0.0 110.512 179.56 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 16' ' ' GLN . . . . . . . . . . . . . 0.8 OUTLIER -70.5 -37.07 74.11 Favored 'General case' 0 N--CA 1.498 1.931 0 O-C-N 121.491 -0.755 . . . . 0.0 110.284 179.745 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 17' ' ' LYS . . . . . . . . . . . . . 2.6 tptt -62.98 -45.68 91.28 Favored 'General case' 0 N--CA 1.496 1.873 0 N-CA-C 109.083 -0.71 . . . . 0.0 109.083 178.756 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 18' ' ' ASN . . . . . . . . . . . . . 15.7 m-80 -70.07 -27.98 65.06 Favored 'General case' 0 N--CA 1.497 1.901 0 O-C-N 121.439 -0.788 . . . . 0.0 109.757 178.642 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 7.3 tt0 -67.33 -51.42 52.56 Favored 'General case' 0 N--CA 1.495 1.776 0 O-C-N 121.445 -0.784 . . . . 0.0 109.247 178.967 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 20' ' ' PHE . . . . . . . . . . . . . 30.6 m-85 -67.19 -27.4 67.23 Favored 'General case' 0 N--CA 1.497 1.877 0 O-C-N 121.328 -0.858 . . . . 0.0 109.798 178.936 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 21' ' ' LYS . . . . . . . . . . . . . 3.1 tptt -58.04 -46.82 84.73 Favored 'General case' 0 N--CA 1.499 1.995 0 O-C-N 121.377 -0.827 . . . . 0.0 109.62 178.885 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 22' ' ' ALA . . . . . . . . . . . . . . . -63.27 -46.67 85.71 Favored 'General case' 0 N--CA 1.496 1.832 0 O-C-N 121.541 -0.725 . . . . 0.0 109.745 179.235 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 23' ' ' ALA . . . . . . . . . . . . . . . -60.65 -42.88 97.87 Favored 'General case' 0 N--CA 1.498 1.962 0 O-C-N 121.516 -0.74 . . . . 0.0 109.625 178.946 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 24' ' ' PHE . . . . . 0.518 ' O ' HG22 ' A' ' 28' ' ' VAL . 59.4 t80 -59.38 -47.92 83.6 Favored 'General case' 0 N--CA 1.494 1.766 0 O-C-N 121.567 -0.708 . . . . 0.0 109.666 179.139 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 25' ' ' ASP . . . . . . . . . . . . . 1.1 m-20 -56.39 -41.41 76.21 Favored 'General case' 0 N--CA 1.498 1.955 0 O-C-N 121.692 -0.63 . . . . 0.0 110.393 179.475 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 26' ' ' ILE . . . . . . . . . . . . . 38.1 mm -64.87 -30.12 49.39 Favored 'Isoleucine or valine' 0 N--CA 1.501 2.109 0 O-C-N 121.389 -0.819 . . . . 0.0 110.047 179.262 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 27' ' ' PHE . . . . . 0.455 ' CE1' ' HB ' ' A' ' 44' ' ' VAL . 0.1 OUTLIER -75.38 -28.98 59.71 Favored 'General case' 0 N--CA 1.496 1.833 0 O-C-N 121.435 -0.791 . . . . 0.0 111.115 -179.954 . . . . . . . . 3 3 . 1 . 011 nuclear build core ' A' A ' 28' ' ' VAL . . . . . 0.518 HG22 ' O ' ' A' ' 24' ' ' PHE . 0.0 OUTLIER -113.75 -79.17 0.38 Allowed 'Isoleucine or valine' 0 N--CA 1.498 1.95 0 O-C-N 121.138 -0.976 . . . . 0.0 110.748 179.859 . . . . . . . . 3 3 . 1 . 011 nuclear build core ' A' A ' 29' ' ' LEU . . . . . 0.42 ' H ' HG23 ' A' ' 28' ' ' VAL . 0.2 OUTLIER 67.19 -68.89 0.14 Allowed 'General case' 0 N--CA 1.504 2.262 0 O-C-N 121.644 -0.66 . . . . 0.0 110.407 -179.615 . . . . . . . . 3 3 . 1 . 011 nuclear build core ' A' A ' 30' ' ' GLY . . . . . . . . . . . . . . . -98.36 40.84 2.37 Favored Glycine 0 N--CA 1.494 2.545 0 N-CA-C 109.538 -1.425 . . . . 0.0 109.538 179.138 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 31' ' ' ALA . . . . . 0.433 ' HB2' ' HB ' ' A' ' 28' ' ' VAL . . . . . . . . 0 N--CA 1.499 2.017 0 O-C-N 121.306 -1.114 . . . . 0.0 110.681 -179.892 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 35' ' ' CYS . . . . . . . . . . . . . 12.9 p . . . . . 0 N--CA 1.496 1.835 0 CA-C-O 121.111 0.481 . . . . 0.0 110.4 . . . . . . . . . 0 0 . 1 . 011 nuclear build core ' A' A ' 36' ' ' ILE . . . . . 0.424 HG12 HG13 ' A' ' 28' ' ' VAL . 69.5 mt -78.05 96.42 1.85 Allowed 'Isoleucine or valine' 0 N--CA 1.496 1.86 0 O-C-N 121.416 -0.802 . . . . 0.0 110.059 -179.988 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 37' ' ' SER . . . . . . . . . . . . . 91.5 p -87.92 -176.79 5.6 Favored 'General case' 0 N--CA 1.496 1.833 0 O-C-N 121.407 -0.808 . . . . 0.0 109.766 179.452 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 38' ' ' THR . . . . . 0.547 HG21 ' HG2' ' A' ' 58' ' ' GLN . 7.3 p -55.45 -36.98 67.14 Favored 'General case' 0 N--CA 1.5 2.032 0 O-C-N 121.361 -0.837 . . . . 0.0 110.487 179.819 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 39' ' ' LYS . . . . . . . . . . . . . 4.2 mtmp? -71.23 -44.92 64.41 Favored 'General case' 0 N--CA 1.499 1.983 0 O-C-N 121.416 -0.802 . . . . 0.0 110.583 179.818 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 40' ' ' GLU . . . . . 0.422 ' HG3' HG12 ' A' ' 28' ' ' VAL . 9.9 mm-40 -63.61 -38.61 91.76 Favored 'General case' 0 N--CA 1.501 2.094 0 O-C-N 121.393 -0.817 . . . . 0.0 110.647 -179.811 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 41' ' ' LEU . . . . . 0.861 HD12 HD13 ' A' ' 57' ' ' LEU . 1.8 tm? -66.14 -66.39 0.56 Allowed 'General case' 0 N--CA 1.499 2.0 0 O-C-N 121.297 -0.877 . . . . 0.0 109.346 179.124 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 42' ' ' GLY . . . . . 0.605 ' HA2' ' HB2' ' A' ' 45' ' ' MET . . . -48.03 -33.28 10.08 Favored Glycine 0 N--CA 1.501 3.011 0 N-CA-C 110.873 -0.891 . . . . 0.0 110.873 179.881 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 43' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -52.52 -46.24 66.61 Favored 'General case' 0 N--CA 1.503 2.178 0 O-C-N 121.383 -1.069 . . . . 0.0 110.566 179.54 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 44' ' ' VAL . . . . . 0.462 HG11 HD11 ' B' ' 157' ' ' LEU . 60.4 t -87.99 -21.61 7.02 Favored 'Isoleucine or valine' 0 N--CA 1.499 1.992 0 O-C-N 121.446 -0.784 . . . . 0.0 110.673 179.828 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 45' ' ' MET . . . . . 0.605 ' HB2' ' HA2' ' A' ' 42' ' ' GLY . 0.2 OUTLIER -57.44 -24.91 58.41 Favored 'General case' 0 N--CA 1.502 2.165 0 O-C-N 121.214 -0.929 . . . . 0.0 111.55 -179.957 . . . . . . . . 3 3 . 1 . 011 nuclear build core ' A' A ' 46' ' ' ARG . . . . . 0.527 ' HA ' ' HG3' ' A' ' 50' ' ' GLN . 4.9 mtm180 -50.33 -36.06 30.39 Favored 'General case' 0 N--CA 1.502 2.13 0 O-C-N 121.321 -0.862 . . . . 0.0 111.119 179.989 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 47' ' ' MET . . . . . . . . . . . . . 20.3 mtm -80.15 -30.86 38.99 Favored 'General case' 0 N--CA 1.497 1.899 0 O-C-N 121.359 -0.838 . . . . 0.0 110.889 -179.96 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 48' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -134.47 84.43 2.11 Favored 'General case' 0 N--CA 1.485 1.287 0 O-C-N 121.211 -0.93 . . . . 0.0 110.872 -179.457 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 49' ' ' GLY . . . . . . . . . . . . . . . 81.02 89.95 0.55 Allowed Glycine 0 N--CA 1.495 2.614 0 N-CA-C 109.828 -1.309 . . . . 0.0 109.828 179.722 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 50' ' ' GLN . . . . . 0.527 ' HG3' ' HA ' ' A' ' 46' ' ' ARG . 7.9 mp0 -65.83 152.49 44.29 Favored 'General case' 0 N--CA 1.498 1.953 0 O-C-N 121.525 -0.985 . . . . 0.0 110.661 -179.943 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 51' ' ' ASN . . . . . 0.432 ' HA ' ' HD2' ' A' ' 52' ' ' PRO . 16.3 p-10 -97.41 110.84 56.47 Favored Pre-proline 0 N--CA 1.494 1.76 0 O-C-N 121.535 -0.728 . . . . 0.0 110.125 179.551 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 52' ' ' PRO . . . . . 0.432 ' HD2' ' HA ' ' A' ' 51' ' ' ASN . 41.7 Cg_endo -69.21 -43.33 3.19 Favored 'Trans proline' 0 C--N 1.312 -1.343 0 O-C-N 123.676 1.356 . . . . 0.0 110.832 -179.885 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 53' ' ' THR . . . . . . . . . . . . . 0.6 OUTLIER -126.93 146.78 58.78 Favored Pre-proline 0 N--CA 1.495 1.824 0 O-C-N 121.336 -0.853 . . . . 0.0 110.282 -179.991 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 54' ' ' PRO . . . . . . . . . . . . . 40.9 Cg_endo -67.37 -36.96 18.91 Favored 'Trans proline' 0 N--CA 1.491 1.371 0 O-C-N 123.729 1.384 . . . . 0.0 110.781 179.811 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 55' ' ' GLU . . . . . 0.478 ' HG2' ' N ' ' A' ' 56' ' ' GLU . 3.1 pm0 -64.29 -24.6 67.72 Favored 'General case' 0 N--CA 1.498 1.965 0 O-C-N 121.365 -0.834 . . . . 0.0 110.748 179.432 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 56' ' ' GLU . . . . . 0.478 ' N ' ' HG2' ' A' ' 55' ' ' GLU . 27.0 tt0 -65.35 -25.41 67.57 Favored 'General case' 0 N--CA 1.498 1.951 0 O-C-N 121.174 -0.954 . . . . 0.0 110.401 179.399 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 57' ' ' LEU . . . . . 0.861 HD13 HD12 ' A' ' 41' ' ' LEU . 4.7 mt -94.13 -18.79 21.41 Favored 'General case' 0 N--CA 1.496 1.85 0 O-C-N 121.155 -0.966 . . . . 0.0 110.189 179.362 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 58' ' ' GLN . . . . . 0.547 ' HG2' HG21 ' A' ' 38' ' ' THR . 4.0 mm100 -59.78 -39.84 86.27 Favored 'General case' 0 N--CA 1.499 2.016 0 O-C-N 121.059 -1.026 . . . . 0.0 109.966 179.638 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 59' ' ' GLU . . . . . 0.529 ' O ' ' HB2' ' A' ' 63' ' ' GLU . 0.0 OUTLIER -59.82 -29.39 68.21 Favored 'General case' 0 N--CA 1.5 2.052 0 O-C-N 121.359 -0.838 . . . . 0.0 109.392 178.576 . . . . . . . . 3 3 . 1 . 011 nuclear build core ' A' A ' 60' ' ' MET . . . . . 0.435 ' HB2' ' O ' ' A' ' 57' ' ' LEU . 0.0 OUTLIER -72.87 -20.69 61.05 Favored 'General case' 0 N--CA 1.493 1.716 0 O-C-N 121.586 -0.696 . . . . 0.0 109.596 178.207 . . . . . . . . 3 3 . 1 . 011 nuclear build core ' A' A ' 61' ' ' ILE . . . . . 0.539 HG23 HG23 ' A' ' 72' ' ' VAL . 28.9 mm -85.14 -59.21 2.89 Favored 'Isoleucine or valine' 0 N--CA 1.496 1.874 0 O-C-N 121.514 -0.741 . . . . 0.0 110.468 179.941 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 62' ' ' ASP . . . . . 0.446 ' HA ' ' HB3' ' A' ' 65' ' ' ASP . 25.2 m-20 -60.16 -33.44 72.19 Favored 'General case' 0 N--CA 1.501 2.11 0 O-C-N 121.736 -0.602 . . . . 0.0 112.115 -178.58 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 63' ' ' GLU . . . . . 0.529 ' HB2' ' O ' ' A' ' 59' ' ' GLU . 0.6 OUTLIER -56.35 -42.36 77.63 Favored 'General case' 0 N--CA 1.504 2.266 0 O-C-N 121.169 -0.957 . . . . 0.0 110.939 -179.492 . . . . . . . . 3 3 . 1 . 011 nuclear build core ' A' A ' 64' ' ' VAL . . . . . 0.736 HG11 ' HB3' ' A' ' 80' ' ' MET . 34.5 m -99.79 -18.0 6.49 Favored 'Isoleucine or valine' 0 N--CA 1.501 2.094 0 O-C-N 121.308 -0.87 . . . . 0.0 111.224 179.872 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 65' ' ' ASP . . . . . 0.476 ' HA ' ' CD ' ' A' ' 76' ' ' GLU . 23.6 t70 -68.37 -87.12 0.02 OUTLIER 'General case' 0 N--CA 1.496 1.831 0 O-C-N 121.371 -0.831 . . . . 0.0 110.521 -179.596 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 66' ' ' GLU . . . . . . . . . . . . . 7.6 mm-40 48.51 33.28 3.91 Favored 'General case' 0 N--CA 1.502 2.135 0 O-C-N 121.35 -0.843 . . . . 0.0 111.171 -179.971 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 67' ' ' ASP . . . . . . . . . . . . . 0.7 OUTLIER -116.88 -18.29 10.21 Favored 'General case' 0 N--CA 1.499 1.995 0 O-C-N 121.104 -0.998 . . . . 0.0 111.601 -179.633 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 68' ' ' GLY . . . . . . . . . . . . . . . 123.05 -30.07 5.14 Favored Glycine 0 N--CA 1.498 2.804 0 N-CA-C 110.42 -1.072 . . . . 0.0 110.42 179.782 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 69' ' ' SER . . . . . . . . . . . . . 1.0 OUTLIER -78.93 -35.58 43.08 Favored 'General case' 0 N--CA 1.499 2.001 0 O-C-N 121.23 -1.159 . . . . 0.0 110.891 -179.635 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 70' ' ' GLY . . . . . . . . . . . . . . . 76.39 28.02 60.57 Favored Glycine 0 N--CA 1.498 2.8 0 N-CA-C 110.391 -1.084 . . . . 0.0 110.391 179.951 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 71' ' ' THR . . . . . . . . . . . . . 2.3 m -144.18 140.67 29.48 Favored 'General case' 0 N--CA 1.499 2.008 0 O-C-N 121.24 -1.153 . . . . 0.0 109.45 179.448 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 72' ' ' VAL . . . . . 0.539 HG23 HG23 ' A' ' 61' ' ' ILE . 24.7 t -75.69 124.49 33.82 Favored 'Isoleucine or valine' 0 N--CA 1.497 1.909 0 O-C-N 121.58 -0.7 . . . . 0.0 110.734 -179.586 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 73' ' ' ASP . . . . . . . . . . . . . 1.1 p30 -111.45 -161.38 0.75 Allowed 'General case' 0 N--CA 1.498 1.949 0 O-C-N 121.539 -0.726 . . . . 0.0 110.037 179.258 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 74' ' ' PHE . . . . . . . . . . . . . 16.9 t80 -66.72 -47.99 70.6 Favored 'General case' 0 N--CA 1.5 2.063 0 O-C-N 121.063 -1.023 . . . . 0.0 111.328 -178.91 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 75' ' ' ASP . . . . . 0.469 ' HA ' HD12 ' A' ' 78' ' ' LEU . 0.4 OUTLIER -68.25 -42.65 79.34 Favored 'General case' 0 N--CA 1.496 1.828 0 O-C-N 121.136 -0.978 . . . . 0.0 110.632 -179.621 . . . . . . . . 3 3 . 1 . 011 nuclear build core ' A' A ' 76' ' ' GLU . . . . . 0.476 ' CD ' ' HA ' ' A' ' 65' ' ' ASP . 2.6 mt-10 -64.86 -30.45 71.45 Favored 'General case' 0 N--CA 1.498 1.935 0 O-C-N 121.207 -0.933 . . . . 0.0 109.742 178.767 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 77' ' ' PHE . . . . . 0.537 ' HA ' ' SD ' ' A' ' 80' ' ' MET . 67.4 t80 -58.96 -28.1 65.98 Favored 'General case' 0 N--CA 1.5 2.056 0 O-C-N 121.539 -0.725 . . . . 0.0 109.835 178.575 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 78' ' ' LEU . . . . . 0.469 HD12 ' HA ' ' A' ' 75' ' ' ASP . 20.0 mt -77.31 -35.36 54.98 Favored 'General case' 0 N--CA 1.495 1.797 0 O-C-N 121.352 -0.843 . . . . 0.0 110.257 179.297 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 79' ' ' VAL . . . . . . . . . . . . . 61.8 t -56.67 -57.21 10.21 Favored 'Isoleucine or valine' 0 N--CA 1.502 2.151 0 O-C-N 121.395 -0.816 . . . . 0.0 110.253 179.795 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 80' ' ' MET . . . . . 0.736 ' HB3' HG11 ' A' ' 64' ' ' VAL . 0.0 OUTLIER -57.17 -34.92 68.96 Favored 'General case' 0 N--CA 1.502 2.135 0 O-C-N 121.425 -0.797 . . . . 0.0 110.402 179.626 . . . . . . . . 3 3 . 1 . 011 nuclear build core ' A' A ' 81' ' ' MET . . . . . . . . . . . . . 12.3 mmt -65.58 -43.87 88.44 Favored 'General case' 0 N--CA 1.498 1.967 0 O-C-N 121.365 -0.834 . . . . 0.0 110.063 179.129 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 82' ' ' VAL . . . . . 0.563 HG11 ' CB ' ' A' ' 8' ' ' ALA . 55.0 t -63.96 -34.62 69.58 Favored 'Isoleucine or valine' 0 N--CA 1.503 2.184 0 O-C-N 121.425 -0.797 . . . . 0.0 110.146 179.317 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 83' ' ' ARG . . . . . 0.413 ' HG2' ' CE1' ' A' ' 5' ' ' TYR . 31.7 mtt180 -66.5 -44.39 82.72 Favored 'General case' 0 N--CA 1.497 1.915 0 O-C-N 121.548 -0.72 . . . . 0.0 110.381 179.864 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 84' ' ' CYS . . . . . . . . . . . . . 84.1 m -71.95 -39.31 69.47 Favored 'General case' 0 N--CA 1.498 1.953 0 O-C-N 121.434 -0.791 . . . . 0.0 110.003 179.439 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 85' ' ' MET . . . . . . . . . . . . . 38.1 ttp . . . . . 0 N--CA 1.497 1.925 0 O-C-N 121.502 -0.749 . . . . 0.0 110.797 179.527 . . . . . . . . 0 0 . 1 . 011 nuclear build core ' B' B ' 149' ' ' SER . . . . . . . . . . . . . 78.9 p . . . . . 0 N--CA 1.497 1.9 0 CA-C-O 121.208 0.528 . . . . 0.0 110.449 . . . . . . . . . 0 0 . 1 . 011 nuclear build core ' B' B ' 150' ' ' ALA . . . . . . . . . . . . . . . -88.75 -45.46 9.77 Favored 'General case' 0 N--CA 1.498 1.944 0 O-C-N 121.258 -0.901 . . . . 0.0 110.523 -179.955 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' B' B ' 151' ' ' ASP . . . . . . . . . . . . . 8.0 p-10 -56.8 -41.64 78.1 Favored 'General case' 0 N--CA 1.503 2.188 0 O-C-N 121.537 -0.727 . . . . 0.0 111.076 -179.977 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' B' B ' 152' ' ' ALA . . . . . . . . . . . . . . . -66.35 -43.09 87.05 Favored 'General case' 0 N--CA 1.498 1.94 0 O-C-N 121.293 -0.879 . . . . 0.0 110.286 179.78 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' B' B ' 153' ' ' MET . . . . . . . . . . . . . 7.3 mmt -63.17 -48.32 78.9 Favored 'General case' 0 N--CA 1.496 1.867 0 O-C-N 121.553 -0.717 . . . . 0.0 109.968 179.516 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' B' B ' 154' ' ' MET . . . . . . . . . . . . . 22.9 mmm -59.99 -37.57 80.05 Favored 'General case' 0 N--CA 1.498 1.957 0 O-C-N 121.566 -0.709 . . . . 0.0 110.092 179.309 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' B' B ' 155' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -69.47 -38.91 77.94 Favored 'General case' 0 N--CA 1.499 2.021 0 O-C-N 121.537 -0.727 . . . . 0.0 110.938 179.696 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' B' B ' 156' ' ' ALA . . . . . . . . . . . . . . . -75.91 -45.34 35.81 Favored 'General case' 0 N--CA 1.498 1.945 0 O-C-N 121.249 -0.907 . . . . 0.0 110.777 -179.507 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' B' B ' 157' ' ' LEU . . . . . 0.462 HD11 HG11 ' A' ' 44' ' ' VAL . 1.4 mp -60.08 -37.08 78.84 Favored 'General case' 0 N--CA 1.499 2.024 0 O-C-N 121.469 -0.77 . . . . 0.0 111.142 -179.737 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' B' B ' 158' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER . . . . . 0 N--CA 1.496 1.829 0 O-C-N 121.254 -0.904 . . . . 0.0 110.297 -179.886 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 4' ' ' ILE . . . . . . . . . . . . . 2.0 mp . . . . . 0 N--CA 1.501 2.099 0 CA-C-O 120.666 0.269 . . . . 0.0 110.316 . . . . . . . . . 0 0 . 1 . 012 nuclear build core ' A' A ' 5' ' ' TYR . . . . . . . . . . . . . 0.4 OUTLIER -55.88 -31.5 62.87 Favored 'General case' 0 N--CA 1.502 2.135 0 O-C-N 121.333 -0.854 . . . . 0.0 110.181 179.448 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -58.02 -38.35 76.02 Favored 'General case' 0 N--CA 1.497 1.886 0 O-C-N 121.602 -0.686 . . . . 0.0 110.589 179.408 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 7' ' ' ALA . . . . . . . . . . . . . . . -61.42 -44.16 97.62 Favored 'General case' 0 N--CA 1.499 2.024 0 O-C-N 121.396 -0.815 . . . . 0.0 110.643 179.644 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 8' ' ' ALA . . . . . . . . . . . . . . . -74.73 -12.26 60.37 Favored 'General case' 0 N--CA 1.499 2.018 0 O-C-N 121.302 -0.874 . . . . 0.0 111.371 179.988 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 9' ' ' VAL . . . . . 0.774 HG13 ' HB3' ' A' ' 78' ' ' LEU . 48.1 t -101.58 -52.68 8.23 Favored 'Isoleucine or valine' 0 N--CA 1.498 1.961 0 O-C-N 121.142 -0.974 . . . . 0.0 110.601 -179.684 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 10' ' ' GLU . . . . . . . . . . . . . 21.9 mm-40 -86.77 -18.62 30.65 Favored 'General case' 0 N--CA 1.494 1.765 0 O-C-N 121.303 -0.873 . . . . 0.0 111.163 -179.544 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 11' ' ' GLN . . . . . . . . . . . . . 0.6 OUTLIER -120.27 59.29 0.9 Allowed 'General case' 0 N--CA 1.496 1.86 0 O-C-N 120.974 -1.078 . . . . 0.0 111.088 -179.933 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 12' ' ' LEU . . . . . 0.571 HD13 ' HB3' ' A' ' 16' ' ' GLN . 0.0 OUTLIER -92.99 -73.14 0.57 Allowed 'General case' 0 N--CA 1.501 2.121 0 O-C-N 120.988 -1.07 . . . . 0.0 108.721 178.33 . . . . . . . . 3 3 . 1 . 012 nuclear build core ' A' A ' 13' ' ' THR . . . . . 0.476 ' HB ' ' HB2' ' A' ' 16' ' ' GLN . 1.6 m -152.23 147.53 26.49 Favored 'General case' 0 N--CA 1.498 1.945 0 O-C-N 121.528 -0.732 . . . . 0.0 109.346 179.034 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 14' ' ' GLU . . . . . . . . . . . . . 0.3 OUTLIER -54.07 -46.24 71.95 Favored 'General case' 0 N--CA 1.494 1.728 0 O-C-N 121.714 -0.616 . . . . 0.0 111.013 -179.238 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 7.0 tp10 -76.87 -26.72 54.54 Favored 'General case' 0 N--CA 1.496 1.839 0 O-C-N 121.297 -0.877 . . . . 0.0 111.048 179.96 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 16' ' ' GLN . . . . . 0.571 ' HB3' HD13 ' A' ' 12' ' ' LEU . 2.5 mt-30 -56.23 -42.44 77.3 Favored 'General case' 0 N--CA 1.503 2.191 0 O-C-N 121.156 -0.965 . . . . 0.0 110.711 -179.897 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 17' ' ' LYS . . . . . 0.46 ' NZ ' HD13 ' A' ' 78' ' ' LEU . 6.7 mttm -65.95 -45.7 80.83 Favored 'General case' 0 N--CA 1.496 1.863 0 N-CA-C 109.245 -0.65 . . . . 0.0 109.245 179.145 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 18' ' ' ASN . . . . . . . . . . . . . 61.9 t30 -64.07 -37.28 86.88 Favored 'General case' 0 N--CA 1.497 1.906 0 O-C-N 121.779 -0.576 . . . . 0.0 109.628 178.736 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 5.6 tt0 -67.07 -52.62 39.87 Favored 'General case' 0 N--CA 1.495 1.799 0 O-C-N 121.543 -0.723 . . . . 0.0 109.363 179.108 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 20' ' ' PHE . . . . . . . . . . . . . 4.0 m-85 -58.58 -34.16 70.78 Favored 'General case' 0 N--CA 1.499 2.012 0 O-C-N 121.419 -0.801 . . . . 0.0 109.699 179.121 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 21' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -61.43 -46.51 89.8 Favored 'General case' 0 N--CA 1.498 1.925 0 O-C-N 121.439 -0.788 . . . . 0.0 109.19 178.852 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 22' ' ' ALA . . . . . . . . . . . . . . . -59.77 -47.9 83.82 Favored 'General case' 0 N--CA 1.499 1.978 0 O-C-N 121.387 -0.82 . . . . 0.0 109.532 179.107 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 23' ' ' ALA . . . . . . . . . . . . . . . -61.02 -41.02 95.75 Favored 'General case' 0 N--CA 1.497 1.919 0 O-C-N 121.455 -0.778 . . . . 0.0 109.412 178.563 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 24' ' ' PHE . . . . . 0.413 ' CE2' HD12 ' A' ' 36' ' ' ILE . 37.7 t80 -67.12 -45.98 75.53 Favored 'General case' 0 N--CA 1.497 1.891 0 O-C-N 121.767 -0.583 . . . . 0.0 110.112 179.339 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 25' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER -53.38 -46.38 69.6 Favored 'General case' 0 N--CA 1.5 2.071 0 O-C-N 121.606 -0.684 . . . . 0.0 110.26 179.72 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 26' ' ' ILE . . . . . 0.542 ' HB ' HD21 ' B' ' 157' ' ' LEU . 51.0 mt -72.45 -30.27 34.05 Favored 'Isoleucine or valine' 0 N--CA 1.497 1.909 0 O-C-N 121.465 -0.772 . . . . 0.0 109.68 179.171 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 27' ' ' PHE . . . . . . . . . . . . . 0.8 OUTLIER -63.52 -38.82 92.59 Favored 'General case' 0 N--CA 1.498 1.932 0 O-C-N 121.434 -0.791 . . . . 0.0 110.299 179.363 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 28' ' ' VAL . . . . . . . . . . . . . 34.9 m -93.78 36.68 0.1 Allowed 'Isoleucine or valine' 0 N--CA 1.501 2.11 0 O-C-N 121.265 -0.897 . . . . 0.0 110.811 179.838 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 29' ' ' LEU . . . . . . . . . . . . . 0.9 OUTLIER -70.22 106.45 3.32 Favored 'General case' 0 N--CA 1.499 1.996 0 O-C-N 121.012 -1.055 . . . . 0.0 109.816 179.476 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 30' ' ' GLY . . . . . . . . . . . . . . . 109.9 -30.87 7.97 Favored Glycine 0 N--CA 1.494 2.556 0 N-CA-C 109.352 -1.499 . . . . 0.0 109.352 -179.228 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 31' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.495 1.779 0 O-C-N 121.411 -1.052 . . . . 0.0 109.642 179.549 . . . . . . . . 0 0 . 1 . 012 nuclear build core ' A' A ' 35' ' ' CYS . . . . . . . . . . . . . 56.3 m . . . . . 0 N--CA 1.496 1.848 0 CA-C-O 121.41 0.624 . . . . 0.0 110.656 . . . . . . . . . 0 0 . 1 . 012 nuclear build core ' A' A ' 36' ' ' ILE . . . . . 0.49 ' O ' HG22 ' A' ' 36' ' ' ILE . 0.5 OUTLIER -102.28 112.58 36.02 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.613 0 CA-C-O 121.44 0.638 . . . . 0.0 109.361 179.596 . . . . . . . . 3 3 . 1 . 012 nuclear build core ' A' A ' 37' ' ' SER . . . . . . . . . . . . . 0.2 OUTLIER -108.57 -173.18 2.21 Favored 'General case' 0 N--CA 1.494 1.728 0 O-C-N 121.413 -0.805 . . . . 0.0 110.628 -179.417 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 38' ' ' THR . . . . . . . . . . . . . 57.2 p -66.21 -42.17 89.12 Favored 'General case' 0 N--CA 1.499 1.99 0 O-C-N 121.486 -0.759 . . . . 0.0 110.911 -179.73 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 39' ' ' LYS . . . . . . . . . . . . . 47.9 mtmt -58.43 -45.57 88.21 Favored 'General case' 0 N--CA 1.502 2.13 0 O-C-N 121.45 -0.781 . . . . 0.0 110.731 -179.87 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 1.1 mp0 -71.86 -27.94 63.21 Favored 'General case' 0 N--CA 1.499 2.005 0 O-C-N 121.551 -0.718 . . . . 0.0 110.522 -179.855 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 41' ' ' LEU . . . . . 0.594 ' HG ' HD13 ' A' ' 57' ' ' LEU . 6.9 tp -72.58 -53.48 11.82 Favored 'General case' 0 N--CA 1.497 1.894 0 O-C-N 121.208 -0.932 . . . . 0.0 110.452 179.72 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 42' ' ' GLY . . . . . . . . . . . . . . . -56.44 -35.89 67.98 Favored Glycine 0 N--CA 1.496 2.666 0 N-CA-C 110.4 -1.08 . . . . 0.0 110.4 -179.406 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 43' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -56.56 -37.16 70.17 Favored 'General case' 0 N--CA 1.5 2.052 0 O-C-N 121.345 -1.091 . . . . 0.0 109.907 179.218 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 44' ' ' VAL . . . . . . . . . . . . . 88.6 t -85.18 -31.8 7.06 Favored 'Isoleucine or valine' 0 N--CA 1.497 1.917 0 O-C-N 121.483 -0.76 . . . . 0.0 109.761 178.837 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 45' ' ' MET . . . . . 0.489 ' CE ' HD11 ' A' ' 41' ' ' LEU . 0.0 OUTLIER -58.52 -53.33 59.5 Favored 'General case' 0 N--CA 1.5 2.034 0 O-C-N 121.398 -0.814 . . . . 0.0 109.96 179.496 . . . . . . . . 3 3 . 1 . 012 nuclear build core ' A' A ' 46' ' ' ARG . . . . . 0.492 ' HA ' ' HB2' ' A' ' 51' ' ' ASN . 1.9 ppt_? -64.25 -28.72 69.93 Favored 'General case' 0 N--CA 1.499 2.011 0 O-C-N 121.377 -0.827 . . . . 0.0 109.938 179.125 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 47' ' ' MET . . . . . . . . . . . . . 13.9 ttp -66.95 -36.22 81.72 Favored 'General case' 0 N--CA 1.495 1.824 0 O-C-N 121.455 -0.778 . . . . 0.0 109.501 178.856 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 48' ' ' LEU . . . . . . . . . . . . . 28.5 mt -75.28 -40.35 58.77 Favored 'General case' 0 N--CA 1.498 1.959 0 O-C-N 121.516 -0.74 . . . . 0.0 110.0 179.151 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 49' ' ' GLY . . . . . . . . . . . . . . . 139.02 -50.81 0.78 Allowed Glycine 0 N--CA 1.495 2.575 0 N-CA-C 109.96 -1.256 . . . . 0.0 109.96 -179.773 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 50' ' ' GLN . . . . . . . . . . . . . 0.6 OUTLIER -84.89 99.69 11.11 Favored 'General case' 0 N--CA 1.498 1.939 0 O-C-N 121.331 -1.1 . . . . 0.0 110.739 -179.662 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 51' ' ' ASN . . . . . 0.492 ' HB2' ' HA ' ' A' ' 46' ' ' ARG . 14.2 t30 -129.69 101.08 18.84 Favored Pre-proline 0 N--CA 1.496 1.856 0 O-C-N 121.473 -0.767 . . . . 0.0 109.992 179.723 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 52' ' ' PRO . . . . . . . . . . . . . 46.1 Cg_endo -73.56 -92.3 0.01 OUTLIER 'Trans proline' 0 C--N 1.314 -1.252 0 O-C-N 123.821 1.432 . . . . 0.0 111.23 -179.569 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 53' ' ' THR . . . . . 0.665 HG22 ' HD2' ' A' ' 54' ' ' PRO . 0.1 OUTLIER -139.54 151.1 65.77 Favored Pre-proline 0 N--CA 1.502 2.164 0 O-C-N 120.918 -1.114 . . . . 0.0 110.432 -179.375 . . . . . . . . 3 3 . 1 . 012 nuclear build core ' A' A ' 54' ' ' PRO . . . . . 0.665 ' HD2' HG22 ' A' ' 53' ' ' THR . 41.8 Cg_endo -69.21 -40.31 6.37 Favored 'Trans proline' 0 N--CA 1.489 1.247 0 O-C-N 123.841 1.443 . . . . 0.0 110.667 179.807 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 55' ' ' GLU . . . . . . . . . . . . . 3.6 mp0 -66.48 -31.14 71.69 Favored 'General case' 0 N--CA 1.496 1.832 0 O-C-N 121.449 -0.782 . . . . 0.0 109.869 179.375 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 16.0 tt0 -63.7 -34.62 78.28 Favored 'General case' 0 N--CA 1.496 1.838 0 O-C-N 121.528 -0.733 . . . . 0.0 110.231 179.291 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 57' ' ' LEU . . . . . 0.594 HD13 ' HG ' ' A' ' 41' ' ' LEU . 56.7 mt -67.25 -25.63 66.17 Favored 'General case' 0 N--CA 1.496 1.853 0 O-C-N 121.186 -0.946 . . . . 0.0 110.273 179.491 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 58' ' ' GLN . . . . . 0.566 ' O ' HG22 ' A' ' 61' ' ' ILE . 0.0 OUTLIER -64.31 -29.77 70.84 Favored 'General case' 0 N--CA 1.498 1.958 0 O-C-N 121.064 -1.022 . . . . 0.0 108.969 178.793 . . . . . . . . 3 3 . 1 . 012 nuclear build core ' A' A ' 59' ' ' GLU . . . . . 0.504 ' N ' ' HG3' ' A' ' 58' ' ' GLN . 17.8 mm-40 -81.28 -32.22 33.29 Favored 'General case' 0 N--CA 1.492 1.632 0 N-CA-C 107.89 -1.152 . . . . 0.0 107.89 177.415 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 60' ' ' MET . . . . . 0.4 ' HB2' ' HA ' ' A' ' 57' ' ' LEU . 0.3 OUTLIER -68.86 -44.4 73.41 Favored 'General case' 0 N--CA 1.495 1.793 0 O-C-N 121.91 -0.494 . . . . 0.0 109.953 178.799 . . . . . . . . 3 3 . 1 . 012 nuclear build core ' A' A ' 61' ' ' ILE . . . . . 0.566 HG22 ' O ' ' A' ' 58' ' ' GLN . 12.6 tt -62.71 -31.34 51.84 Favored 'Isoleucine or valine' 0 N--CA 1.497 1.915 0 O-C-N 121.493 -0.754 . . . . 0.0 110.201 179.631 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 62' ' ' ASP . . . . . 0.573 ' HA ' ' HB3' ' A' ' 65' ' ' ASP . 17.6 t70 -64.41 -35.47 81.01 Favored 'General case' 0 N--CA 1.499 1.987 0 O-C-N 121.459 -0.776 . . . . 0.0 110.838 179.675 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 63' ' ' GLU . . . . . . . . . . . . . 5.1 tt0 -51.31 -38.51 53.34 Favored 'General case' 0 N--CA 1.503 2.225 0 O-C-N 121.399 -0.813 . . . . 0.0 110.291 179.571 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 64' ' ' VAL . . . . . . . . . . . . . 65.0 t -100.3 -24.67 4.06 Favored 'Isoleucine or valine' 0 N--CA 1.497 1.883 0 O-C-N 121.516 -0.74 . . . . 0.0 109.966 179.015 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 65' ' ' ASP . . . . . 0.573 ' HB3' ' HA ' ' A' ' 62' ' ' ASP . 18.4 t70 -79.57 -93.03 0.04 OUTLIER 'General case' 0 N--CA 1.494 1.728 0 O-C-N 121.529 -0.732 . . . . 0.0 110.58 -179.595 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 66' ' ' GLU . . . . . . . . . . . . . 0.5 OUTLIER 47.05 32.31 1.89 Allowed 'General case' 0 N--CA 1.501 2.12 0 O-C-N 121.389 -0.819 . . . . 0.0 111.073 -179.592 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 67' ' ' ASP . . . . . . . . . . . . . 4.9 p-10 -118.31 1.63 11.85 Favored 'General case' 0 N--CA 1.498 1.926 0 O-C-N 121.135 -0.978 . . . . 0.0 111.695 -179.559 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 68' ' ' GLY . . . . . . . . . . . . . . . 106.13 -41.33 2.2 Favored Glycine 0 N--CA 1.495 2.605 0 N-CA-C 109.908 -1.277 . . . . 0.0 109.908 179.949 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 69' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -60.9 -51.24 70.11 Favored 'General case' 0 N--CA 1.501 2.095 0 O-C-N 121.482 -1.01 . . . . 0.0 110.778 -179.732 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 70' ' ' GLY . . . . . . . . . . . . . . . 100.06 -28.04 17.54 Favored Glycine 0 N--CA 1.498 2.783 0 C-N-CA 120.152 -1.023 . . . . 0.0 110.959 179.535 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 71' ' ' THR . . . . . . . . . . . . . 11.7 t -104.89 159.89 15.44 Favored 'General case' 0 N--CA 1.5 2.025 0 O-C-N 120.997 -1.296 . . . . 0.0 111.389 -179.533 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 72' ' ' VAL . . . . . 0.541 HG23 HG13 ' A' ' 61' ' ' ILE . 2.5 t -94.35 118.44 40.35 Favored 'Isoleucine or valine' 0 N--CA 1.497 1.884 0 O-C-N 121.751 -0.593 . . . . 0.0 110.239 179.922 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 73' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -91.8 -166.76 1.63 Allowed 'General case' 0 N--CA 1.495 1.809 0 O-C-N 121.165 -0.96 . . . . 0.0 110.012 179.519 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 74' ' ' PHE . . . . . . . . . . . . . 77.3 t80 -61.57 -45.23 95.03 Favored 'General case' 0 N--CA 1.499 2.02 0 O-C-N 121.17 -0.956 . . . . 0.0 110.558 179.827 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 75' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -62.88 -46.2 88.96 Favored 'General case' 0 N--CA 1.499 1.989 0 O-C-N 121.432 -0.793 . . . . 0.0 110.536 179.819 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 76' ' ' GLU . . . . . . . . . . . . . 27.3 mt-10 -63.98 -36.97 85.72 Favored 'General case' 0 N--CA 1.501 2.084 0 O-C-N 121.441 -0.787 . . . . 0.0 109.807 179.35 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 77' ' ' PHE . . . . . . . . . . . . . 5.9 t80 -55.67 -43.43 76.35 Favored 'General case' 0 N--CA 1.494 1.772 0 O-C-N 121.759 -0.588 . . . . 0.0 109.818 179.266 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 78' ' ' LEU . . . . . 0.774 ' HB3' HG13 ' A' ' 9' ' ' VAL . 35.0 mt -70.41 -45.05 66.71 Favored 'General case' 0 N--CA 1.497 1.881 0 O-C-N 121.467 -0.771 . . . . 0.0 110.491 179.553 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 79' ' ' VAL . . . . . . . . . . . . . 24.1 t -58.59 -34.13 50.45 Favored 'Isoleucine or valine' 0 N--CA 1.502 2.138 0 O-C-N 121.335 -0.853 . . . . 0.0 109.202 178.968 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 80' ' ' MET . . . . . . . . . . . . . 0.8 OUTLIER -73.77 -42.27 61.28 Favored 'General case' 0 N--CA 1.493 1.693 0 O-C-N 121.526 -0.734 . . . . 0.0 109.238 178.489 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 81' ' ' MET . . . . . 0.516 ' HG3' ' CB ' ' B' ' 150' ' ' ALA . 0.0 OUTLIER -55.11 -51.25 67.0 Favored 'General case' 0 N--CA 1.499 2.014 0 O-C-N 121.76 -0.588 . . . . 0.0 110.559 179.576 . . . . . . . . 3 3 . 1 . 012 nuclear build core ' A' A ' 82' ' ' VAL . . . . . 0.439 HG21 ' CG2' ' A' ' 9' ' ' VAL . 33.7 m -65.99 -29.07 45.68 Favored 'Isoleucine or valine' 0 N--CA 1.502 2.156 0 O-C-N 121.453 -0.779 . . . . 0.0 110.671 179.931 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 83' ' ' ARG . . . . . . . . . . . . . 2.1 mtt180 -64.95 -43.0 94.15 Favored 'General case' 0 N--CA 1.496 1.827 0 O-C-N 121.255 -0.903 . . . . 0.0 109.395 179.237 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 84' ' ' CYS . . . . . . . . . . . . . 0.0 OUTLIER -72.05 -42.63 66.05 Favored 'General case' 0 N--CA 1.495 1.777 0 O-C-N 121.549 -0.719 . . . . 0.0 110.123 179.17 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 85' ' ' MET . . . . . . . . . . . . . 70.7 mtm . . . . . 0 N--CA 1.499 2.019 0 O-C-N 121.473 -0.767 . . . . 0.0 111.225 179.834 . . . . . . . . 0 0 . 1 . 012 nuclear build core ' B' B ' 149' ' ' SER . . . . . . . . . . . . . 6.8 t . . . . . 0 N--CA 1.496 1.874 0 CA-C-O 121.608 0.718 . . . . 0.0 111.246 . . . . . . . . . 0 0 . 1 . 012 nuclear build core ' B' B ' 150' ' ' ALA . . . . . 0.516 ' CB ' ' HG3' ' A' ' 81' ' ' MET . . . -61.54 -51.67 67.64 Favored 'General case' 0 N--CA 1.497 1.901 0 O-C-N 121.73 -0.606 . . . . 0.0 110.509 179.732 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' B' B ' 151' ' ' ASP . . . . . . . . . . . . . 6.8 p-10 -61.57 -31.92 71.98 Favored 'General case' 0 N--CA 1.499 2.018 0 O-C-N 121.627 -0.671 . . . . 0.0 110.717 179.685 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' B' B ' 152' ' ' ALA . . . . . . . . . . . . . . . -70.16 -46.52 64.5 Favored 'General case' 0 N--CA 1.497 1.902 0 O-C-N 121.21 -0.931 . . . . 0.0 110.545 179.987 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' B' B ' 153' ' ' MET . . . . . . . . . . . . . 1.5 tpt -75.2 -37.65 61.08 Favored 'General case' 0 N--CA 1.498 1.947 0 O-C-N 121.287 -0.883 . . . . 0.0 110.848 -179.99 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' B' B ' 154' ' ' MET . . . . . . . . . . . . . 2.7 ttp -70.6 -50.54 36.05 Favored 'General case' 0 N--CA 1.498 1.938 0 O-C-N 121.302 -0.874 . . . . 0.0 110.918 -179.652 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' B' B ' 155' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -64.39 -35.77 81.98 Favored 'General case' 0 N--CA 1.5 2.052 0 O-C-N 121.273 -0.892 . . . . 0.0 110.801 -179.752 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' B' B ' 156' ' ' ALA . . . . . . . . . . . . . . . -59.31 -46.91 87.3 Favored 'General case' 0 N--CA 1.498 1.933 0 O-C-N 121.303 -0.873 . . . . 0.0 110.112 179.604 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' B' B ' 157' ' ' LEU . . . . . 0.542 HD21 ' HB ' ' A' ' 26' ' ' ILE . 14.8 tp -61.22 -53.79 52.38 Favored 'General case' 0 N--CA 1.496 1.859 0 O-C-N 121.586 -0.696 . . . . 0.0 110.4 179.653 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' B' B ' 158' ' ' LEU . . . . . . . . . . . . . 1.6 mt . . . . . 0 N--CA 1.495 1.79 0 O-C-N 121.451 -0.781 . . . . 0.0 109.792 179.624 . . . . . . . . 0 0 . 1 . 013 nuclear build core ' A' A ' 4' ' ' ILE . . . . . . . . . . . . . 7.8 mt . . . . . 0 N--CA 1.493 1.72 0 N-CA-C 108.975 -0.75 . . . . 0.0 108.975 . . . . . . . . . 0 0 . 1 . 013 nuclear build core ' A' A ' 5' ' ' TYR . . . . . 0.411 ' HB3' HG13 ' A' ' 82' ' ' VAL . 47.8 m-85 -73.56 -30.61 63.16 Favored 'General case' 0 N--CA 1.496 1.853 0 O-C-N 121.644 -0.66 . . . . 0.0 109.92 179.124 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 6' ' ' LYS . . . . . 0.404 ' HA ' HG22 ' A' ' 79' ' ' VAL . 0.3 OUTLIER -56.67 -34.24 67.18 Favored 'General case' 0 N--CA 1.498 1.939 0 O-C-N 121.613 -0.679 . . . . 0.0 109.855 179.041 . . . . . . . . 3 3 . 1 . 013 nuclear build core ' A' A ' 7' ' ' ALA . . . . . . . . . . . . . . . -61.76 -43.05 99.61 Favored 'General case' 0 N--CA 1.496 1.859 0 O-C-N 121.519 -0.738 . . . . 0.0 109.965 179.187 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 8' ' ' ALA . . . . . . . . . . . . . . . -60.66 -34.01 73.67 Favored 'General case' 0 N--CA 1.501 2.081 0 O-C-N 121.438 -0.789 . . . . 0.0 110.829 179.521 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 9' ' ' VAL . . . . . 0.641 HG13 ' HB3' ' A' ' 78' ' ' LEU . 72.9 t -58.73 -43.84 88.73 Favored 'Isoleucine or valine' 0 N--CA 1.501 2.09 0 O-C-N 121.437 -0.79 . . . . 0.0 111.064 -179.92 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 10' ' ' GLU . . . . . . . . . . . . . 12.0 mm-40 -89.76 -1.9 58.11 Favored 'General case' 0 N--CA 1.496 1.842 0 O-C-N 121.257 -0.902 . . . . 0.0 111.166 -179.949 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 11' ' ' GLN . . . . . . . . . . . . . 4.1 mt-30 -99.63 -22.76 15.29 Favored 'General case' 0 N--CA 1.496 1.839 0 O-C-N 121.086 -1.009 . . . . 0.0 110.978 179.78 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 12' ' ' LEU . . . . . 0.556 ' C ' HD12 ' A' ' 12' ' ' LEU . 4.6 pp -67.2 171.9 5.28 Favored 'General case' 0 N--CA 1.505 2.287 0 O-C-N 121.069 -1.019 . . . . 0.0 110.998 -179.811 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 13' ' ' THR . . . . . . . . . . . . . 76.4 p -92.84 159.97 15.14 Favored 'General case' 0 N--CA 1.501 2.092 0 O-C-N 121.332 -0.855 . . . . 0.0 110.854 -179.572 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 14' ' ' GLU . . . . . . . . . . . . . 0.8 OUTLIER -56.77 -28.76 61.78 Favored 'General case' 0 N--CA 1.493 1.716 0 O-C-N 121.643 -0.661 . . . . 0.0 110.653 -179.967 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 1.3 mp0 -60.6 -41.33 94.53 Favored 'General case' 0 N--CA 1.498 1.973 0 O-C-N 121.439 -0.788 . . . . 0.0 110.167 179.419 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 16' ' ' GLN . . . . . 0.471 ' HG2' ' HB2' ' A' ' 12' ' ' LEU . 0.0 OUTLIER -80.24 -33.59 37.85 Favored 'General case' 0 N--CA 1.491 1.591 0 O-C-N 121.423 -0.798 . . . . 0.0 110.087 179.539 . . . . . . . . 3 3 . 1 . 013 nuclear build core ' A' A ' 17' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -70.78 -40.11 72.79 Favored 'General case' 0 N--CA 1.498 1.961 0 O-C-N 121.552 -0.718 . . . . 0.0 110.054 179.305 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 18' ' ' ASN . . . . . . . . . . . . . 3.9 t30 -61.24 -34.6 75.41 Favored 'General case' 0 N--CA 1.497 1.878 0 O-C-N 121.513 -0.742 . . . . 0.0 109.995 179.331 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -62.98 -49.2 75.62 Favored 'General case' 0 N--CA 1.498 1.966 0 O-C-N 121.497 -0.752 . . . . 0.0 109.809 179.295 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 20' ' ' PHE . . . . . . . . . . . . . 12.9 m-85 -64.55 -34.64 78.71 Favored 'General case' 0 N--CA 1.5 2.055 0 O-C-N 121.419 -0.8 . . . . 0.0 110.005 179.098 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 21' ' ' LYS . . . . . . . . . . . . . 1.6 tptp -55.23 -47.35 75.48 Favored 'General case' 0 N--CA 1.498 1.956 0 O-C-N 121.566 -0.709 . . . . 0.0 110.201 179.591 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 22' ' ' ALA . . . . . . . . . . . . . . . -56.07 -44.87 79.33 Favored 'General case' 0 N--CA 1.499 1.996 0 O-C-N 121.598 -0.689 . . . . 0.0 110.082 179.575 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 23' ' ' ALA . . . . . 0.449 ' HA ' HD12 ' A' ' 26' ' ' ILE . . . -66.99 -35.89 80.95 Favored 'General case' 0 N--CA 1.497 1.887 0 O-C-N 121.353 -0.842 . . . . 0.0 109.66 178.726 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 24' ' ' PHE . . . . . 0.422 ' HE1' HD12 ' A' ' 36' ' ' ILE . 76.9 t80 -65.69 -37.85 87.62 Favored 'General case' 0 N--CA 1.497 1.917 0 O-C-N 121.582 -0.699 . . . . 0.0 110.223 179.309 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 25' ' ' ASP . . . . . . . . . . . . . 51.5 m-20 -56.18 -39.72 72.82 Favored 'General case' 0 N--CA 1.501 2.083 0 O-C-N 121.549 -0.719 . . . . 0.0 110.733 179.903 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 26' ' ' ILE . . . . . 0.752 ' HA ' HD12 ' A' ' 29' ' ' LEU . 6.7 mt -71.02 -31.68 45.87 Favored 'Isoleucine or valine' 0 N--CA 1.499 1.986 0 O-C-N 121.174 -0.954 . . . . 0.0 109.846 179.379 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 27' ' ' PHE . . . . . 0.59 ' HB3' HD11 ' A' ' 36' ' ' ILE . 0.2 OUTLIER -71.09 -39.68 71.97 Favored 'General case' 0 N--CA 1.496 1.846 0 O-C-N 121.359 -0.838 . . . . 0.0 110.291 179.522 . . . . . . . . 3 3 . 1 . 013 nuclear build core ' A' A ' 28' ' ' VAL . . . . . 0.465 HG12 HG13 ' A' ' 36' ' ' ILE . 23.5 m -87.99 9.07 2.27 Favored 'Isoleucine or valine' 0 N--CA 1.501 2.086 0 O-C-N 121.365 -0.834 . . . . 0.0 111.281 179.862 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 29' ' ' LEU . . . . . 0.752 HD12 ' HA ' ' A' ' 26' ' ' ILE . 0.7 OUTLIER -61.08 105.82 0.53 Allowed 'General case' 0 N--CA 1.497 1.907 0 O-C-N 121.022 -1.049 . . . . 0.0 110.058 -179.936 . . . . . . . . 3 3 . 1 . 013 nuclear build core ' A' A ' 30' ' ' GLY . . . . . . . . . . . . . . . 96.09 16.62 37.58 Favored Glycine 0 N--CA 1.495 2.623 0 N-CA-C 110.366 -1.094 . . . . 0.0 110.366 -179.577 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 31' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.493 1.719 0 O-C-N 121.024 -1.28 . . . . 0.0 109.959 179.768 . . . . . . . . 0 0 . 1 . 013 nuclear build core ' A' A ' 35' ' ' CYS . . . . . . . . . . . . . 25.8 p . . . . . 0 N--CA 1.499 1.99 0 CA-C-O 121.095 0.474 . . . . 0.0 110.359 . . . . . . . . . 0 0 . 1 . 013 nuclear build core ' A' A ' 36' ' ' ILE . . . . . 0.59 HD11 ' HB3' ' A' ' 27' ' ' PHE . 31.0 mt -123.85 130.35 73.97 Favored 'Isoleucine or valine' 0 N--CA 1.497 1.888 0 O-C-N 121.369 -0.832 . . . . 0.0 110.618 -179.826 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 37' ' ' SER . . . . . . . . . . . . . 1.7 t -122.51 -176.49 3.39 Favored 'General case' 0 N--CA 1.496 1.871 0 O-C-N 121.64 -0.662 . . . . 0.0 109.877 179.307 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 38' ' ' THR . . . . . 0.557 ' HB ' ' HA ' ' A' ' 54' ' ' PRO . 54.7 p -65.12 -36.45 84.31 Favored 'General case' 0 N--CA 1.503 2.216 0 O-C-N 121.329 -0.857 . . . . 0.0 110.617 179.891 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 39' ' ' LYS . . . . . . . . . . . . . 7.1 mttm -66.73 -44.47 81.46 Favored 'General case' 0 N--CA 1.498 1.95 0 O-C-N 121.39 -0.818 . . . . 0.0 110.476 179.761 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 1.2 mp0 -71.81 -23.3 61.53 Favored 'General case' 0 N--CA 1.497 1.916 0 O-C-N 121.494 -0.754 . . . . 0.0 110.935 -179.864 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 41' ' ' LEU . . . . . 0.809 HD21 HD22 ' A' ' 57' ' ' LEU . 5.4 tp -63.2 -47.51 82.26 Favored 'General case' 0 N--CA 1.498 1.944 0 O-C-N 121.079 -1.013 . . . . 0.0 110.157 179.774 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 42' ' ' GLY . . . . . 0.495 ' HA2' ' HB2' ' A' ' 45' ' ' MET . . . -55.94 -28.81 54.06 Favored Glycine 0 N--CA 1.495 2.614 0 N-CA-C 110.478 -1.049 . . . . 0.0 110.478 -179.951 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 43' ' ' LYS . . . . . . . . . . . . . 13.5 ttmt -50.99 -47.89 61.42 Favored 'General case' 0 N--CA 1.501 2.079 0 O-C-N 121.374 -1.074 . . . . 0.0 109.984 179.039 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 44' ' ' VAL . . . . . 0.415 HG22 HD21 ' B' ' 157' ' ' LEU . 38.1 t -80.5 -29.14 11.93 Favored 'Isoleucine or valine' 0 N--CA 1.498 1.954 0 O-C-N 121.557 -0.714 . . . . 0.0 110.03 179.053 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 45' ' ' MET . . . . . 0.495 ' HB2' ' HA2' ' A' ' 42' ' ' GLY . 5.1 mmt -57.09 -40.63 77.34 Favored 'General case' 0 N--CA 1.501 2.093 0 O-C-N 121.345 -0.847 . . . . 0.0 110.268 179.654 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 46' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -59.32 -40.61 86.84 Favored 'General case' 0 N--CA 1.501 2.109 0 O-C-N 121.411 -0.805 . . . . 0.0 110.224 179.383 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 47' ' ' MET . . . . . . . . . . . . . 0.2 OUTLIER -59.76 -43.09 94.48 Favored 'General case' 0 N--CA 1.499 1.981 0 O-C-N 121.493 -0.755 . . . . 0.0 110.185 179.552 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 48' ' ' LEU . . . . . . . . . . . . . 83.9 mt -78.21 -37.49 45.33 Favored 'General case' 0 N--CA 1.498 1.931 0 O-C-N 121.443 -0.785 . . . . 0.0 109.875 179.153 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 49' ' ' GLY . . . . . . . . . . . . . . . 115.92 50.56 0.43 Allowed Glycine 0 N--CA 1.495 2.629 0 N-CA-C 109.582 -1.407 . . . . 0.0 109.582 179.792 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 50' ' ' GLN . . . . . . . . . . . . . 25.1 mt-30 -132.6 145.59 51.22 Favored 'General case' 0 N--CA 1.497 1.923 0 O-C-N 121.408 -1.054 . . . . 0.0 110.111 -179.829 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 51' ' ' ASN . . . . . . . . . . . . . 1.2 t30 -132.36 62.56 63.86 Favored Pre-proline 0 N--CA 1.497 1.919 0 O-C-N 121.273 -0.892 . . . . 0.0 110.959 -179.887 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 52' ' ' PRO . . . . . 0.714 ' HG2' HD11 ' A' ' 57' ' ' LEU . 51.3 Cg_endo -78.16 157.43 30.06 Favored 'Trans proline' 0 C--N 1.314 -1.255 0 O-C-N 123.656 1.345 . . . . 0.0 110.624 179.569 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 53' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -85.14 153.82 59.92 Favored Pre-proline 0 N--CA 1.499 1.98 0 O-C-N 121.235 -0.916 . . . . 0.0 110.191 179.728 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 54' ' ' PRO . . . . . 0.557 ' HA ' ' HB ' ' A' ' 38' ' ' THR . 39.9 Cg_endo -66.15 -47.44 3.43 Favored 'Trans proline' 0 C--N 1.313 -1.303 0 O-C-N 123.686 1.361 . . . . 0.0 110.623 -179.693 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 55' ' ' GLU . . . . . . . . . . . . . 1.3 tt0 -61.45 -30.49 70.62 Favored 'General case' 0 N--CA 1.498 1.95 0 O-C-N 121.307 -0.87 . . . . 0.0 109.834 178.917 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 1.7 tm-20 -73.6 -45.8 50.96 Favored 'General case' 0 N--CA 1.495 1.781 0 O-C-N 121.461 -0.774 . . . . 0.0 110.029 179.252 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 57' ' ' LEU . . . . . 0.809 HD22 HD21 ' A' ' 41' ' ' LEU . 15.6 mt -69.63 -18.16 63.57 Favored 'General case' 0 N--CA 1.497 1.898 0 O-C-N 121.246 -0.908 . . . . 0.0 110.813 179.736 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 58' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -52.68 -51.23 61.16 Favored 'General case' 0 N--CA 1.497 1.921 0 O-C-N 121.084 -1.01 . . . . 0.0 110.538 179.723 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 59' ' ' GLU . . . . . . . . . . . . . 6.8 mm-40 -56.86 -32.23 65.61 Favored 'General case' 0 N--CA 1.499 1.987 0 O-C-N 121.603 -0.686 . . . . 0.0 110.138 179.386 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 60' ' ' MET . . . . . . . . . . . . . 11.5 tpp -59.14 -38.56 79.97 Favored 'General case' 0 N--CA 1.497 1.894 0 O-C-N 121.386 -0.821 . . . . 0.0 109.685 178.863 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 61' ' ' ILE . . . . . 0.449 HG12 ' CG2' ' A' ' 72' ' ' VAL . 15.9 mt -70.73 -41.65 77.59 Favored 'Isoleucine or valine' 0 N--CA 1.497 1.885 0 O-C-N 121.433 -0.792 . . . . 0.0 109.353 178.862 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 62' ' ' ASP . . . . . 0.53 ' HA ' ' HB3' ' A' ' 65' ' ' ASP . 17.8 m-20 -54.84 -32.37 60.51 Favored 'General case' 0 N--CA 1.5 2.036 0 O-C-N 121.596 -0.69 . . . . 0.0 110.719 179.522 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 63' ' ' GLU . . . . . . . . . . . . . 1.4 tm-20 -50.27 -43.35 53.28 Favored 'General case' 0 N--CA 1.5 2.072 0 O-C-N 121.641 -0.662 . . . . 0.0 110.878 179.914 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 64' ' ' VAL . . . . . . . . . . . . . 27.2 m -113.08 0.2 9.08 Favored 'Isoleucine or valine' 0 N--CA 1.501 2.092 0 O-C-N 121.265 -0.897 . . . . 0.0 111.219 179.631 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 65' ' ' ASP . . . . . 0.53 ' HB3' ' HA ' ' A' ' 62' ' ' ASP . 19.7 t70 -86.32 -95.18 0.08 Allowed 'General case' 0 N--CA 1.498 1.949 0 O-C-N 121.211 -0.931 . . . . 0.0 110.37 179.927 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 66' ' ' GLU . . . . . . . . . . . . . 2.3 tp10 50.89 35.21 11.86 Favored 'General case' 0 N--CA 1.502 2.161 0 O-C-N 121.214 -0.929 . . . . 0.0 111.253 -179.759 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 67' ' ' ASP . . . . . . . . . . . . . 3.8 p-10 -117.2 -5.45 11.35 Favored 'General case' 0 N--CA 1.501 2.084 0 O-C-N 121.1 -1.0 . . . . 0.0 111.673 -179.946 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 68' ' ' GLY . . . . . . . . . . . . . . . 109.66 -26.46 14.37 Favored Glycine 0 N--CA 1.496 2.64 0 N-CA-C 110.239 -1.145 . . . . 0.0 110.239 179.822 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 69' ' ' SER . . . . . . . . . . . . . 0.5 OUTLIER -79.68 -41.22 27.29 Favored 'General case' 0 N--CA 1.498 1.955 0 O-C-N 121.227 -1.161 . . . . 0.0 110.731 -179.769 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 70' ' ' GLY . . . . . . . . . . . . . . . 74.0 26.57 68.51 Favored Glycine 0 N--CA 1.497 2.756 0 N-CA-C 109.643 -1.383 . . . . 0.0 109.643 -179.578 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 71' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -140.11 148.29 41.49 Favored 'General case' 0 N--CA 1.497 1.879 0 O-C-N 121.527 -0.984 . . . . 0.0 109.193 179.931 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 72' ' ' VAL . . . . . 0.542 ' HB ' ' HB ' ' A' ' 36' ' ' ILE . 59.4 t -75.34 114.78 15.83 Favored 'Isoleucine or valine' 0 N--CA 1.498 1.957 0 O-C-N 121.367 -0.833 . . . . 0.0 110.539 -179.553 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 73' ' ' ASP . . . . . . . . . . . . . 4.6 m-20 -86.23 -166.32 1.51 Allowed 'General case' 0 N--CA 1.498 1.973 0 O-C-N 121.331 -0.856 . . . . 0.0 109.242 179.263 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 74' ' ' PHE . . . . . . . . . . . . . 53.4 t80 -74.25 -58.38 3.33 Favored 'General case' 0 N--CA 1.498 1.964 0 O-C-N 120.841 -1.162 . . . . 0.0 109.714 179.328 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 75' ' ' ASP . . . . . 0.804 ' HA ' HD12 ' A' ' 78' ' ' LEU . 0.4 OUTLIER -63.84 -33.82 76.54 Favored 'General case' 0 N--CA 1.496 1.864 0 O-C-N 121.452 -0.78 . . . . 0.0 110.162 179.552 . . . . . . . . 3 3 . 1 . 013 nuclear build core ' A' A ' 76' ' ' GLU . . . . . . . . . . . . . 6.1 tt0 -62.16 -38.67 89.93 Favored 'General case' 0 N--CA 1.497 1.893 0 O-C-N 121.23 -0.918 . . . . 0.0 108.884 178.507 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 77' ' ' PHE . . . . . . . . . . . . . 65.2 t80 -62.72 -38.63 91.22 Favored 'General case' 0 N--CA 1.494 1.753 0 O-C-N 121.69 -0.631 . . . . 0.0 109.355 178.347 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 78' ' ' LEU . . . . . 0.804 HD12 ' HA ' ' A' ' 75' ' ' ASP . 14.3 mt -60.86 -36.59 79.54 Favored 'General case' 0 N--CA 1.498 1.967 0 O-C-N 121.475 -0.765 . . . . 0.0 110.049 178.899 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 79' ' ' VAL . . . . . 0.564 HG22 HG21 ' A' ' 9' ' ' VAL . 45.0 t -62.67 -43.56 98.7 Favored 'Isoleucine or valine' 0 N--CA 1.501 2.099 0 O-C-N 121.43 -0.794 . . . . 0.0 109.067 179.205 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 80' ' ' MET . . . . . . . . . . . . . 13.6 ttm -65.58 -36.11 82.79 Favored 'General case' 0 N--CA 1.494 1.753 0 O-C-N 121.542 -0.724 . . . . 0.0 109.355 178.593 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 81' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -58.43 -53.11 61.98 Favored 'General case' 0 N--CA 1.497 1.899 0 O-C-N 121.531 -0.731 . . . . 0.0 110.115 179.403 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 82' ' ' VAL . . . . . 0.523 HG23 ' HE3' ' A' ' 85' ' ' MET . 14.2 p -69.88 -26.51 30.37 Favored 'Isoleucine or valine' 0 N--CA 1.499 2.002 0 O-C-N 121.242 -0.911 . . . . 0.0 110.289 179.213 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 83' ' ' ARG . . . . . 0.519 ' HD2' HG12 ' A' ' 79' ' ' VAL . 27.2 mtt-85 -69.41 -45.18 69.82 Favored 'General case' 0 N--CA 1.498 1.967 0 O-C-N 121.282 -0.886 . . . . 0.0 110.111 179.387 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 84' ' ' CYS . . . . . 0.495 ' HB3' ' HA ' ' B' ' 149' ' ' SER . 86.3 m -98.69 27.08 5.09 Favored 'General case' 0 N--CA 1.498 1.928 0 O-C-N 121.392 -0.818 . . . . 0.0 110.584 179.593 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 85' ' ' MET . . . . . 0.523 ' HE3' HG23 ' A' ' 82' ' ' VAL . 0.0 OUTLIER . . . . . 0 N--CA 1.498 1.939 0 O-C-N 121.252 -0.905 . . . . 0.0 110.59 179.646 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' B' B ' 149' ' ' SER . . . . . 0.495 ' HA ' ' HB3' ' A' ' 84' ' ' CYS . 86.3 p . . . . . 0 N--CA 1.496 1.86 0 CA-C-O 121.097 0.475 . . . . 0.0 110.096 . . . . . . . . . 1 1 . 1 . 013 nuclear build core ' B' B ' 150' ' ' ALA . . . . . . . . . . . . . . . -74.65 -42.3 58.77 Favored 'General case' 0 N--CA 1.497 1.907 0 O-C-N 121.302 -0.874 . . . . 0.0 110.871 -179.731 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' B' B ' 151' ' ' ASP . . . . . . . . . . . . . 31.2 t70 -61.39 -52.62 63.86 Favored 'General case' 0 N--CA 1.498 1.97 0 O-C-N 121.462 -0.773 . . . . 0.0 110.882 -179.732 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' B' B ' 152' ' ' ALA . . . . . . . . . . . . . . . -52.33 -45.22 65.56 Favored 'General case' 0 N--CA 1.504 2.232 0 O-C-N 121.3 -0.875 . . . . 0.0 111.047 -179.918 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' B' B ' 153' ' ' MET . . . . . . . . . . . . . 1.3 ttt -73.16 -44.05 60.59 Favored 'General case' 0 N--CA 1.499 1.985 0 O-C-N 121.281 -0.887 . . . . 0.0 110.655 179.984 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' B' B ' 154' ' ' MET . . . . . 0.575 ' HG3' HD12 ' B' ' 158' ' ' LEU . 0.0 OUTLIER -59.4 -37.97 79.36 Favored 'General case' 0 N--CA 1.501 2.113 0 O-C-N 121.467 -0.771 . . . . 0.0 110.457 179.792 . . . . . . . . 3 3 . 1 . 013 nuclear build core ' B' B ' 155' ' ' GLN . . . . . . . . . . . . . 47.5 mt-30 -67.11 -38.4 85.57 Favored 'General case' 0 N--CA 1.499 1.998 0 O-C-N 121.539 -0.726 . . . . 0.0 110.908 179.859 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' B' B ' 156' ' ' ALA . . . . . . . . . . . . . . . -79.03 -34.39 43.94 Favored 'General case' 0 N--CA 1.498 1.951 0 O-C-N 121.321 -0.862 . . . . 0.0 110.971 -179.713 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' B' B ' 157' ' ' LEU . . . . . 0.452 HD22 ' HB ' ' A' ' 26' ' ' ILE . 17.6 mt -75.27 -42.03 55.88 Favored 'General case' 0 N--CA 1.499 1.978 0 O-C-N 121.244 -0.91 . . . . 0.0 111.211 -179.497 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' B' B ' 158' ' ' LEU . . . . . 0.575 HD12 ' HG3' ' B' ' 154' ' ' MET . 95.9 mt . . . . . 0 N--CA 1.499 2.005 0 O-C-N 121.137 -0.977 . . . . 0.0 110.941 -179.366 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 4' ' ' ILE . . . . . . . . . . . . . 4.9 mt . . . . . 0 N--CA 1.499 1.988 0 CA-C-O 120.78 0.324 . . . . 0.0 110.589 . . . . . . . . . 0 0 . 1 . 014 nuclear build core ' A' A ' 5' ' ' TYR . . . . . . . . . . . . . 1.6 m-85 -63.93 -29.78 70.92 Favored 'General case' 0 N--CA 1.502 2.142 0 O-C-N 121.26 -0.9 . . . . 0.0 110.703 179.691 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 27.7 ttpt -65.11 -36.86 85.63 Favored 'General case' 0 N--CA 1.497 1.907 0 O-C-N 121.24 -0.913 . . . . 0.0 110.057 179.182 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 7' ' ' ALA . . . . . . . . . . . . . . . -58.13 -38.66 76.96 Favored 'General case' 0 N--CA 1.497 1.882 0 O-C-N 121.6 -0.688 . . . . 0.0 110.13 179.505 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 8' ' ' ALA . . . . . . . . . . . . . . . -66.42 -44.03 84.07 Favored 'General case' 0 N--CA 1.497 1.906 0 O-C-N 121.507 -0.746 . . . . 0.0 110.182 179.454 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 9' ' ' VAL . . . . . . . . . . . . . 19.6 t -64.89 -44.01 96.25 Favored 'Isoleucine or valine' 0 N--CA 1.5 2.051 0 O-C-N 121.352 -0.843 . . . . 0.0 110.015 179.362 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 10' ' ' GLU . . . . . . . . . . . . . 31.1 mm-40 -74.09 -19.66 60.52 Favored 'General case' 0 N--CA 1.496 1.849 0 O-C-N 121.346 -0.846 . . . . 0.0 110.356 179.42 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 11' ' ' GLN . . . . . . . . . . . . . 0.2 OUTLIER -58.98 -49.38 78.12 Favored 'General case' 0 N--CA 1.498 1.947 0 O-C-N 121.412 -0.805 . . . . 0.0 109.906 179.425 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 12' ' ' LEU . . . . . 0.711 HD11 ' HG3' ' A' ' 17' ' ' LYS . 0.9 OUTLIER -72.18 134.45 45.69 Favored 'General case' 0 N--CA 1.495 1.812 0 O-C-N 121.314 -0.866 . . . . 0.0 109.003 178.953 . . . . . . . . 3 3 . 1 . 014 nuclear build core ' A' A ' 13' ' ' THR . . . . . 0.477 HG23 ' HB2' ' A' ' 15' ' ' GLU . 13.3 t -60.76 166.16 3.5 Favored 'General case' 0 N--CA 1.501 2.116 0 O-C-N 121.277 -0.889 . . . . 0.0 112.12 -178.009 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 14' ' ' GLU . . . . . 0.558 ' HA ' ' HD3' ' A' ' 17' ' ' LYS . 4.5 tp10 -61.51 -26.21 67.77 Favored 'General case' 0 N--CA 1.493 1.695 0 CA-C-N 116.213 -0.449 . . . . 0.0 110.921 -179.538 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 15' ' ' GLU . . . . . 0.477 ' HB2' HG23 ' A' ' 13' ' ' THR . 1.4 mp0 -57.54 -44.06 84.86 Favored 'General case' 0 N--CA 1.498 1.973 0 O-C-N 121.279 -0.888 . . . . 0.0 109.068 179.049 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 16' ' ' GLN . . . . . 0.494 ' HB2' HD12 ' A' ' 12' ' ' LEU . 44.1 mt-30 -68.82 -38.46 79.88 Favored 'General case' 0 N--CA 1.497 1.889 0 CA-C-O 121.743 0.782 . . . . 0.0 109.033 178.168 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 17' ' ' LYS . . . . . 0.711 ' HG3' HD11 ' A' ' 12' ' ' LEU . 0.0 OUTLIER -61.84 -29.54 70.24 Favored 'General case' 0 N--CA 1.497 1.898 0 N-CA-C 109.608 -0.516 . . . . 0.0 109.608 178.734 . . . . . . . . 3 3 . 1 . 014 nuclear build core ' A' A ' 18' ' ' ASN . . . . . . . . . . . . . 4.6 t-20 -59.45 -43.34 93.19 Favored 'General case' 0 N--CA 1.499 1.976 0 O-C-N 121.592 -0.693 . . . . 0.0 110.154 179.357 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 19' ' ' GLU . . . . . 0.596 ' HB3' ' HE2' ' B' ' 154' ' ' MET . 1.2 mp0 -56.82 -41.86 78.56 Favored 'General case' 0 N--CA 1.497 1.911 0 O-C-N 121.381 -0.825 . . . . 0.0 109.499 179.138 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 20' ' ' PHE . . . . . . . . . . . . . 14.9 m-85 -70.19 -37.4 75.11 Favored 'General case' 0 N--CA 1.494 1.757 0 O-C-N 121.445 -0.784 . . . . 0.0 109.32 178.413 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 21' ' ' LYS . . . . . 0.553 ' HG3' ' N ' ' A' ' 22' ' ' ALA . 0.0 OUTLIER -63.82 -31.7 72.97 Favored 'General case' 0 N--CA 1.495 1.806 0 O-C-N 121.489 -0.757 . . . . 0.0 109.188 178.677 . . . . . . . . 3 3 . 1 . 014 nuclear build core ' A' A ' 22' ' ' ALA . . . . . 0.553 ' N ' ' HG3' ' A' ' 21' ' ' LYS . . . -69.13 -43.58 74.1 Favored 'General case' 0 N--CA 1.495 1.778 0 O-C-N 121.402 -0.811 . . . . 0.0 109.007 178.154 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 23' ' ' ALA . . . . . . . . . . . . . . . -68.84 -43.45 75.45 Favored 'General case' 0 N--CA 1.497 1.885 0 O-C-N 121.558 -0.714 . . . . 0.0 109.369 178.672 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 24' ' ' PHE . . . . . . . . . . . . . 20.1 t80 -60.53 -37.63 81.82 Favored 'General case' 0 N--CA 1.497 1.876 0 O-C-N 121.64 -0.662 . . . . 0.0 109.851 179.027 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 25' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -54.1 -45.59 71.86 Favored 'General case' 0 N--CA 1.5 2.038 0 O-C-N 121.675 -0.641 . . . . 0.0 110.769 179.547 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 26' ' ' ILE . . . . . . . . . . . . . 2.3 mt -87.07 -9.84 11.07 Favored 'Isoleucine or valine' 0 N--CA 1.499 2.01 0 O-C-N 121.304 -0.872 . . . . 0.0 110.485 179.844 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 27' ' ' PHE . . . . . 0.56 ' CE1' HD22 ' A' ' 41' ' ' LEU . 0.1 OUTLIER -73.83 -32.24 63.59 Favored 'General case' 0 N--CA 1.496 1.857 0 O-C-N 121.145 -0.972 . . . . 0.0 109.994 179.386 . . . . . . . . 3 3 . 1 . 014 nuclear build core ' A' A ' 28' ' ' VAL . . . . . . . . . . . . . 15.7 m -100.23 48.56 0.12 Allowed 'Isoleucine or valine' 0 N--CA 1.499 1.989 0 O-C-N 121.52 -0.738 . . . . 0.0 110.246 179.55 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 29' ' ' LEU . . . . . . . . . . . . . 7.0 mt -67.1 -48.51 67.94 Favored 'General case' 0 N--CA 1.5 2.069 0 O-C-N 121.287 -0.883 . . . . 0.0 109.911 179.653 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 30' ' ' GLY . . . . . . . . . . . . . . . -109.24 28.63 10.69 Favored Glycine 0 N--CA 1.495 2.578 0 N-CA-C 109.392 -1.483 . . . . 0.0 109.392 179.117 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 31' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.493 1.723 0 O-C-N 121.308 -1.113 . . . . 0.0 110.053 179.953 . . . . . . . . 0 0 . 1 . 014 nuclear build core ' A' A ' 35' ' ' CYS . . . . . 0.49 ' HB3' ' HA ' ' A' ' 73' ' ' ASP . 0.1 OUTLIER . . . . . 0 N--CA 1.498 1.931 0 CA-C-O 121.081 0.467 . . . . 0.0 110.426 . . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 36' ' ' ILE . . . . . 0.573 ' O ' HG22 ' A' ' 71' ' ' THR . 38.2 mt -75.87 122.49 29.98 Favored 'Isoleucine or valine' 0 N--CA 1.497 1.922 0 O-C-N 121.115 -0.99 . . . . 0.0 110.537 -179.478 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 37' ' ' SER . . . . . . . . . . . . . 41.6 t -92.5 159.84 15.33 Favored 'General case' 0 N--CA 1.495 1.787 0 O-C-N 121.58 -0.7 . . . . 0.0 110.041 179.516 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 38' ' ' THR . . . . . 0.567 HG21 ' HA ' ' A' ' 58' ' ' GLN . 11.4 p -63.2 -37.21 86.32 Favored 'General case' 0 N--CA 1.501 2.106 0 O-C-N 121.337 -0.852 . . . . 0.0 110.556 179.954 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 39' ' ' LYS . . . . . . . . . . . . . 2.4 tttp -59.35 -42.79 92.35 Favored 'General case' 0 N--CA 1.498 1.969 0 O-C-N 121.357 -0.839 . . . . 0.0 109.903 179.322 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 1.6 mm-40 -69.1 -42.88 75.52 Favored 'General case' 0 N--CA 1.497 1.913 0 O-C-N 121.525 -0.735 . . . . 0.0 109.92 179.28 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 41' ' ' LEU . . . . . 0.56 HD22 ' CE1' ' A' ' 27' ' ' PHE . 0.1 OUTLIER -60.34 -63.94 1.13 Allowed 'General case' 0 N--CA 1.499 1.997 0 O-C-N 121.655 -0.653 . . . . 0.0 110.23 179.647 . . . . . . . . 3 3 . 1 . 014 nuclear build core ' A' A ' 42' ' ' GLY . . . . . . . . . . . . . . . -48.02 -42.11 22.72 Favored Glycine 0 N--CA 1.502 3.098 0 N-CA-C 110.098 -1.201 . . . . 0.0 110.098 179.655 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 43' ' ' LYS . . . . . . . . . . . . . 66.3 tttt -62.93 -38.05 89.49 Favored 'General case' 0 N--CA 1.501 2.103 0 O-C-N 121.301 -1.117 . . . . 0.0 110.356 179.184 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 44' ' ' VAL . . . . . . . . . . . . . 5.3 t -66.91 -26.62 37.33 Favored 'Isoleucine or valine' 0 N--CA 1.502 2.127 0 O-C-N 121.469 -0.769 . . . . 0.0 110.752 179.589 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 45' ' ' MET . . . . . . . . . . . . . 4.9 mmt -58.79 -29.52 66.9 Favored 'General case' 0 N--CA 1.503 2.222 0 O-C-N 121.192 -0.942 . . . . 0.0 111.455 -179.82 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 46' ' ' ARG . . . . . . . . . . . . . 18.0 ttp180 -56.01 -38.24 70.24 Favored 'General case' 0 N--CA 1.503 2.181 0 O-C-N 121.212 -0.93 . . . . 0.0 110.931 -179.91 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 47' ' ' MET . . . . . . . . . . . . . 14.5 ttp -89.13 4.76 47.41 Favored 'General case' 0 N--CA 1.501 2.087 0 O-C-N 121.27 -0.894 . . . . 0.0 111.148 179.716 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 48' ' ' LEU . . . . . . . . . . . . . 11.9 tp -117.14 -53.73 2.45 Favored 'General case' 0 N--CA 1.494 1.768 0 O-C-N 120.978 -1.076 . . . . 0.0 110.33 -179.824 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 49' ' ' GLY . . . . . 0.461 ' O ' ' HB2' ' A' ' 50' ' ' GLN . . . 170.51 119.4 0.5 Allowed Glycine 0 N--CA 1.493 2.466 0 N-CA-C 109.69 -1.364 . . . . 0.0 109.69 -179.976 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 50' ' ' GLN . . . . . 0.461 ' HB2' ' O ' ' A' ' 49' ' ' GLY . 64.3 mt-30 60.29 -177.7 0.1 Allowed 'General case' 0 N--CA 1.505 2.292 0 O-C-N 121.913 -0.757 . . . . 0.0 111.251 -179.97 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 51' ' ' ASN . . . . . . . . . . . . . 8.7 t-20 -159.35 105.37 1.51 Allowed Pre-proline 0 N--CA 1.496 1.858 0 O-C-N 121.231 -0.918 . . . . 0.0 110.274 -179.769 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 52' ' ' PRO . . . . . 0.71 ' HG2' HD11 ' A' ' 57' ' ' LEU . 52.6 Cg_endo -78.57 165.8 24.63 Favored 'Trans proline' 0 C--N 1.314 -1.252 0 O-C-N 123.819 1.431 . . . . 0.0 110.287 179.98 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 53' ' ' THR . . . . . 0.554 ' HB ' ' HD2' ' A' ' 54' ' ' PRO . 41.5 p -73.76 166.78 41.2 Favored Pre-proline 0 N--CA 1.5 2.042 0 O-C-N 121.103 -0.998 . . . . 0.0 110.448 179.938 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 54' ' ' PRO . . . . . 0.554 ' HD2' ' HB ' ' A' ' 53' ' ' THR . 39.6 Cg_endo -65.52 -40.87 16.8 Favored 'Trans proline' 0 N--CA 1.493 1.452 0 O-C-N 123.707 1.372 . . . . 0.0 111.051 -179.78 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 55' ' ' GLU . . . . . . . . . . . . . 27.3 mm-40 -69.43 -30.3 68.2 Favored 'General case' 0 N--CA 1.496 1.846 0 O-C-N 121.393 -0.817 . . . . 0.0 110.075 179.41 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 1.4 tt0 -54.86 -50.45 68.65 Favored 'General case' 0 N--CA 1.498 1.957 0 O-C-N 121.455 -0.778 . . . . 0.0 110.248 179.643 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 57' ' ' LEU . . . . . 0.71 HD11 ' HG2' ' A' ' 52' ' ' PRO . 1.2 mt -77.58 -22.66 50.6 Favored 'General case' 0 N--CA 1.495 1.796 0 O-C-N 121.36 -0.838 . . . . 0.0 110.825 179.754 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 58' ' ' GLN . . . . . 0.567 ' HA ' HG21 ' A' ' 38' ' ' THR . 0.0 OUTLIER -60.61 -34.62 74.5 Favored 'General case' 0 N--CA 1.499 2.008 0 O-C-N 120.978 -1.076 . . . . 0.0 109.297 179.289 . . . . . . . . 3 3 . 1 . 014 nuclear build core ' A' A ' 59' ' ' GLU . . . . . 0.552 ' N ' ' HG3' ' A' ' 58' ' ' GLN . 12.9 mm-40 -79.77 -33.76 40.36 Favored 'General case' 0 N--CA 1.493 1.695 0 O-C-N 121.289 -0.882 . . . . 0.0 108.697 177.91 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 60' ' ' MET . . . . . . . . . . . . . 16.3 ttm -67.91 -41.42 82.69 Favored 'General case' 0 N--CA 1.495 1.808 0 O-C-N 121.714 -0.616 . . . . 0.0 109.836 178.681 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 61' ' ' ILE . . . . . 0.673 HG13 HG23 ' A' ' 72' ' ' VAL . 3.2 tt -68.04 -36.96 77.39 Favored 'Isoleucine or valine' 0 N--CA 1.495 1.824 0 O-C-N 121.561 -0.712 . . . . 0.0 109.839 179.53 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 62' ' ' ASP . . . . . 0.44 ' HA ' ' HB2' ' A' ' 65' ' ' ASP . 0.4 OUTLIER -68.68 -32.34 72.1 Favored 'General case' 0 N--CA 1.498 1.934 0 O-C-N 121.374 -0.829 . . . . 0.0 110.233 179.009 . . . . . . . . 3 3 . 1 . 014 nuclear build core ' A' A ' 63' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER -59.88 -44.27 94.3 Favored 'General case' 0 N--CA 1.498 1.962 0 O-C-N 121.363 -0.836 . . . . 0.0 110.16 179.534 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 64' ' ' VAL . . . . . 0.567 HG11 ' SD ' ' A' ' 80' ' ' MET . 11.9 p -103.86 24.32 1.83 Allowed 'Isoleucine or valine' 0 N--CA 1.496 1.846 0 O-C-N 121.432 -0.793 . . . . 0.0 110.768 179.839 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 65' ' ' ASP . . . . . 0.44 ' HB2' ' HA ' ' A' ' 62' ' ' ASP . 2.7 t70 -84.41 153.62 23.3 Favored 'General case' 0 N--CA 1.495 1.803 0 O-C-N 120.971 -1.081 . . . . 0.0 110.256 179.756 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 66' ' ' GLU . . . . . . . . . . . . . 32.4 mt-10 -121.11 11.15 10.86 Favored 'General case' 0 N--CA 1.495 1.787 0 O-C-N 121.423 -0.798 . . . . 0.0 111.828 -179.263 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 67' ' ' ASP . . . . . . . . . . . . . 1.1 p30 -146.84 0.51 0.75 Allowed 'General case' 0 N--CA 1.502 2.16 0 O-C-N 120.753 -1.217 . . . . 0.0 113.205 -179.692 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 68' ' ' GLY . . . . . . . . . . . . . . . 89.02 -24.63 12.29 Favored Glycine 0 N--CA 1.497 2.702 0 O-C-N 120.576 -1.328 . . . . 0.0 111.1 179.14 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 69' ' ' SER . . . . . . . . . . . . . 4.2 p -54.45 -29.75 50.66 Favored 'General case' 0 N--CA 1.503 2.181 0 O-C-N 121.107 -1.231 . . . . 0.0 110.403 179.943 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 70' ' ' GLY . . . . . . . . . . . . . . . 71.32 41.89 58.16 Favored Glycine 0 N--CA 1.497 2.712 0 N-CA-C 109.419 -1.472 . . . . 0.0 109.419 -179.761 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 71' ' ' THR . . . . . 0.573 HG22 ' O ' ' A' ' 36' ' ' ILE . 0.2 OUTLIER -142.67 139.04 31.04 Favored 'General case' 0 N--CA 1.498 1.932 0 O-C-N 121.513 -0.992 . . . . 0.0 109.017 179.85 . . . . . . . . 3 3 . 1 . 014 nuclear build core ' A' A ' 72' ' ' VAL . . . . . 0.673 HG23 HG13 ' A' ' 61' ' ' ILE . 38.5 t -75.41 111.44 11.71 Favored 'Isoleucine or valine' 0 N--CA 1.499 1.991 0 O-C-N 121.337 -0.852 . . . . 0.0 111.178 -178.899 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 73' ' ' ASP . . . . . 0.49 ' HA ' ' HB3' ' A' ' 35' ' ' CYS . 8.6 m-20 -87.53 -173.01 4.15 Favored 'General case' 0 N--CA 1.494 1.728 0 O-C-N 121.711 -0.618 . . . . 0.0 109.405 178.941 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 74' ' ' PHE . . . . . . . . . . . . . 87.2 t80 -61.95 -48.47 80.26 Favored 'General case' 0 N--CA 1.5 2.054 0 O-C-N 121.071 -1.018 . . . . 0.0 110.237 179.804 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 75' ' ' ASP . . . . . . . . . . . . . 0.1 OUTLIER -69.36 -45.11 70.15 Favored 'General case' 0 N--CA 1.496 1.852 0 O-C-N 121.457 -0.777 . . . . 0.0 110.355 179.786 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 76' ' ' GLU . . . . . . . . . . . . . 3.2 mt-10 -59.6 -34.73 73.12 Favored 'General case' 0 N--CA 1.499 1.998 0 O-C-N 121.433 -0.792 . . . . 0.0 110.073 179.38 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 77' ' ' PHE . . . . . . . . . . . . . 48.2 t80 -62.25 -43.96 97.63 Favored 'General case' 0 N--CA 1.496 1.86 0 O-C-N 121.48 -0.763 . . . . 0.0 109.644 178.866 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 78' ' ' LEU . . . . . . . . . . . . . 67.5 mt -66.39 -40.94 89.96 Favored 'General case' 0 N--CA 1.499 1.986 0 O-C-N 121.516 -0.74 . . . . 0.0 109.742 179.11 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 79' ' ' VAL . . . . . . . . . . . . . 5.2 t -62.98 -35.0 69.58 Favored 'Isoleucine or valine' 0 N--CA 1.501 2.082 0 O-C-N 121.502 -0.749 . . . . 0.0 110.11 179.355 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 80' ' ' MET . . . . . 0.567 ' SD ' HG11 ' A' ' 64' ' ' VAL . 0.0 OUTLIER -73.58 -31.85 63.82 Favored 'General case' 0 N--CA 1.497 1.891 0 O-C-N 121.308 -0.87 . . . . 0.0 110.341 179.647 . . . . . . . . 3 3 . 1 . 014 nuclear build core ' A' A ' 81' ' ' MET . . . . . . . . . . . . . 12.0 mmt -63.54 -50.5 69.32 Favored 'General case' 0 N--CA 1.498 1.965 0 O-C-N 121.419 -0.801 . . . . 0.0 110.465 179.857 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 82' ' ' VAL . . . . . . . . . . . . . 10.9 p -66.87 -29.14 45.33 Favored 'Isoleucine or valine' 0 N--CA 1.498 1.953 0 O-C-N 121.368 -0.833 . . . . 0.0 110.29 179.606 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 83' ' ' ARG . . . . . . . . . . . . . 3.0 mtt85 -56.92 -41.16 77.68 Favored 'General case' 0 N--CA 1.501 2.103 0 O-C-N 121.307 -0.87 . . . . 0.0 109.777 178.99 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 84' ' ' CYS . . . . . . . . . . . . . 84.4 m -85.45 -33.9 21.78 Favored 'General case' 0 N--CA 1.497 1.893 0 O-C-N 121.477 -0.764 . . . . 0.0 109.584 178.857 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 85' ' ' MET . . . . . . . . . . . . . 36.2 ttp . . . . . 0 N--CA 1.496 1.864 0 O-C-N 121.46 -0.775 . . . . 0.0 109.88 179.403 . . . . . . . . 0 0 . 1 . 014 nuclear build core ' B' B ' 149' ' ' SER . . . . . . . . . . . . . 8.8 t . . . . . 0 N--CA 1.502 2.159 0 CA-C-O 121.093 0.473 . . . . 0.0 110.766 . . . . . . . . . 0 0 . 1 . 014 nuclear build core ' B' B ' 150' ' ' ALA . . . . . . . . . . . . . . . -111.36 -43.64 3.67 Favored 'General case' 0 N--CA 1.496 1.84 0 O-C-N 121.259 -0.9 . . . . 0.0 110.403 -179.974 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' B' B ' 151' ' ' ASP . . . . . . . . . . . . . 8.0 p-10 -58.09 -42.87 86.57 Favored 'General case' 0 N--CA 1.499 1.993 0 O-C-N 121.541 -0.725 . . . . 0.0 111.287 -179.771 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' B' B ' 152' ' ' ALA . . . . . . . . . . . . . . . -58.49 -50.02 75.25 Favored 'General case' 0 N--CA 1.499 2.009 0 O-C-N 121.149 -0.969 . . . . 0.0 110.239 179.8 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' B' B ' 153' ' ' MET . . . . . . . . . . . . . 1.5 ttt -68.33 -36.58 79.49 Favored 'General case' 0 N--CA 1.497 1.905 0 O-C-N 121.431 -0.793 . . . . 0.0 109.908 179.233 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' B' B ' 154' ' ' MET . . . . . 0.596 ' HE2' ' HB3' ' A' ' 19' ' ' GLU . 4.1 mtt -61.5 -47.83 83.83 Favored 'General case' 0 N--CA 1.497 1.912 0 O-C-N 121.501 -0.75 . . . . 0.0 110.063 179.523 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' B' B ' 155' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -63.33 -28.51 70.06 Favored 'General case' 0 N--CA 1.499 1.99 0 O-C-N 121.462 -0.774 . . . . 0.0 110.962 179.739 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' B' B ' 156' ' ' ALA . . . . . . . . . . . . . . . -89.66 -22.23 22.37 Favored 'General case' 0 N--CA 1.501 2.078 0 O-C-N 121.236 -0.915 . . . . 0.0 111.724 -179.439 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' B' B ' 157' ' ' LEU . . . . . . . . . . . . . 9.3 mt -99.12 -43.56 6.6 Favored 'General case' 0 N--CA 1.499 2.012 0 O-C-N 120.893 -1.129 . . . . 0.0 111.203 -179.486 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' B' B ' 158' ' ' LEU . . . . . . . . . . . . . 5.9 mp . . . . . 0 N--CA 1.499 1.999 0 O-C-N 121.201 -0.937 . . . . 0.0 110.49 -179.66 . . . . . . . . 0 0 . 1 . 015 nuclear build core ' A' A ' 4' ' ' ILE . . . . . . . . . . . . . 2.7 mp . . . . . 0 N--CA 1.497 1.919 0 CA-C-O 120.734 0.302 . . . . 0.0 110.417 . . . . . . . . . 0 0 . 1 . 015 nuclear build core ' A' A ' 5' ' ' TYR . . . . . . . . . . . . . 12.2 m-85 -62.3 -40.56 96.69 Favored 'General case' 0 N--CA 1.499 2.013 0 O-C-N 121.303 -0.873 . . . . 0.0 110.306 179.842 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 9.7 ttmt -69.95 -37.59 75.88 Favored 'General case' 0 N--CA 1.496 1.846 0 O-C-N 121.4 -0.813 . . . . 0.0 110.061 179.326 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 7' ' ' ALA . . . . . . . . . . . . . . . -51.81 -49.57 62.52 Favored 'General case' 0 N--CA 1.5 2.049 0 O-C-N 121.577 -0.702 . . . . 0.0 110.258 179.632 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 8' ' ' ALA . . . . . . . . . . . . . . . -61.0 -42.89 99.3 Favored 'General case' 0 N--CA 1.497 1.92 0 O-C-N 121.501 -0.749 . . . . 0.0 109.977 179.23 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 9' ' ' VAL . . . . . 0.408 ' HA ' HD12 ' A' ' 12' ' ' LEU . 38.3 t -60.07 -38.19 75.89 Favored 'Isoleucine or valine' 0 N--CA 1.501 2.123 0 O-C-N 121.48 -0.763 . . . . 0.0 110.135 179.414 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 10' ' ' GLU . . . . . . . . . . . . . 36.8 mt-10 -81.57 -31.66 32.51 Favored 'General case' 0 N--CA 1.497 1.877 0 O-C-N 121.51 -0.744 . . . . 0.0 110.192 179.633 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 11' ' ' GLN . . . . . . . . . . . . . 41.0 mt-30 -63.04 -32.03 73.3 Favored 'General case' 0 N--CA 1.5 2.063 0 O-C-N 121.588 -0.695 . . . . 0.0 111.027 179.923 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 12' ' ' LEU . . . . . 0.408 HD12 ' HA ' ' A' ' 9' ' ' VAL . 30.5 mt -54.54 139.49 37.8 Favored 'General case' 0 N--CA 1.501 2.112 0 O-C-N 121.292 -0.88 . . . . 0.0 110.397 179.85 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 13' ' ' THR . . . . . . . . . . . . . 72.1 p -77.55 165.01 24.86 Favored 'General case' 0 N--CA 1.499 1.979 0 O-C-N 121.216 -0.927 . . . . 0.0 110.025 179.643 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 14' ' ' GLU . . . . . 0.503 ' HA ' ' HD3' ' A' ' 17' ' ' LYS . 0.5 OUTLIER -55.22 -27.51 46.62 Favored 'General case' 0 N--CA 1.493 1.697 0 O-C-N 121.507 -0.746 . . . . 0.0 110.788 -179.6 . . . . . . . . 3 3 . 1 . 015 nuclear build core ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 1.5 mp0 -61.31 -47.49 85.69 Favored 'General case' 0 N--CA 1.496 1.848 0 O-C-N 121.351 -0.843 . . . . 0.0 109.329 178.828 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 16' ' ' GLN . . . . . . . . . . . . . 1.2 mt-30 -67.02 -41.65 86.26 Favored 'General case' 0 N--CA 1.498 1.953 0 CA-C-O 121.581 0.705 . . . . 0.0 109.614 178.784 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 17' ' ' LYS . . . . . 0.503 ' HD3' ' HA ' ' A' ' 14' ' ' GLU . 0.2 OUTLIER -59.42 -45.14 92.37 Favored 'General case' 0 N--CA 1.499 1.999 0 CA-C-O 121.119 0.485 . . . . 0.0 109.786 179.202 . . . . . . . . 3 3 . 1 . 015 nuclear build core ' A' A ' 18' ' ' ASN . . . . . . . . . . . . . 0.8 OUTLIER -69.35 -41.08 77.08 Favored 'General case' 0 N--CA 1.496 1.863 0 O-C-N 121.593 -0.692 . . . . 0.0 109.945 179.316 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 0.3 OUTLIER -60.39 -45.49 93.37 Favored 'General case' 0 N--CA 1.5 2.036 0 O-C-N 121.416 -0.802 . . . . 0.0 109.694 179.083 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 20' ' ' PHE . . . . . 0.456 ' CE1' ' HG2' ' A' ' 81' ' ' MET . 8.4 m-85 -64.73 -35.29 80.59 Favored 'General case' 0 N--CA 1.497 1.882 0 O-C-N 121.531 -0.731 . . . . 0.0 109.77 178.94 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 21' ' ' LYS . . . . . 0.467 ' HG3' ' N ' ' A' ' 22' ' ' ALA . 0.0 OUTLIER -60.82 -39.89 90.69 Favored 'General case' 0 N--CA 1.497 1.885 0 O-C-N 121.439 -0.788 . . . . 0.0 109.6 179.173 . . . . . . . . 3 3 . 1 . 015 nuclear build core ' A' A ' 22' ' ' ALA . . . . . 0.467 ' N ' ' HG3' ' A' ' 21' ' ' LYS . . . -62.99 -46.84 85.78 Favored 'General case' 0 N--CA 1.498 1.943 0 O-C-N 121.386 -0.821 . . . . 0.0 109.816 179.136 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 23' ' ' ALA . . . . . . . . . . . . . . . -66.81 -39.3 87.66 Favored 'General case' 0 N--CA 1.497 1.891 0 O-C-N 121.497 -0.752 . . . . 0.0 110.145 179.259 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 24' ' ' PHE . . . . . 0.447 ' CZ ' HG11 ' A' ' 28' ' ' VAL . 73.1 t80 -68.41 -39.83 81.49 Favored 'General case' 0 N--CA 1.498 1.941 0 O-C-N 121.516 -0.74 . . . . 0.0 110.297 179.607 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 25' ' ' ASP . . . . . . . . . . . . . 0.9 OUTLIER -54.24 -43.51 70.95 Favored 'General case' 0 N--CA 1.498 1.974 0 O-C-N 121.5 -0.75 . . . . 0.0 110.047 179.733 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 26' ' ' ILE . . . . . 0.718 ' HA ' HD23 ' A' ' 29' ' ' LEU . 12.9 mt -74.57 -28.07 21.75 Favored 'Isoleucine or valine' 0 N--CA 1.498 1.929 0 O-C-N 121.424 -0.797 . . . . 0.0 109.478 178.564 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 27' ' ' PHE . . . . . . . . . . . . . 0.2 OUTLIER -73.36 -10.54 59.85 Favored 'General case' 0 N--CA 1.498 1.953 0 O-C-N 121.285 -0.884 . . . . 0.0 111.239 179.452 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 28' ' ' VAL . . . . . 0.691 HG12 HG13 ' A' ' 36' ' ' ILE . 21.2 m -125.26 3.17 4.57 Favored 'Isoleucine or valine' 0 N--CA 1.501 2.103 0 O-C-N 121.036 -1.04 . . . . 0.0 111.25 179.841 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 29' ' ' LEU . . . . . 0.718 HD23 ' HA ' ' A' ' 26' ' ' ILE . 2.1 pp -65.64 -32.49 74.09 Favored 'General case' 0 N--CA 1.5 2.033 0 O-C-N 120.913 -1.117 . . . . 0.0 110.154 179.666 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 30' ' ' GLY . . . . . . . . . . . . . . . -114.58 28.05 8.44 Favored Glycine 0 N--CA 1.495 2.628 0 N-CA-C 109.283 -1.527 . . . . 0.0 109.283 178.939 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 31' ' ' ALA . . . . . 0.539 ' HB3' ' HA ' ' A' ' 28' ' ' VAL . . . . . . . . 0 N--CA 1.493 1.725 0 O-C-N 121.516 -0.99 . . . . 0.0 109.668 -179.994 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 35' ' ' CYS . . . . . . . . . . . . . 1.1 m . . . . . 0 N--CA 1.497 1.895 0 CA-C-O 121.163 0.506 . . . . 0.0 110.777 . . . . . . . . . 0 0 . 1 . 015 nuclear build core ' A' A ' 36' ' ' ILE . . . . . 0.691 HG13 HG12 ' A' ' 28' ' ' VAL . 4.1 mt -129.12 126.12 63.72 Favored 'Isoleucine or valine' 0 N--CA 1.498 1.954 0 O-C-N 121.506 -0.746 . . . . 0.0 110.33 -179.983 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 37' ' ' SER . . . . . 0.559 ' C ' HG23 ' A' ' 38' ' ' THR . 1.1 t -125.1 66.33 1.12 Allowed 'General case' 0 N--CA 1.496 1.867 0 O-C-N 121.406 -0.809 . . . . 0.0 110.265 179.755 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 38' ' ' THR . . . . . 0.559 HG23 ' C ' ' A' ' 37' ' ' SER . 1.2 p 66.25 -43.59 0.4 Allowed 'General case' 0 N--CA 1.518 2.958 0 N-CA-C 112.866 0.691 . . . . 0.0 112.866 179.69 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 39' ' ' LYS . . . . . . . . . . . . . 3.7 ttpp -46.59 -64.84 0.66 Allowed 'General case' 0 N--CA 1.505 2.31 0 O-C-N 121.045 -1.035 . . . . 0.0 111.826 -178.941 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 40' ' ' GLU . . . . . 0.427 ' HB2' ' HB2' ' A' ' 31' ' ' ALA . 0.4 OUTLIER -71.44 -32.0 67.84 Favored 'General case' 0 N--CA 1.5 2.033 0 O-C-N 121.076 -1.015 . . . . 0.0 110.245 179.916 . . . . . . . . 3 3 . 1 . 015 nuclear build core ' A' A ' 41' ' ' LEU . . . . . 0.499 ' O ' HD12 ' A' ' 41' ' ' LEU . 4.8 tp -59.08 -50.95 72.13 Favored 'General case' 0 N--CA 1.497 1.919 0 O-C-N 121.5 -0.75 . . . . 0.0 110.377 179.737 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 42' ' ' GLY . . . . . . . . . . . . . . . -59.93 -38.06 93.56 Favored Glycine 0 N--CA 1.493 2.475 0 N-CA-C 110.033 -1.227 . . . . 0.0 110.033 -179.922 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 43' ' ' LYS . . . . . . . . . . . . . 1.9 ttpt -54.23 -44.32 71.61 Favored 'General case' 0 N--CA 1.5 2.036 0 O-C-N 121.439 -1.036 . . . . 0.0 109.832 179.251 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 44' ' ' VAL . . . . . . . . . . . . . 92.7 t -76.31 -39.46 34.58 Favored 'Isoleucine or valine' 0 N--CA 1.496 1.851 0 O-C-N 121.521 -0.737 . . . . 0.0 109.788 179.153 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 45' ' ' MET . . . . . . . . . . . . . 8.7 mmt -61.3 -36.74 80.91 Favored 'General case' 0 N--CA 1.501 2.089 0 O-C-N 121.393 -0.817 . . . . 0.0 109.944 179.222 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 46' ' ' ARG . . . . . . . . . . . . . 0.9 OUTLIER -64.02 -34.44 78.01 Favored 'General case' 0 N--CA 1.5 2.037 0 O-C-N 121.487 -0.758 . . . . 0.0 109.949 179.122 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 47' ' ' MET . . . . . . . . . . . . . 3.1 ttp -77.48 -35.16 53.95 Favored 'General case' 0 N--CA 1.496 1.852 0 O-C-N 121.484 -0.76 . . . . 0.0 109.777 179.401 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 48' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -136.04 89.89 2.53 Favored 'General case' 0 N--CA 1.495 1.794 0 O-C-N 121.407 -0.808 . . . . 0.0 109.57 179.295 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 49' ' ' GLY . . . . . 0.456 ' C ' ' HG3' ' A' ' 50' ' ' GLN . . . 147.36 -114.63 0.72 Allowed Glycine 0 N--CA 1.497 2.701 0 N-CA-C 109.617 -1.393 . . . . 0.0 109.617 -179.503 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 50' ' ' GLN . . . . . 0.456 ' HG3' ' C ' ' A' ' 49' ' ' GLY . 0.0 OUTLIER -149.21 -52.93 0.16 Allowed 'General case' 0 N--CA 1.502 2.163 0 O-C-N 121.575 -0.956 . . . . 0.0 109.818 179.914 . . . . . . . . 3 3 . 1 . 015 nuclear build core ' A' A ' 51' ' ' ASN . . . . . . . . . . . . . 45.3 t30 54.72 78.75 0.37 Allowed Pre-proline 0 N--CA 1.502 2.134 0 O-C-N 121.8 -0.562 . . . . 0.0 112.11 179.317 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 52' ' ' PRO . . . . . . . . . . . . . 44.8 Cg_endo -78.64 -61.55 0.03 OUTLIER 'Trans proline' 0 C--N 1.315 -1.224 0 O-C-N 123.601 1.316 . . . . 0.0 110.0 178.573 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 53' ' ' THR . . . . . . . . . . . . . 3.3 p -134.67 162.29 58.58 Favored Pre-proline 0 N--CA 1.492 1.639 0 O-C-N 121.297 -0.877 . . . . 0.0 109.623 179.611 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 54' ' ' PRO . . . . . . . . . . . . . 43.4 Cg_endo -68.42 -31.06 28.59 Favored 'Trans proline' 0 N--CA 1.491 1.381 0 O-C-N 123.498 1.262 . . . . 0.0 110.515 179.555 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 55' ' ' GLU . . . . . . . . . . . . . 28.9 mp0 -67.39 -29.4 68.9 Favored 'General case' 0 N--CA 1.496 1.853 0 O-C-N 121.548 -0.72 . . . . 0.0 110.227 179.381 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -60.57 -32.74 71.82 Favored 'General case' 0 N--CA 1.499 2.015 0 O-C-N 121.519 -0.738 . . . . 0.0 111.45 -179.754 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 57' ' ' LEU . . . . . 0.46 ' HB3' ' CD2' ' A' ' 41' ' ' LEU . 9.0 mt -89.17 -12.65 40.36 Favored 'General case' 0 N--CA 1.496 1.85 0 O-C-N 121.043 -1.036 . . . . 0.0 111.413 -179.408 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 58' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -66.3 -47.95 71.94 Favored 'General case' 0 N--CA 1.492 1.662 0 O-C-N 120.912 -1.118 . . . . 0.0 108.69 179.234 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 59' ' ' GLU . . . . . . . . . . . . . 8.5 pt-20 -61.15 -31.38 71.1 Favored 'General case' 0 N--CA 1.495 1.819 0 O-C-N 121.548 -0.72 . . . . 0.0 109.601 178.69 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 60' ' ' MET . . . . . 0.427 ' HB2' ' O ' ' A' ' 57' ' ' LEU . 1.9 mmm -61.08 -42.14 97.95 Favored 'General case' 0 N--CA 1.497 1.878 0 O-C-N 121.5 -0.75 . . . . 0.0 109.663 178.811 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 61' ' ' ILE . . . . . 0.848 HG23 HG23 ' A' ' 72' ' ' VAL . 10.9 mt -72.75 -45.42 57.01 Favored 'Isoleucine or valine' 0 N--CA 1.497 1.89 0 O-C-N 121.355 -0.841 . . . . 0.0 109.658 178.982 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 62' ' ' ASP . . . . . . . . . . . . . 10.4 m-20 -54.11 -35.09 61.77 Favored 'General case' 0 N--CA 1.499 1.989 0 O-C-N 121.675 -0.641 . . . . 0.0 111.064 -179.735 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 63' ' ' GLU . . . . . . . . . . . . . 3.5 tm-20 -58.47 -39.93 81.3 Favored 'General case' 0 N--CA 1.501 2.089 0 O-C-N 121.217 -0.927 . . . . 0.0 110.068 179.459 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 64' ' ' VAL . . . . . 0.512 HG12 ' NH2' ' A' ' 83' ' ' ARG . 23.1 m -107.23 23.81 3.04 Favored 'Isoleucine or valine' 0 N--CA 1.497 1.913 0 O-C-N 121.404 -0.81 . . . . 0.0 110.709 179.5 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 65' ' ' ASP . . . . . . . . . . . . . 11.3 t0 -98.2 97.15 8.6 Favored 'General case' 0 N--CA 1.495 1.806 0 O-C-N 121.104 -0.998 . . . . 0.0 110.074 179.648 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 66' ' ' GLU . . . . . . . . . . . . . 3.3 mp0 -91.88 28.67 1.75 Allowed 'General case' 0 N--CA 1.495 1.803 0 O-C-N 121.416 -0.802 . . . . 0.0 109.264 178.818 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 67' ' ' ASP . . . . . . . . . . . . . 1.0 OUTLIER -107.61 -29.58 9.09 Favored 'General case' 0 N--CA 1.492 1.65 0 O-C-N 121.593 -0.692 . . . . 0.0 110.361 -179.477 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 68' ' ' GLY . . . . . . . . . . . . . . . 80.08 19.39 69.91 Favored Glycine 0 N--CA 1.492 2.398 0 N-CA-C 108.215 -1.954 . . . . 0.0 108.215 -177.548 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 69' ' ' SER . . . . . . . . . . . . . 59.9 p -109.81 -44.9 3.73 Favored 'General case' 0 N--CA 1.493 1.704 0 O-C-N 121.609 -0.936 . . . . 0.0 110.393 -179.592 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 70' ' ' GLY . . . . . 0.417 ' O ' HG21 ' A' ' 61' ' ' ILE . . . 118.06 -40.21 2.38 Favored Glycine 0 N--CA 1.499 2.89 0 C-N-CA 119.927 -1.13 . . . . 0.0 110.881 179.518 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 71' ' ' THR . . . . . . . . . . . . . 4.7 m -76.45 144.21 40.05 Favored 'General case' 0 N--CA 1.505 2.276 0 O-C-N 121.002 -1.293 . . . . 0.0 110.342 -179.686 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 72' ' ' VAL . . . . . 0.848 HG23 HG23 ' A' ' 61' ' ' ILE . 0.7 OUTLIER -98.69 136.93 27.76 Favored 'Isoleucine or valine' 0 N--CA 1.497 1.888 0 O-C-N 121.496 -0.753 . . . . 0.0 110.373 179.919 . . . . . . . . 3 3 . 1 . 015 nuclear build core ' A' A ' 73' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER -113.81 -165.37 1.0 Allowed 'General case' 0 N--CA 1.496 1.874 0 O-C-N 121.371 -0.831 . . . . 0.0 110.05 179.814 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 74' ' ' PHE . . . . . . . . . . . . . 23.6 t80 -64.37 -44.85 90.09 Favored 'General case' 0 N--CA 1.499 1.984 0 O-C-N 121.174 -0.953 . . . . 0.0 110.475 179.893 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 75' ' ' ASP . . . . . . . . . . . . . 30.2 t70 -57.72 -51.9 67.64 Favored 'General case' 0 N--CA 1.497 1.909 0 O-C-N 121.412 -0.805 . . . . 0.0 109.881 179.447 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 76' ' ' GLU . . . . . 0.627 ' HB3' HG22 ' A' ' 72' ' ' VAL . 35.0 mt-10 -60.49 -37.09 79.95 Favored 'General case' 0 N--CA 1.499 1.989 0 O-C-N 121.576 -0.702 . . . . 0.0 109.771 178.9 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 77' ' ' PHE . . . . . 0.522 ' HA ' ' CE ' ' A' ' 80' ' ' MET . 2.4 t80 -57.63 -36.64 72.08 Favored 'General case' 0 N--CA 1.496 1.849 0 O-C-N 121.691 -0.63 . . . . 0.0 110.279 179.362 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 78' ' ' LEU . . . . . . . . . . . . . 12.5 mt -75.29 -37.12 61.04 Favored 'General case' 0 N--CA 1.496 1.84 0 O-C-N 121.512 -0.742 . . . . 0.0 110.943 -179.945 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 79' ' ' VAL . . . . . . . . . . . . . 66.1 t -62.11 -49.26 84.81 Favored 'Isoleucine or valine' 0 N--CA 1.503 2.196 0 O-C-N 121.23 -0.919 . . . . 0.0 111.21 -179.504 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 80' ' ' MET . . . . . 0.522 ' CE ' ' HA ' ' A' ' 77' ' ' PHE . 16.2 ptt? -69.67 -24.27 63.58 Favored 'General case' 0 N--CA 1.502 2.147 0 O-C-N 120.872 -1.143 . . . . 0.0 110.727 -179.806 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 81' ' ' MET . . . . . 0.456 ' HG2' ' CE1' ' A' ' 20' ' ' PHE . 24.9 tpp -73.89 -50.46 20.12 Favored 'General case' 0 N--CA 1.494 1.757 0 O-C-N 121.098 -1.002 . . . . 0.0 109.825 179.2 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 82' ' ' VAL . . . . . . . . . . . . . 30.1 m -62.25 -26.08 39.33 Favored 'Isoleucine or valine' 0 N--CA 1.503 2.19 0 O-C-N 121.174 -0.954 . . . . 0.0 109.846 178.905 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 83' ' ' ARG . . . . . 0.512 ' NH2' HG12 ' A' ' 64' ' ' VAL . 19.6 mtt180 -66.1 -52.32 49.72 Favored 'General case' 0 N--CA 1.496 1.858 0 O-C-N 121.283 -0.886 . . . . 0.0 108.936 178.601 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 84' ' ' CYS . . . . . . . . . . . . . 37.7 t -64.74 -23.36 67.22 Favored 'General case' 0 N--CA 1.499 2.009 0 O-C-N 121.648 -0.658 . . . . 0.0 110.397 178.964 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 85' ' ' MET . . . . . . . . . . . . . 9.5 mtt . . . . . 0 N--CA 1.499 1.991 0 O-C-N 121.301 -0.874 . . . . 0.0 110.647 179.257 . . . . . . . . 0 0 . 1 . 015 nuclear build core ' B' B ' 149' ' ' SER . . . . . . . . . . . . . 30.1 t . . . . . 0 N--CA 1.499 1.994 0 CA-C-O 121.09 0.472 . . . . 0.0 110.477 . . . . . . . . . 0 0 . 1 . 015 nuclear build core ' B' B ' 150' ' ' ALA . . . . . . . . . . . . . . . -58.24 -41.86 85.08 Favored 'General case' 0 N--CA 1.499 2.002 0 O-C-N 121.556 -0.715 . . . . 0.0 110.582 179.765 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' B' B ' 151' ' ' ASP . . . . . . . . . . . . . 20.7 t70 -67.16 -47.14 71.89 Favored 'General case' 0 N--CA 1.497 1.909 0 O-C-N 121.317 -0.864 . . . . 0.0 110.308 179.677 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' B' B ' 152' ' ' ALA . . . . . . . . . . . . . . . -60.01 -47.36 86.17 Favored 'General case' 0 N--CA 1.499 1.978 0 O-C-N 121.511 -0.743 . . . . 0.0 110.731 -179.94 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' B' B ' 153' ' ' MET . . . . . . . . . . . . . 0.1 OUTLIER -64.74 -40.05 94.65 Favored 'General case' 0 N--CA 1.498 1.932 0 O-C-N 121.328 -0.858 . . . . 0.0 110.239 179.769 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' B' B ' 154' ' ' MET . . . . . . . . . . . . . 3.1 tpp -63.18 -47.69 81.55 Favored 'General case' 0 N--CA 1.499 1.976 0 O-C-N 121.434 -0.791 . . . . 0.0 110.16 179.501 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' B' B ' 155' ' ' GLN . . . . . . . . . . . . . 0.8 OUTLIER -68.7 -36.95 79.14 Favored 'General case' 0 N--CA 1.5 2.032 0 O-C-N 121.388 -0.82 . . . . 0.0 110.494 179.573 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' B' B ' 156' ' ' ALA . . . . . . . . . . . . . . . -69.65 -29.79 67.34 Favored 'General case' 0 N--CA 1.499 2.005 0 O-C-N 121.306 -0.871 . . . . 0.0 110.934 179.881 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' B' B ' 157' ' ' LEU . . . . . 0.542 HD21 ' HB ' ' A' ' 26' ' ' ILE . 4.8 tp -84.9 -33.99 22.65 Favored 'General case' 0 N--CA 1.497 1.877 0 O-C-N 121.319 -0.863 . . . . 0.0 110.501 179.981 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' B' B ' 158' ' ' LEU . . . . . . . . . . . . . 4.2 mm? . . . . . 0 N--CA 1.496 1.862 0 O-C-N 121.297 -0.877 . . . . 0.0 110.308 -179.748 . . . . . . . . 0 0 . 1 . 016 nuclear build core ' A' A ' 4' ' ' ILE . . . . . . . . . . . . . 9.5 mt . . . . . 0 N--CA 1.499 1.977 0 CA-C-O 121.033 0.444 . . . . 0.0 109.945 . . . . . . . . . 0 0 . 1 . 016 nuclear build core ' A' A ' 5' ' ' TYR . . . . . 0.413 ' HB3' ' CG2' ' A' ' 79' ' ' VAL . 0.9 OUTLIER -66.92 -39.54 87.4 Favored 'General case' 0 N--CA 1.496 1.831 0 O-C-N 121.369 -0.832 . . . . 0.0 109.563 179.125 . . . . . . . . 3 3 . 1 . 016 nuclear build core ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 0.4 OUTLIER -68.07 -32.73 73.27 Favored 'General case' 0 N--CA 1.495 1.818 0 O-C-N 121.562 -0.712 . . . . 0.0 109.81 178.946 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 7' ' ' ALA . . . . . . . . . . . . . . . -63.4 -34.65 78.2 Favored 'General case' 0 N--CA 1.499 1.975 0 O-C-N 121.233 -0.917 . . . . 0.0 109.483 178.728 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 8' ' ' ALA . . . . . . . . . . . . . . . -66.02 -28.05 68.58 Favored 'General case' 0 N--CA 1.495 1.808 0 O-C-N 121.496 -0.753 . . . . 0.0 110.229 178.892 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 9' ' ' VAL . . . . . 0.434 HG13 ' HB3' ' A' ' 78' ' ' LEU . 68.6 t -64.52 -32.75 59.09 Favored 'Isoleucine or valine' 0 N--CA 1.5 2.069 0 O-C-N 121.318 -0.864 . . . . 0.0 110.338 179.475 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 10' ' ' GLU . . . . . . . . . . . . . 15.4 mt-10 -65.58 -25.45 67.41 Favored 'General case' 0 N--CA 1.499 2.01 0 O-C-N 121.301 -0.874 . . . . 0.0 110.665 179.871 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 11' ' ' GLN . . . . . . . . . . . . . 0.3 OUTLIER -65.45 -24.47 67.18 Favored 'General case' 0 N--CA 1.5 2.065 0 O-C-N 121.407 -0.808 . . . . 0.0 110.991 179.635 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 12' ' ' LEU . . . . . . . . . . . . . 10.2 mt -61.47 135.83 57.81 Favored 'General case' 0 N--CA 1.499 2.023 0 O-C-N 121.256 -0.902 . . . . 0.0 110.45 -179.935 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 13' ' ' THR . . . . . . . . . . . . . 27.9 p -77.97 165.02 24.57 Favored 'General case' 0 N--CA 1.498 1.966 0 O-C-N 121.275 -0.891 . . . . 0.0 110.357 179.623 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 14' ' ' GLU . . . . . . . . . . . . . 0.6 OUTLIER -56.52 -31.49 64.17 Favored 'General case' 0 N--CA 1.494 1.739 0 O-C-N 121.678 -0.639 . . . . 0.0 110.407 -179.879 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 1.4 mp0 -62.07 -52.79 62.47 Favored 'General case' 0 N--CA 1.498 1.933 0 O-C-N 121.467 -0.771 . . . . 0.0 109.761 179.306 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 16' ' ' GLN . . . . . 0.433 ' HA ' ' HB3' ' A' ' 19' ' ' GLU . 38.9 mt-30 -65.02 -33.18 75.44 Favored 'General case' 0 N--CA 1.497 1.888 0 O-C-N 121.627 -0.671 . . . . 0.0 110.111 179.448 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 17' ' ' LYS . . . . . . . . . . . . . 15.4 mttp -63.56 -49.0 75.15 Favored 'General case' 0 N--CA 1.497 1.904 0 N-CA-C 109.47 -0.567 . . . . 0.0 109.47 179.009 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 18' ' ' ASN . . . . . 0.554 ' HA ' ' HG2' ' A' ' 21' ' ' LYS . 41.7 t30 -71.47 -32.21 68.02 Favored 'General case' 0 N--CA 1.497 1.894 0 O-C-N 121.537 -0.727 . . . . 0.0 109.225 178.398 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 19' ' ' GLU . . . . . 0.433 ' HB3' ' HA ' ' A' ' 16' ' ' GLN . 2.4 tt0 -66.73 -41.78 87.33 Favored 'General case' 0 N--CA 1.496 1.848 0 O-C-N 121.539 -0.726 . . . . 0.0 109.425 178.925 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 20' ' ' PHE . . . . . . . . . . . . . 3.0 m-85 -70.68 -34.72 72.3 Favored 'General case' 0 N--CA 1.497 1.877 0 O-C-N 121.497 -0.752 . . . . 0.0 110.301 179.477 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 21' ' ' LYS . . . . . 0.592 ' HG3' ' N ' ' A' ' 22' ' ' ALA . 0.0 OUTLIER -64.47 -28.03 69.39 Favored 'General case' 0 N--CA 1.497 1.921 0 O-C-N 121.33 -0.856 . . . . 0.0 110.158 179.524 . . . . . . . . 3 3 . 1 . 016 nuclear build core ' A' A ' 22' ' ' ALA . . . . . 0.592 ' N ' ' HG3' ' A' ' 21' ' ' LYS . . . -65.44 -44.49 87.13 Favored 'General case' 0 N--CA 1.498 1.963 0 O-C-N 121.143 -0.973 . . . . 0.0 108.96 178.401 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 23' ' ' ALA . . . . . 0.485 ' HB2' HD11 ' B' ' 158' ' ' LEU . . . -71.71 -40.44 69.48 Favored 'General case' 0 N--CA 1.493 1.7 0 N-CA-C 109.086 -0.709 . . . . 0.0 109.086 178.33 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 24' ' ' PHE . . . . . . . . . . . . . 65.2 t80 -59.37 -43.63 92.83 Favored 'General case' 0 N--CA 1.499 1.999 0 O-C-N 121.65 -0.656 . . . . 0.0 110.511 179.448 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 25' ' ' ASP . . . . . . . . . . . . . 16.3 m-20 -61.15 -45.51 94.34 Favored 'General case' 0 N--CA 1.499 2.004 0 O-C-N 121.4 -0.813 . . . . 0.0 110.67 179.997 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 26' ' ' ILE . . . . . . . . . . . . . 54.4 mt -73.56 -21.25 18.46 Favored 'Isoleucine or valine' 0 N--CA 1.501 2.081 0 O-C-N 121.419 -0.801 . . . . 0.0 110.96 179.971 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 27' ' ' PHE . . . . . 0.65 ' CE1' HG21 ' A' ' 44' ' ' VAL . 0.2 OUTLIER -70.29 -11.24 60.77 Favored 'General case' 0 N--CA 1.502 2.15 0 O-C-N 120.991 -1.068 . . . . 0.0 111.878 -179.691 . . . . . . . . 3 3 . 1 . 016 nuclear build core ' A' A ' 28' ' ' VAL . . . . . . . . . . . . . 6.8 m -127.63 -46.83 1.2 Allowed 'Isoleucine or valine' 0 N--CA 1.499 1.984 0 O-C-N 120.949 -1.094 . . . . 0.0 111.049 179.859 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 29' ' ' LEU . . . . . . . . . . . . . 12.7 mt 47.78 39.53 10.63 Favored 'General case' 0 N--CA 1.504 2.238 0 O-C-N 121.364 -0.835 . . . . 0.0 110.629 -179.7 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 30' ' ' GLY . . . . . . . . . . . . . . . 85.13 39.96 8.24 Favored Glycine 0 N--CA 1.494 2.535 0 N-CA-C 109.588 -1.405 . . . . 0.0 109.588 -179.322 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 31' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.501 2.107 0 O-C-N 121.535 -0.979 . . . . 0.0 110.456 -179.881 . . . . . . . . 0 0 . 1 . 016 nuclear build core ' A' A ' 35' ' ' CYS . . . . . . . . . . . . . 68.1 m . . . . . 0 N--CA 1.497 1.875 0 CA-C-O 121.048 0.451 . . . . 0.0 110.514 . . . . . . . . . 0 0 . 1 . 016 nuclear build core ' A' A ' 36' ' ' ILE . . . . . . . . . . . . . 55.7 mt -97.16 135.31 31.8 Favored 'Isoleucine or valine' 0 N--CA 1.498 1.931 0 O-C-N 121.374 -0.829 . . . . 0.0 109.869 179.502 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 37' ' ' SER . . . . . . . . . . . . . 7.5 p -115.12 -177.77 3.21 Favored 'General case' 0 N--CA 1.496 1.857 0 O-C-N 121.288 -0.883 . . . . 0.0 110.442 179.821 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 38' ' ' THR . . . . . . . . . . . . . 42.9 p -65.38 -37.45 87.03 Favored 'General case' 0 N--CA 1.502 2.125 0 O-C-N 121.498 -0.752 . . . . 0.0 110.463 179.754 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 39' ' ' LYS . . . . . . . . . . . . . 2.6 mtmp? -63.0 -36.95 85.28 Favored 'General case' 0 N--CA 1.501 2.082 0 O-C-N 121.521 -0.737 . . . . 0.0 110.055 179.598 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 40' ' ' GLU . . . . . 0.424 ' HA ' ' HD2' ' A' ' 43' ' ' LYS . 1.1 mp0 -76.45 -26.82 55.84 Favored 'General case' 0 N--CA 1.496 1.845 0 O-C-N 121.545 -0.722 . . . . 0.0 110.664 -179.902 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 41' ' ' LEU . . . . . 0.621 HD23 ' HB3' ' A' ' 57' ' ' LEU . 4.9 tp -69.56 -49.94 49.49 Favored 'General case' 0 N--CA 1.498 1.972 0 O-C-N 121.1 -1.0 . . . . 0.0 110.135 179.591 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 42' ' ' GLY . . . . . 0.555 ' HA2' ' HB2' ' A' ' 45' ' ' MET . . . -55.02 -32.53 56.63 Favored Glycine 0 N--CA 1.497 2.734 0 N-CA-C 110.798 -0.921 . . . . 0.0 110.798 -179.423 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 43' ' ' LYS . . . . . 0.424 ' HD2' ' HA ' ' A' ' 40' ' ' GLU . 5.4 mttt -54.27 -47.96 71.73 Favored 'General case' 0 N--CA 1.501 2.081 0 O-C-N 121.419 -1.047 . . . . 0.0 110.378 179.822 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 44' ' ' VAL . . . . . 0.65 HG21 ' CE1' ' A' ' 27' ' ' PHE . 61.9 t -82.26 -28.26 9.13 Favored 'Isoleucine or valine' 0 N--CA 1.5 2.04 0 O-C-N 121.287 -0.883 . . . . 0.0 110.064 179.367 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 45' ' ' MET . . . . . 0.555 ' HB2' ' HA2' ' A' ' 42' ' ' GLY . 0.5 OUTLIER -56.95 -31.05 64.59 Favored 'General case' 0 N--CA 1.502 2.156 0 O-C-N 121.308 -0.87 . . . . 0.0 110.991 179.612 . . . . . . . . 3 3 . 1 . 016 nuclear build core ' A' A ' 46' ' ' ARG . . . . . 0.592 ' HA ' ' HG3' ' A' ' 50' ' ' GLN . 7.0 mmm180 -53.5 -27.47 25.67 Favored 'General case' 0 N--CA 1.505 2.296 0 O-C-N 121.35 -0.844 . . . . 0.0 111.729 -179.586 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 47' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -81.6 -39.73 24.07 Favored 'General case' 0 N--CA 1.496 1.871 0 O-C-N 121.101 -0.999 . . . . 0.0 110.812 -179.825 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 48' ' ' LEU . . . . . . . . . . . . . 1.1 mt -153.31 104.8 2.81 Favored 'General case' 0 N--CA 1.491 1.613 0 O-C-N 121.264 -0.897 . . . . 0.0 110.17 -179.83 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 49' ' ' GLY . . . . . 0.501 ' O ' ' HB2' ' A' ' 50' ' ' GLN . . . 124.48 -67.13 0.52 Allowed Glycine 0 N--CA 1.498 2.833 0 N-CA-C 109.677 -1.369 . . . . 0.0 109.677 -179.996 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 50' ' ' GLN . . . . . 0.592 ' HG3' ' HA ' ' A' ' 46' ' ' ARG . 0.5 OUTLIER 66.53 131.56 0.02 OUTLIER 'General case' 0 N--CA 1.504 2.244 0 CA-C-O 121.582 0.706 . . . . 0.0 111.186 179.935 . . . . . . . . 3 3 . 1 . 016 nuclear build core ' A' A ' 51' ' ' ASN . . . . . 0.613 ' CB ' HD11 ' A' ' 57' ' ' LEU . 14.6 p-10 -97.82 114.82 65.52 Favored Pre-proline 0 N--CA 1.493 1.719 0 O-C-N 121.279 -0.888 . . . . 0.0 109.653 179.367 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 52' ' ' PRO . . . . . . . . . . . . . 43.0 Cg_endo -69.29 -39.16 7.78 Favored 'Trans proline' 0 C--N 1.313 -1.334 0 O-C-N 123.613 1.323 . . . . 0.0 111.084 -179.419 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 53' ' ' THR . . . . . 0.851 HG22 ' HD2' ' A' ' 54' ' ' PRO . 0.2 OUTLIER -126.37 152.88 74.61 Favored Pre-proline 0 N--CA 1.497 1.92 0 O-C-N 121.406 -0.808 . . . . 0.0 109.956 -179.962 . . . . . . . . 3 3 . 1 . 016 nuclear build core ' A' A ' 54' ' ' PRO . . . . . 0.851 ' HD2' HG22 ' A' ' 53' ' ' THR . 42.6 Cg_endo -70.82 -44.85 1.18 Allowed 'Trans proline' 0 C--N 1.314 -1.262 0 O-C-N 123.793 1.417 . . . . 0.0 110.392 179.761 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 55' ' ' GLU . . . . . . . . . . . . . 0.9 OUTLIER -68.98 -19.85 64.16 Favored 'General case' 0 N--CA 1.497 1.881 0 O-C-N 121.441 -0.787 . . . . 0.0 110.33 179.151 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 0.6 OUTLIER -56.99 -41.61 78.73 Favored 'General case' 0 N--CA 1.498 1.939 0 O-C-N 121.361 -0.837 . . . . 0.0 110.269 179.592 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 57' ' ' LEU . . . . . 0.621 ' HB3' HD23 ' A' ' 41' ' ' LEU . 19.7 mt -78.49 -23.54 46.33 Favored 'General case' 0 N--CA 1.495 1.816 0 O-C-N 121.444 -0.785 . . . . 0.0 110.183 179.51 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 58' ' ' GLN . . . . . 0.578 ' O ' HG22 ' A' ' 61' ' ' ILE . 0.0 OUTLIER -59.41 -31.82 69.61 Favored 'General case' 0 N--CA 1.497 1.914 0 O-C-N 121.193 -0.942 . . . . 0.0 109.165 179.13 . . . . . . . . 3 3 . 1 . 016 nuclear build core ' A' A ' 59' ' ' GLU . . . . . 0.544 ' N ' ' HG3' ' A' ' 58' ' ' GLN . 0.8 OUTLIER -72.62 -41.71 65.26 Favored 'General case' 0 N--CA 1.491 1.603 0 N-CA-C 108.508 -0.923 . . . . 0.0 108.508 177.85 . . . . . . . . 3 3 . 1 . 016 nuclear build core ' A' A ' 60' ' ' MET . . . . . . . . . . . . . 2.3 mtp -60.57 -38.56 84.98 Favored 'General case' 0 N--CA 1.495 1.806 0 O-C-N 121.77 -0.581 . . . . 0.0 109.853 178.513 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 61' ' ' ILE . . . . . 0.595 HG13 HG23 ' A' ' 72' ' ' VAL . 3.5 tt -73.17 -33.13 41.01 Favored 'Isoleucine or valine' 0 N--CA 1.497 1.921 0 O-C-N 121.397 -0.814 . . . . 0.0 110.492 179.659 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 62' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -74.9 -29.86 61.11 Favored 'General case' 0 N--CA 1.498 1.941 0 O-C-N 121.334 -0.854 . . . . 0.0 110.501 179.552 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 63' ' ' GLU . . . . . . . . . . . . . 26.7 mt-10 -61.14 -26.23 67.55 Favored 'General case' 0 N--CA 1.502 2.155 0 O-C-N 121.381 -0.824 . . . . 0.0 110.939 179.72 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 64' ' ' VAL . . . . . 0.514 HG11 ' HG3' ' A' ' 80' ' ' MET . 14.0 m -112.35 -12.55 11.61 Favored 'Isoleucine or valine' 0 N--CA 1.501 2.078 0 O-C-N 121.42 -0.8 . . . . 0.0 111.195 -179.665 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 65' ' ' ASP . . . . . 0.416 ' HA ' ' CD ' ' A' ' 76' ' ' GLU . 22.3 t70 -60.17 150.69 29.09 Favored 'General case' 0 N--CA 1.498 1.946 0 O-C-N 121.362 -0.836 . . . . 0.0 110.701 -179.8 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 66' ' ' GLU . . . . . . . . . . . . . 2.1 tt0 -140.07 18.12 2.45 Favored 'General case' 0 N--CA 1.494 1.772 0 O-C-N 121.45 -0.782 . . . . 0.0 111.522 -179.482 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 67' ' ' ASP . . . . . . . . . . . . . 5.9 p30 -140.17 1.22 1.8 Allowed 'General case' 0 N--CA 1.503 2.178 0 O-C-N 120.776 -1.202 . . . . 0.0 112.546 -179.787 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 68' ' ' GLY . . . . . . . . . . . . . . . 86.04 -16.04 45.12 Favored Glycine 0 N--CA 1.496 2.644 0 O-C-N 120.649 -1.282 . . . . 0.0 110.657 179.956 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 69' ' ' SER . . . . . . . . . . . . . 1.1 p -66.96 -27.29 67.33 Favored 'General case' 0 N--CA 1.498 1.934 0 O-C-N 121.013 -1.287 . . . . 0.0 110.224 179.693 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 70' ' ' GLY . . . . . . . . . . . . . . . 87.17 -57.73 4.56 Favored Glycine 0 N--CA 1.499 2.834 0 N-CA-C 110.289 -1.124 . . . . 0.0 110.289 179.441 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 71' ' ' THR . . . . . . . . . . . . . 1.0 OUTLIER -47.99 137.94 9.63 Favored 'General case' 0 N--CA 1.506 2.339 0 O-C-N 121.585 -0.95 . . . . 0.0 110.506 -179.7 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 72' ' ' VAL . . . . . 0.595 HG23 HG13 ' A' ' 61' ' ' ILE . 0.9 OUTLIER -75.91 125.55 35.7 Favored 'Isoleucine or valine' 0 N--CA 1.499 2.0 0 CA-C-O 121.7 0.762 . . . . 0.0 111.631 -178.787 . . . . . . . . 3 3 . 1 . 016 nuclear build core ' A' A ' 73' ' ' ASP . . . . . 0.401 ' H ' ' HB2' ' A' ' 76' ' ' GLU . 1.0 OUTLIER -97.1 -170.55 2.05 Favored 'General case' 0 N--CA 1.495 1.797 0 N-CA-C 109.172 -0.677 . . . . 0.0 109.172 178.724 . . . . . . . . 3 3 . 1 . 016 nuclear build core ' A' A ' 74' ' ' PHE . . . . . . . . . . . . . 28.3 t80 -67.0 -47.72 70.64 Favored 'General case' 0 N--CA 1.499 2.024 0 O-C-N 120.826 -1.171 . . . . 0.0 110.263 179.64 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 75' ' ' ASP . . . . . . . . . . . . . 10.6 t70 -63.64 -44.5 93.68 Favored 'General case' 0 N--CA 1.498 1.967 0 O-C-N 121.412 -0.805 . . . . 0.0 110.146 179.406 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 76' ' ' GLU . . . . . 0.591 ' O ' HG12 ' A' ' 79' ' ' VAL . 95.5 mt-10 -65.77 -35.12 79.82 Favored 'General case' 0 N--CA 1.498 1.929 0 O-C-N 121.464 -0.772 . . . . 0.0 110.277 179.843 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 77' ' ' PHE . . . . . . . . . . . . . 71.2 t80 -67.19 -38.55 85.57 Favored 'General case' 0 N--CA 1.494 1.755 0 O-C-N 121.112 -0.993 . . . . 0.0 109.496 178.978 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 78' ' ' LEU . . . . . 0.434 ' HB3' HG13 ' A' ' 9' ' ' VAL . 41.3 mt -66.29 -43.82 85.27 Favored 'General case' 0 N--CA 1.498 1.955 0 O-C-N 121.542 -0.724 . . . . 0.0 110.38 179.46 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 79' ' ' VAL . . . . . 0.591 HG12 ' O ' ' A' ' 76' ' ' GLU . 7.6 p -69.34 -15.64 19.78 Favored 'Isoleucine or valine' 0 N--CA 1.502 2.165 0 O-C-N 121.185 -0.947 . . . . 0.0 110.314 179.119 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 80' ' ' MET . . . . . 0.514 ' HG3' HG11 ' A' ' 64' ' ' VAL . 15.8 ttp -76.73 -37.43 56.01 Favored 'General case' 0 N--CA 1.493 1.71 0 O-C-N 121.116 -0.99 . . . . 0.0 109.383 178.849 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 81' ' ' MET . . . . . . . . . . . . . 3.8 mmm -69.23 -45.44 69.77 Favored 'General case' 0 N--CA 1.499 2.008 0 O-C-N 121.473 -0.767 . . . . 0.0 110.343 179.696 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 82' ' ' VAL . . . . . 0.455 ' HA ' ' HB2' ' A' ' 85' ' ' MET . 35.6 m -59.51 -28.72 40.66 Favored 'Isoleucine or valine' 0 N--CA 1.505 2.316 0 O-C-N 121.388 -0.82 . . . . 0.0 110.844 -179.985 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 83' ' ' ARG . . . . . 0.493 ' HD2' HG12 ' A' ' 64' ' ' VAL . 4.0 mtp-105 -57.86 -37.07 73.24 Favored 'General case' 0 N--CA 1.502 2.132 0 O-C-N 121.131 -0.981 . . . . 0.0 109.61 178.817 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 84' ' ' CYS . . . . . . . . . . . . . 9.9 t -83.25 -28.54 29.11 Favored 'General case' 0 N--CA 1.495 1.783 0 O-C-N 121.625 -0.672 . . . . 0.0 109.833 178.868 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 85' ' ' MET . . . . . 0.455 ' HB2' ' HA ' ' A' ' 82' ' ' VAL . 66.9 mtm . . . . . 0 N--CA 1.497 1.887 0 O-C-N 121.431 -0.793 . . . . 0.0 110.876 179.887 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' B' B ' 149' ' ' SER . . . . . . . . . . . . . 20.1 t . . . . . 0 N--CA 1.505 2.324 0 CA-C-O 121.477 0.656 . . . . 0.0 110.934 . . . . . . . . . 0 0 . 1 . 016 nuclear build core ' B' B ' 150' ' ' ALA . . . . . . . . . . . . . . . -57.57 -42.71 83.65 Favored 'General case' 0 N--CA 1.5 2.045 0 O-C-N 121.5 -0.75 . . . . 0.0 110.93 179.952 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' B' B ' 151' ' ' ASP . . . . . . . . . . . . . 5.4 m-20 -62.73 -49.81 73.58 Favored 'General case' 0 N--CA 1.5 2.041 0 O-C-N 121.4 -0.812 . . . . 0.0 110.644 -179.973 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' B' B ' 152' ' ' ALA . . . . . . . . . . . . . . . -63.35 -44.93 93.44 Favored 'General case' 0 N--CA 1.497 1.918 0 O-C-N 121.379 -0.826 . . . . 0.0 110.149 179.631 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' B' B ' 153' ' ' MET . . . . . . . . . . . . . 0.2 OUTLIER -63.62 -44.66 93.29 Favored 'General case' 0 N--CA 1.497 1.877 0 O-C-N 121.512 -0.743 . . . . 0.0 109.991 179.361 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' B' B ' 154' ' ' MET . . . . . 0.585 ' HG2' HD12 ' B' ' 158' ' ' LEU . 3.8 ttm -60.25 -44.26 95.42 Favored 'General case' 0 N--CA 1.497 1.916 0 O-C-N 121.419 -0.801 . . . . 0.0 110.014 179.308 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' B' B ' 155' ' ' GLN . . . . . . . . . . . . . 1.0 OUTLIER -62.5 -33.14 74.29 Favored 'General case' 0 N--CA 1.498 1.975 0 O-C-N 121.511 -0.743 . . . . 0.0 110.221 179.299 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' B' B ' 156' ' ' ALA . . . . . . . . . . . . . . . -71.78 -26.68 62.52 Favored 'General case' 0 N--CA 1.497 1.889 0 O-C-N 121.523 -0.736 . . . . 0.0 110.723 179.511 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' B' B ' 157' ' ' LEU . . . . . 0.419 HD11 HG11 ' A' ' 44' ' ' VAL . 13.9 mt -92.87 -41.97 9.77 Favored 'General case' 0 N--CA 1.495 1.82 0 O-C-N 121.273 -0.892 . . . . 0.0 111.326 -179.338 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' B' B ' 158' ' ' LEU . . . . . 0.585 HD12 ' HG2' ' B' ' 154' ' ' MET . 66.0 mt . . . . . 0 N--CA 1.5 2.06 0 O-C-N 121.198 -0.939 . . . . 0.0 111.597 -179.393 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 4' ' ' ILE . . . . . . . . . . . . . 15.4 mt . . . . . 0 N--CA 1.501 2.095 0 CA-C-O 120.965 0.412 . . . . 0.0 110.51 . . . . . . . . . 0 0 . 1 . 017 nuclear build core ' A' A ' 5' ' ' TYR . . . . . 0.568 ' CE1' ' HG2' ' A' ' 83' ' ' ARG . 6.3 m-85 -70.86 -34.76 71.97 Favored 'General case' 0 N--CA 1.498 1.932 0 O-C-N 121.351 -0.843 . . . . 0.0 110.686 -179.987 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -68.57 -30.41 69.18 Favored 'General case' 0 N--CA 1.498 1.969 0 O-C-N 121.251 -0.906 . . . . 0.0 110.53 179.614 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 7' ' ' ALA . . . . . . . . . . . . . . . -55.12 -36.27 65.55 Favored 'General case' 0 N--CA 1.5 2.033 0 O-C-N 121.236 -0.915 . . . . 0.0 109.784 179.146 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 8' ' ' ALA . . . . . 0.63 ' HB1' ' HB ' ' A' ' 82' ' ' VAL . . . -65.24 -35.3 80.62 Favored 'General case' 0 N--CA 1.496 1.842 0 O-C-N 121.586 -0.697 . . . . 0.0 109.778 178.768 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 9' ' ' VAL . . . . . 0.458 ' HA ' HG11 ' A' ' 82' ' ' VAL . 43.7 t -62.62 -32.96 57.23 Favored 'Isoleucine or valine' 0 N--CA 1.502 2.128 0 O-C-N 121.456 -0.777 . . . . 0.0 109.523 178.827 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 10' ' ' GLU . . . . . . . . . . . . . 9.3 mt-10 -88.57 -5.84 57.93 Favored 'General case' 0 N--CA 1.498 1.943 0 O-C-N 121.408 -0.808 . . . . 0.0 110.732 179.273 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 11' ' ' GLN . . . . . . . . . . . . . 1.4 mt-30 -87.97 -29.6 20.66 Favored 'General case' 0 N--CA 1.496 1.865 0 O-C-N 121.105 -0.997 . . . . 0.0 111.063 -179.809 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 12' ' ' LEU . . . . . 0.408 ' HB2' ' CB ' ' A' ' 16' ' ' GLN . 3.7 pp -66.98 153.11 44.43 Favored 'General case' 0 N--CA 1.5 2.065 0 O-C-N 121.104 -0.997 . . . . 0.0 110.739 -179.71 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 13' ' ' THR . . . . . . . . . . . . . 22.2 p -99.48 -177.55 3.62 Favored 'General case' 0 N--CA 1.501 2.105 0 O-C-N 121.416 -0.803 . . . . 0.0 111.368 -179.147 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 14' ' ' GLU . . . . . 0.44 ' O ' ' HB2' ' A' ' 18' ' ' ASN . 12.8 tp10 -53.86 -39.32 65.56 Favored 'General case' 0 N--CA 1.492 1.669 0 O-C-N 121.912 -0.492 . . . . 0.0 110.697 -179.683 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 1.5 mp0 -54.53 -36.95 64.82 Favored 'General case' 0 N--CA 1.5 2.055 0 O-C-N 121.463 -0.773 . . . . 0.0 110.783 179.766 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 16' ' ' GLN . . . . . 0.408 ' CB ' ' HB2' ' A' ' 12' ' ' LEU . 0.8 OUTLIER -72.18 -63.84 1.06 Allowed 'General case' 0 N--CA 1.497 1.897 0 O-C-N 121.292 -0.88 . . . . 0.0 111.146 -179.716 . . . . . . . . 3 3 . 1 . 017 nuclear build core ' A' A ' 17' ' ' LYS . . . . . 0.427 ' HG3' ' O ' ' A' ' 14' ' ' GLU . 5.3 ptmt -54.81 -32.54 60.47 Favored 'General case' 0 N--CA 1.503 2.194 0 O-C-N 121.839 -0.538 . . . . 0.0 111.347 -179.456 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 18' ' ' ASN . . . . . 0.44 ' HB2' ' O ' ' A' ' 14' ' ' GLU . 7.6 t-20 -70.02 -49.45 51.19 Favored 'General case' 0 N--CA 1.494 1.775 0 O-C-N 121.269 -0.894 . . . . 0.0 110.308 179.999 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 0.3 OUTLIER -62.91 -43.48 98.69 Favored 'General case' 0 N--CA 1.497 1.922 0 O-C-N 121.3 -0.875 . . . . 0.0 109.545 179.187 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 20' ' ' PHE . . . . . . . . . . . . . 12.7 m-85 -59.41 -33.79 71.66 Favored 'General case' 0 N--CA 1.497 1.918 0 O-C-N 121.447 -0.783 . . . . 0.0 109.769 178.941 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 21' ' ' LYS . . . . . 0.505 ' HG3' ' N ' ' A' ' 22' ' ' ALA . 0.0 OUTLIER -65.65 -41.78 92.16 Favored 'General case' 0 N--CA 1.496 1.832 0 O-C-N 121.538 -0.726 . . . . 0.0 109.233 178.629 . . . . . . . . 3 3 . 1 . 017 nuclear build core ' A' A ' 22' ' ' ALA . . . . . 0.658 ' O ' HD12 ' A' ' 26' ' ' ILE . . . -69.69 -45.45 68.27 Favored 'General case' 0 N--CA 1.496 1.828 0 O-C-N 121.286 -0.884 . . . . 0.0 109.589 179.181 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 23' ' ' ALA . . . . . . . . . . . . . . . -63.35 -49.73 72.74 Favored 'General case' 0 N--CA 1.497 1.897 0 O-C-N 121.648 -0.658 . . . . 0.0 110.455 179.412 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 24' ' ' PHE . . . . . 0.425 ' CD2' HD12 ' A' ' 36' ' ' ILE . 27.4 t80 -55.92 -43.55 77.45 Favored 'General case' 0 N--CA 1.5 2.069 0 O-C-N 121.507 -0.746 . . . . 0.0 110.47 179.724 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 25' ' ' ASP . . . . . . . . . . . . . 20.2 t70 -62.79 -52.14 64.36 Favored 'General case' 0 N--CA 1.496 1.841 0 O-C-N 121.625 -0.672 . . . . 0.0 110.387 179.815 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 26' ' ' ILE . . . . . 0.658 HD12 ' O ' ' A' ' 22' ' ' ALA . 1.9 mt -64.55 -28.29 44.52 Favored 'Isoleucine or valine' 0 N--CA 1.498 1.963 0 O-C-N 121.334 -0.854 . . . . 0.0 110.495 179.584 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 27' ' ' PHE . . . . . 0.482 ' CZ ' HG21 ' A' ' 44' ' ' VAL . 0.1 OUTLIER -63.9 -42.86 97.32 Favored 'General case' 0 N--CA 1.498 1.947 0 O-C-N 121.194 -0.942 . . . . 0.0 110.511 179.68 . . . . . . . . 3 3 . 1 . 017 nuclear build core ' A' A ' 28' ' ' VAL . . . . . . . . . . . . . 19.5 m -91.38 -35.7 7.32 Favored 'Isoleucine or valine' 0 N--CA 1.499 2.004 0 O-C-N 121.317 -0.864 . . . . 0.0 110.772 -179.975 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 29' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER 57.24 -87.64 0.02 OUTLIER 'General case' 0 N--CA 1.501 2.082 0 O-C-N 121.672 -0.643 . . . . 0.0 110.631 -179.63 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 30' ' ' GLY . . . . . . . . . . . . . . . -89.73 -16.99 55.68 Favored Glycine 0 N--CA 1.496 2.656 0 N-CA-C 110.14 -1.184 . . . . 0.0 110.14 179.421 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 31' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.499 1.984 0 O-C-N 121.095 -1.238 . . . . 0.0 110.322 179.747 . . . . . . . . 0 0 . 1 . 017 nuclear build core ' A' A ' 35' ' ' CYS . . . . . . . . . . . . . 12.7 m . . . . . 0 N--CA 1.502 2.139 0 CA-C-O 121.213 0.53 . . . . 0.0 111.08 . . . . . . . . . 0 0 . 1 . 017 nuclear build core ' A' A ' 36' ' ' ILE . . . . . 0.425 HD12 ' CD2' ' A' ' 24' ' ' PHE . 65.2 mt -79.36 123.26 36.05 Favored 'Isoleucine or valine' 0 N--CA 1.499 2.009 0 O-C-N 121.191 -0.943 . . . . 0.0 111.059 -179.175 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 37' ' ' SER . . . . . 0.42 ' HB2' HG23 ' A' ' 71' ' ' THR . 18.3 t -125.08 -178.84 4.32 Favored 'General case' 0 N--CA 1.494 1.762 0 O-C-N 121.632 -0.667 . . . . 0.0 109.613 178.948 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 38' ' ' THR . . . . . . . . . . . . . 3.2 p -61.55 -36.34 80.34 Favored 'General case' 0 N--CA 1.501 2.117 0 O-C-N 121.324 -0.86 . . . . 0.0 110.597 179.709 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 39' ' ' LYS . . . . . . . . . . . . . 4.1 tptt -68.3 -34.28 75.86 Favored 'General case' 0 N--CA 1.498 1.951 0 O-C-N 121.529 -0.732 . . . . 0.0 110.804 179.843 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 40' ' ' GLU . . . . . 0.575 ' HA ' ' HD2' ' A' ' 43' ' ' LYS . 25.7 mm-40 -83.58 -24.14 31.65 Favored 'General case' 0 N--CA 1.499 1.978 0 O-C-N 121.299 -0.876 . . . . 0.0 111.083 -179.643 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 41' ' ' LEU . . . . . 0.754 HD12 HD22 ' A' ' 57' ' ' LEU . 3.4 tm? -70.22 -64.66 0.85 Allowed 'General case' 0 N--CA 1.499 1.99 0 O-C-N 121.135 -0.978 . . . . 0.0 109.711 179.519 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 42' ' ' GLY . . . . . . . . . . . . . . . -47.59 -31.85 7.44 Favored Glycine 0 N--CA 1.501 3.025 0 N-CA-C 110.621 -0.992 . . . . 0.0 110.621 179.836 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 43' ' ' LYS . . . . . 0.575 ' HD2' ' HA ' ' A' ' 40' ' ' GLU . 11.1 mttp -49.22 -49.29 43.73 Favored 'General case' 0 N--CA 1.503 2.187 0 O-C-N 121.572 -0.958 . . . . 0.0 110.91 179.602 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 44' ' ' VAL . . . . . 0.606 HG22 ' O ' ' A' ' 41' ' ' LEU . 33.6 m -81.76 -22.02 10.16 Favored 'Isoleucine or valine' 0 N--CA 1.503 2.204 0 O-C-N 121.322 -0.862 . . . . 0.0 111.204 -179.878 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 45' ' ' MET . . . . . 0.424 ' CE ' HD11 ' A' ' 41' ' ' LEU . 19.6 mmt -59.27 -38.74 80.87 Favored 'General case' 0 N--CA 1.502 2.13 0 O-C-N 121.121 -0.987 . . . . 0.0 110.258 179.672 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 46' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -57.7 -41.91 82.65 Favored 'General case' 0 N--CA 1.498 1.939 0 O-C-N 121.572 -0.705 . . . . 0.0 110.454 179.704 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 47' ' ' MET . . . . . . . . . . . . . 29.9 ttp -68.23 -36.05 78.88 Favored 'General case' 0 N--CA 1.498 1.937 0 O-C-N 121.494 -0.754 . . . . 0.0 110.562 179.693 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 48' ' ' LEU . . . . . . . . . . . . . 6.2 tp -75.02 -44.74 46.29 Favored 'General case' 0 N--CA 1.492 1.669 0 O-C-N 121.357 -0.839 . . . . 0.0 110.298 179.951 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 49' ' ' GLY . . . . . . . . . . . . . . . -155.28 -76.77 0.02 OUTLIER Glycine 0 N--CA 1.495 2.613 0 N-CA-C 110.024 -1.23 . . . . 0.0 110.024 179.918 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 50' ' ' GLN . . . . . . . . . . . . . 36.9 mt-30 -137.54 171.63 14.17 Favored 'General case' 0 N--CA 1.499 1.975 0 O-C-N 121.409 -1.053 . . . . 0.0 110.584 -179.833 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 51' ' ' ASN . . . . . . . . . . . . . 1.3 t30 -106.66 105.74 55.76 Favored Pre-proline 0 N--CA 1.499 1.993 0 O-C-N 121.225 -0.922 . . . . 0.0 111.266 -179.556 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 52' ' ' PRO . . . . . 0.598 ' HG2' HD11 ' A' ' 57' ' ' LEU . 46.8 Cg_endo -77.34 166.23 26.44 Favored 'Trans proline' 0 C--N 1.315 -1.225 0 O-C-N 123.668 1.352 . . . . 0.0 110.242 178.799 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 53' ' ' THR . . . . . . . . . . . . . 65.4 p -79.16 159.23 73.38 Favored Pre-proline 0 N--CA 1.5 2.044 0 O-C-N 121.198 -0.939 . . . . 0.0 110.833 -179.527 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 54' ' ' PRO . . . . . . . . . . . . . 41.6 Cg_endo -67.18 -38.7 15.0 Favored 'Trans proline' 0 N--CA 1.49 1.287 0 O-C-N 123.818 1.43 . . . . 0.0 110.817 179.793 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 55' ' ' GLU . . . . . 0.414 ' O ' ' HB2' ' A' ' 58' ' ' GLN . 0.1 OUTLIER -58.88 -39.61 81.91 Favored 'General case' 0 N--CA 1.498 1.933 0 O-C-N 121.394 -0.816 . . . . 0.0 110.107 179.505 . . . . . . . . 3 3 . 1 . 017 nuclear build core ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 5.8 mt-10 -66.58 -37.94 86.0 Favored 'General case' 0 N--CA 1.497 1.876 0 O-C-N 121.38 -0.825 . . . . 0.0 110.302 179.307 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 57' ' ' LEU . . . . . 0.754 HD22 HD12 ' A' ' 41' ' ' LEU . 9.0 mt -81.51 -9.79 59.62 Favored 'General case' 0 N--CA 1.499 1.993 0 O-C-N 121.332 -0.855 . . . . 0.0 111.25 179.958 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 58' ' ' GLN . . . . . 0.414 ' HB2' ' O ' ' A' ' 55' ' ' GLU . 9.7 mm100 -57.36 -52.1 66.7 Favored 'General case' 0 N--CA 1.5 2.062 0 O-C-N 120.997 -1.064 . . . . 0.0 110.113 -179.892 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 59' ' ' GLU . . . . . . . . . . . . . 10.9 tp10 -53.07 -40.11 63.79 Favored 'General case' 0 N--CA 1.498 1.936 0 O-C-N 121.623 -0.673 . . . . 0.0 110.362 179.461 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 60' ' ' MET . . . . . 0.495 ' HE2' HD23 ' A' ' 57' ' ' LEU . 0.4 OUTLIER -53.37 -34.44 57.64 Favored 'General case' 0 N--CA 1.501 2.082 0 O-C-N 121.415 -0.803 . . . . 0.0 110.376 179.389 . . . . . . . . 3 3 . 1 . 017 nuclear build core ' A' A ' 61' ' ' ILE . . . . . 0.574 HG12 HG23 ' A' ' 72' ' ' VAL . 15.1 mt -91.97 -44.27 14.19 Favored 'Isoleucine or valine' 0 N--CA 1.497 1.921 0 O-C-N 121.407 -0.808 . . . . 0.0 110.124 179.196 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 62' ' ' ASP . . . . . . . . . . . . . 71.8 m-20 -57.12 -33.17 67.07 Favored 'General case' 0 N--CA 1.5 2.026 0 O-C-N 121.465 -0.772 . . . . 0.0 111.04 -179.607 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 63' ' ' GLU . . . . . . . . . . . . . 1.9 tt0 -66.91 -26.85 67.06 Favored 'General case' 0 N--CA 1.5 2.044 0 O-C-N 121.186 -0.946 . . . . 0.0 111.035 179.809 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 64' ' ' VAL . . . . . 0.537 HG21 ' SD ' ' A' ' 80' ' ' MET . 24.5 m -117.14 9.96 7.22 Favored 'Isoleucine or valine' 0 N--CA 1.503 2.178 0 O-C-N 121.148 -0.97 . . . . 0.0 111.481 -179.882 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 65' ' ' ASP . . . . . . . . . . . . . 19.0 t70 -80.3 138.23 36.72 Favored 'General case' 0 N--CA 1.498 1.935 0 O-C-N 120.897 -1.127 . . . . 0.0 110.154 179.897 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 66' ' ' GLU . . . . . . . . . . . . . 21.2 mt-10 -128.77 24.07 5.74 Favored 'General case' 0 N--CA 1.497 1.914 0 O-C-N 121.376 -0.827 . . . . 0.0 111.642 -179.132 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 67' ' ' ASP . . . . . . . . . . . . . 42.6 p-10 -141.22 -0.3 1.45 Allowed 'General case' 0 N--CA 1.501 2.109 0 O-C-N 120.767 -1.208 . . . . 0.0 112.865 -179.91 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 68' ' ' GLY . . . . . . . . . . . . . . . 86.97 -21.27 20.68 Favored Glycine 0 N--CA 1.496 2.698 0 O-C-N 120.705 -1.247 . . . . 0.0 110.687 179.653 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 69' ' ' SER . . . . . . . . . . . . . 1.7 p -59.52 -27.99 66.68 Favored 'General case' 0 N--CA 1.499 1.987 0 O-C-N 121.253 -1.145 . . . . 0.0 110.482 179.83 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 70' ' ' GLY . . . . . . . . . . . . . . . 71.44 30.21 67.12 Favored Glycine 0 N--CA 1.498 2.817 0 N-CA-C 110.195 -1.162 . . . . 0.0 110.195 -179.981 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 71' ' ' THR . . . . . 0.42 HG23 ' HB2' ' A' ' 37' ' ' SER . 5.3 m -134.54 142.93 47.14 Favored 'General case' 0 N--CA 1.499 1.999 0 O-C-N 121.407 -1.055 . . . . 0.0 108.929 179.489 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 72' ' ' VAL . . . . . 0.574 HG23 HG12 ' A' ' 61' ' ' ILE . 17.0 t -75.92 113.49 14.91 Favored 'Isoleucine or valine' 0 N--CA 1.498 1.944 0 O-C-N 121.192 -0.943 . . . . 0.0 111.198 -179.002 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 73' ' ' ASP . . . . . . . . . . . . . 17.0 m-20 -88.48 -178.69 5.91 Favored 'General case' 0 N--CA 1.494 1.772 0 N-CA-C 108.7 -0.852 . . . . 0.0 108.7 178.409 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 74' ' ' PHE . . . . . . . . . . . . . 49.1 t80 -63.91 -42.18 97.47 Favored 'General case' 0 N--CA 1.499 2.015 0 O-C-N 120.905 -1.122 . . . . 0.0 109.828 179.266 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 75' ' ' ASP . . . . . . . . . . . . . 1.0 OUTLIER -66.54 -47.13 73.83 Favored 'General case' 0 N--CA 1.496 1.862 0 O-C-N 121.511 -0.743 . . . . 0.0 110.228 179.435 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 76' ' ' GLU . . . . . . . . . . . . . 72.4 mt-10 -63.95 -38.01 89.53 Favored 'General case' 0 N--CA 1.499 1.986 0 O-C-N 121.453 -0.779 . . . . 0.0 109.755 179.238 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 77' ' ' PHE . . . . . . . . . . . . . 75.7 t80 -57.11 -40.6 77.39 Favored 'General case' 0 N--CA 1.495 1.785 0 O-C-N 121.673 -0.642 . . . . 0.0 109.628 179.118 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 78' ' ' LEU . . . . . . . . . . . . . 43.2 mt -63.15 -43.68 97.64 Favored 'General case' 0 N--CA 1.498 1.945 0 O-C-N 121.396 -0.815 . . . . 0.0 109.476 178.802 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 79' ' ' VAL . . . . . . . . . . . . . 73.2 t -61.27 -39.53 82.93 Favored 'Isoleucine or valine' 0 N--CA 1.501 2.101 0 O-C-N 121.616 -0.677 . . . . 0.0 109.473 178.948 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 80' ' ' MET . . . . . 0.537 ' SD ' HG21 ' A' ' 64' ' ' VAL . 11.8 ttp -67.16 -35.19 79.16 Favored 'General case' 0 N--CA 1.496 1.866 0 O-C-N 121.486 -0.759 . . . . 0.0 110.096 179.168 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 81' ' ' MET . . . . . . . . . . . . . 11.3 mmt -70.49 -51.78 26.64 Favored 'General case' 0 N--CA 1.497 1.892 0 O-C-N 121.486 -0.758 . . . . 0.0 110.767 -179.915 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 82' ' ' VAL . . . . . 0.63 ' HB ' ' HB1' ' A' ' 8' ' ' ALA . 34.2 m -62.61 -24.53 35.65 Favored 'Isoleucine or valine' 0 N--CA 1.501 2.1 0 O-C-N 121.141 -0.975 . . . . 0.0 110.655 -179.982 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 83' ' ' ARG . . . . . 0.568 ' HG2' ' CE1' ' A' ' 5' ' ' TYR . 11.3 mtt180 -62.45 -31.48 72.2 Favored 'General case' 0 N--CA 1.499 1.99 0 O-C-N 121.232 -0.917 . . . . 0.0 110.206 179.145 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 84' ' ' CYS . . . . . . . . . . . . . 3.3 t -86.58 -30.88 21.52 Favored 'General case' 0 N--CA 1.494 1.765 0 O-C-N 121.479 -0.763 . . . . 0.0 109.474 178.651 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 85' ' ' MET . . . . . . . . . . . . . 30.9 mtm . . . . . 0 N--CA 1.499 2.001 0 O-C-N 121.486 -0.759 . . . . 0.0 111.247 -179.96 . . . . . . . . 0 0 . 1 . 017 nuclear build core ' B' B ' 149' ' ' SER . . . . . . . . . . . . . 45.5 t . . . . . 0 N--CA 1.493 1.692 0 CA-C-O 121.191 0.519 . . . . 0.0 110.227 . . . . . . . . . 0 0 . 1 . 017 nuclear build core ' B' B ' 150' ' ' ALA . . . . . . . . . . . . . . . -55.67 -38.37 69.52 Favored 'General case' 0 N--CA 1.497 1.906 0 O-C-N 121.678 -0.638 . . . . 0.0 110.591 179.836 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' B' B ' 151' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -65.35 -46.28 80.83 Favored 'General case' 0 N--CA 1.497 1.908 0 O-C-N 121.329 -0.857 . . . . 0.0 110.445 179.695 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' B' B ' 152' ' ' ALA . . . . . . . . . . . . . . . -51.0 -48.32 61.42 Favored 'General case' 0 N--CA 1.501 2.081 0 O-C-N 121.486 -0.759 . . . . 0.0 110.644 179.943 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' B' B ' 153' ' ' MET . . . . . . . . . . . . . 11.6 mmt -63.17 -42.9 99.49 Favored 'General case' 0 N--CA 1.498 1.973 0 O-C-N 121.357 -0.839 . . . . 0.0 110.099 179.468 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' B' B ' 154' ' ' MET . . . . . . . . . . . . . 13.2 mtt -64.55 -37.04 86.17 Favored 'General case' 0 N--CA 1.498 1.959 0 O-C-N 121.493 -0.755 . . . . 0.0 110.499 179.586 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' B' B ' 155' ' ' GLN . . . . . . . . . . . . . 0.3 OUTLIER -58.02 -33.98 69.55 Favored 'General case' 0 N--CA 1.502 2.166 0 O-C-N 121.419 -0.801 . . . . 0.0 111.533 -179.67 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' B' B ' 156' ' ' ALA . . . . . . . . . . . . . . . -100.8 -44.23 5.85 Favored 'General case' 0 N--CA 1.501 2.094 0 O-C-N 121.159 -0.963 . . . . 0.0 111.162 -179.598 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' B' B ' 157' ' ' LEU . . . . . . . . . . . . . 10.0 mt -75.78 -37.88 58.79 Favored 'General case' 0 N--CA 1.501 2.101 0 O-C-N 121.27 -0.894 . . . . 0.0 111.018 -179.493 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' B' B ' 158' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER . . . . . 0 N--CA 1.498 1.929 0 O-C-N 121.257 -0.902 . . . . 0.0 110.375 179.877 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 4' ' ' ILE . . . . . . . . . . . . . 2.7 mp . . . . . 0 N--CA 1.496 1.86 0 N-CA-C 110.02 -0.363 . . . . 0.0 110.02 . . . . . . . . . 0 0 . 1 . 018 nuclear build core ' A' A ' 5' ' ' TYR . . . . . . . . . . . . . 5.8 m-85 -57.63 -30.01 65.03 Favored 'General case' 0 N--CA 1.5 2.048 0 O-C-N 121.306 -0.872 . . . . 0.0 110.082 179.384 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 6' ' ' LYS . . . . . 0.547 ' O ' HG12 ' A' ' 9' ' ' VAL . 14.8 mttt -61.15 -43.53 98.74 Favored 'General case' 0 N--CA 1.499 1.997 0 O-C-N 121.385 -0.822 . . . . 0.0 109.716 178.986 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 7' ' ' ALA . . . . . . . . . . . . . . . -55.32 -32.67 62.66 Favored 'General case' 0 N--CA 1.499 2.007 0 O-C-N 121.342 -0.849 . . . . 0.0 110.238 179.099 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 8' ' ' ALA . . . . . . . . . . . . . . . -71.32 -37.52 71.75 Favored 'General case' 0 N--CA 1.499 1.985 0 O-C-N 121.433 -0.792 . . . . 0.0 110.424 179.39 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 9' ' ' VAL . . . . . 0.576 ' HA ' HD11 ' A' ' 12' ' ' LEU . 0.3 OUTLIER -77.4 -23.1 14.37 Favored 'Isoleucine or valine' 0 N--CA 1.499 2.008 0 O-C-N 121.503 -0.748 . . . . 0.0 111.169 -179.66 . . . . . . . . 3 3 . 1 . 018 nuclear build core ' A' A ' 10' ' ' GLU . . . . . . . . . . . . . 28.1 mt-10 -92.89 -26.26 17.7 Favored 'General case' 0 N--CA 1.495 1.811 0 O-C-N 121.238 -0.914 . . . . 0.0 111.918 -179.233 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 11' ' ' GLN . . . . . . . . . . . . . 2.8 mt-30 -119.35 64.06 0.79 Allowed 'General case' 0 N--CA 1.499 2.009 0 O-C-N 120.825 -1.172 . . . . 0.0 112.239 -178.825 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 12' ' ' LEU . . . . . 0.576 HD11 ' HA ' ' A' ' 9' ' ' VAL . 0.5 OUTLIER -90.36 164.15 14.44 Favored 'General case' 0 N--CA 1.501 2.11 0 O-C-N 120.933 -1.105 . . . . 0.0 109.796 178.422 . . . . . . . . 3 3 . 1 . 018 nuclear build core ' A' A ' 13' ' ' THR . . . . . . . . . . . . . 39.4 p -79.47 162.46 25.43 Favored 'General case' 0 N--CA 1.499 1.999 0 O-C-N 121.005 -1.06 . . . . 0.0 109.379 178.658 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 14' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER -55.92 -33.21 64.47 Favored 'General case' 0 N--CA 1.493 1.693 0 O-C-N 121.389 -0.819 . . . . 0.0 110.709 -179.349 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 1.8 mp0 -73.71 -55.81 5.79 Favored 'General case' 0 N--CA 1.498 1.961 0 O-C-N 121.29 -0.881 . . . . 0.0 109.935 179.349 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 16' ' ' GLN . . . . . . . . . . . . . 2.1 mp0 -57.03 -53.59 56.33 Favored 'General case' 0 N--CA 1.503 2.177 0 O-C-N 121.425 -0.797 . . . . 0.0 110.891 -179.827 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 17' ' ' LYS . . . . . 0.507 ' HD3' ' HB2' ' A' ' 12' ' ' LEU . 2.6 ttpm? -57.65 -42.73 84.07 Favored 'General case' 0 N--CA 1.499 2.021 0 CA-C-N 116.228 -0.442 . . . . 0.0 110.96 -179.95 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 18' ' ' ASN . . . . . . . . . . . . . 14.7 t30 -70.62 -42.51 70.81 Favored 'General case' 0 N--CA 1.497 1.921 0 O-C-N 121.288 -0.882 . . . . 0.0 110.66 -179.993 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -56.96 -47.55 80.45 Favored 'General case' 0 N--CA 1.499 2.018 0 O-C-N 121.369 -0.832 . . . . 0.0 110.608 -179.657 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 20' ' ' PHE . . . . . . . . . . . . . 23.3 m-85 -64.7 -37.82 88.88 Favored 'General case' 0 N--CA 1.501 2.095 0 O-C-N 121.051 -1.03 . . . . 0.0 109.863 179.363 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 21' ' ' LYS . . . . . . . . . . . . . 17.3 tptp -62.7 -41.74 99.28 Favored 'General case' 0 N--CA 1.499 1.993 0 O-C-N 121.525 -0.734 . . . . 0.0 109.908 179.228 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 22' ' ' ALA . . . . . . . . . . . . . . . -77.73 -42.62 33.66 Favored 'General case' 0 N--CA 1.496 1.863 0 O-C-N 121.488 -0.757 . . . . 0.0 110.084 179.506 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 23' ' ' ALA . . . . . . . . . . . . . . . -62.71 -42.86 99.86 Favored 'General case' 0 N--CA 1.497 1.903 0 O-C-N 121.463 -0.773 . . . . 0.0 110.461 179.717 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 24' ' ' PHE . . . . . 0.453 ' CE1' HG13 ' A' ' 36' ' ' ILE . 79.7 t80 -62.96 -42.82 99.93 Favored 'General case' 0 N--CA 1.496 1.865 0 O-C-N 121.393 -0.817 . . . . 0.0 110.476 179.854 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 25' ' ' ASP . . . . . . . . . . . . . 0.7 OUTLIER -58.14 -45.38 87.48 Favored 'General case' 0 N--CA 1.499 2.02 0 O-C-N 121.44 -0.787 . . . . 0.0 110.253 179.784 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 26' ' ' ILE . . . . . . . . . . . . . 21.1 mt -68.19 -28.39 40.68 Favored 'Isoleucine or valine' 0 N--CA 1.497 1.912 0 O-C-N 121.42 -0.8 . . . . 0.0 109.611 178.956 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 27' ' ' PHE . . . . . 0.424 ' CE2' HD13 ' B' ' 157' ' ' LEU . 0.1 OUTLIER -73.11 -42.56 62.81 Favored 'General case' 0 N--CA 1.498 1.95 0 O-C-N 121.405 -0.809 . . . . 0.0 111.108 179.871 . . . . . . . . 3 3 . 1 . 018 nuclear build core ' A' A ' 28' ' ' VAL . . . . . 0.429 ' CG1' HG13 ' A' ' 36' ' ' ILE . 18.7 m -92.26 38.33 0.09 OUTLIER 'Isoleucine or valine' 0 N--CA 1.506 2.337 0 O-C-N 121.238 -0.914 . . . . 0.0 111.503 -179.471 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 29' ' ' LEU . . . . . . . . . . . . . 4.7 mt -69.3 -36.75 77.34 Favored 'General case' 0 N--CA 1.498 1.932 0 O-C-N 120.954 -1.091 . . . . 0.0 109.878 179.042 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 30' ' ' GLY . . . . . . . . . . . . . . . -102.67 38.32 3.26 Favored Glycine 0 N--CA 1.494 2.514 0 N-CA-C 109.372 -1.491 . . . . 0.0 109.372 179.018 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 31' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.496 1.853 0 O-C-N 121.575 -0.956 . . . . 0.0 110.371 -179.992 . . . . . . . . 0 0 . 1 . 018 nuclear build core ' A' A ' 35' ' ' CYS . . . . . . . . . . . . . 3.3 t . . . . . 0 N--CA 1.497 1.906 0 CA-C-O 121.042 0.449 . . . . 0.0 110.093 . . . . . . . . . 0 0 . 1 . 018 nuclear build core ' A' A ' 36' ' ' ILE . . . . . 0.453 HG13 ' CE1' ' A' ' 24' ' ' PHE . 14.8 mt -76.51 132.37 33.11 Favored 'Isoleucine or valine' 0 N--CA 1.5 2.048 0 O-C-N 121.235 -0.916 . . . . 0.0 110.367 -179.775 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 37' ' ' SER . . . . . . . . . . . . . 22.9 t -117.14 173.36 6.71 Favored 'General case' 0 N--CA 1.496 1.848 0 O-C-N 121.601 -0.687 . . . . 0.0 109.804 179.126 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 38' ' ' THR . . . . . 0.503 ' HB ' ' O ' ' A' ' 54' ' ' PRO . 23.3 p -61.04 -45.8 93.31 Favored 'General case' 0 N--CA 1.502 2.153 0 O-C-N 121.215 -0.928 . . . . 0.0 110.613 -180.0 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 39' ' ' LYS . . . . . . . . . . . . . 9.6 tmtt? -59.64 -35.18 73.89 Favored 'General case' 0 N--CA 1.499 1.976 0 O-C-N 121.596 -0.69 . . . . 0.0 110.557 179.728 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 40' ' ' GLU . . . . . 0.401 ' O ' ' HB3' ' A' ' 43' ' ' LYS . 9.3 mm-40 -69.58 -36.68 76.48 Favored 'General case' 0 N--CA 1.497 1.899 0 O-C-N 121.363 -0.836 . . . . 0.0 110.579 -179.968 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 41' ' ' LEU . . . . . 0.566 HD23 ' HB3' ' A' ' 57' ' ' LEU . 6.8 tp -67.59 -45.16 76.32 Favored 'General case' 0 N--CA 1.497 1.922 0 O-C-N 121.028 -1.045 . . . . 0.0 109.053 178.748 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 42' ' ' GLY . . . . . . . . . . . . . . . -57.73 -34.3 70.21 Favored Glycine 0 N--CA 1.491 2.316 0 N-CA-C 110.073 -1.211 . . . . 0.0 110.073 179.862 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 43' ' ' LYS . . . . . 0.401 ' HB3' ' O ' ' A' ' 40' ' ' GLU . 15.2 ttpt -54.0 -37.96 64.57 Favored 'General case' 0 N--CA 1.501 2.11 0 O-C-N 121.472 -1.017 . . . . 0.0 109.773 179.057 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 44' ' ' VAL . . . . . . . . . . . . . 98.0 t -84.55 -41.24 15.92 Favored 'Isoleucine or valine' 0 N--CA 1.499 2.017 0 O-C-N 121.395 -0.816 . . . . 0.0 109.699 179.097 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 45' ' ' MET . . . . . . . . . . . . . 2.6 mtt -64.31 -22.67 67.03 Favored 'General case' 0 N--CA 1.502 2.149 0 O-C-N 121.485 -0.759 . . . . 0.0 110.992 179.564 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 46' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -49.6 -40.96 40.75 Favored 'General case' 0 N--CA 1.501 2.079 0 O-C-N 121.364 -0.835 . . . . 0.0 111.555 -179.642 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 47' ' ' MET . . . . . . . . . . . . . 2.7 ptt? -94.39 4.23 54.13 Favored 'General case' 0 N--CA 1.5 2.037 0 O-C-N 121.26 -0.9 . . . . 0.0 111.741 -179.646 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 48' ' ' LEU . . . . . . . . . . . . . 43.0 tp -132.84 -64.07 0.76 Allowed 'General case' 0 N--CA 1.493 1.723 0 O-C-N 120.803 -1.185 . . . . 0.0 111.045 -179.466 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 49' ' ' GLY . . . . . 0.463 ' O ' ' HB2' ' A' ' 50' ' ' GLN . . . -96.96 19.24 55.58 Favored Glycine 0 N--CA 1.498 2.772 0 C-N-CA 120.405 -0.903 . . . . 0.0 111.115 -179.464 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 50' ' ' GLN . . . . . 0.463 ' HB2' ' O ' ' A' ' 49' ' ' GLY . 36.1 mt-30 65.19 -68.4 0.11 Allowed 'General case' 0 N--CA 1.507 2.407 0 CA-C-N 118.254 1.027 . . . . 0.0 111.469 179.661 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 51' ' ' ASN . . . . . . . . . . . . . 0.9 OUTLIER 63.49 94.28 0.05 OUTLIER Pre-proline 0 N--CA 1.504 2.227 0 O-C-N 121.492 -0.755 . . . . 0.0 110.956 -179.759 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 52' ' ' PRO . . . . . . . . . . . . . 49.2 Cg_endo -75.41 -42.96 0.4 Allowed 'Trans proline' 0 N--CA 1.49 1.274 0 O-C-N 123.747 1.393 . . . . 0.0 111.212 179.819 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 53' ' ' THR . . . . . 0.603 HG23 ' HB2' ' A' ' 56' ' ' GLU . 0.0 OUTLIER -143.54 153.94 59.23 Favored Pre-proline 0 N--CA 1.501 2.086 0 O-C-N 121.198 -0.939 . . . . 0.0 110.622 -179.875 . . . . . . . . 3 3 . 1 . 018 nuclear build core ' A' A ' 54' ' ' PRO . . . . . 0.503 ' O ' ' HB ' ' A' ' 38' ' ' THR . 44.2 Cg_endo -69.9 -42.08 3.56 Favored 'Trans proline' 0 C--N 1.312 -1.382 0 O-C-N 124.111 1.585 . . . . 0.0 110.774 179.431 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 55' ' ' GLU . . . . . . . . . . . . . 3.0 mp0 -55.04 -28.6 53.43 Favored 'General case' 0 N--CA 1.504 2.24 0 O-C-N 121.312 -0.867 . . . . 0.0 111.045 179.997 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 56' ' ' GLU . . . . . 0.603 ' HB2' HG23 ' A' ' 53' ' ' THR . 22.5 tt0 -65.74 -29.96 70.55 Favored 'General case' 0 N--CA 1.496 1.836 0 O-C-N 121.317 -0.865 . . . . 0.0 111.206 179.91 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 57' ' ' LEU . . . . . 0.67 HD22 ' N ' ' A' ' 57' ' ' LEU . 3.1 mm? -84.51 -12.95 53.26 Favored 'General case' 0 N--CA 1.5 2.035 0 O-C-N 120.949 -1.095 . . . . 0.0 111.58 -179.459 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 58' ' ' GLN . . . . . 0.673 ' HA ' HG22 ' A' ' 61' ' ' ILE . 0.0 OUTLIER -57.2 -30.57 64.67 Favored 'General case' 0 N--CA 1.502 2.132 0 O-C-N 121.126 -0.984 . . . . 0.0 109.525 179.545 . . . . . . . . 3 3 . 1 . 018 nuclear build core ' A' A ' 59' ' ' GLU . . . . . . . . . . . . . 0.7 OUTLIER -61.9 -37.46 84.69 Favored 'General case' 0 N--CA 1.498 1.966 0 O-C-N 121.058 -1.027 . . . . 0.0 109.013 178.214 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 60' ' ' MET . . . . . . . . . . . . . 0.7 OUTLIER -72.55 -40.54 66.63 Favored 'General case' 0 N--CA 1.495 1.786 0 O-C-N 121.798 -0.564 . . . . 0.0 110.509 179.49 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 61' ' ' ILE . . . . . 0.673 HG22 ' HA ' ' A' ' 58' ' ' GLN . 15.2 tt -76.23 -38.32 33.63 Favored 'Isoleucine or valine' 0 N--CA 1.498 1.954 0 O-C-N 121.245 -0.909 . . . . 0.0 111.019 -179.75 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 62' ' ' ASP . . . . . . . . . . . . . 0.7 OUTLIER -66.84 -35.23 79.58 Favored 'General case' 0 N--CA 1.499 2.023 0 O-C-N 121.148 -0.97 . . . . 0.0 110.433 179.928 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 63' ' ' GLU . . . . . . . . . . . . . 1.2 tt0 -56.84 -34.27 67.59 Favored 'General case' 0 N--CA 1.499 1.982 0 O-C-N 121.535 -0.728 . . . . 0.0 110.452 179.412 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 64' ' ' VAL . . . . . 0.54 HG11 ' HB2' ' A' ' 80' ' ' MET . 27.5 t -101.63 -20.64 5.47 Favored 'Isoleucine or valine' 0 N--CA 1.496 1.872 0 O-C-N 121.311 -0.868 . . . . 0.0 110.651 179.632 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 65' ' ' ASP . . . . . . . . . . . . . 30.0 t70 -58.55 -70.93 0.13 Allowed 'General case' 0 N--CA 1.5 2.071 0 O-C-N 121.359 -0.838 . . . . 0.0 110.778 -179.641 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 66' ' ' GLU . . . . . . . . . . . . . 15.8 mm-40 49.18 30.61 3.12 Favored 'General case' 0 N--CA 1.504 2.23 0 O-C-N 121.489 -0.757 . . . . 0.0 110.293 -179.209 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 67' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -105.05 -29.15 10.61 Favored 'General case' 0 N--CA 1.492 1.633 0 O-C-N 121.604 -0.685 . . . . 0.0 110.549 -179.45 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 68' ' ' GLY . . . . . . . . . . . . . . . 110.92 -11.68 29.56 Favored Glycine 0 N--CA 1.495 2.569 0 N-CA-C 109.406 -1.477 . . . . 0.0 109.406 -178.729 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 69' ' ' SER . . . . . . . . . . . . . 89.7 p -102.32 -42.89 5.85 Favored 'General case' 0 N--CA 1.495 1.818 0 O-C-N 121.468 -1.019 . . . . 0.0 111.015 -179.847 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 70' ' ' GLY . . . . . . . . . . . . . . . 95.31 38.14 4.88 Favored Glycine 0 N--CA 1.496 2.657 0 N-CA-C 108.417 -1.873 . . . . 0.0 108.417 -178.954 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 71' ' ' THR . . . . . . . . . . . . . 8.1 p -142.6 134.31 26.77 Favored 'General case' 0 N--CA 1.492 1.648 0 O-C-N 121.763 -0.845 . . . . 0.0 109.954 -179.086 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 72' ' ' VAL . . . . . . . . . . . . . 2.9 t -103.05 113.56 40.16 Favored 'Isoleucine or valine' 0 N--CA 1.494 1.733 0 O-C-N 121.386 -0.821 . . . . 0.0 110.59 -179.859 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 73' ' ' ASP . . . . . . . . . . . . . 1.6 p-10 -87.15 -159.32 0.5 Allowed 'General case' 0 N--CA 1.496 1.83 0 O-C-N 121.493 -0.754 . . . . 0.0 110.042 179.581 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 74' ' ' PHE . . . . . . . . . . . . . 46.7 t80 -61.67 -51.87 66.64 Favored 'General case' 0 N--CA 1.496 1.866 0 O-C-N 121.303 -0.873 . . . . 0.0 110.323 179.812 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 75' ' ' ASP . . . . . 0.418 ' HA ' HD23 ' A' ' 78' ' ' LEU . 0.3 OUTLIER -61.61 -47.31 86.01 Favored 'General case' 0 N--CA 1.496 1.87 0 O-C-N 121.518 -0.738 . . . . 0.0 110.675 -179.935 . . . . . . . . 3 3 . 1 . 018 nuclear build core ' A' A ' 76' ' ' GLU . . . . . . . . . . . . . 14.2 mt-10 -63.58 -33.53 75.81 Favored 'General case' 0 N--CA 1.499 2.004 0 O-C-N 121.327 -0.858 . . . . 0.0 110.433 179.586 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 77' ' ' PHE . . . . . . . . . . . . . 33.6 t80 -76.68 -46.2 26.59 Favored 'General case' 0 N--CA 1.497 1.886 0 O-C-N 121.173 -0.954 . . . . 0.0 110.033 179.358 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 78' ' ' LEU . . . . . 0.568 HD11 HD11 ' A' ' 12' ' ' LEU . 0.1 OUTLIER -66.44 -36.14 82.05 Favored 'General case' 0 N--CA 1.498 1.946 0 O-C-N 121.429 -0.794 . . . . 0.0 110.429 -179.791 . . . . . . . . 3 3 . 1 . 018 nuclear build core ' A' A ' 79' ' ' VAL . . . . . 0.488 ' N ' ' HG ' ' A' ' 78' ' ' LEU . 4.3 p -71.78 -33.91 49.97 Favored 'Isoleucine or valine' 0 N--CA 1.499 2.015 0 O-C-N 120.951 -1.093 . . . . 0.0 109.206 178.684 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 80' ' ' MET . . . . . 0.54 ' HB2' HG11 ' A' ' 64' ' ' VAL . 56.2 ttp -61.24 -33.53 73.67 Favored 'General case' 0 N--CA 1.496 1.829 0 O-C-N 121.545 -0.722 . . . . 0.0 109.198 178.415 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 81' ' ' MET . . . . . . . . . . . . . 9.1 mmt -62.96 -42.85 99.95 Favored 'General case' 0 N--CA 1.494 1.763 0 O-C-N 121.667 -0.646 . . . . 0.0 109.544 178.881 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 82' ' ' VAL . . . . . . . . . . . . . 71.9 t -60.69 -38.85 79.76 Favored 'Isoleucine or valine' 0 N--CA 1.5 2.06 0 O-C-N 121.478 -0.764 . . . . 0.0 109.363 178.832 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 83' ' ' ARG . . . . . . . . . . . . . 20.1 mtp180 -62.79 -37.06 85.18 Favored 'General case' 0 N--CA 1.498 1.965 0 O-C-N 121.372 -0.83 . . . . 0.0 109.383 178.62 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 84' ' ' CYS . . . . . 0.404 ' HB3' ' HA ' ' B' ' 149' ' ' SER . 66.7 m -78.86 -24.88 44.04 Favored 'General case' 0 N--CA 1.496 1.863 0 O-C-N 121.577 -0.702 . . . . 0.0 110.311 179.226 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 85' ' ' MET . . . . . . . . . . . . . 2.5 mtp . . . . . 0 N--CA 1.499 2.012 0 O-C-N 121.28 -0.888 . . . . 0.0 109.7 179.156 . . . . . . . . 0 0 . 1 . 018 nuclear build core ' B' B ' 149' ' ' SER . . . . . 0.404 ' HA ' ' HB3' ' A' ' 84' ' ' CYS . 40.8 t . . . . . 0 N--CA 1.5 2.042 0 CA-C-O 121.325 0.583 . . . . 0.0 111.163 . . . . . . . . . 1 1 . 1 . 018 nuclear build core ' B' B ' 150' ' ' ALA . . . . . . . . . . . . . . . -55.75 -50.58 70.0 Favored 'General case' 0 N--CA 1.499 2.019 0 O-C-N 121.72 -0.612 . . . . 0.0 111.084 -179.792 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' B' B ' 151' ' ' ASP . . . . . . . . . . . . . 4.7 p-10 -56.97 -37.28 71.39 Favored 'General case' 0 N--CA 1.501 2.083 0 O-C-N 121.392 -0.817 . . . . 0.0 110.696 179.893 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' B' B ' 152' ' ' ALA . . . . . . . . . . . . . . . -70.44 -45.29 66.12 Favored 'General case' 0 N--CA 1.495 1.803 0 O-C-N 121.321 -0.862 . . . . 0.0 109.636 179.304 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' B' B ' 153' ' ' MET . . . . . . . . . . . . . 1.1 mmt -62.74 -40.95 98.83 Favored 'General case' 0 N--CA 1.496 1.86 0 O-C-N 121.613 -0.68 . . . . 0.0 110.137 179.364 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' B' B ' 154' ' ' MET . . . . . . . . . . . . . 9.9 mmt -61.86 -47.94 82.77 Favored 'General case' 0 N--CA 1.499 1.993 0 O-C-N 121.358 -0.839 . . . . 0.0 109.956 179.458 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' B' B ' 155' ' ' GLN . . . . . . . . . . . . . 13.9 mt-30 -68.72 -29.69 68.16 Favored 'General case' 0 N--CA 1.498 1.973 0 O-C-N 121.338 -0.851 . . . . 0.0 110.505 179.334 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' B' B ' 156' ' ' ALA . . . . . . . . . . . . . . . -80.39 -20.32 44.28 Favored 'General case' 0 N--CA 1.498 1.973 0 O-C-N 121.243 -0.911 . . . . 0.0 111.082 179.867 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' B' B ' 157' ' ' LEU . . . . . 0.424 HD13 ' CE2' ' A' ' 27' ' ' PHE . 13.6 tp -96.59 -49.18 5.22 Favored 'General case' 0 N--CA 1.497 1.907 0 O-C-N 121.041 -1.037 . . . . 0.0 111.017 -179.685 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' B' B ' 158' ' ' LEU . . . . . . . . . . . . . 19.0 mt . . . . . 0 N--CA 1.5 2.069 0 O-C-N 121.15 -0.969 . . . . 0.0 111.587 -179.24 . . . . . . . . 0 0 . 1 . 019 nuclear build core ' A' A ' 4' ' ' ILE . . . . . . . . . . . . . 72.3 mt . . . . . 0 N--CA 1.502 2.17 0 CA-C-O 120.859 0.362 . . . . 0.0 110.371 . . . . . . . . . 0 0 . 1 . 019 nuclear build core ' A' A ' 5' ' ' TYR . . . . . . . . . . . . . 44.1 m-85 -66.26 -42.22 88.81 Favored 'General case' 0 N--CA 1.501 2.122 0 O-C-N 121.244 -0.91 . . . . 0.0 110.525 179.931 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 6' ' ' LYS . . . . . 0.483 ' HB3' ' HE3' ' A' ' 6' ' ' LYS . 15.9 mtpp -65.3 -32.18 73.7 Favored 'General case' 0 N--CA 1.493 1.683 0 O-C-N 121.332 -0.855 . . . . 0.0 110.415 179.99 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 7' ' ' ALA . . . . . . . . . . . . . . . -51.65 -42.91 62.42 Favored 'General case' 0 N--CA 1.498 1.954 0 O-C-N 121.253 -0.904 . . . . 0.0 109.306 178.803 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 8' ' ' ALA . . . . . 0.472 ' HB3' HG21 ' A' ' 82' ' ' VAL . . . -70.23 -42.24 72.5 Favored 'General case' 0 N--CA 1.495 1.812 0 O-C-N 121.503 -0.748 . . . . 0.0 109.158 178.218 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 9' ' ' VAL . . . . . 0.768 HG13 ' HB3' ' A' ' 78' ' ' LEU . 69.7 t -61.52 -40.53 86.79 Favored 'Isoleucine or valine' 0 N--CA 1.5 2.034 0 O-C-N 121.704 -0.623 . . . . 0.0 110.103 179.15 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 10' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER -69.16 -28.83 66.77 Favored 'General case' 0 N--CA 1.497 1.912 0 O-C-N 121.512 -0.743 . . . . 0.0 110.587 179.7 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 11' ' ' GLN . . . . . . . . . . . . . 0.1 OUTLIER -92.42 41.61 1.08 Allowed 'General case' 0 N--CA 1.496 1.836 0 O-C-N 121.279 -0.888 . . . . 0.0 110.946 -179.754 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 12' ' ' LEU . . . . . 0.557 HD12 ' HA ' ' A' ' 9' ' ' VAL . 10.7 mt -106.8 123.82 48.71 Favored 'General case' 0 N--CA 1.497 1.904 0 O-C-N 121.134 -0.979 . . . . 0.0 110.177 179.516 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 13' ' ' THR . . . . . . . . . . . . . 0.3 OUTLIER -79.69 164.49 23.7 Favored 'General case' 0 N--CA 1.498 1.927 0 O-C-N 121.193 -0.942 . . . . 0.0 110.07 179.621 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 14' ' ' GLU . . . . . . . . . . . . . 0.2 OUTLIER -52.54 -30.75 32.2 Favored 'General case' 0 N--CA 1.497 1.879 0 O-C-N 121.625 -0.672 . . . . 0.0 111.196 -179.281 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 1.5 mp0 -59.65 -51.23 70.71 Favored 'General case' 0 N--CA 1.497 1.892 0 O-C-N 121.449 -0.782 . . . . 0.0 109.838 179.483 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 16' ' ' GLN . . . . . . . . . . . . . 3.0 mp0 -79.99 -26.79 39.77 Favored 'General case' 0 N--CA 1.5 2.03 0 O-C-N 121.452 -0.78 . . . . 0.0 110.12 179.148 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 17' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -69.15 -42.57 75.76 Favored 'General case' 0 N--CA 1.496 1.867 0 O-C-N 121.628 -0.67 . . . . 0.0 110.097 179.707 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 18' ' ' ASN . . . . . 0.508 ' HA ' ' HG2' ' A' ' 21' ' ' LYS . 12.2 t30 -56.9 -39.69 74.89 Favored 'General case' 0 N--CA 1.499 2.002 0 O-C-N 121.6 -0.688 . . . . 0.0 110.761 179.923 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 4.4 mt-10 -54.88 -48.51 72.9 Favored 'General case' 0 N--CA 1.499 2.011 0 O-C-N 121.33 -0.856 . . . . 0.0 109.987 179.553 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 20' ' ' PHE . . . . . . . . . . . . . 43.9 m-85 -77.65 -33.58 53.41 Favored 'General case' 0 N--CA 1.497 1.919 0 O-C-N 121.436 -0.79 . . . . 0.0 110.282 179.516 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 21' ' ' LYS . . . . . 0.514 ' HG3' ' N ' ' A' ' 22' ' ' ALA . 0.0 OUTLIER -64.21 -34.31 77.79 Favored 'General case' 0 N--CA 1.496 1.858 0 O-C-N 121.183 -0.948 . . . . 0.0 109.508 179.02 . . . . . . . . 3 3 . 1 . 019 nuclear build core ' A' A ' 22' ' ' ALA . . . . . 0.514 ' N ' ' HG3' ' A' ' 21' ' ' LYS . . . -76.02 -41.52 50.74 Favored 'General case' 0 N--CA 1.496 1.873 0 O-C-N 121.556 -0.715 . . . . 0.0 109.153 178.434 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 23' ' ' ALA . . . . . 0.492 ' O ' ' HB2' ' A' ' 27' ' ' PHE . . . -73.3 -7.27 50.83 Favored 'General case' 0 N--CA 1.494 1.732 0 O-C-N 121.679 -0.638 . . . . 0.0 110.75 178.975 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 24' ' ' PHE . . . . . . . . . . . . . 38.5 t80 -107.92 -49.32 3.23 Favored 'General case' 0 N--CA 1.495 1.793 0 O-C-N 121.181 -0.949 . . . . 0.0 110.795 -179.574 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 25' ' ' ASP . . . . . . . . . . . . . 0.1 OUTLIER -61.38 -41.84 97.75 Favored 'General case' 0 N--CA 1.5 2.065 0 O-C-N 121.307 -0.871 . . . . 0.0 110.891 -179.389 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 26' ' ' ILE . . . . . . . . . . . . . 37.4 mt -76.62 -27.05 16.83 Favored 'Isoleucine or valine' 0 N--CA 1.499 1.977 0 O-C-N 121.152 -0.968 . . . . 0.0 109.798 179.037 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 27' ' ' PHE . . . . . 0.567 ' HA ' HD21 ' B' ' 157' ' ' LEU . 1.7 t80 -59.08 -50.6 73.45 Favored 'General case' 0 N--CA 1.497 1.894 0 O-C-N 121.638 -0.664 . . . . 0.0 110.421 179.484 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 28' ' ' VAL . . . . . . . . . . . . . 18.6 m -91.04 -35.4 7.12 Favored 'Isoleucine or valine' 0 N--CA 1.497 1.906 0 O-C-N 121.555 -0.716 . . . . 0.0 111.254 -179.288 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 29' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER 46.48 43.66 12.31 Favored 'General case' 0 N--CA 1.497 1.919 0 O-C-N 121.45 -0.781 . . . . 0.0 110.218 -179.654 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 30' ' ' GLY . . . . . . . . . . . . . . . 106.06 -62.04 0.33 Allowed Glycine 0 N--CA 1.494 2.503 0 N-CA-C 108.794 -1.722 . . . . 0.0 108.794 -178.768 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 31' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.501 2.121 0 O-C-N 121.81 -0.817 . . . . 0.0 111.13 179.531 . . . . . . . . 0 0 . 1 . 019 nuclear build core ' A' A ' 35' ' ' CYS . . . . . . . . . . . . . 96.7 m . . . . . 0 N--CA 1.508 2.456 0 CA-C-O 120.758 0.313 . . . . 0.0 111.302 . . . . . . . . . 0 0 . 1 . 019 nuclear build core ' A' A ' 36' ' ' ILE . . . . . . . . . . . . . 30.5 mt -80.95 105.56 11.0 Favored 'Isoleucine or valine' 0 N--CA 1.5 2.054 0 O-C-N 120.792 -1.193 . . . . 0.0 110.141 -179.893 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 37' ' ' SER . . . . . . . . . . . . . 5.7 t -100.57 175.71 5.58 Favored 'General case' 0 N--CA 1.496 1.835 0 O-C-N 121.429 -0.794 . . . . 0.0 110.098 179.595 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 38' ' ' THR . . . . . 0.407 HG21 ' HG2' ' A' ' 58' ' ' GLN . 33.6 p -61.81 -38.8 89.49 Favored 'General case' 0 N--CA 1.501 2.1 0 O-C-N 121.231 -0.918 . . . . 0.0 110.041 179.553 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 39' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -65.64 -40.29 92.36 Favored 'General case' 0 N--CA 1.499 2.005 0 O-C-N 121.674 -0.641 . . . . 0.0 110.379 179.535 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 2.3 mp0 -65.42 -48.8 71.57 Favored 'General case' 0 N--CA 1.499 2.014 0 O-C-N 121.434 -0.791 . . . . 0.0 110.399 179.896 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 41' ' ' LEU . . . . . 0.542 HD11 ' HE1' ' A' ' 45' ' ' MET . 7.7 tp -61.69 -47.44 85.31 Favored 'General case' 0 N--CA 1.499 1.983 0 O-C-N 121.481 -0.762 . . . . 0.0 110.323 179.898 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 42' ' ' GLY . . . . . . . . . . . . . . . -58.16 -40.06 93.16 Favored Glycine 0 N--CA 1.493 2.472 0 N-CA-C 110.155 -1.178 . . . . 0.0 110.155 -179.712 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 43' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -56.42 -45.21 80.82 Favored 'General case' 0 N--CA 1.5 2.066 0 O-C-N 121.439 -1.036 . . . . 0.0 109.97 179.426 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 44' ' ' VAL . . . . . 0.447 HG21 ' CE1' ' A' ' 27' ' ' PHE . 72.1 t -67.84 -42.69 86.14 Favored 'Isoleucine or valine' 0 N--CA 1.498 1.94 0 O-C-N 121.42 -0.8 . . . . 0.0 109.557 179.154 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 45' ' ' MET . . . . . 0.542 ' HE1' HD11 ' A' ' 41' ' ' LEU . 0.9 OUTLIER -60.04 -39.27 85.35 Favored 'General case' 0 N--CA 1.499 2.012 0 O-C-N 121.431 -0.793 . . . . 0.0 109.59 178.805 . . . . . . . . 3 3 . 1 . 019 nuclear build core ' A' A ' 46' ' ' ARG . . . . . . . . . . . . . 0.3 OUTLIER -61.49 -37.49 83.87 Favored 'General case' 0 N--CA 1.496 1.832 0 O-C-N 121.65 -0.656 . . . . 0.0 109.706 178.859 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 47' ' ' MET . . . . . . . . . . . . . 18.1 ttp -67.02 -38.65 86.33 Favored 'General case' 0 N--CA 1.496 1.863 0 O-C-N 121.711 -0.618 . . . . 0.0 110.032 179.153 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 48' ' ' LEU . . . . . . . . . . . . . 5.9 tp -68.9 -36.79 78.45 Favored 'General case' 0 N--CA 1.493 1.677 0 O-C-N 121.4 -0.812 . . . . 0.0 110.307 179.691 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 49' ' ' GLY . . . . . . . . . . . . . . . 131.98 -39.61 1.74 Allowed Glycine 0 N--CA 1.494 2.561 0 N-CA-C 110.023 -1.231 . . . . 0.0 110.023 179.925 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 50' ' ' GLN . . . . . . . . . . . . . 7.8 mt-30 -88.16 107.51 18.81 Favored 'General case' 0 N--CA 1.497 1.922 0 O-C-N 121.274 -1.133 . . . . 0.0 110.626 -179.741 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 51' ' ' ASN . . . . . . . . . . . . . 24.4 t-20 -156.79 100.76 1.99 Allowed Pre-proline 0 N--CA 1.499 1.999 0 O-C-N 121.412 -0.805 . . . . 0.0 110.196 179.81 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 52' ' ' PRO . . . . . . . . . . . . . 49.0 Cg_endo -79.53 -89.2 0.0 OUTLIER 'Trans proline' 0 C--N 1.317 -1.131 0 O-C-N 123.839 1.441 . . . . 0.0 111.178 -179.999 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 53' ' ' THR . . . . . . . . . . . . . 4.6 p -127.95 165.83 27.77 Favored Pre-proline 0 N--CA 1.496 1.846 0 O-C-N 120.945 -1.097 . . . . 0.0 110.791 -179.233 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 54' ' ' PRO . . . . . . . . . . . . . 42.7 Cg_endo -68.79 -31.76 24.64 Favored 'Trans proline' 0 N--CA 1.491 1.335 0 O-C-N 123.704 1.371 . . . . 0.0 110.939 179.495 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 55' ' ' GLU . . . . . . . . . . . . . 1.9 mp0 -67.4 -29.45 68.97 Favored 'General case' 0 N--CA 1.499 1.994 0 O-C-N 121.22 -0.925 . . . . 0.0 110.075 179.271 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 4.6 tm-20 -56.82 -35.99 69.44 Favored 'General case' 0 N--CA 1.499 1.979 0 O-C-N 121.53 -0.732 . . . . 0.0 110.663 179.587 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 57' ' ' LEU . . . . . 0.593 ' H ' HD22 ' A' ' 57' ' ' LEU . 0.7 OUTLIER -69.58 -29.26 66.77 Favored 'General case' 0 N--CA 1.499 1.98 0 O-C-N 121.33 -0.856 . . . . 0.0 110.87 179.983 . . . . . . . . 3 3 . 1 . 019 nuclear build core ' A' A ' 58' ' ' GLN . . . . . 0.748 ' O ' HG22 ' A' ' 61' ' ' ILE . 0.0 OUTLIER -56.86 -49.74 74.57 Favored 'General case' 0 N--CA 1.498 1.941 0 O-C-N 121.051 -1.031 . . . . 0.0 109.451 179.642 . . . . . . . . 3 3 . 1 . 019 nuclear build core ' A' A ' 59' ' ' GLU . . . . . . . . . . . . . 0.7 OUTLIER -64.65 -38.1 89.85 Favored 'General case' 0 N--CA 1.495 1.805 0 N-CA-C 108.418 -0.956 . . . . 0.0 108.418 177.971 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 60' ' ' MET . . . . . 0.442 ' HB2' ' HA ' ' A' ' 57' ' ' LEU . 7.5 mmm -58.8 -39.1 80.15 Favored 'General case' 0 N--CA 1.496 1.838 0 O-C-N 121.795 -0.566 . . . . 0.0 110.096 178.772 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 61' ' ' ILE . . . . . 0.748 HG22 ' O ' ' A' ' 58' ' ' GLN . 5.1 tt -76.72 -26.9 16.59 Favored 'Isoleucine or valine' 0 N--CA 1.498 1.943 0 O-C-N 121.435 -0.791 . . . . 0.0 110.575 179.729 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 62' ' ' ASP . . . . . . . . . . . . . 1.8 t70 -62.32 -25.22 67.76 Favored 'General case' 0 N--CA 1.498 1.948 0 O-C-N 121.417 -0.802 . . . . 0.0 110.487 179.683 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 63' ' ' GLU . . . . . . . . . . . . . 16.2 tt0 -47.28 -42.39 20.79 Favored 'General case' 0 N--CA 1.501 2.097 0 O-C-N 121.613 -0.68 . . . . 0.0 110.961 179.459 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 64' ' ' VAL . . . . . 0.563 HG11 ' HB2' ' A' ' 80' ' ' MET . 27.5 m -127.45 30.14 1.81 Allowed 'Isoleucine or valine' 0 N--CA 1.498 1.96 0 O-C-N 121.342 -0.849 . . . . 0.0 110.85 179.929 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 65' ' ' ASP . . . . . . . . . . . . . 19.3 t70 -119.9 -97.82 0.46 Allowed 'General case' 0 N--CA 1.495 1.78 0 O-C-N 121.173 -0.955 . . . . 0.0 110.062 179.589 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 66' ' ' GLU . . . . . . . . . . . . . 1.4 mm-40 47.24 35.34 3.66 Favored 'General case' 0 N--CA 1.502 2.126 0 O-C-N 121.354 -0.841 . . . . 0.0 110.967 -179.903 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 67' ' ' ASP . . . . . . . . . . . . . 4.4 p-10 -114.09 7.45 16.71 Favored 'General case' 0 N--CA 1.497 1.884 0 O-C-N 121.213 -0.93 . . . . 0.0 111.367 -179.691 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 68' ' ' GLY . . . . . . . . . . . . . . . 98.34 -27.1 21.0 Favored Glycine 0 N--CA 1.497 2.759 0 N-CA-C 110.45 -1.06 . . . . 0.0 110.45 179.888 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 69' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -80.34 -42.36 23.08 Favored 'General case' 0 N--CA 1.498 1.951 0 O-C-N 121.22 -1.165 . . . . 0.0 111.01 -179.612 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 70' ' ' GLY . . . . . . . . . . . . . . . 81.13 6.77 89.16 Favored Glycine 0 N--CA 1.499 2.854 0 C-N-CA 120.205 -0.997 . . . . 0.0 110.871 179.959 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 71' ' ' THR . . . . . . . . . . . . . 2.7 m -124.33 140.53 52.87 Favored 'General case' 0 N--CA 1.498 1.955 0 O-C-N 121.09 -1.241 . . . . 0.0 109.842 179.697 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 72' ' ' VAL . . . . . 0.658 HG23 HG12 ' A' ' 61' ' ' ILE . 3.0 t -92.35 123.63 44.52 Favored 'Isoleucine or valine' 0 N--CA 1.495 1.791 0 O-C-N 121.426 -0.796 . . . . 0.0 110.723 -179.633 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 73' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER -97.28 -163.5 1.05 Allowed 'General case' 0 N--CA 1.494 1.736 0 O-C-N 121.525 -0.735 . . . . 0.0 109.671 179.28 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 74' ' ' PHE . . . . . 0.412 ' CE2' HD11 ' A' ' 78' ' ' LEU . 11.1 t80 -64.97 -45.49 85.47 Favored 'General case' 0 N--CA 1.499 2.023 0 O-C-N 121.067 -1.02 . . . . 0.0 110.475 179.771 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 75' ' ' ASP . . . . . . . . . . . . . 16.3 t70 -59.85 -50.76 72.54 Favored 'General case' 0 N--CA 1.498 1.974 0 O-C-N 121.358 -0.839 . . . . 0.0 109.978 179.389 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 76' ' ' GLU . . . . . . . . . . . . . 43.5 mt-10 -62.18 -40.7 96.91 Favored 'General case' 0 N--CA 1.498 1.943 0 O-C-N 121.515 -0.741 . . . . 0.0 109.553 179.167 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 77' ' ' PHE . . . . . . . . . . . . . 71.8 t80 -60.83 -44.19 97.27 Favored 'General case' 0 N--CA 1.496 1.872 0 O-C-N 121.617 -0.677 . . . . 0.0 109.703 178.712 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 78' ' ' LEU . . . . . 0.768 ' HB3' HG13 ' A' ' 9' ' ' VAL . 52.6 mt -65.98 -43.62 87.29 Favored 'General case' 0 N--CA 1.5 2.046 0 O-C-N 121.567 -0.708 . . . . 0.0 110.087 179.389 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 79' ' ' VAL . . . . . 0.642 ' O ' HG12 ' A' ' 82' ' ' VAL . 45.2 t -60.2 -44.68 95.94 Favored 'Isoleucine or valine' 0 N--CA 1.497 1.891 0 O-C-N 121.61 -0.681 . . . . 0.0 109.393 179.374 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 80' ' ' MET . . . . . 0.563 ' HB2' HG11 ' A' ' 64' ' ' VAL . 2.3 ttp -62.78 -39.77 95.26 Favored 'General case' 0 N--CA 1.495 1.812 0 O-C-N 121.517 -0.74 . . . . 0.0 110.013 178.923 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 81' ' ' MET . . . . . . . . . . . . . 11.2 mmt -62.33 -44.29 96.84 Favored 'General case' 0 N--CA 1.498 1.948 0 O-C-N 121.57 -0.706 . . . . 0.0 110.743 179.946 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 82' ' ' VAL . . . . . 0.642 HG12 ' O ' ' A' ' 79' ' ' VAL . 2.4 p -70.21 -26.57 29.69 Favored 'Isoleucine or valine' 0 N--CA 1.5 2.05 0 O-C-N 121.169 -0.957 . . . . 0.0 110.292 179.514 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 83' ' ' ARG . . . . . 0.618 ' HD2' HG12 ' A' ' 79' ' ' VAL . 4.0 mtp180 -74.6 -33.68 62.68 Favored 'General case' 0 N--CA 1.495 1.795 0 O-C-N 121.222 -0.924 . . . . 0.0 109.444 178.742 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 84' ' ' CYS . . . . . . . . . . . . . 0.1 OUTLIER -71.59 -11.52 60.89 Favored 'General case' 0 N--CA 1.496 1.869 0 O-C-N 121.703 -0.623 . . . . 0.0 110.921 179.323 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 85' ' ' MET . . . . . . . . . . . . . 12.2 tpp . . . . . 0 N--CA 1.5 2.029 0 O-C-N 121.315 -0.865 . . . . 0.0 111.563 -179.953 . . . . . . . . 0 0 . 1 . 019 nuclear build core ' B' B ' 149' ' ' SER . . . . . . . . . . . . . 89.0 p . . . . . 0 N--CA 1.496 1.839 0 CA-C-O 121.284 0.564 . . . . 0.0 110.391 . . . . . . . . . 0 0 . 1 . 019 nuclear build core ' B' B ' 150' ' ' ALA . . . . . . . . . . . . . . . -58.85 -50.09 75.28 Favored 'General case' 0 N--CA 1.498 1.974 0 O-C-N 121.482 -0.761 . . . . 0.0 111.104 -179.652 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' B' B ' 151' ' ' ASP . . . . . . . . . . . . . 7.2 p-10 -60.62 -35.75 76.92 Favored 'General case' 0 N--CA 1.502 2.137 0 O-C-N 121.371 -0.83 . . . . 0.0 111.252 -179.804 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' B' B ' 152' ' ' ALA . . . . . . . . . . . . . . . -74.36 -38.82 63.1 Favored 'General case' 0 N--CA 1.496 1.825 0 O-C-N 121.131 -0.981 . . . . 0.0 110.252 179.645 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' B' B ' 153' ' ' MET . . . . . . . . . . . . . 0.4 OUTLIER -64.66 -47.97 76.49 Favored 'General case' 0 N--CA 1.498 1.962 0 O-C-N 121.41 -0.806 . . . . 0.0 110.608 179.973 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' B' B ' 154' ' ' MET . . . . . 0.427 ' HG3' ' N ' ' B' ' 155' ' ' GLN . 17.2 ptp -63.84 -30.25 71.36 Favored 'General case' 0 N--CA 1.5 2.04 0 O-C-N 121.167 -0.958 . . . . 0.0 110.298 179.57 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' B' B ' 155' ' ' GLN . . . . . 0.427 ' N ' ' HG3' ' B' ' 154' ' ' MET . 0.2 OUTLIER -65.54 -35.79 81.88 Favored 'General case' 0 N--CA 1.498 1.961 0 O-C-N 121.327 -0.858 . . . . 0.0 110.201 179.074 . . . . . . . . 3 3 . 1 . 019 nuclear build core ' B' B ' 156' ' ' ALA . . . . . . . . . . . . . . . -87.28 -43.77 11.92 Favored 'General case' 0 N--CA 1.495 1.799 0 O-C-N 121.431 -0.793 . . . . 0.0 110.143 179.719 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' B' B ' 157' ' ' LEU . . . . . 0.567 HD21 ' HA ' ' A' ' 27' ' ' PHE . 0.9 OUTLIER -64.67 -48.65 73.96 Favored 'General case' 0 N--CA 1.498 1.972 0 O-C-N 121.614 -0.679 . . . . 0.0 110.481 179.969 . . . . . . . . 3 3 . 1 . 019 nuclear build core ' B' B ' 158' ' ' LEU . . . . . . . . . . . . . 6.3 mt . . . . . 0 N--CA 1.498 1.947 0 O-C-N 121.161 -0.962 . . . . 0.0 110.856 -179.988 . . . . . . . . 0 0 . 1 . 020 nuclear build core ' A' A ' 4' ' ' ILE . . . . . . . . . . . . . 1.8 pp . . . . . 0 N--CA 1.499 2.009 0 CA-C-O 120.866 0.365 . . . . 0.0 110.626 . . . . . . . . . 0 0 . 1 . 020 nuclear build core ' A' A ' 5' ' ' TYR . . . . . 0.423 ' CE1' ' HG2' ' A' ' 83' ' ' ARG . 16.5 m-85 -72.07 -42.55 66.08 Favored 'General case' 0 N--CA 1.496 1.872 0 O-C-N 121.252 -0.905 . . . . 0.0 109.767 179.407 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -66.5 -44.13 83.44 Favored 'General case' 0 N--CA 1.495 1.791 0 O-C-N 121.541 -0.724 . . . . 0.0 109.771 179.121 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 7' ' ' ALA . . . . . . . . . . . . . . . -52.42 -41.26 63.06 Favored 'General case' 0 N--CA 1.498 1.973 0 O-C-N 121.464 -0.773 . . . . 0.0 109.936 179.12 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 8' ' ' ALA . . . . . . . . . . . . . . . -60.12 -33.07 71.63 Favored 'General case' 0 N--CA 1.498 1.948 0 O-C-N 121.515 -0.741 . . . . 0.0 110.633 179.203 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 9' ' ' VAL . . . . . 0.503 ' HA ' HD23 ' A' ' 12' ' ' LEU . 84.5 t -84.61 -37.46 12.64 Favored 'Isoleucine or valine' 0 N--CA 1.498 1.958 0 O-C-N 121.459 -0.776 . . . . 0.0 110.566 179.996 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 10' ' ' GLU . . . . . . . . . . . . . 0.5 OUTLIER -67.98 -26.31 65.86 Favored 'General case' 0 N--CA 1.499 2.022 0 O-C-N 121.431 -0.793 . . . . 0.0 112.447 -178.73 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 11' ' ' GLN . . . . . . . . . . . . . 0.8 OUTLIER -134.13 65.82 1.56 Allowed 'General case' 0 N--CA 1.498 1.974 0 O-C-N 120.638 -1.289 . . . . 0.0 112.18 -179.346 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 12' ' ' LEU . . . . . 0.566 ' C ' HD12 ' A' ' 12' ' ' LEU . 4.4 pp -110.41 160.17 16.82 Favored 'General case' 0 N--CA 1.499 2.01 0 O-C-N 121.236 -0.915 . . . . 0.0 109.317 177.854 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 13' ' ' THR . . . . . . . . . . . . . 60.5 p -73.91 157.05 36.97 Favored 'General case' 0 N--CA 1.505 2.276 0 O-C-N 121.084 -1.01 . . . . 0.0 111.456 -178.627 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 14' ' ' GLU . . . . . . . . . . . . . 3.0 tp10 -53.18 -34.82 58.59 Favored 'General case' 0 N--CA 1.495 1.801 0 O-C-N 121.828 -0.545 . . . . 0.0 110.338 179.848 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 1.2 mp0 -63.29 -43.88 96.64 Favored 'General case' 0 N--CA 1.496 1.829 0 O-C-N 121.601 -0.687 . . . . 0.0 109.59 179.389 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 16' ' ' GLN . . . . . 0.505 ' HB3' HD13 ' A' ' 12' ' ' LEU . 0.1 OUTLIER -58.52 -37.88 76.56 Favored 'General case' 0 N--CA 1.498 1.931 0 CA-C-O 121.587 0.708 . . . . 0.0 110.144 179.269 . . . . . . . . 3 3 . 1 . 020 nuclear build core ' A' A ' 17' ' ' LYS . . . . . 0.527 ' HB2' HD11 ' A' ' 12' ' ' LEU . 1.3 ttpt -77.8 -33.72 52.41 Favored 'General case' 0 N--CA 1.493 1.709 0 O-C-N 121.5 -0.75 . . . . 0.0 109.986 179.173 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 18' ' ' ASN . . . . . . . . . . . . . 52.5 m-20 -68.42 -46.31 70.25 Favored 'General case' 0 N--CA 1.498 1.973 0 O-C-N 121.417 -0.802 . . . . 0.0 110.847 179.92 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 12.6 pt-20 -60.61 -35.84 77.12 Favored 'General case' 0 N--CA 1.502 2.131 0 O-C-N 121.173 -0.954 . . . . 0.0 110.121 179.856 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 20' ' ' PHE . . . . . . . . . . . . . 18.4 m-30 -77.12 -32.18 56.28 Favored 'General case' 0 N--CA 1.496 1.847 0 O-C-N 121.317 -0.864 . . . . 0.0 109.927 178.923 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 21' ' ' LYS . . . . . . . . . . . . . 2.9 tptp -60.97 -46.95 88.67 Favored 'General case' 0 N--CA 1.498 1.956 0 O-C-N 121.484 -0.76 . . . . 0.0 109.649 178.961 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 22' ' ' ALA . . . . . 0.497 ' O ' HD12 ' A' ' 26' ' ' ILE . . . -61.73 -50.23 73.24 Favored 'General case' 0 N--CA 1.499 1.989 0 O-C-N 121.395 -0.816 . . . . 0.0 109.869 179.324 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 23' ' ' ALA . . . . . . . . . . . . . . . -59.04 -40.44 85.05 Favored 'General case' 0 N--CA 1.498 1.929 0 O-C-N 121.557 -0.715 . . . . 0.0 109.647 178.94 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 24' ' ' PHE . . . . . 0.53 ' O ' HG13 ' A' ' 28' ' ' VAL . 73.9 t80 -64.55 -43.8 92.78 Favored 'General case' 0 N--CA 1.498 1.946 0 O-C-N 121.788 -0.57 . . . . 0.0 109.89 179.212 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 25' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER -56.6 -45.47 81.42 Favored 'General case' 0 N--CA 1.499 2.013 0 O-C-N 121.475 -0.766 . . . . 0.0 110.496 179.573 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 26' ' ' ILE . . . . . 0.543 ' HB ' HD12 ' B' ' 157' ' ' LEU . 6.6 mt -70.56 -31.75 47.41 Favored 'Isoleucine or valine' 0 N--CA 1.498 1.966 0 O-C-N 121.168 -0.957 . . . . 0.0 109.518 179.143 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 27' ' ' PHE . . . . . 0.585 ' CZ ' HG11 ' A' ' 44' ' ' VAL . 0.2 OUTLIER -74.46 -22.5 59.08 Favored 'General case' 0 N--CA 1.496 1.845 0 O-C-N 121.102 -0.999 . . . . 0.0 110.774 179.186 . . . . . . . . 3 3 . 1 . 020 nuclear build core ' A' A ' 28' ' ' VAL . . . . . 0.692 HG12 HG13 ' A' ' 36' ' ' ILE . 10.6 m -107.36 10.6 9.13 Favored 'Isoleucine or valine' 0 N--CA 1.501 2.076 0 O-C-N 121.153 -0.967 . . . . 0.0 111.902 -179.354 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 29' ' ' LEU . . . . . 0.622 ' O ' HD12 ' A' ' 29' ' ' LEU . 4.6 pp -57.13 136.85 56.4 Favored 'General case' 0 N--CA 1.504 2.242 0 O-C-N 120.77 -1.206 . . . . 0.0 109.398 179.379 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 30' ' ' GLY . . . . . . . . . . . . . . . 90.39 -49.6 3.22 Favored Glycine 0 N--CA 1.495 2.628 0 N-CA-C 108.093 -2.003 . . . . 0.0 108.093 -177.838 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 31' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.491 1.616 0 O-C-N 121.617 -0.931 . . . . 0.0 108.727 178.481 . . . . . . . . 0 0 . 1 . 020 nuclear build core ' A' A ' 35' ' ' CYS . . . . . . . . . . . . . 28.3 p . . . . . 0 N--CA 1.495 1.79 0 CA-C-O 121.281 0.563 . . . . 0.0 110.203 . . . . . . . . . 0 0 . 1 . 020 nuclear build core ' A' A ' 36' ' ' ILE . . . . . 0.692 HG13 HG12 ' A' ' 28' ' ' VAL . 17.9 mt -121.42 118.59 56.46 Favored 'Isoleucine or valine' 0 N--CA 1.494 1.752 0 O-C-N 121.383 -0.823 . . . . 0.0 109.987 -179.965 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 37' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -101.07 163.19 12.4 Favored 'General case' 0 N--CA 1.493 1.72 0 O-C-N 121.558 -0.714 . . . . 0.0 109.637 179.167 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 38' ' ' THR . . . . . 0.832 HG21 ' HA ' ' A' ' 58' ' ' GLN . 77.7 p -64.27 -32.76 74.47 Favored 'General case' 0 N--CA 1.5 2.045 0 O-C-N 121.31 -0.869 . . . . 0.0 110.595 -179.829 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 39' ' ' LYS . . . . . 0.473 ' HA ' ' HB3' ' A' ' 54' ' ' PRO . 11.6 mttp -60.88 -34.33 74.46 Favored 'General case' 0 N--CA 1.496 1.864 0 O-C-N 121.518 -0.739 . . . . 0.0 109.465 178.777 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 1.2 mp0 -83.42 -30.55 27.23 Favored 'General case' 0 N--CA 1.497 1.921 0 O-C-N 121.485 -0.76 . . . . 0.0 109.604 178.471 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 41' ' ' LEU . . . . . 0.485 ' HG ' HD13 ' A' ' 57' ' ' LEU . 6.4 tp -62.46 -39.83 94.67 Favored 'General case' 0 N--CA 1.497 1.877 0 O-C-N 121.412 -0.805 . . . . 0.0 110.412 179.574 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 42' ' ' GLY . . . . . 0.507 ' HA2' ' HB2' ' A' ' 45' ' ' MET . . . -53.92 -36.18 55.17 Favored Glycine 0 N--CA 1.495 2.616 0 N-CA-C 110.831 -0.908 . . . . 0.0 110.831 -179.049 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 43' ' ' LYS . . . . . . . . . . . . . 1.6 mtmt -55.21 -34.13 63.65 Favored 'General case' 0 N--CA 1.502 2.145 0 O-C-N 121.381 -1.07 . . . . 0.0 110.561 179.711 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 44' ' ' VAL . . . . . 0.585 HG11 ' CZ ' ' A' ' 27' ' ' PHE . 42.1 t -93.07 -36.72 7.74 Favored 'Isoleucine or valine' 0 N--CA 1.498 1.936 0 O-C-N 121.334 -0.854 . . . . 0.0 109.6 178.921 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 45' ' ' MET . . . . . 0.507 ' HB2' ' HA2' ' A' ' 42' ' ' GLY . 0.3 OUTLIER -58.29 -38.08 76.3 Favored 'General case' 0 N--CA 1.5 2.036 0 O-C-N 121.47 -0.769 . . . . 0.0 110.777 179.646 . . . . . . . . 3 3 . 1 . 020 nuclear build core ' A' A ' 46' ' ' ARG . . . . . 0.47 ' HA ' ' C ' ' A' ' 50' ' ' GLN . 16.6 ptt180 -63.44 -23.68 67.5 Favored 'General case' 0 N--CA 1.499 2.012 0 O-C-N 121.304 -0.872 . . . . 0.0 110.911 179.97 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 47' ' ' MET . . . . . . . . . . . . . 7.1 ttp -82.14 1.18 37.41 Favored 'General case' 0 N--CA 1.495 1.798 0 O-C-N 121.397 -0.815 . . . . 0.0 110.731 179.389 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 48' ' ' LEU . . . . . . . . . . . . . 45.1 mt -131.16 -50.7 1.02 Allowed 'General case' 0 N--CA 1.496 1.83 0 O-C-N 121.078 -1.014 . . . . 0.0 111.052 -179.82 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 49' ' ' GLY . . . . . 0.508 ' O ' ' HB2' ' A' ' 50' ' ' GLN . . . -125.52 38.04 2.37 Favored Glycine 0 N--CA 1.498 2.772 0 C-N-CA 119.866 -1.159 . . . . 0.0 110.987 -179.14 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 50' ' ' GLN . . . . . 0.508 ' HB2' ' O ' ' A' ' 49' ' ' GLY . 10.9 mt-30 67.12 -50.06 0.48 Allowed 'General case' 0 N--CA 1.512 2.636 0 CA-C-N 117.913 0.857 . . . . 0.0 112.498 179.122 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 51' ' ' ASN . . . . . 0.555 ' OD1' HD11 ' A' ' 57' ' ' LEU . 8.3 t30 64.94 101.24 0.04 OUTLIER Pre-proline 0 N--CA 1.504 2.258 0 O-C-N 121.414 -0.804 . . . . 0.0 110.542 -179.185 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 52' ' ' PRO . . . . . . . . . . . . . 44.3 Cg_endo -74.64 -52.87 0.11 Allowed 'Trans proline' 0 C--N 1.312 -1.352 0 O-C-N 123.938 1.494 . . . . 0.0 111.464 -179.642 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 53' ' ' THR . . . . . 0.703 HG23 ' HB2' ' A' ' 56' ' ' GLU . 0.0 OUTLIER -149.31 153.04 36.96 Favored Pre-proline 0 N--CA 1.5 2.048 0 O-C-N 121.131 -0.981 . . . . 0.0 111.073 -179.63 . . . . . . . . 3 3 . 1 . 020 nuclear build core ' A' A ' 54' ' ' PRO . . . . . 0.473 ' HB3' ' HA ' ' A' ' 39' ' ' LYS . 46.4 Cg_endo -71.75 -36.28 6.55 Favored 'Trans proline' 0 C--N 1.313 -1.331 0 O-C-N 124.205 1.634 . . . . 0.0 110.69 179.563 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 55' ' ' GLU . . . . . 0.458 ' O ' ' HB3' ' A' ' 58' ' ' GLN . 0.7 OUTLIER -65.11 -27.78 68.98 Favored 'General case' 0 N--CA 1.5 2.063 0 O-C-N 121.338 -0.851 . . . . 0.0 110.959 179.931 . . . . . . . . 3 3 . 1 . 020 nuclear build core ' A' A ' 56' ' ' GLU . . . . . 0.703 ' HB2' HG23 ' A' ' 53' ' ' THR . 24.0 tt0 -66.8 -30.12 70.24 Favored 'General case' 0 N--CA 1.498 1.93 0 O-C-N 121.119 -0.988 . . . . 0.0 110.275 179.28 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 57' ' ' LEU . . . . . 0.555 HD11 ' OD1' ' A' ' 51' ' ' ASN . 29.7 mt -80.31 -9.54 59.74 Favored 'General case' 0 N--CA 1.496 1.843 0 O-C-N 121.253 -0.904 . . . . 0.0 111.414 -179.889 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 58' ' ' GLN . . . . . 0.832 ' HA ' HG21 ' A' ' 38' ' ' THR . 0.0 OUTLIER -56.74 -42.11 78.69 Favored 'General case' 0 N--CA 1.5 2.052 0 O-C-N 121.032 -1.042 . . . . 0.0 110.142 -179.819 . . . . . . . . 3 3 . 1 . 020 nuclear build core ' A' A ' 59' ' ' GLU . . . . . . . . . . . . . 7.8 tt0 -59.2 -35.94 74.49 Favored 'General case' 0 N--CA 1.498 1.963 0 O-C-N 121.37 -0.831 . . . . 0.0 110.035 179.175 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 60' ' ' MET . . . . . . . . . . . . . 2.5 tpp -59.18 -46.2 89.04 Favored 'General case' 0 N--CA 1.498 1.95 0 O-C-N 121.584 -0.698 . . . . 0.0 109.989 179.304 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 61' ' ' ILE . . . . . 0.469 HG23 HG23 ' A' ' 72' ' ' VAL . 1.9 mt -72.65 -41.1 62.81 Favored 'Isoleucine or valine' 0 N--CA 1.497 1.884 0 O-C-N 121.352 -0.843 . . . . 0.0 109.716 179.276 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 62' ' ' ASP . . . . . . . . . . . . . 75.1 m-20 -53.62 -31.11 45.83 Favored 'General case' 0 N--CA 1.501 2.098 0 O-C-N 121.476 -0.765 . . . . 0.0 110.956 179.566 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 63' ' ' GLU . . . . . . . . . . . . . 0.3 OUTLIER -68.27 -25.54 65.22 Favored 'General case' 0 N--CA 1.5 2.028 0 O-C-N 121.359 -0.838 . . . . 0.0 111.254 179.958 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 64' ' ' VAL . . . . . 0.463 HG22 ' NH1' ' A' ' 83' ' ' ARG . 20.1 t -121.76 6.34 5.89 Favored 'Isoleucine or valine' 0 N--CA 1.501 2.098 0 O-C-N 121.162 -0.962 . . . . 0.0 111.436 -179.328 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 65' ' ' ASP . . . . . . . . . . . . . 5.6 t70 -98.35 73.94 2.16 Favored 'General case' 0 N--CA 1.496 1.833 0 O-C-N 120.706 -1.246 . . . . 0.0 110.459 179.87 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 66' ' ' GLU . . . . . . . . . . . . . 4.6 mp0 -88.56 55.91 3.58 Favored 'General case' 0 N--CA 1.496 1.832 0 O-C-N 121.239 -0.913 . . . . 0.0 108.978 179.23 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 67' ' ' ASP . . . . . . . . . . . . . 2.1 t70 -126.58 -59.33 1.29 Allowed 'General case' 0 N--CA 1.493 1.71 0 O-C-N 121.6 -0.688 . . . . 0.0 110.944 -178.759 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 68' ' ' GLY . . . . . . . . . . . . . . . 143.09 -40.18 1.26 Allowed Glycine 0 N--CA 1.494 2.518 0 N-CA-C 109.715 -1.354 . . . . 0.0 109.715 -179.434 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 69' ' ' SER . . . . . . . . . . . . . 59.6 p -63.89 -29.0 70.22 Favored 'General case' 0 N--CA 1.5 2.031 0 O-C-N 121.404 -1.057 . . . . 0.0 111.206 -179.9 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 70' ' ' GLY . . . . . . . . . . . . . . . 86.72 -12.91 60.14 Favored Glycine 0 N--CA 1.497 2.717 0 C-N-CA 119.875 -1.155 . . . . 0.0 110.569 -179.806 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 71' ' ' THR . . . . . . . . . . . . . 3.5 m -101.09 138.0 38.71 Favored 'General case' 0 N--CA 1.497 1.91 0 O-C-N 121.028 -1.278 . . . . 0.0 109.681 179.694 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 72' ' ' VAL . . . . . 0.469 HG23 HG23 ' A' ' 61' ' ' ILE . 8.1 t -82.36 125.63 39.88 Favored 'Isoleucine or valine' 0 N--CA 1.496 1.861 0 O-C-N 121.704 -0.622 . . . . 0.0 110.793 -179.634 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 73' ' ' ASP . . . . . . . . . . . . . 0.8 OUTLIER -99.75 -163.17 1.01 Allowed 'General case' 0 N--CA 1.494 1.757 0 O-C-N 121.41 -0.806 . . . . 0.0 109.564 179.206 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 74' ' ' PHE . . . . . 0.754 ' CE2' HD11 ' A' ' 78' ' ' LEU . 65.4 t80 -63.16 -45.78 90.23 Favored 'General case' 0 N--CA 1.5 2.039 0 O-C-N 121.161 -0.962 . . . . 0.0 110.361 179.827 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 75' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -62.22 -51.72 66.65 Favored 'General case' 0 N--CA 1.499 1.979 0 O-C-N 121.373 -0.83 . . . . 0.0 110.616 179.897 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 76' ' ' GLU . . . . . . . . . . . . . 55.5 mt-10 -64.88 -23.22 67.17 Favored 'General case' 0 N--CA 1.501 2.076 0 O-C-N 121.326 -0.859 . . . . 0.0 110.085 179.449 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 77' ' ' PHE . . . . . . . . . . . . . 88.4 t80 -79.34 -35.31 41.22 Favored 'General case' 0 N--CA 1.496 1.868 0 O-C-N 121.3 -0.875 . . . . 0.0 109.677 178.872 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 78' ' ' LEU . . . . . 0.754 HD11 ' CE2' ' A' ' 74' ' ' PHE . 65.5 mt -62.41 -50.42 71.58 Favored 'General case' 0 N--CA 1.498 1.944 0 O-C-N 121.412 -0.805 . . . . 0.0 109.984 179.454 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 79' ' ' VAL . . . . . . . . . . . . . 7.4 p -62.74 -31.91 53.86 Favored 'Isoleucine or valine' 0 N--CA 1.5 2.065 0 O-C-N 121.369 -0.832 . . . . 0.0 109.797 179.066 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 80' ' ' MET . . . . . . . . . . . . . 5.2 ttp -65.71 -38.94 90.58 Favored 'General case' 0 N--CA 1.496 1.839 0 O-C-N 121.255 -0.903 . . . . 0.0 109.47 178.633 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 81' ' ' MET . . . . . . . . . . . . . 7.6 mmt -62.08 -41.62 98.36 Favored 'General case' 0 N--CA 1.497 1.881 0 O-C-N 121.501 -0.749 . . . . 0.0 110.036 179.261 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 82' ' ' VAL . . . . . . . . . . . . . 30.6 t -61.41 -35.85 69.21 Favored 'Isoleucine or valine' 0 N--CA 1.5 2.04 0 O-C-N 121.245 -0.909 . . . . 0.0 109.21 178.79 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 83' ' ' ARG . . . . . 0.463 ' NH1' HG22 ' A' ' 64' ' ' VAL . 8.5 mtt180 -68.18 -26.1 65.57 Favored 'General case' 0 N--CA 1.498 1.938 0 O-C-N 121.422 -0.799 . . . . 0.0 109.761 178.496 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 84' ' ' CYS . . . . . 0.515 ' HB3' ' HA ' ' B' ' 149' ' ' SER . 73.2 m -85.25 11.6 9.69 Favored 'General case' 0 N--CA 1.499 2.009 0 O-C-N 121.364 -0.835 . . . . 0.0 111.097 179.468 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 85' ' ' MET . . . . . . . . . . . . . 2.6 tpp . . . . . 0 N--CA 1.499 2.008 0 O-C-N 121.043 -1.036 . . . . 0.0 111.071 179.782 . . . . . . . . 0 0 . 1 . 020 nuclear build core ' B' B ' 149' ' ' SER . . . . . 0.515 ' HA ' ' HB3' ' A' ' 84' ' ' CYS . 74.0 p . . . . . 0 N--CA 1.495 1.789 0 CA-C-O 121.429 0.633 . . . . 0.0 111.068 . . . . . . . . . 1 1 . 1 . 020 nuclear build core ' B' B ' 150' ' ' ALA . . . . . . . . . . . . . . . -65.49 -49.4 69.18 Favored 'General case' 0 N--CA 1.494 1.772 0 O-C-N 121.704 -0.623 . . . . 0.0 110.766 -179.831 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' B' B ' 151' ' ' ASP . . . . . . . . . . . . . 5.7 p-10 -54.95 -38.84 68.24 Favored 'General case' 0 N--CA 1.502 2.17 0 O-C-N 121.539 -0.726 . . . . 0.0 110.885 179.932 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' B' B ' 152' ' ' ALA . . . . . . . . . . . . . . . -74.64 -44.21 51.56 Favored 'General case' 0 N--CA 1.496 1.851 0 O-C-N 121.296 -0.878 . . . . 0.0 110.43 179.678 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' B' B ' 153' ' ' MET . . . . . . . . . . . . . 2.1 mmt -67.67 -31.73 71.91 Favored 'General case' 0 N--CA 1.498 1.962 0 O-C-N 121.267 -0.896 . . . . 0.0 110.65 179.841 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' B' B ' 154' ' ' MET . . . . . . . . . . . . . 4.4 ttm -57.61 -44.0 85.13 Favored 'General case' 0 N--CA 1.5 2.049 0 O-C-N 121.361 -0.837 . . . . 0.0 110.501 179.876 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' B' B ' 155' ' ' GLN . . . . . . . . . . . . . 1.3 tm0? -66.11 -37.19 85.12 Favored 'General case' 0 N--CA 1.5 2.06 0 O-C-N 121.384 -0.822 . . . . 0.0 110.354 179.631 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' B' B ' 156' ' ' ALA . . . . . . . . . . . . . . . -76.74 -34.29 58.09 Favored 'General case' 0 N--CA 1.499 2.022 0 O-C-N 121.478 -0.764 . . . . 0.0 111.178 -179.753 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' B' B ' 157' ' ' LEU . . . . . 0.543 HD12 ' HB ' ' A' ' 26' ' ' ILE . 3.1 mm? -85.22 -49.68 8.0 Favored 'General case' 0 N--CA 1.5 2.044 0 O-C-N 121.186 -0.946 . . . . 0.0 110.522 -179.565 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' B' B ' 158' ' ' LEU . . . . . . . . . . . . . 3.7 mp . . . . . 0 N--CA 1.496 1.865 0 O-C-N 121.275 -0.89 . . . . 0.0 110.01 179.967 . . . . . . . . 0 0 . 1 . 001 nuclear build full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 0.2 OUTLIER . . . . . 0 N--CA 1.498 1.932 0 CA-C-O 121.058 0.456 . . . . 0.0 110.55 . . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 2' ' ' ASP . . . . . . . . . . . . . 0.8 OUTLIER -123.52 -172.59 2.55 Favored 'General case' 0 N--CA 1.494 1.773 0 O-C-N 121.573 -0.705 . . . . 0.0 110.31 179.81 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 3' ' ' ASP . . . . . . . . . . . . . 3.5 t70 53.65 46.01 26.86 Favored 'General case' 0 N--CA 1.501 2.101 0 O-C-N 121.513 -0.742 . . . . 0.0 110.52 -179.873 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 4' ' ' ILE . . . . . . . . . . . . . 2.8 mp -86.88 -43.48 15.98 Favored 'Isoleucine or valine' 0 N--CA 1.496 1.87 0 O-C-N 121.033 -1.042 . . . . 0.0 110.05 179.943 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 5' ' ' TYR . . . . . . . . . . . . . 9.6 m-85 -71.04 -37.85 72.56 Favored 'General case' 0 N--CA 1.496 1.863 0 O-C-N 121.226 -0.921 . . . . 0.0 110.585 179.849 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -70.49 -32.09 69.46 Favored 'General case' 0 N--CA 1.498 1.963 0 O-C-N 121.16 -0.962 . . . . 0.0 110.04 179.336 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 7' ' ' ALA . . . . . . . . . . . . . . . -55.6 -41.38 73.34 Favored 'General case' 0 N--CA 1.497 1.92 0 O-C-N 121.384 -0.823 . . . . 0.0 109.254 178.54 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 8' ' ' ALA . . . . . . . . . . . . . . . -69.94 -37.04 75.75 Favored 'General case' 0 N--CA 1.495 1.78 0 O-C-N 121.705 -0.622 . . . . 0.0 109.423 178.487 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 9' ' ' VAL . . . . . 0.679 HG11 ' CG2' ' A' ' 79' ' ' VAL . 53.3 t -60.58 -45.11 97.74 Favored 'Isoleucine or valine' 0 N--CA 1.5 2.048 0 O-C-N 121.637 -0.664 . . . . 0.0 109.806 179.148 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 10' ' ' GLU . . . . . . . . . . . . . 25.3 mt-10 -66.06 -46.25 78.47 Favored 'General case' 0 N--CA 1.498 1.932 0 O-C-N 121.567 -0.708 . . . . 0.0 110.068 179.602 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 11' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -80.71 -84.76 0.1 Allowed 'General case' 0 N--CA 1.488 1.455 0 O-C-N 121.531 -0.731 . . . . 0.0 109.661 179.655 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 12' ' ' LEU . . . . . 0.623 HD12 ' HA ' ' A' ' 9' ' ' VAL . 0.8 OUTLIER 53.23 -159.59 0.14 Allowed 'General case' 0 N--CA 1.501 2.08 0 O-C-N 121.428 -0.795 . . . . 0.0 111.047 179.472 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 13' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -142.96 154.69 44.3 Favored 'General case' 0 N--CA 1.495 1.824 0 O-C-N 121.301 -0.874 . . . . 0.0 109.913 179.813 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 14' ' ' GLU . . . . . . . . . . . . . 0.7 OUTLIER -54.15 -39.82 66.88 Favored 'General case' 0 N--CA 1.491 1.6 0 O-C-N 121.696 -0.627 . . . . 0.0 111.015 -179.58 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 1.4 mp0 -55.56 -45.4 77.28 Favored 'General case' 0 N--CA 1.498 1.943 0 O-C-N 121.475 -0.766 . . . . 0.0 110.629 179.742 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 16' ' ' GLN . . . . . . . . . . . . . 69.0 mt-30 -86.01 -33.19 21.12 Favored 'General case' 0 N--CA 1.499 1.991 0 O-C-N 121.344 -0.848 . . . . 0.0 110.983 179.929 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 17' ' ' LYS . . . . . . . . . . . . . 0.4 OUTLIER -65.03 -52.88 53.46 Favored 'General case' 0 N--CA 1.5 2.063 0 O-C-N 121.596 -0.69 . . . . 0.0 110.035 -179.963 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 18' ' ' ASN . . . . . . . . . . . . . 1.3 t-20 -62.37 -32.22 72.99 Favored 'General case' 0 N--CA 1.497 1.902 0 O-C-N 121.545 -0.722 . . . . 0.0 109.462 178.9 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 0.7 OUTLIER -61.37 -45.07 95.91 Favored 'General case' 0 N--CA 1.495 1.817 0 O-C-N 121.558 -0.714 . . . . 0.0 109.687 178.966 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 20' ' ' PHE . . . . . . . . . . . . . 13.4 m-85 -62.77 -35.92 81.37 Favored 'General case' 0 N--CA 1.498 1.974 0 O-C-N 121.409 -0.807 . . . . 0.0 109.438 178.873 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 21' ' ' LYS . . . . . . . . . . . . . 9.5 tptp -64.76 -46.22 83.08 Favored 'General case' 0 N--CA 1.498 1.938 0 O-C-N 121.516 -0.74 . . . . 0.0 109.389 178.602 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 22' ' ' ALA . . . . . . . . . . . . . . . -66.8 -31.15 71.59 Favored 'General case' 0 N--CA 1.498 1.949 0 O-C-N 121.599 -0.688 . . . . 0.0 110.202 179.085 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 23' ' ' ALA . . . . . . . . . . . . . . . -87.17 -7.97 57.41 Favored 'General case' 0 N--CA 1.497 1.899 0 O-C-N 121.231 -0.918 . . . . 0.0 110.806 179.448 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 24' ' ' PHE . . . . . 0.414 ' O ' HG12 ' A' ' 28' ' ' VAL . 93.1 t80 -87.6 -49.89 6.87 Favored 'General case' 0 N--CA 1.498 1.937 0 O-C-N 121.236 -0.915 . . . . 0.0 111.631 -179.265 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 25' ' ' ASP . . . . . . . . . . . . . 5.4 p-10 -58.05 -38.45 76.3 Favored 'General case' 0 N--CA 1.503 2.22 0 O-C-N 121.086 -1.009 . . . . 0.0 111.535 -178.817 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 26' ' ' ILE . . . . . 0.438 ' CG2' HD11 ' B' ' 157' ' ' LEU . 34.2 mt -65.84 -35.54 75.38 Favored 'Isoleucine or valine' 0 N--CA 1.5 2.055 0 O-C-N 120.854 -1.154 . . . . 0.0 109.386 178.918 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 27' ' ' PHE . . . . . 0.705 ' CE1' HG21 ' A' ' 44' ' ' VAL . 0.2 OUTLIER -66.13 -48.48 70.7 Favored 'General case' 0 N--CA 1.497 1.912 0 O-C-N 121.346 -0.846 . . . . 0.0 109.292 178.843 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 28' ' ' VAL . . . . . 1.033 HG23 ' HB3' ' A' ' 31' ' ' ALA . 2.2 p -112.18 95.75 4.1 Favored 'Isoleucine or valine' 0 N--CA 1.497 1.882 0 O-C-N 121.678 -0.638 . . . . 0.0 109.658 178.986 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 29' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -96.18 -39.56 9.63 Favored 'General case' 0 N--CA 1.5 2.06 0 O-C-N 121.371 -0.83 . . . . 0.0 109.879 -179.898 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 30' ' ' GLY . . . . . . . . . . . . . . . -135.32 55.86 0.72 Allowed Glycine 0 N--CA 1.494 2.559 0 N-CA-C 109.121 -1.591 . . . . 0.0 109.121 179.615 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 31' ' ' ALA . . . . . 1.033 ' HB3' HG23 ' A' ' 28' ' ' VAL . . . -119.83 105.25 10.93 Favored 'General case' 0 N--CA 1.492 1.642 0 O-C-N 121.479 -1.012 . . . . 0.0 110.43 -179.712 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 32' ' ' GLU . . . . . . . . . . . . . 1.1 mp0 51.62 -114.95 0.85 Allowed 'General case' 0 N--CA 1.499 1.991 0 O-C-N 121.866 -0.521 . . . . 0.0 111.054 179.679 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -112.4 37.25 3.09 Favored 'General case' 0 N--CA 1.497 1.901 0 O-C-N 120.862 -1.149 . . . . 0.0 110.882 -179.503 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 34' ' ' GLY . . . . . . . . . . . . . . . 92.14 42.35 4.67 Favored Glycine 0 N--CA 1.496 2.685 0 N-CA-C 110.17 -1.172 . . . . 0.0 110.17 179.58 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 35' ' ' CYS . . . . . 0.707 ' N ' HG21 ' A' ' 28' ' ' VAL . 84.0 m -127.02 123.92 38.16 Favored 'General case' 0 N--CA 1.492 1.644 0 O-C-N 121.341 -1.094 . . . . 0.0 109.612 179.4 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 36' ' ' ILE . . . . . 0.557 HG12 ' HB3' ' A' ' 27' ' ' PHE . 87.2 mt -59.2 113.89 0.8 Allowed 'Isoleucine or valine' 0 N--CA 1.498 1.974 0 O-C-N 121.369 -0.832 . . . . 0.0 110.133 -179.724 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 37' ' ' SER . . . . . . . . . . . . . 0.2 OUTLIER -107.47 -172.96 2.17 Favored 'General case' 0 N--CA 1.496 1.854 0 O-C-N 121.581 -0.699 . . . . 0.0 110.373 -179.684 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 38' ' ' THR . . . . . . . . . . . . . 17.6 p -59.23 -42.63 91.49 Favored 'General case' 0 N--CA 1.504 2.228 0 O-C-N 121.338 -0.851 . . . . 0.0 110.831 -179.861 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 39' ' ' LYS . . . . . . . . . . . . . 4.1 ttmt -64.54 -41.44 96.34 Favored 'General case' 0 N--CA 1.5 2.056 0 O-C-N 121.454 -0.779 . . . . 0.0 111.298 -179.602 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 40' ' ' GLU . . . . . 0.547 ' CG ' ' HB2' ' A' ' 31' ' ' ALA . 8.8 mm-40 -67.31 -46.0 74.82 Favored 'General case' 0 N--CA 1.499 2.025 0 O-C-N 121.257 -0.902 . . . . 0.0 109.925 -179.85 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 41' ' ' LEU . . . . . 0.569 ' O ' HD12 ' A' ' 41' ' ' LEU . 3.9 tp -63.58 -40.33 96.69 Favored 'General case' 0 N--CA 1.496 1.838 0 O-C-N 121.344 -0.848 . . . . 0.0 109.561 179.0 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 42' ' ' GLY . . . . . . . . . . . . . . . -60.5 -31.57 74.97 Favored Glycine 0 N--CA 1.494 2.524 0 N-CA-C 110.144 -1.182 . . . . 0.0 110.144 179.576 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 43' ' ' LYS . . . . . . . . . . . . . 0.5 OUTLIER -58.59 -47.97 82.51 Favored 'General case' 0 N--CA 1.5 2.038 0 O-C-N 121.272 -1.134 . . . . 0.0 109.563 179.219 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 44' ' ' VAL . . . . . 0.705 HG21 ' CE1' ' A' ' 27' ' ' PHE . 86.9 t -71.5 -29.78 36.42 Favored 'Isoleucine or valine' 0 N--CA 1.498 1.961 0 O-C-N 121.511 -0.743 . . . . 0.0 109.847 178.889 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 45' ' ' MET . . . . . . . . . . . . . 5.6 mmt -58.9 -39.04 80.31 Favored 'General case' 0 N--CA 1.501 2.079 0 O-C-N 121.344 -0.848 . . . . 0.0 109.861 179.147 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 46' ' ' ARG . . . . . . . . . . . . . 1.6 ttp180 -64.32 -32.41 74.01 Favored 'General case' 0 N--CA 1.496 1.875 0 O-C-N 121.624 -0.673 . . . . 0.0 110.434 179.408 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 47' ' ' MET . . . . . . . . . . . . . 12.0 mmm -61.24 -37.83 84.47 Favored 'General case' 0 N--CA 1.502 2.165 0 O-C-N 121.392 -0.818 . . . . 0.0 110.102 179.524 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 48' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -68.17 -37.98 81.56 Favored 'General case' 0 N--CA 1.497 1.904 0 O-C-N 121.413 -0.805 . . . . 0.0 110.186 179.537 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 49' ' ' GLY . . . . . . . . . . . . . . . 130.77 11.1 2.42 Favored Glycine 0 N--CA 1.497 2.716 0 C-N-CA 120.506 -0.854 . . . . 0.0 111.18 179.537 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 50' ' ' GLN . . . . . . . . . . . . . 0.1 OUTLIER -127.78 138.01 52.6 Favored 'General case' 0 N--CA 1.495 1.789 0 O-C-N 120.887 -1.361 . . . . 0.0 110.524 179.934 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 51' ' ' ASN . . . . . . . . . . . . . 1.4 m120 -122.18 80.32 44.07 Favored Pre-proline 0 N--CA 1.495 1.787 0 O-C-N 121.551 -0.718 . . . . 0.0 109.721 179.713 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 52' ' ' PRO . . . . . . . . . . . . . 49.8 Cg_endo -78.03 168.18 22.39 Favored 'Trans proline' 0 C--N 1.316 -1.136 0 O-C-N 123.885 1.466 . . . . 0.0 111.078 -179.292 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 53' ' ' THR . . . . . 0.561 ' HB ' ' HD2' ' A' ' 54' ' ' PRO . 41.3 p -76.56 168.81 24.8 Favored Pre-proline 0 N--CA 1.498 1.951 0 O-C-N 121.473 -0.767 . . . . 0.0 109.694 179.411 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 54' ' ' PRO . . . . . 0.561 ' HD2' ' HB ' ' A' ' 53' ' ' THR . 40.8 Cg_endo -64.83 -25.62 60.33 Favored 'Trans proline' 0 N--CA 1.491 1.338 0 O-C-N 123.45 1.237 . . . . 0.0 110.888 -179.984 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 55' ' ' GLU . . . . . . . . . . . . . 0.6 OUTLIER -64.79 -39.49 93.68 Favored 'General case' 0 N--CA 1.498 1.962 0 O-C-N 121.437 -0.789 . . . . 0.0 109.974 179.091 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 56' ' ' GLU . . . . . 0.45 ' O ' ' HE3' ' A' ' 60' ' ' MET . 0.6 OUTLIER -54.22 -46.48 72.51 Favored 'General case' 0 N--CA 1.499 1.988 0 O-C-N 121.634 -0.666 . . . . 0.0 109.985 179.526 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 57' ' ' LEU . . . . . 0.62 ' H ' HD22 ' A' ' 57' ' ' LEU . 0.7 OUTLIER -77.83 -28.01 50.1 Favored 'General case' 0 N--CA 1.492 1.673 0 O-C-N 121.334 -0.854 . . . . 0.0 110.245 179.545 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 58' ' ' GLN . . . . . 0.594 ' HG3' ' N ' ' A' ' 59' ' ' GLU . 0.0 OUTLIER -59.76 -34.2 72.68 Favored 'General case' 0 N--CA 1.497 1.884 0 O-C-N 121.08 -1.012 . . . . 0.0 109.077 179.054 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 59' ' ' GLU . . . . . 0.594 ' N ' ' HG3' ' A' ' 58' ' ' GLN . 0.5 OUTLIER -69.63 -37.05 76.65 Favored 'General case' 0 N--CA 1.494 1.763 0 N-CA-C 108.505 -0.924 . . . . 0.0 108.505 177.781 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 60' ' ' MET . . . . . 0.45 ' HE3' ' O ' ' A' ' 56' ' ' GLU . 4.1 mtm -63.1 -44.62 95.16 Favored 'General case' 0 N--CA 1.496 1.867 0 O-C-N 121.809 -0.557 . . . . 0.0 109.835 178.602 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 61' ' ' ILE . . . . . 0.59 HG13 HG23 ' A' ' 72' ' ' VAL . 0.2 OUTLIER -66.93 -33.6 64.45 Favored 'Isoleucine or valine' 0 N--CA 1.498 1.968 0 O-C-N 121.624 -0.673 . . . . 0.0 110.472 179.826 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 62' ' ' ASP . . . . . . . . . . . . . 0.9 OUTLIER -70.2 -35.86 74.22 Favored 'General case' 0 N--CA 1.498 1.947 0 O-C-N 121.27 -0.894 . . . . 0.0 110.276 179.607 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 63' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER -65.78 -35.73 81.54 Favored 'General case' 0 N--CA 1.497 1.912 0 O-C-N 121.355 -0.841 . . . . 0.0 111.174 -179.882 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 64' ' ' VAL . . . . . 0.652 HG11 ' SD ' ' A' ' 80' ' ' MET . 33.4 m -102.54 -15.58 7.8 Favored 'Isoleucine or valine' 0 N--CA 1.502 2.126 0 O-C-N 121.212 -0.93 . . . . 0.0 111.964 -179.359 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 65' ' ' ASP . . . . . . . . . . . . . 21.6 t0 -131.74 140.74 49.34 Favored 'General case' 0 N--CA 1.498 1.956 0 O-C-N 120.843 -1.16 . . . . 0.0 111.6 -179.774 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 66' ' ' GLU . . . . . . . . . . . . . 3.3 tp10 -155.46 40.01 0.4 Allowed 'General case' 0 N--CA 1.492 1.631 0 CA-C-O 121.477 0.656 . . . . 0.0 109.43 179.017 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 67' ' ' ASP . . . . . . . . . . . . . 12.1 p-10 -99.15 4.49 46.85 Favored 'General case' 0 N--CA 1.498 1.962 0 O-C-N 121.437 -0.789 . . . . 0.0 111.536 -179.532 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 68' ' ' GLY . . . . . . . . . . . . . . . 105.8 -32.39 7.45 Favored Glycine 0 N--CA 1.493 2.452 0 N-CA-C 109.543 -1.423 . . . . 0.0 109.543 -179.724 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 69' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER -69.07 -42.8 75.73 Favored 'General case' 0 N--CA 1.495 1.823 0 O-C-N 121.396 -1.061 . . . . 0.0 110.428 179.826 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 70' ' ' GLY . . . . . . . . . . . . . . . 72.78 29.76 64.82 Favored Glycine 0 N--CA 1.496 2.688 0 N-CA-C 109.248 -1.541 . . . . 0.0 109.248 -179.781 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 71' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -136.39 143.07 43.8 Favored 'General case' 0 N--CA 1.492 1.638 0 O-C-N 121.622 -0.928 . . . . 0.0 108.968 179.938 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 72' ' ' VAL . . . . . 0.59 HG23 HG13 ' A' ' 61' ' ' ILE . 3.9 t -75.5 110.63 10.71 Favored 'Isoleucine or valine' 0 N--CA 1.497 1.891 0 O-C-N 121.635 -0.665 . . . . 0.0 110.235 -179.585 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 73' ' ' ASP . . . . . . . . . . . . . 46.0 m-20 -83.03 -174.57 5.37 Favored 'General case' 0 N--CA 1.496 1.848 0 O-C-N 121.596 -0.69 . . . . 0.0 109.431 179.72 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 74' ' ' PHE . . . . . . . . . . . . . 52.2 t80 -60.62 -47.69 85.09 Favored 'General case' 0 N--CA 1.5 2.027 0 O-C-N 121.093 -1.004 . . . . 0.0 109.792 179.701 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 75' ' ' ASP . . . . . 0.572 ' HA ' HD23 ' A' ' 78' ' ' LEU . 23.6 t70 -62.14 -52.33 64.29 Favored 'General case' 0 N--CA 1.494 1.729 0 O-C-N 121.66 -0.65 . . . . 0.0 110.148 179.534 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 76' ' ' GLU . . . . . . . . . . . . . 18.4 mt-10 -57.65 -38.38 74.98 Favored 'General case' 0 N--CA 1.5 2.028 0 O-C-N 121.534 -0.729 . . . . 0.0 110.508 179.631 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 77' ' ' PHE . . . . . . . . . . . . . 58.0 t80 -63.48 -48.15 78.85 Favored 'General case' 0 N--CA 1.496 1.848 0 O-C-N 121.367 -0.833 . . . . 0.0 109.619 179.019 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 78' ' ' LEU . . . . . 0.572 HD23 ' HA ' ' A' ' 75' ' ' ASP . 0.1 OUTLIER -71.13 -30.93 67.11 Favored 'General case' 0 N--CA 1.496 1.867 0 O-C-N 121.45 -0.781 . . . . 0.0 109.734 179.117 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 79' ' ' VAL . . . . . 0.679 ' CG2' HG11 ' A' ' 9' ' ' VAL . 4.8 t -68.4 -39.71 81.23 Favored 'Isoleucine or valine' 0 N--CA 1.501 2.093 0 O-C-N 121.216 -0.927 . . . . 0.0 109.102 178.276 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 80' ' ' MET . . . . . 0.652 ' SD ' HG11 ' A' ' 64' ' ' VAL . 26.0 ttp -68.5 -27.46 66.15 Favored 'General case' 0 N--CA 1.495 1.822 0 O-C-N 121.562 -0.711 . . . . 0.0 109.936 179.057 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 81' ' ' MET . . . . . 0.414 ' O ' ' HB2' ' A' ' 85' ' ' MET . 8.1 mmt -67.01 -55.17 15.58 Favored 'General case' 0 N--CA 1.496 1.845 0 O-C-N 121.467 -0.77 . . . . 0.0 110.793 179.948 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 82' ' ' VAL . . . . . 0.408 HG22 ' O ' ' A' ' 79' ' ' VAL . 20.2 m -59.46 -30.66 44.9 Favored 'Isoleucine or valine' 0 N--CA 1.503 2.177 0 O-C-N 121.424 -0.798 . . . . 0.0 110.681 -179.829 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 83' ' ' ARG . . . . . . . . . . . . . 5.3 mtp-105 -52.6 -47.27 67.05 Favored 'General case' 0 N--CA 1.5 2.047 0 O-C-N 121.468 -0.77 . . . . 0.0 110.297 179.424 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 84' ' ' CYS . . . . . . . . . . . . . 36.1 m -94.3 -4.35 48.88 Favored 'General case' 0 N--CA 1.499 2.0 0 O-C-N 121.426 -0.796 . . . . 0.0 110.465 178.968 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 85' ' ' MET . . . . . 0.496 ' O ' ' HB2' ' A' ' 86' ' ' LYS . 3.3 ttm -82.47 -11.83 58.23 Favored 'General case' 0 N--CA 1.497 1.923 0 O-C-N 121.219 -0.925 . . . . 0.0 111.118 179.503 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 86' ' ' LYS . . . . . 0.496 ' HB2' ' O ' ' A' ' 85' ' ' MET . 0.0 OUTLIER 63.57 -176.34 0.16 Allowed 'General case' 0 N--CA 1.505 2.301 0 O-C-N 121.435 -0.791 . . . . 0.0 110.553 -179.686 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 87' ' ' ASP . . . . . . . . . . . . . 7.7 p-10 -109.7 -175.37 2.73 Favored 'General case' 0 N--CA 1.499 1.992 0 O-C-N 121.082 -1.011 . . . . 0.0 111.212 -179.393 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 88' ' ' ASP . . . . . . . . . . . . . 6.6 p-10 -95.98 -25.17 16.04 Favored 'General case' 0 N--CA 1.499 2.011 0 O-C-N 121.503 -0.748 . . . . 0.0 111.665 -179.113 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 89' ' ' SER . . . . . . . . . . . . . 8.0 m . . . . . 0 N--CA 1.503 2.178 0 CA-C-O 117.75 -1.119 . . . . 0.0 111.244 -179.582 . . . . . . . . 0 0 . 1 . 001 nuclear build full ' B' B ' 144' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.497 1.877 0 CA-C-O 121.043 0.449 . . . . 0.0 110.112 . . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 145' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -114.58 57.31 0.71 Allowed 'General case' 0 N--CA 1.494 1.769 0 O-C-N 121.39 -0.819 . . . . 0.0 110.346 -179.616 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' B' B ' 146' ' ' VAL . . . . . . . . . . . . . 72.0 t -121.76 103.29 13.32 Favored 'Isoleucine or valine' 0 N--CA 1.499 1.991 0 O-C-N 121.217 -0.927 . . . . 0.0 110.127 -179.941 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 147' ' ' ARG . . . . . . . . . . . . . 16.7 tpp180 -164.84 135.91 4.12 Favored 'General case' 0 N--CA 1.497 1.893 0 O-C-N 121.505 -0.747 . . . . 0.0 109.944 -179.879 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 148' ' ' ILE . . . . . 0.414 HD13 ' HAH' ' A' ' 91' ' ' SXK . 2.7 mp -132.06 142.29 43.24 Favored 'Isoleucine or valine' 0 N--CA 1.496 1.863 0 O-C-N 121.469 -0.77 . . . . 0.0 110.63 -179.352 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' B' B ' 149' ' ' SER . . . . . . . . . . . . . 2.2 t -112.75 158.06 20.56 Favored 'General case' 0 N--CA 1.497 1.895 0 O-C-N 121.563 -0.71 . . . . 0.0 109.563 179.348 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 150' ' ' ALA . . . . . . . . . . . . . . . -57.79 -55.47 34.47 Favored 'General case' 0 N--CA 1.499 2.008 0 O-C-N 121.261 -0.899 . . . . 0.0 110.542 -179.828 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 151' ' ' ASP . . . . . . . . . . . . . 18.5 t70 -65.27 -41.54 94.12 Favored 'General case' 0 N--CA 1.497 1.894 0 O-C-N 121.328 -0.858 . . . . 0.0 110.58 179.752 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 152' ' ' ALA . . . . . . . . . . . . . . . -59.84 -52.37 65.74 Favored 'General case' 0 N--CA 1.499 2.013 0 O-C-N 121.414 -0.804 . . . . 0.0 110.649 179.981 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 153' ' ' MET . . . . . . . . . . . . . 1.3 tpt -63.22 -40.56 97.8 Favored 'General case' 0 N--CA 1.497 1.892 0 O-C-N 121.291 -0.881 . . . . 0.0 110.183 179.779 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 154' ' ' MET . . . . . . . . . . . . . 1.7 mtp -63.34 -43.85 96.53 Favored 'General case' 0 N--CA 1.501 2.118 0 O-C-N 121.346 -0.846 . . . . 0.0 110.121 179.345 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 155' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -60.25 -40.17 89.35 Favored 'General case' 0 N--CA 1.498 1.965 0 O-C-N 121.635 -0.666 . . . . 0.0 110.049 179.493 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' B' B ' 156' ' ' ALA . . . . . . . . . . . . . . . -78.29 -25.11 46.5 Favored 'General case' 0 N--CA 1.495 1.816 0 O-C-N 121.434 -0.791 . . . . 0.0 110.33 179.213 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 157' ' ' LEU . . . . . 0.438 HD11 ' CG2' ' A' ' 26' ' ' ILE . 0.5 OUTLIER -69.65 -50.36 44.84 Favored 'General case' 0 N--CA 1.497 1.921 0 O-C-N 121.349 -0.844 . . . . 0.0 110.503 179.951 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' B' B ' 158' ' ' LEU . . . . . . . . . . . . . 1.6 mt -116.63 46.83 1.55 Allowed 'General case' 0 N--CA 1.496 1.874 0 O-C-N 121.224 -0.922 . . . . 0.0 110.245 179.713 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 159' ' ' GLY . . . . . . . . . . . . . . . -156.18 -57.2 0.01 OUTLIER Glycine 0 N--CA 1.496 2.644 0 N-CA-C 109.901 -1.28 . . . . 0.0 109.901 -179.957 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 160' ' ' ALA . . . . . . . . . . . . . . . -67.01 97.54 0.5 Allowed 'General case' 0 N--CA 1.496 1.845 0 O-C-N 121.467 -1.019 . . . . 0.0 110.399 -179.972 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 161' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER 51.02 45.93 27.11 Favored 'General case' 0 N--CA 1.501 2.09 0 O-C-N 121.561 -0.712 . . . . 0.0 110.852 179.966 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' B' B ' 162' ' ' ALA . . . . . . . . . . . . . . . -136.2 -49.69 0.68 Allowed 'General case' 0 N--CA 1.495 1.823 0 O-C-N 121.235 -0.915 . . . . 0.0 110.374 -179.926 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 163' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER . . . . . 0 N--CA 1.496 1.848 0 CA-C-O 118.204 -0.903 . . . . 0.0 110.391 179.704 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 90' ' ' ' CA' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 nuclear build full ' A' A ' 91' ' ' SXK . . . . . 0.521 ' HAI' ' HG2' ' A' ' 80' ' ' MET . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 1.4 mpp? . . . . . 0 N--CA 1.494 1.771 0 CA-C-O 120.907 0.385 . . . . 0.0 110.107 . . . . . . . . . 0 0 . 1 . 002 nuclear build full ' A' A ' 2' ' ' ASP . . . . . . . . . . . . . 30.5 t70 -108.24 -77.84 0.59 Allowed 'General case' 0 N--CA 1.496 1.856 0 O-C-N 121.371 -0.83 . . . . 0.0 110.433 -179.754 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 3' ' ' ASP . . . . . 0.602 ' HB3' ' HB2' ' A' ' 6' ' ' LYS . 5.1 t70 -132.12 142.07 49.37 Favored 'General case' 0 N--CA 1.493 1.72 0 O-C-N 121.211 -0.93 . . . . 0.0 110.119 -179.98 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 4' ' ' ILE . . . . . 0.426 HG13 ' N ' ' A' ' 5' ' ' TYR . 35.3 pt -67.34 -38.01 80.06 Favored 'Isoleucine or valine' 0 N--CA 1.501 2.094 0 O-C-N 121.544 -0.722 . . . . 0.0 110.615 -179.659 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 5' ' ' TYR . . . . . 0.426 ' N ' HG13 ' A' ' 4' ' ' ILE . 56.8 m-85 -71.1 -21.78 62.18 Favored 'General case' 0 N--CA 1.496 1.834 0 O-C-N 121.297 -0.877 . . . . 0.0 109.749 179.022 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 6' ' ' LYS . . . . . 0.602 ' HB2' ' HB3' ' A' ' 3' ' ' ASP . 0.1 OUTLIER -69.32 -49.64 53.88 Favored 'General case' 0 N--CA 1.494 1.762 0 O-C-N 121.492 -0.755 . . . . 0.0 109.722 178.916 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 7' ' ' ALA . . . . . . . . . . . . . . . -50.56 -38.84 47.4 Favored 'General case' 0 N--CA 1.499 2.017 0 O-C-N 121.572 -0.705 . . . . 0.0 110.345 179.422 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 8' ' ' ALA . . . . . . . . . . . . . . . -59.07 -42.31 90.05 Favored 'General case' 0 N--CA 1.497 1.889 0 O-C-N 121.561 -0.712 . . . . 0.0 109.758 178.978 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 9' ' ' VAL . . . . . 0.616 HG21 ' CG2' ' A' ' 79' ' ' VAL . 55.3 t -66.91 -42.67 89.22 Favored 'Isoleucine or valine' 0 N--CA 1.498 1.967 0 O-C-N 121.602 -0.686 . . . . 0.0 109.552 178.969 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 10' ' ' GLU . . . . . . . . . . . . . 0.9 OUTLIER -57.93 -39.83 78.96 Favored 'General case' 0 N--CA 1.499 1.989 0 O-C-N 121.484 -0.76 . . . . 0.0 110.041 178.949 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 11' ' ' GLN . . . . . . . . . . . . . 5.4 mt-30 -109.1 48.22 0.88 Allowed 'General case' 0 N--CA 1.495 1.786 0 O-C-N 121.486 -0.759 . . . . 0.0 109.926 179.501 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 12' ' ' LEU . . . . . 0.479 HD22 ' HB3' ' A' ' 16' ' ' GLN . 2.8 mt -82.8 158.73 22.66 Favored 'General case' 0 N--CA 1.5 2.027 0 O-C-N 121.309 -0.869 . . . . 0.0 110.636 -179.874 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 13' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -80.15 153.36 28.7 Favored 'General case' 0 N--CA 1.498 1.945 0 O-C-N 121.49 -0.756 . . . . 0.0 110.488 179.876 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 14' ' ' GLU . . . . . . . . . . . . . 12.4 tp10 -58.17 -47.18 84.2 Favored 'General case' 0 N--CA 1.492 1.673 0 C-N-CA 120.106 -0.637 . . . . 0.0 109.966 179.81 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 5.0 tt0 -57.68 -45.51 85.51 Favored 'General case' 0 N--CA 1.499 2.0 0 O-C-N 121.443 -0.786 . . . . 0.0 109.906 179.157 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 16' ' ' GLN . . . . . 0.479 ' HB3' HD22 ' A' ' 12' ' ' LEU . 3.0 mp0 -63.29 -48.41 78.25 Favored 'General case' 0 N--CA 1.496 1.875 0 CA-C-O 121.648 0.737 . . . . 0.0 110.158 179.381 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 17' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -60.97 -49.33 77.87 Favored 'General case' 0 N--CA 1.496 1.871 0 CA-C-N 116.245 -0.434 . . . . 0.0 110.199 179.647 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 18' ' ' ASN . . . . . . . . . . . . . 0.5 OUTLIER -62.12 -39.95 94.25 Favored 'General case' 0 N--CA 1.497 1.896 0 O-C-N 121.504 -0.748 . . . . 0.0 110.129 179.619 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 19' ' ' GLU . . . . . 0.403 ' HB3' ' CE ' ' B' ' 154' ' ' MET . 7.6 mm-40 -63.89 -49.32 73.18 Favored 'General case' 0 N--CA 1.497 1.907 0 O-C-N 121.51 -0.744 . . . . 0.0 110.001 179.529 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 20' ' ' PHE . . . . . 0.4 ' CE1' ' HB3' ' A' ' 81' ' ' MET . 15.6 m-85 -66.49 -35.04 79.28 Favored 'General case' 0 N--CA 1.499 2.0 0 O-C-N 121.365 -0.834 . . . . 0.0 110.235 179.497 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 21' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -58.58 -54.2 49.7 Favored 'General case' 0 N--CA 1.498 1.951 0 O-C-N 121.423 -0.798 . . . . 0.0 109.907 179.434 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 22' ' ' ALA . . . . . . . . . . . . . . . -66.04 -42.07 90.02 Favored 'General case' 0 N--CA 1.496 1.834 0 O-C-N 121.53 -0.732 . . . . 0.0 110.619 179.974 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 23' ' ' ALA . . . . . . . . . . . . . . . -61.99 -40.77 96.78 Favored 'General case' 0 N--CA 1.499 1.994 0 O-C-N 121.324 -0.86 . . . . 0.0 110.105 179.478 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 24' ' ' PHE . . . . . . . . . . . . . 67.9 t80 -60.82 -45.31 94.95 Favored 'General case' 0 N--CA 1.498 1.956 0 O-C-N 121.561 -0.712 . . . . 0.0 110.088 179.392 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 25' ' ' ASP . . . . . . . . . . . . . 3.2 m-20 -60.52 -38.2 83.62 Favored 'General case' 0 N--CA 1.498 1.942 0 O-C-N 121.595 -0.691 . . . . 0.0 110.246 179.694 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 26' ' ' ILE . . . . . 0.574 ' HA ' HD12 ' A' ' 29' ' ' LEU . 57.1 mt -74.68 -26.87 20.13 Favored 'Isoleucine or valine' 0 N--CA 1.5 2.043 0 O-C-N 121.311 -0.868 . . . . 0.0 109.919 179.285 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 27' ' ' PHE . . . . . 0.479 ' CE1' HG21 ' A' ' 44' ' ' VAL . 0.2 OUTLIER -71.4 -37.92 71.5 Favored 'General case' 0 N--CA 1.496 1.866 0 O-C-N 121.288 -0.883 . . . . 0.0 111.245 -179.836 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 28' ' ' VAL . . . . . 0.567 ' CG2' ' HA ' ' A' ' 33' ' ' ASP . 28.1 m -79.71 9.79 0.7 Allowed 'Isoleucine or valine' 0 N--CA 1.503 2.211 0 O-C-N 121.29 -0.881 . . . . 0.0 111.726 -179.518 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 29' ' ' LEU . . . . . 0.574 HD12 ' HA ' ' A' ' 26' ' ' ILE . 2.5 mt -70.63 96.11 1.17 Allowed 'General case' 0 N--CA 1.496 1.834 0 O-C-N 121.001 -1.062 . . . . 0.0 109.737 179.449 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 30' ' ' GLY . . . . . . . . . . . . . . . 143.47 -25.21 2.16 Favored Glycine 0 N--CA 1.493 2.471 0 N-CA-C 109.264 -1.534 . . . . 0.0 109.264 -178.963 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 31' ' ' ALA . . . . . . . . . . . . . . . -98.8 -83.21 0.42 Allowed 'General case' 0 N--CA 1.494 1.757 0 O-C-N 121.42 -1.047 . . . . 0.0 109.951 179.679 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 32' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -157.63 27.41 0.28 Allowed 'General case' 0 N--CA 1.5 2.056 0 O-C-N 121.465 -0.772 . . . . 0.0 110.445 179.82 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 33' ' ' ASP . . . . . 0.567 ' HA ' ' CG2' ' A' ' 28' ' ' VAL . 11.2 m-20 51.76 54.07 11.58 Favored 'General case' 0 N--CA 1.5 2.048 0 O-C-N 121.535 -0.728 . . . . 0.0 111.066 179.819 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 34' ' ' GLY . . . . . . . . . . . . . . . -166.85 -38.51 0.02 OUTLIER Glycine 0 N--CA 1.499 2.883 0 C-N-CA 119.782 -1.199 . . . . 0.0 111.668 -179.817 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 35' ' ' CYS . . . . . . . . . . . . . 0.1 OUTLIER -135.69 156.24 49.15 Favored 'General case' 0 N--CA 1.498 1.975 0 O-C-N 120.981 -1.305 . . . . 0.0 111.353 -178.832 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 36' ' ' ILE . . . . . 0.566 ' HB ' ' HB ' ' A' ' 72' ' ' VAL . 1.2 mp -113.75 126.74 71.28 Favored 'Isoleucine or valine' 0 N--CA 1.496 1.875 0 O-C-N 121.405 -0.809 . . . . 0.0 109.81 179.253 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 37' ' ' SER . . . . . . . . . . . . . 52.1 p -103.06 -168.34 1.5 Allowed 'General case' 0 N--CA 1.497 1.887 0 O-C-N 121.482 -0.761 . . . . 0.0 110.593 -179.902 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 38' ' ' THR . . . . . . . . . . . . . 30.1 p -65.49 -46.21 80.64 Favored 'General case' 0 N--CA 1.501 2.103 0 O-C-N 121.291 -0.88 . . . . 0.0 110.255 179.675 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 39' ' ' LYS . . . . . . . . . . . . . 10.8 mttm -65.75 -38.34 88.83 Favored 'General case' 0 N--CA 1.499 1.99 0 O-C-N 121.484 -0.76 . . . . 0.0 110.031 179.459 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 40' ' ' GLU . . . . . 0.405 ' HB3' HG23 ' A' ' 36' ' ' ILE . 4.2 tp10 -64.69 -30.74 71.76 Favored 'General case' 0 N--CA 1.496 1.832 0 O-C-N 121.528 -0.732 . . . . 0.0 110.22 179.465 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 41' ' ' LEU . . . . . 0.698 ' CD2' HD22 ' A' ' 57' ' ' LEU . 6.0 tp -85.96 -45.84 11.11 Favored 'General case' 0 N--CA 1.496 1.841 0 O-C-N 121.445 -0.784 . . . . 0.0 110.602 179.615 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 42' ' ' GLY . . . . . . . . . . . . . . . -51.71 -39.12 45.95 Favored Glycine 0 N--CA 1.497 2.754 0 N-CA-C 111.141 -0.783 . . . . 0.0 111.141 -178.939 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 43' ' ' LYS . . . . . . . . . . . . . 2.7 pttm -58.9 -30.83 68.08 Favored 'General case' 0 N--CA 1.5 2.056 0 O-C-N 121.242 -1.152 . . . . 0.0 110.793 -179.975 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 44' ' ' VAL . . . . . 0.479 HG21 ' CE1' ' A' ' 27' ' ' PHE . 93.4 t -86.66 -32.49 6.59 Favored 'Isoleucine or valine' 0 N--CA 1.499 2.002 0 O-C-N 121.232 -0.917 . . . . 0.0 109.658 178.765 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 45' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -57.28 -50.67 72.16 Favored 'General case' 0 N--CA 1.5 2.04 0 O-C-N 121.443 -0.785 . . . . 0.0 110.282 179.8 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 46' ' ' ARG . . . . . 0.417 ' N ' ' HB2' ' A' ' 51' ' ' ASN . 0.0 OUTLIER -69.28 -41.04 77.38 Favored 'General case' 0 N--CA 1.499 1.987 0 O-C-N 121.394 -0.816 . . . . 0.0 109.796 179.393 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 47' ' ' MET . . . . . . . . . . . . . 0.2 OUTLIER -62.2 -37.44 85.3 Favored 'General case' 0 N--CA 1.499 1.988 0 O-C-N 121.574 -0.704 . . . . 0.0 110.112 179.238 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 48' ' ' LEU . . . . . 0.534 HD13 ' HG3' ' B' ' 153' ' ' MET . 0.4 OUTLIER -75.86 -46.75 28.59 Favored 'General case' 0 N--CA 1.493 1.686 0 O-C-N 121.446 -0.784 . . . . 0.0 110.229 179.592 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 49' ' ' GLY . . . . . . . . . . . . . . . -161.8 -82.69 0.04 OUTLIER Glycine 0 N--CA 1.494 2.508 0 N-CA-C 110.237 -1.145 . . . . 0.0 110.237 -179.832 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 50' ' ' GLN . . . . . . . . . . . . . 78.2 mt-30 -127.28 143.07 51.31 Favored 'General case' 0 N--CA 1.497 1.891 0 O-C-N 121.408 -1.054 . . . . 0.0 111.144 -179.361 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 51' ' ' ASN . . . . . 0.417 ' HB2' ' N ' ' A' ' 46' ' ' ARG . 33.1 t30 -116.4 110.97 42.35 Favored Pre-proline 0 N--CA 1.493 1.712 0 O-C-N 121.485 -0.759 . . . . 0.0 109.574 178.859 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 52' ' ' PRO . . . . . . . . . . . . . 44.0 Cg_endo -71.34 -92.62 0.01 OUTLIER 'Trans proline' 0 C--N 1.312 -1.361 0 O-C-N 124.003 1.528 . . . . 0.0 111.014 -179.541 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 53' ' ' THR . . . . . . . . . . . . . 0.6 OUTLIER -144.92 160.38 46.91 Favored Pre-proline 0 N--CA 1.495 1.801 0 O-C-N 120.841 -1.162 . . . . 0.0 110.667 -179.532 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 54' ' ' PRO . . . . . . . . . . . . . 43.5 Cg_endo -69.42 -38.14 8.97 Favored 'Trans proline' 0 N--CA 1.492 1.392 0 O-C-N 124.039 1.547 . . . . 0.0 111.307 179.993 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 55' ' ' GLU . . . . . . . . . . . . . 32.6 mt-10 -61.31 -38.44 86.86 Favored 'General case' 0 N--CA 1.499 1.996 0 O-C-N 121.381 -0.825 . . . . 0.0 110.634 -179.837 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 15.1 mm-40 -62.19 -37.99 87.39 Favored 'General case' 0 N--CA 1.498 1.961 0 O-C-N 121.417 -0.802 . . . . 0.0 110.765 179.736 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 57' ' ' LEU . . . . . 0.698 HD22 ' CD2' ' A' ' 41' ' ' LEU . 74.4 mt -68.65 -31.91 71.38 Favored 'General case' 0 N--CA 1.496 1.871 0 O-C-N 121.228 -0.92 . . . . 0.0 110.405 179.952 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 58' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -55.13 -52.56 62.89 Favored 'General case' 0 N--CA 1.498 1.946 0 O-C-N 121.287 -0.883 . . . . 0.0 109.041 179.024 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 59' ' ' GLU . . . . . . . . . . . . . 1.5 tm-20 -66.37 -35.96 81.67 Favored 'General case' 0 N--CA 1.494 1.744 0 N-CA-C 108.958 -0.756 . . . . 0.0 108.958 178.033 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 60' ' ' MET . . . . . . . . . . . . . 3.0 tpp -55.98 -40.68 73.63 Favored 'General case' 0 N--CA 1.498 1.949 0 O-C-N 121.571 -0.705 . . . . 0.0 109.775 178.715 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 61' ' ' ILE . . . . . 0.464 HG12 ' CG2' ' A' ' 72' ' ' VAL . 69.2 mt -71.19 -50.14 43.64 Favored 'Isoleucine or valine' 0 N--CA 1.498 1.959 0 O-C-N 121.446 -0.784 . . . . 0.0 109.302 178.928 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 62' ' ' ASP . . . . . 0.445 ' HA ' ' CB ' ' A' ' 65' ' ' ASP . 5.1 m-20 -58.9 -26.97 64.79 Favored 'General case' 0 N--CA 1.498 1.965 0 O-C-N 121.704 -0.623 . . . . 0.0 110.865 179.64 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 63' ' ' GLU . . . . . . . . . . . . . 3.0 tt0 -50.94 -39.08 53.98 Favored 'General case' 0 N--CA 1.501 2.076 0 O-C-N 121.347 -0.846 . . . . 0.0 109.981 179.179 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 64' ' ' VAL . . . . . . . . . . . . . 9.8 p -125.83 25.78 2.87 Favored 'Isoleucine or valine' 0 N--CA 1.495 1.824 0 O-C-N 121.587 -0.696 . . . . 0.0 110.393 179.259 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 65' ' ' ASP . . . . . 0.445 ' CB ' ' HA ' ' A' ' 62' ' ' ASP . 9.3 t70 -86.74 116.36 24.79 Favored 'General case' 0 N--CA 1.498 1.934 0 O-C-N 121.099 -1.001 . . . . 0.0 110.397 179.886 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 66' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER -80.07 -20.98 43.91 Favored 'General case' 0 N--CA 1.497 1.895 0 O-C-N 121.505 -0.747 . . . . 0.0 110.627 179.457 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 67' ' ' ASP . . . . . . . . . . . . . 70.0 m-20 -80.52 -15.75 55.93 Favored 'General case' 0 N--CA 1.497 1.918 0 O-C-N 121.18 -0.95 . . . . 0.0 111.729 -179.7 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 68' ' ' GLY . . . . . . . . . . . . . . . 66.66 16.68 66.0 Favored Glycine 0 N--CA 1.494 2.56 0 N-CA-C 108.731 -1.747 . . . . 0.0 108.731 -178.17 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 69' ' ' SER . . . . . . . . . . . . . 88.7 p -94.22 -34.53 12.85 Favored 'General case' 0 N--CA 1.492 1.66 0 O-C-N 121.674 -0.898 . . . . 0.0 109.984 -179.86 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 70' ' ' GLY . . . . . . . . . . . . . . . 94.87 30.34 8.48 Favored Glycine 0 N--CA 1.499 2.877 0 N-CA-C 110.137 -1.185 . . . . 0.0 110.137 179.962 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 71' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -128.75 134.34 48.39 Favored 'General case' 0 N--CA 1.499 2.025 0 O-C-N 121.516 -0.991 . . . . 0.0 108.64 179.346 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 72' ' ' VAL . . . . . 0.566 ' HB ' ' HB ' ' A' ' 36' ' ' ILE . 74.0 t -75.61 113.66 14.75 Favored 'Isoleucine or valine' 0 N--CA 1.5 2.043 0 O-C-N 121.199 -0.938 . . . . 0.0 111.375 -178.87 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 73' ' ' ASP . . . . . . . . . . . . . 3.5 m-20 -96.9 -174.61 3.03 Favored 'General case' 0 N--CA 1.493 1.721 0 O-C-N 121.724 -0.61 . . . . 0.0 109.423 178.788 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 74' ' ' PHE . . . . . . . . . . . . . 27.6 t80 -72.37 -40.51 67.25 Favored 'General case' 0 N--CA 1.498 1.943 0 O-C-N 120.928 -1.107 . . . . 0.0 109.747 179.729 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 75' ' ' ASP . . . . . . . . . . . . . 3.0 p-10 -67.69 -36.37 80.53 Favored 'General case' 0 N--CA 1.494 1.734 0 O-C-N 121.705 -0.622 . . . . 0.0 109.977 179.251 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 76' ' ' GLU . . . . . . . . . . . . . 7.6 mt-10 -73.12 -41.46 63.99 Favored 'General case' 0 N--CA 1.494 1.763 0 O-C-N 121.485 -0.76 . . . . 0.0 109.826 179.247 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 77' ' ' PHE . . . . . 0.446 ' O ' ' HG2' ' A' ' 81' ' ' MET . 61.3 t80 -57.76 -49.92 74.98 Favored 'General case' 0 N--CA 1.498 1.963 0 O-C-N 121.669 -0.644 . . . . 0.0 110.653 179.803 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 78' ' ' LEU . . . . . . . . . . . . . 46.6 mt -54.42 -45.98 73.1 Favored 'General case' 0 N--CA 1.501 2.079 0 O-C-N 121.363 -0.836 . . . . 0.0 110.372 179.928 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 79' ' ' VAL . . . . . 0.616 ' CG2' HG21 ' A' ' 9' ' ' VAL . 75.5 t -66.33 -37.99 80.87 Favored 'Isoleucine or valine' 0 N--CA 1.5 2.035 0 O-C-N 121.51 -0.744 . . . . 0.0 109.773 179.196 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 80' ' ' MET . . . . . 0.527 ' HA ' ' HG2' ' A' ' 83' ' ' ARG . 25.8 ttp -65.74 -41.84 91.67 Favored 'General case' 0 N--CA 1.495 1.786 0 O-C-N 121.53 -0.731 . . . . 0.0 110.837 179.93 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 81' ' ' MET . . . . . 0.446 ' HG2' ' O ' ' A' ' 77' ' ' PHE . 22.8 mmm -66.06 -49.87 66.13 Favored 'General case' 0 N--CA 1.497 1.923 0 O-C-N 121.286 -0.884 . . . . 0.0 111.121 -179.351 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 82' ' ' VAL . . . . . 0.45 ' HA ' ' HE2' ' A' ' 85' ' ' MET . 34.9 m -64.4 -35.19 73.59 Favored 'Isoleucine or valine' 0 N--CA 1.503 2.215 0 O-C-N 121.135 -0.978 . . . . 0.0 111.197 -179.418 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 83' ' ' ARG . . . . . 0.527 ' HG2' ' HA ' ' A' ' 80' ' ' MET . 0.0 OUTLIER -79.33 -21.11 46.32 Favored 'General case' 0 N--CA 1.499 1.996 0 O-C-N 121.094 -1.004 . . . . 0.0 110.642 179.564 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 84' ' ' CYS . . . . . 0.485 ' N ' ' HG3' ' A' ' 83' ' ' ARG . 41.3 t -78.72 -25.17 44.58 Favored 'General case' 0 N--CA 1.498 1.967 0 O-C-N 121.103 -0.998 . . . . 0.0 110.614 179.74 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 85' ' ' MET . . . . . 0.45 ' HE2' ' HA ' ' A' ' 82' ' ' VAL . 7.6 mtm -55.77 -53.93 50.57 Favored 'General case' 0 N--CA 1.501 2.111 0 O-C-N 121.449 -0.782 . . . . 0.0 110.988 -179.882 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 86' ' ' LYS . . . . . . . . . . . . . 1.3 tmtm? -145.67 88.84 1.86 Allowed 'General case' 0 N--CA 1.497 1.89 0 O-C-N 121.209 -0.932 . . . . 0.0 110.72 -179.902 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 87' ' ' ASP . . . . . . . . . . . . . 0.6 OUTLIER -101.77 -58.87 1.8 Allowed 'General case' 0 N--CA 1.495 1.823 0 O-C-N 121.316 -0.865 . . . . 0.0 109.808 179.484 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 88' ' ' ASP . . . . . . . . . . . . . 3.9 m-20 -72.79 125.11 26.75 Favored 'General case' 0 N--CA 1.496 1.833 0 O-C-N 121.457 -0.777 . . . . 0.0 109.813 179.344 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 89' ' ' SER . . . . . . . . . . . . . 31.8 m . . . . . 0 N--CA 1.497 1.905 0 CA-C-O 117.94 -1.028 . . . . 0.0 110.365 -179.807 . . . . . . . . 0 0 . 1 . 002 nuclear build full ' B' B ' 144' ' ' ARG . . . . . . . . . . . . . 10.8 mtt-85 . . . . . 0 N--CA 1.495 1.819 0 CA-C-O 120.887 0.375 . . . . 0.0 110.282 . . . . . . . . . 0 0 . 1 . 002 nuclear build full ' B' B ' 145' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER 63.18 170.01 0.15 Allowed 'General case' 0 N--CA 1.503 2.194 0 CA-C-O 121.448 0.642 . . . . 0.0 110.908 -179.75 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' B' B ' 146' ' ' VAL . . . . . 0.477 HG13 HG12 ' B' ' 148' ' ' ILE . 3.2 p -103.12 153.01 5.76 Favored 'Isoleucine or valine' 0 N--CA 1.495 1.817 0 O-C-N 121.191 -0.943 . . . . 0.0 110.231 179.936 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' B' B ' 147' ' ' ARG . . . . . . . . . . . . . 0.7 OUTLIER -100.79 107.66 19.28 Favored 'General case' 0 N--CA 1.494 1.769 0 O-C-N 121.376 -0.828 . . . . 0.0 110.68 -179.246 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' B' B ' 148' ' ' ILE . . . . . 0.477 HG12 HG13 ' B' ' 146' ' ' VAL . 37.1 mm -107.89 -59.43 3.33 Favored 'Isoleucine or valine' 0 N--CA 1.495 1.79 0 O-C-N 121.505 -0.747 . . . . 0.0 109.751 179.479 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' B' B ' 149' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER 64.3 111.85 0.03 OUTLIER 'General case' 0 N--CA 1.504 2.257 0 CA-C-O 121.474 0.654 . . . . 0.0 111.132 179.551 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' B' B ' 150' ' ' ALA . . . . . . . . . . . . . . . -56.89 -41.76 78.64 Favored 'General case' 0 N--CA 1.5 2.045 0 O-C-N 121.298 -0.876 . . . . 0.0 110.283 179.632 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 151' ' ' ASP . . . . . . . . . . . . . 7.9 p-10 -61.56 -38.72 88.51 Favored 'General case' 0 N--CA 1.498 1.944 0 O-C-N 121.505 -0.747 . . . . 0.0 110.444 179.438 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 152' ' ' ALA . . . . . . . . . . . . . . . -67.02 -48.32 68.76 Favored 'General case' 0 N--CA 1.497 1.886 0 O-C-N 121.312 -0.868 . . . . 0.0 109.703 179.392 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 153' ' ' MET . . . . . 0.534 ' HG3' HD13 ' A' ' 48' ' ' LEU . 1.6 ttt -64.23 -36.85 85.42 Favored 'General case' 0 N--CA 1.498 1.927 0 O-C-N 121.545 -0.722 . . . . 0.0 110.155 179.221 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' B' B ' 154' ' ' MET . . . . . 0.403 ' CE ' ' HB3' ' A' ' 19' ' ' GLU . 15.8 mtp -58.82 -48.3 81.79 Favored 'General case' 0 N--CA 1.499 1.977 0 O-C-N 121.571 -0.706 . . . . 0.0 110.092 179.449 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' B' B ' 155' ' ' GLN . . . . . . . . . . . . . 19.1 mt-30 -71.97 -33.33 68.07 Favored 'General case' 0 N--CA 1.498 1.95 0 O-C-N 121.479 -0.763 . . . . 0.0 110.387 179.46 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 156' ' ' ALA . . . . . . . . . . . . . . . -62.98 -42.72 99.91 Favored 'General case' 0 N--CA 1.496 1.848 0 O-C-N 121.42 -0.8 . . . . 0.0 110.497 -179.889 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 157' ' ' LEU . . . . . . . . . . . . . 0.8 OUTLIER -86.4 -54.03 4.66 Favored 'General case' 0 N--CA 1.497 1.9 0 O-C-N 121.356 -0.84 . . . . 0.0 110.298 179.803 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' B' B ' 158' ' ' LEU . . . . . 0.423 ' HA ' ' O ' ' B' ' 162' ' ' ALA . 4.8 mt -89.87 67.26 7.18 Favored 'General case' 0 N--CA 1.495 1.803 0 O-C-N 121.368 -0.833 . . . . 0.0 109.907 179.751 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' B' B ' 159' ' ' GLY . . . . . . . . . . . . . . . -162.05 -63.27 0.02 OUTLIER Glycine 0 N--CA 1.495 2.572 0 N-CA-C 109.976 -1.25 . . . . 0.0 109.976 179.997 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 160' ' ' ALA . . . . . 0.497 ' O ' ' HB2' ' B' ' 161' ' ' ARG . . . -68.41 103.7 1.71 Allowed 'General case' 0 N--CA 1.496 1.838 0 O-C-N 121.496 -1.002 . . . . 0.0 110.439 -179.78 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' B' B ' 161' ' ' ARG . . . . . 0.497 ' HB2' ' O ' ' B' ' 160' ' ' ALA . 3.7 mtt-85 69.93 -54.27 0.61 Allowed 'General case' 0 N--CA 1.51 2.54 0 O-C-N 122.038 -0.414 . . . . 0.0 111.699 179.911 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' B' B ' 162' ' ' ALA . . . . . 0.423 ' O ' ' HA ' ' B' ' 158' ' ' LEU . . . -100.91 115.1 29.62 Favored 'General case' 0 N--CA 1.494 1.751 0 O-C-N 121.029 -1.045 . . . . 0.0 110.119 -179.665 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' B' B ' 163' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.496 1.843 0 CA-C-O 117.853 -1.07 . . . . 0.0 110.948 -179.867 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 90' ' ' ' CA' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 002 nuclear build full ' A' A ' 91' ' ' SXK . . . . . 0.543 ' HAK' HD22 ' A' ' 41' ' ' LEU . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 8.8 tpt . . . . . 0 N--CA 1.495 1.793 0 CA-C-O 121.231 0.539 . . . . 0.0 110.202 . . . . . . . . . 0 0 . 1 . 003 nuclear build full ' A' A ' 2' ' ' ASP . . . . . 0.451 ' HB2' ' HB2' ' A' ' 5' ' ' TYR . 8.1 p-10 -170.99 -45.93 0.02 OUTLIER 'General case' 0 N--CA 1.5 2.058 0 O-C-N 121.467 -0.771 . . . . 0.0 110.157 -179.916 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 3' ' ' ASP . . . . . . . . . . . . . 11.8 m-20 55.07 -82.72 0.01 OUTLIER 'General case' 0 N--CA 1.501 2.102 0 N-CA-C 112.447 0.536 . . . . 0.0 112.447 178.889 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 4' ' ' ILE . . . . . 0.729 HG21 ' HA ' ' A' ' 89' ' ' SER . 49.4 mt -51.41 -36.98 18.15 Favored 'Isoleucine or valine' 0 N--CA 1.504 2.252 0 O-C-N 121.349 -0.844 . . . . 0.0 111.899 -179.011 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 5' ' ' TYR . . . . . 0.489 ' CE1' ' HA ' ' A' ' 83' ' ' ARG . 31.7 m-85 -60.53 -32.66 71.68 Favored 'General case' 0 N--CA 1.502 2.147 0 O-C-N 121.053 -1.03 . . . . 0.0 111.246 -179.501 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -62.68 -38.93 92.3 Favored 'General case' 0 N--CA 1.498 1.941 0 O-C-N 121.117 -0.989 . . . . 0.0 109.741 178.811 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 7' ' ' ALA . . . . . . . . . . . . . . . -59.73 -38.49 81.86 Favored 'General case' 0 N--CA 1.497 1.909 0 O-C-N 121.544 -0.722 . . . . 0.0 110.251 179.13 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 8' ' ' ALA . . . . . 0.702 ' HB1' HG21 ' A' ' 82' ' ' VAL . . . -60.34 -33.93 73.11 Favored 'General case' 0 N--CA 1.498 1.928 0 O-C-N 121.364 -0.835 . . . . 0.0 110.308 179.232 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 9' ' ' VAL . . . . . 0.44 HG21 ' HB ' ' A' ' 79' ' ' VAL . 93.3 t -65.96 -34.88 73.22 Favored 'Isoleucine or valine' 0 N--CA 1.5 2.046 0 O-C-N 121.403 -0.81 . . . . 0.0 109.745 179.3 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 10' ' ' GLU . . . . . . . . . . . . . 22.7 mt-10 -62.98 -31.68 72.85 Favored 'General case' 0 N--CA 1.498 1.93 0 O-C-N 121.376 -0.828 . . . . 0.0 109.951 178.951 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 11' ' ' GLN . . . . . . . . . . . . . 1.0 OUTLIER -67.1 -28.63 68.33 Favored 'General case' 0 N--CA 1.499 1.978 0 O-C-N 121.413 -0.804 . . . . 0.0 110.247 179.202 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 12' ' ' LEU . . . . . 0.486 HD22 ' HB3' ' A' ' 16' ' ' GLN . 81.0 mt -77.11 98.56 5.08 Favored 'General case' 0 N--CA 1.496 1.838 0 O-C-N 121.227 -0.92 . . . . 0.0 109.797 179.661 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 13' ' ' THR . . . . . . . . . . . . . 11.6 p -77.31 -176.2 4.04 Favored 'General case' 0 N--CA 1.498 1.964 0 O-C-N 121.438 -0.789 . . . . 0.0 110.874 -179.588 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 14' ' ' GLU . . . . . 0.419 ' HA ' ' HB2' ' A' ' 17' ' ' LYS . 0.5 OUTLIER -50.54 -36.32 33.72 Favored 'General case' 0 N--CA 1.496 1.828 0 O-C-N 121.734 -0.604 . . . . 0.0 111.299 -178.848 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 1.9 mp0 -60.82 -46.62 89.83 Favored 'General case' 0 N--CA 1.5 2.033 0 O-C-N 121.422 -0.799 . . . . 0.0 109.972 179.516 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 16' ' ' GLN . . . . . 0.486 ' HB3' HD22 ' A' ' 12' ' ' LEU . 1.1 mp0 -75.96 -35.73 59.55 Favored 'General case' 0 N--CA 1.497 1.913 0 O-C-N 121.567 -0.708 . . . . 0.0 109.986 179.208 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 17' ' ' LYS . . . . . 0.419 ' HB2' ' HA ' ' A' ' 14' ' ' GLU . 14.0 mmtt -62.92 -41.45 99.48 Favored 'General case' 0 N--CA 1.495 1.812 0 O-C-N 121.925 -0.484 . . . . 0.0 109.811 179.271 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 18' ' ' ASN . . . . . . . . . . . . . 9.4 t30 -62.46 -40.46 96.7 Favored 'General case' 0 N--CA 1.496 1.863 0 O-C-N 121.598 -0.689 . . . . 0.0 110.399 179.587 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 19' ' ' GLU . . . . . 0.514 ' HB3' ' HE3' ' B' ' 154' ' ' MET . 4.5 mm-40 -61.0 -42.87 99.28 Favored 'General case' 0 N--CA 1.501 2.085 0 O-C-N 121.438 -0.789 . . . . 0.0 110.129 179.503 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 20' ' ' PHE . . . . . . . . . . . . . 5.7 m-85 -77.41 -36.42 53.33 Favored 'General case' 0 N--CA 1.499 2.008 0 O-C-N 121.326 -0.859 . . . . 0.0 109.978 179.221 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 21' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -57.79 -48.65 79.08 Favored 'General case' 0 N--CA 1.499 1.993 0 O-C-N 121.645 -0.659 . . . . 0.0 110.15 179.408 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 22' ' ' ALA . . . . . . . . . . . . . . . -59.98 -43.97 94.8 Favored 'General case' 0 N--CA 1.497 1.881 0 O-C-N 121.605 -0.685 . . . . 0.0 110.036 179.597 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 23' ' ' ALA . . . . . . . . . . . . . . . -66.67 -35.44 80.17 Favored 'General case' 0 N--CA 1.497 1.902 0 O-C-N 121.334 -0.854 . . . . 0.0 109.142 178.597 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 24' ' ' PHE . . . . . 0.568 ' CE1' HD12 ' A' ' 36' ' ' ILE . 56.5 t80 -62.4 -34.51 76.87 Favored 'General case' 0 N--CA 1.497 1.876 0 O-C-N 121.737 -0.602 . . . . 0.0 110.173 179.029 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 25' ' ' ASP . . . . . . . . . . . . . 16.5 m-20 -58.45 -52.62 64.85 Favored 'General case' 0 N--CA 1.5 2.026 0 O-C-N 121.523 -0.736 . . . . 0.0 110.503 179.675 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 26' ' ' ILE . . . . . 0.502 HD13 ' O ' ' B' ' 157' ' ' LEU . 3.2 mt -63.38 -37.75 80.36 Favored 'Isoleucine or valine' 0 N--CA 1.498 1.966 0 O-C-N 121.393 -0.817 . . . . 0.0 109.678 179.527 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 27' ' ' PHE . . . . . 0.696 ' HB3' HD11 ' A' ' 36' ' ' ILE . 0.1 OUTLIER -61.62 -34.43 75.65 Favored 'General case' 0 N--CA 1.498 1.932 0 O-C-N 121.603 -0.685 . . . . 0.0 110.672 179.632 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 28' ' ' VAL . . . . . 0.704 HG12 HG13 ' A' ' 36' ' ' ILE . 16.0 m -101.93 -6.39 9.2 Favored 'Isoleucine or valine' 0 N--CA 1.502 2.169 0 O-C-N 121.166 -0.959 . . . . 0.0 111.527 -179.879 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 29' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -52.73 -56.97 11.76 Favored 'General case' 0 N--CA 1.501 2.112 0 O-C-N 121.129 -0.982 . . . . 0.0 110.886 -179.671 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 30' ' ' GLY . . . . . . . . . . . . . . . -105.28 51.4 0.77 Allowed Glycine 0 N--CA 1.494 2.525 0 N-CA-C 108.851 -1.7 . . . . 0.0 108.851 179.381 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 31' ' ' ALA . . . . . 0.546 ' HA ' ' HG2' ' A' ' 40' ' ' GLU . . . -98.17 33.21 2.22 Favored 'General case' 0 N--CA 1.495 1.775 0 O-C-N 121.37 -1.076 . . . . 0.0 111.562 -179.235 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 32' ' ' GLU . . . . . . . . . . . . . 3.7 mt-10 54.07 -86.25 0.01 OUTLIER 'General case' 0 N--CA 1.505 2.303 0 O-C-N 121.614 -0.679 . . . . 0.0 111.395 179.256 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 5.1 p-10 -69.84 -32.7 71.24 Favored 'General case' 0 N--CA 1.497 1.879 0 O-C-N 121.135 -0.978 . . . . 0.0 110.57 179.866 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 34' ' ' GLY . . . . . 0.521 ' O ' ' HB ' ' A' ' 28' ' ' VAL . . . 136.21 -43.7 1.22 Allowed Glycine 0 N--CA 1.495 2.632 0 C-N-CA 119.886 -1.15 . . . . 0.0 110.54 179.335 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 35' ' ' CYS . . . . . . . . . . . . . 94.9 m -86.63 159.5 19.19 Favored 'General case' 0 N--CA 1.499 1.998 0 O-C-N 121.266 -1.137 . . . . 0.0 110.652 -179.686 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 36' ' ' ILE . . . . . 0.704 HG13 HG12 ' A' ' 28' ' ' VAL . 4.7 mt -68.91 112.23 3.55 Favored 'Isoleucine or valine' 0 N--CA 1.499 1.999 0 O-C-N 121.339 -0.851 . . . . 0.0 110.27 -179.82 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 37' ' ' SER . . . . . . . . . . . . . 18.6 t -101.03 -174.61 2.65 Favored 'General case' 0 N--CA 1.495 1.823 0 O-C-N 121.517 -0.739 . . . . 0.0 109.825 179.558 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 38' ' ' THR . . . . . . . . . . . . . 8.3 p -60.55 -53.33 58.8 Favored 'General case' 0 N--CA 1.504 2.239 0 O-C-N 121.345 -0.847 . . . . 0.0 111.303 -179.447 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 39' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -59.14 -39.63 82.99 Favored 'General case' 0 N--CA 1.502 2.153 0 O-C-N 121.422 -0.799 . . . . 0.0 111.512 -179.22 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 40' ' ' GLU . . . . . 0.546 ' HG2' ' HA ' ' A' ' 31' ' ' ALA . 1.1 mp0 -63.09 -46.18 88.6 Favored 'General case' 0 N--CA 1.502 2.127 0 O-C-N 121.064 -1.023 . . . . 0.0 110.346 179.652 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 41' ' ' LEU . . . . . 0.594 HD21 ' HAK' ' A' ' 91' ' ' SXK . 0.1 OUTLIER -58.71 -61.02 2.92 Favored 'General case' 0 N--CA 1.499 1.983 0 O-C-N 121.544 -0.723 . . . . 0.0 109.693 179.192 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 42' ' ' GLY . . . . . . . . . . . . . . . -48.99 -33.33 13.32 Favored Glycine 0 N--CA 1.5 2.907 0 N-CA-C 111.036 -0.826 . . . . 0.0 111.036 179.938 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 43' ' ' LYS . . . . . . . . . . . . . 2.4 tmtt? -56.7 -42.36 79.0 Favored 'General case' 0 N--CA 1.504 2.243 0 O-C-N 121.224 -1.162 . . . . 0.0 110.322 179.912 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 44' ' ' VAL . . . . . . . . . . . . . 76.8 t -76.84 -33.84 21.88 Favored 'Isoleucine or valine' 0 N--CA 1.494 1.762 0 O-C-N 121.296 -0.877 . . . . 0.0 109.265 179.191 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 45' ' ' MET . . . . . 0.681 ' HE2' HG12 ' B' ' 148' ' ' ILE . 1.2 mtt -57.73 -55.28 36.97 Favored 'General case' 0 N--CA 1.497 1.913 0 O-C-N 121.514 -0.741 . . . . 0.0 109.825 179.103 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 46' ' ' ARG . . . . . . . . . . . . . 15.4 ptp180 -61.45 -34.22 75.05 Favored 'General case' 0 N--CA 1.502 2.163 0 O-C-N 121.343 -0.848 . . . . 0.0 110.279 179.279 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 47' ' ' MET . . . . . . . . . . . . . 16.5 ttp -61.31 -32.9 72.76 Favored 'General case' 0 N--CA 1.499 2.007 0 O-C-N 121.281 -0.887 . . . . 0.0 109.388 178.557 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 48' ' ' LEU . . . . . . . . . . . . . 8.2 tp -85.06 -42.46 14.81 Favored 'General case' 0 N--CA 1.492 1.649 0 O-C-N 121.617 -0.677 . . . . 0.0 110.003 179.164 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 49' ' ' GLY . . . . . . . . . . . . . . . 169.9 -65.8 0.17 Allowed Glycine 0 N--CA 1.497 2.705 0 C-N-CA 119.759 -1.21 . . . . 0.0 110.896 179.882 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 50' ' ' GLN . . . . . . . . . . . . . 1.2 mt-30 -59.59 136.52 58.01 Favored 'General case' 0 N--CA 1.504 2.236 0 O-C-N 121.356 -1.085 . . . . 0.0 111.165 -179.03 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 51' ' ' ASN . . . . . . . . . . . . . 2.2 m-80 -118.74 77.98 15.22 Favored Pre-proline 0 N--CA 1.498 1.937 0 O-C-N 121.282 -0.887 . . . . 0.0 110.693 -179.97 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 52' ' ' PRO . . . . . 0.519 ' HG3' ' SD ' ' A' ' 45' ' ' MET . 54.2 Cg_endo -81.94 163.68 18.06 Favored 'Trans proline' 0 C--N 1.313 -1.294 0 O-C-N 123.814 1.428 . . . . 0.0 110.809 179.768 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 53' ' ' THR . . . . . 0.514 ' O ' HD12 ' A' ' 57' ' ' LEU . 34.2 p -95.25 161.98 26.26 Favored Pre-proline 0 N--CA 1.496 1.854 0 O-C-N 121.325 -0.859 . . . . 0.0 109.826 179.245 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 54' ' ' PRO . . . . . . . . . . . . . 38.9 Cg_endo -65.85 -32.73 45.23 Favored 'Trans proline' 0 C--N 1.312 -1.362 0 O-C-N 123.703 1.37 . . . . 0.0 110.255 179.355 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 55' ' ' GLU . . . . . . . . . . . . . 12.2 mp0 -66.73 -38.47 86.74 Favored 'General case' 0 N--CA 1.496 1.834 0 O-C-N 121.401 -0.812 . . . . 0.0 109.425 178.558 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 0.3 OUTLIER -74.14 -40.78 62.39 Favored 'General case' 0 N--CA 1.495 1.804 0 O-C-N 121.568 -0.707 . . . . 0.0 110.078 179.298 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 57' ' ' LEU . . . . . 0.552 ' HA ' ' HG3' ' A' ' 60' ' ' MET . 6.7 mt -62.39 -20.25 64.26 Favored 'General case' 0 N--CA 1.5 2.037 0 O-C-N 121.259 -0.9 . . . . 0.0 110.93 179.69 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 58' ' ' GLN . . . . . 0.576 ' HG3' ' N ' ' A' ' 59' ' ' GLU . 0.0 OUTLIER -59.81 -37.55 79.47 Favored 'General case' 0 N--CA 1.496 1.865 0 O-C-N 121.05 -1.031 . . . . 0.0 109.095 179.131 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 59' ' ' GLU . . . . . 0.576 ' N ' ' HG3' ' A' ' 58' ' ' GLN . 0.4 OUTLIER -73.56 -35.81 65.53 Favored 'General case' 0 N--CA 1.497 1.879 0 N-CA-C 108.9 -0.778 . . . . 0.0 108.9 178.128 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 60' ' ' MET . . . . . 0.552 ' HG3' ' HA ' ' A' ' 57' ' ' LEU . 1.6 mmm -58.92 -42.64 90.2 Favored 'General case' 0 N--CA 1.497 1.881 0 O-C-N 121.708 -0.62 . . . . 0.0 109.679 179.04 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 61' ' ' ILE . . . . . 0.568 HG23 HG23 ' A' ' 72' ' ' VAL . 3.2 mt -76.86 -42.29 32.87 Favored 'Isoleucine or valine' 0 N--CA 1.497 1.923 0 O-C-N 121.511 -0.743 . . . . 0.0 109.913 179.226 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 62' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -58.9 -31.5 68.67 Favored 'General case' 0 N--CA 1.502 2.141 0 O-C-N 121.438 -0.789 . . . . 0.0 110.909 179.943 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 63' ' ' GLU . . . . . . . . . . . . . 2.7 tt0 -53.54 -34.73 59.27 Favored 'General case' 0 N--CA 1.5 2.035 0 O-C-N 121.7 -0.625 . . . . 0.0 111.099 179.893 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 64' ' ' VAL . . . . . 0.512 HG21 HG13 ' A' ' 79' ' ' VAL . 9.8 p -118.46 16.87 7.04 Favored 'Isoleucine or valine' 0 N--CA 1.497 1.888 0 O-C-N 121.25 -0.906 . . . . 0.0 111.16 179.999 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 65' ' ' ASP . . . . . . . . . . . . . 25.7 t70 -92.6 -88.43 0.21 Allowed 'General case' 0 N--CA 1.498 1.934 0 O-C-N 120.902 -1.124 . . . . 0.0 110.091 179.673 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 66' ' ' GLU . . . . . . . . . . . . . 3.3 mt-10 47.84 38.67 9.26 Favored 'General case' 0 N--CA 1.504 2.24 0 O-C-N 121.374 -0.828 . . . . 0.0 111.326 179.654 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 67' ' ' ASP . . . . . . . . . . . . . 0.8 OUTLIER -114.77 -32.74 5.72 Favored 'General case' 0 N--CA 1.5 2.058 0 O-C-N 121.062 -1.024 . . . . 0.0 111.455 -179.774 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 68' ' ' GLY . . . . . . . . . . . . . . . 140.13 -30.87 2.31 Favored Glycine 0 N--CA 1.497 2.703 0 C-N-CA 120.006 -1.092 . . . . 0.0 110.658 179.923 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 69' ' ' SER . . . . . . . . . . . . . 11.4 p -93.55 -29.68 15.38 Favored 'General case' 0 N--CA 1.499 2.006 0 O-C-N 121.189 -1.183 . . . . 0.0 111.847 -179.358 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 70' ' ' GLY . . . . . . . . . . . . . . . 89.2 -42.62 3.03 Favored Glycine 0 N--CA 1.498 2.824 0 C-N-CA 119.614 -1.279 . . . . 0.0 109.919 -179.383 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 71' ' ' THR . . . . . . . . . . . . . 26.7 m -71.41 153.25 42.42 Favored 'General case' 0 N--CA 1.502 2.128 0 O-C-N 121.373 -1.075 . . . . 0.0 110.38 179.966 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 72' ' ' VAL . . . . . 0.568 HG23 HG23 ' A' ' 61' ' ' ILE . 1.7 t -77.22 138.11 21.13 Favored 'Isoleucine or valine' 0 N--CA 1.501 2.11 0 O-C-N 121.29 -0.881 . . . . 0.0 111.016 -179.579 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 73' ' ' ASP . . . . . . . . . . . . . 5.0 m-20 -104.0 -162.0 0.87 Allowed 'General case' 0 N--CA 1.5 2.042 0 O-C-N 121.597 -0.689 . . . . 0.0 109.858 179.291 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 74' ' ' PHE . . . . . . . . . . . . . 16.9 t80 -78.66 -65.21 1.02 Allowed 'General case' 0 N--CA 1.502 2.16 0 O-C-N 120.927 -1.108 . . . . 0.0 110.015 179.642 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 75' ' ' ASP . . . . . 0.754 ' HA ' HD12 ' A' ' 78' ' ' LEU . 0.6 OUTLIER -60.17 -31.43 70.1 Favored 'General case' 0 N--CA 1.498 1.933 0 O-C-N 121.327 -0.858 . . . . 0.0 109.73 179.34 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 76' ' ' GLU . . . . . 0.646 ' O ' HG12 ' A' ' 79' ' ' VAL . 3.8 tt0 -65.73 -36.37 83.39 Favored 'General case' 0 N--CA 1.498 1.971 0 O-C-N 121.365 -0.834 . . . . 0.0 108.793 178.07 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 77' ' ' PHE . . . . . 0.428 ' O ' ' HG2' ' A' ' 81' ' ' MET . 19.1 t80 -69.97 -37.98 75.94 Favored 'General case' 0 N--CA 1.494 1.732 0 N-CA-C 108.907 -0.775 . . . . 0.0 108.907 178.301 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 78' ' ' LEU . . . . . 0.754 HD12 ' HA ' ' A' ' 75' ' ' ASP . 17.4 mt -58.88 -44.51 91.12 Favored 'General case' 0 N--CA 1.498 1.954 0 O-C-N 121.581 -0.699 . . . . 0.0 110.292 179.308 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 79' ' ' VAL . . . . . 0.646 HG12 ' O ' ' A' ' 76' ' ' GLU . 9.0 p -72.74 -18.88 18.76 Favored 'Isoleucine or valine' 0 N--CA 1.5 2.034 0 O-C-N 121.334 -0.854 . . . . 0.0 110.211 178.803 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 80' ' ' MET . . . . . 0.411 ' SD ' HG11 ' A' ' 64' ' ' VAL . 13.6 ttt -76.58 -39.03 53.89 Favored 'General case' 0 N--CA 1.497 1.91 0 O-C-N 121.226 -0.921 . . . . 0.0 109.783 179.035 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 81' ' ' MET . . . . . 0.428 ' HG2' ' O ' ' A' ' 77' ' ' PHE . 55.3 mmm -60.69 -45.64 93.4 Favored 'General case' 0 N--CA 1.497 1.91 0 O-C-N 121.441 -0.787 . . . . 0.0 110.209 179.479 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 82' ' ' VAL . . . . . 0.702 HG21 ' HB1' ' A' ' 8' ' ' ALA . 1.8 p -69.91 -30.6 44.93 Favored 'Isoleucine or valine' 0 N--CA 1.496 1.826 0 O-C-N 121.364 -0.835 . . . . 0.0 110.111 179.558 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 83' ' ' ARG . . . . . 0.489 ' HA ' ' CE1' ' A' ' 5' ' ' TYR . 4.0 mtt-85 -65.5 -44.44 87.01 Favored 'General case' 0 N--CA 1.496 1.871 0 O-C-N 121.278 -0.888 . . . . 0.0 109.369 178.811 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 84' ' ' CYS . . . . . . . . . . . . . 23.9 t -72.63 -38.23 67.8 Favored 'General case' 0 N--CA 1.495 1.816 0 O-C-N 121.619 -0.676 . . . . 0.0 109.788 178.795 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 85' ' ' MET . . . . . 0.416 ' O ' ' CB ' ' A' ' 86' ' ' LYS . 4.0 ttm -69.96 -25.48 63.65 Favored 'General case' 0 N--CA 1.498 1.96 0 O-C-N 121.506 -0.746 . . . . 0.0 110.514 179.453 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 86' ' ' LYS . . . . . 0.416 ' CB ' ' O ' ' A' ' 85' ' ' MET . 0.1 OUTLIER 70.44 115.26 0.05 OUTLIER 'General case' 0 N--CA 1.501 2.109 0 CA-C-O 121.525 0.678 . . . . 0.0 110.796 -179.872 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 87' ' ' ASP . . . . . . . . . . . . . 5.3 p-10 -108.7 -163.55 0.88 Allowed 'General case' 0 N--CA 1.495 1.779 0 O-C-N 121.407 -0.808 . . . . 0.0 110.268 179.872 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 88' ' ' ASP . . . . . . . . . . . . . 3.7 m-20 -60.05 -42.58 94.76 Favored 'General case' 0 N--CA 1.499 1.991 0 O-C-N 121.392 -0.818 . . . . 0.0 110.44 179.905 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 89' ' ' SER . . . . . 0.729 ' HA ' HG21 ' A' ' 4' ' ' ILE . 14.8 m . . . . . 0 N--CA 1.502 2.165 0 CA-C-O 118.11 -0.948 . . . . 0.0 110.8 179.916 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 144' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.498 1.958 0 CA-C-O 120.904 0.383 . . . . 0.0 110.596 . . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 145' ' ' ARG . . . . . 0.652 ' HG3' HG23 ' B' ' 146' ' ' VAL . 36.9 tpt85 -132.12 -63.27 0.81 Allowed 'General case' 0 N--CA 1.5 2.038 0 O-C-N 121.306 -0.871 . . . . 0.0 110.438 -179.91 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' B' B ' 146' ' ' VAL . . . . . 0.652 HG23 ' HG3' ' B' ' 145' ' ' ARG . 40.1 t -105.81 156.7 6.57 Favored 'Isoleucine or valine' 0 N--CA 1.5 2.026 0 O-C-N 121.376 -0.828 . . . . 0.0 110.352 -179.789 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' B' B ' 147' ' ' ARG . . . . . . . . . . . . . 0.3 OUTLIER -114.34 -79.16 0.58 Allowed 'General case' 0 N--CA 1.496 1.842 0 O-C-N 121.394 -0.816 . . . . 0.0 110.59 -179.985 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' B' B ' 148' ' ' ILE . . . . . 0.681 HG12 ' HE2' ' A' ' 45' ' ' MET . 1.1 mp 64.56 156.9 0.0 OUTLIER 'Isoleucine or valine' 0 N--CA 1.504 2.263 0 CA-C-O 121.435 0.636 . . . . 0.0 110.481 -179.479 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' B' B ' 149' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER -127.84 144.77 51.08 Favored 'General case' 0 N--CA 1.496 1.826 0 O-C-N 121.111 -0.993 . . . . 0.0 110.443 -179.824 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' B' B ' 150' ' ' ALA . . . . . . . . . . . . . . . -57.72 -45.57 85.58 Favored 'General case' 0 N--CA 1.499 1.993 0 O-C-N 121.577 -0.702 . . . . 0.0 110.742 -179.915 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 151' ' ' ASP . . . . . . . . . . . . . 6.9 p-10 -67.64 -37.53 82.57 Favored 'General case' 0 N--CA 1.499 2.007 0 O-C-N 121.511 -0.743 . . . . 0.0 110.414 179.703 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 152' ' ' ALA . . . . . . . . . . . . . . . -62.55 -47.56 83.33 Favored 'General case' 0 N--CA 1.498 1.945 0 O-C-N 121.345 -0.847 . . . . 0.0 109.875 179.367 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 153' ' ' MET . . . . . . . . . . . . . 5.1 mtt -66.16 -39.9 90.14 Favored 'General case' 0 N--CA 1.496 1.846 0 O-C-N 121.692 -0.63 . . . . 0.0 110.029 179.254 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 154' ' ' MET . . . . . 0.514 ' HE3' ' HB3' ' A' ' 19' ' ' GLU . 0.3 OUTLIER -63.01 -51.88 65.11 Favored 'General case' 0 N--CA 1.496 1.83 0 O-C-N 121.622 -0.674 . . . . 0.0 110.314 179.815 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' B' B ' 155' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -64.15 -40.95 97.24 Favored 'General case' 0 N--CA 1.497 1.909 0 O-C-N 121.367 -0.833 . . . . 0.0 110.196 179.377 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' B' B ' 156' ' ' ALA . . . . . . . . . . . . . . . -62.43 -37.76 87.08 Favored 'General case' 0 N--CA 1.499 1.993 0 O-C-N 121.349 -0.844 . . . . 0.0 110.514 179.526 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 157' ' ' LEU . . . . . 0.502 ' O ' HD13 ' A' ' 26' ' ' ILE . 0.3 OUTLIER -89.13 -1.71 58.21 Favored 'General case' 0 N--CA 1.5 2.03 0 O-C-N 121.205 -0.934 . . . . 0.0 111.284 179.722 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' B' B ' 158' ' ' LEU . . . . . . . . . . . . . 1.5 mt -83.69 -53.83 5.36 Favored 'General case' 0 N--CA 1.5 2.037 0 O-C-N 120.943 -1.098 . . . . 0.0 110.541 179.985 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 159' ' ' GLY . . . . . . . . . . . . . . . -168.46 50.05 0.23 Allowed Glycine 0 N--CA 1.498 2.769 0 N-CA-C 110.09 -1.204 . . . . 0.0 110.09 179.875 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 160' ' ' ALA . . . . . . . . . . . . . . . -108.43 -53.07 2.68 Favored 'General case' 0 N--CA 1.496 1.838 0 O-C-N 121.37 -1.077 . . . . 0.0 110.094 179.843 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 161' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -147.91 93.95 2.27 Favored 'General case' 0 N--CA 1.496 1.861 0 O-C-N 121.402 -0.811 . . . . 0.0 109.78 179.512 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' B' B ' 162' ' ' ALA . . . . . . . . . . . . . . . -74.11 170.01 16.37 Favored 'General case' 0 N--CA 1.498 1.974 0 O-C-N 121.259 -0.901 . . . . 0.0 110.488 -179.834 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 163' ' ' LYS . . . . . . . . . . . . . 0.4 OUTLIER . . . . . 0 N--CA 1.503 2.189 0 CA-C-O 117.636 -1.173 . . . . 0.0 110.643 -179.781 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 90' ' ' ' CA' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 003 nuclear build full ' A' A ' 91' ' ' SXK . . . . . 0.594 ' HAK' HD21 ' A' ' 41' ' ' LEU . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 46.0 mtm . . . . . 0 N--CA 1.495 1.818 0 N-CA-C 110.003 -0.369 . . . . 0.0 110.003 . . . . . . . . . 0 0 . 1 . 004 nuclear build full ' A' A ' 2' ' ' ASP . . . . . 0.459 ' CG ' ' HD2' ' A' ' 6' ' ' LYS . 5.7 t0 -134.75 149.64 50.47 Favored 'General case' 0 N--CA 1.495 1.787 0 O-C-N 121.451 -0.781 . . . . 0.0 110.654 -179.766 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 3' ' ' ASP . . . . . . . . . . . . . 27.4 t70 -156.09 -63.81 0.11 Allowed 'General case' 0 N--CA 1.495 1.817 0 O-C-N 121.588 -0.695 . . . . 0.0 109.776 179.712 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 4' ' ' ILE . . . . . 0.465 ' CG2' ' HB2' ' A' ' 88' ' ' ASP . 16.7 mt -77.48 -40.5 28.66 Favored 'Isoleucine or valine' 0 N--CA 1.497 1.889 0 O-C-N 121.464 -0.772 . . . . 0.0 110.595 179.902 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 5' ' ' TYR . . . . . 0.434 ' CE1' ' HD3' ' A' ' 83' ' ' ARG . 72.2 m-85 -59.05 -42.97 91.59 Favored 'General case' 0 N--CA 1.5 2.062 0 O-C-N 121.428 -0.795 . . . . 0.0 110.148 -179.919 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 6' ' ' LYS . . . . . 0.459 ' HD2' ' CG ' ' A' ' 2' ' ' ASP . 0.0 OUTLIER -62.52 -41.22 98.71 Favored 'General case' 0 N--CA 1.497 1.921 0 O-C-N 121.363 -0.836 . . . . 0.0 108.995 178.586 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 7' ' ' ALA . . . . . . . . . . . . . . . -63.6 -38.19 90.19 Favored 'General case' 0 N--CA 1.496 1.838 0 O-C-N 121.562 -0.711 . . . . 0.0 109.94 178.752 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 8' ' ' ALA . . . . . . . . . . . . . . . -58.67 -35.08 72.02 Favored 'General case' 0 N--CA 1.499 1.993 0 O-C-N 121.405 -0.809 . . . . 0.0 109.887 179.193 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 9' ' ' VAL . . . . . 0.58 ' HA ' HD12 ' A' ' 12' ' ' LEU . 40.9 t -61.27 -41.59 90.26 Favored 'Isoleucine or valine' 0 N--CA 1.498 1.946 0 O-C-N 121.495 -0.753 . . . . 0.0 109.493 178.908 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 10' ' ' GLU . . . . . . . . . . . . . 10.1 mt-10 -69.37 -26.91 64.9 Favored 'General case' 0 N--CA 1.498 1.972 0 O-C-N 121.55 -0.719 . . . . 0.0 110.224 179.082 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 11' ' ' GLN . . . . . . . . . . . . . 8.9 mt-30 -73.55 -36.2 65.6 Favored 'General case' 0 N--CA 1.499 2.013 0 O-C-N 121.403 -0.811 . . . . 0.0 110.694 179.91 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 12' ' ' LEU . . . . . 0.58 HD12 ' HA ' ' A' ' 9' ' ' VAL . 18.9 mt -58.5 136.75 57.61 Favored 'General case' 0 N--CA 1.496 1.87 0 O-C-N 121.51 -0.744 . . . . 0.0 110.619 -179.673 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 13' ' ' THR . . . . . . . . . . . . . 82.7 p -81.65 171.98 13.97 Favored 'General case' 0 N--CA 1.499 1.977 0 O-C-N 121.348 -0.845 . . . . 0.0 110.359 179.971 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 14' ' ' GLU . . . . . . . . . . . . . 1.0 OUTLIER -57.27 -34.34 68.54 Favored 'General case' 0 N--CA 1.491 1.583 0 O-C-N 121.511 -0.743 . . . . 0.0 109.981 179.84 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 1.4 mp0 -57.7 -55.48 34.32 Favored 'General case' 0 N--CA 1.497 1.885 0 O-C-N 121.652 -0.655 . . . . 0.0 109.745 179.273 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 16' ' ' GLN . . . . . 0.471 ' HA ' ' HB2' ' A' ' 19' ' ' GLU . 1.7 mt-30 -65.6 -37.77 87.57 Favored 'General case' 0 N--CA 1.498 1.967 0 O-C-N 121.494 -0.754 . . . . 0.0 110.178 179.345 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 17' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -58.91 -49.14 78.9 Favored 'General case' 0 N--CA 1.496 1.872 0 N-CA-C 109.333 -0.618 . . . . 0.0 109.333 179.009 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 18' ' ' ASN . . . . . . . . . . . . . 2.1 t30 -71.05 -34.37 71.19 Favored 'General case' 0 N--CA 1.494 1.762 0 O-C-N 121.62 -0.675 . . . . 0.0 109.449 178.861 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 19' ' ' GLU . . . . . 0.471 ' HB2' ' HA ' ' A' ' 16' ' ' GLN . 7.7 mt-10 -56.63 -48.03 78.4 Favored 'General case' 0 N--CA 1.5 2.062 0 O-C-N 121.567 -0.708 . . . . 0.0 110.064 178.991 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 20' ' ' PHE . . . . . . . . . . . . . 18.4 m-85 -66.8 -38.24 86.11 Favored 'General case' 0 N--CA 1.498 1.937 0 O-C-N 121.537 -0.727 . . . . 0.0 110.211 179.586 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 21' ' ' LYS . . . . . . . . . . . . . 14.2 tptt -56.7 -53.04 62.32 Favored 'General case' 0 N--CA 1.5 2.074 0 O-C-N 121.455 -0.778 . . . . 0.0 109.895 179.522 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 22' ' ' ALA . . . . . . . . . . . . . . . -60.1 -45.95 91.22 Favored 'General case' 0 N--CA 1.499 1.989 0 O-C-N 121.518 -0.739 . . . . 0.0 110.046 179.513 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 23' ' ' ALA . . . . . . . . . . . . . . . -61.73 -37.56 84.67 Favored 'General case' 0 N--CA 1.496 1.871 0 O-C-N 121.583 -0.698 . . . . 0.0 109.867 179.131 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 24' ' ' PHE . . . . . 0.529 ' O ' HG12 ' A' ' 28' ' ' VAL . 25.6 t80 -62.72 -45.39 92.96 Favored 'General case' 0 N--CA 1.495 1.823 0 O-C-N 121.565 -0.709 . . . . 0.0 109.971 179.328 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 25' ' ' ASP . . . . . . . . . . . . . 18.7 m-20 -56.37 -43.75 79.47 Favored 'General case' 0 N--CA 1.498 1.962 0 O-C-N 121.562 -0.711 . . . . 0.0 109.973 179.468 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 26' ' ' ILE . . . . . . . . . . . . . 41.0 mt -71.68 -32.24 44.68 Favored 'Isoleucine or valine' 0 N--CA 1.498 1.974 0 O-C-N 121.523 -0.736 . . . . 0.0 109.825 179.14 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 27' ' ' PHE . . . . . 0.758 ' HE2' HD11 ' B' ' 157' ' ' LEU . 0.2 OUTLIER -63.11 -43.56 98.11 Favored 'General case' 0 N--CA 1.498 1.947 0 O-C-N 121.511 -0.743 . . . . 0.0 110.421 179.727 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 28' ' ' VAL . . . . . 0.761 HG23 ' HB2' ' A' ' 31' ' ' ALA . 5.7 p -110.02 63.6 0.17 Allowed 'Isoleucine or valine' 0 N--CA 1.498 1.951 0 O-C-N 121.283 -0.885 . . . . 0.0 110.952 -179.956 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 29' ' ' LEU . . . . . . . . . . . . . 28.0 mt -80.0 77.17 6.7 Favored 'General case' 0 N--CA 1.499 2.007 0 N-CA-C 107.618 -1.253 . . . . 0.0 107.618 177.87 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 30' ' ' GLY . . . . . . . . . . . . . . . 97.48 -55.43 1.23 Allowed Glycine 0 N--CA 1.491 2.337 0 N-CA-C 107.185 -2.366 . . . . 0.0 107.185 -176.963 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 31' ' ' ALA . . . . . 0.761 ' HB2' HG23 ' A' ' 28' ' ' VAL . . . 52.98 -168.69 0.05 OUTLIER 'General case' 0 N--CA 1.5 2.043 0 CA-C-O 121.556 0.693 . . . . 0.0 111.946 178.367 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 32' ' ' GLU . . . . . . . . . . . . . 2.2 mt-10 -104.76 -50.12 3.36 Favored 'General case' 0 N--CA 1.493 1.689 0 O-C-N 121.528 -0.732 . . . . 0.0 110.405 -179.724 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 9.2 m-20 -104.64 -1.92 25.73 Favored 'General case' 0 N--CA 1.499 1.981 0 O-C-N 121.507 -0.745 . . . . 0.0 111.483 -179.382 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 34' ' ' GLY . . . . . 0.662 ' O ' HG21 ' A' ' 28' ' ' VAL . . . 108.46 -23.58 24.25 Favored Glycine 0 N--CA 1.497 2.705 0 N-CA-C 109.681 -1.367 . . . . 0.0 109.681 -179.391 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 35' ' ' CYS . . . . . . . . . . . . . 1.2 m -110.33 -167.61 1.21 Allowed 'General case' 0 N--CA 1.495 1.786 0 O-C-N 121.477 -1.014 . . . . 0.0 109.464 179.32 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 36' ' ' ILE . . . . . 0.456 ' HB ' ' HB ' ' A' ' 72' ' ' VAL . 2.5 mp -91.84 98.87 8.87 Favored 'Isoleucine or valine' 0 N--CA 1.495 1.795 0 O-C-N 121.023 -1.048 . . . . 0.0 110.168 179.823 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 37' ' ' SER . . . . . . . . . . . . . 10.1 p -94.0 -165.75 1.38 Allowed 'General case' 0 N--CA 1.498 1.935 0 O-C-N 121.396 -0.815 . . . . 0.0 110.132 179.776 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 38' ' ' THR . . . . . . . . . . . . . 17.7 p -58.93 -39.28 81.12 Favored 'General case' 0 N--CA 1.502 2.138 0 O-C-N 121.284 -0.885 . . . . 0.0 110.527 179.727 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 39' ' ' LYS . . . . . . . . . . . . . 32.7 mttt -67.62 -45.82 74.29 Favored 'General case' 0 N--CA 1.499 1.975 0 O-C-N 121.43 -0.794 . . . . 0.0 110.071 179.567 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 2.4 mp0 -65.21 -40.35 94.04 Favored 'General case' 0 N--CA 1.502 2.129 0 O-C-N 121.383 -0.823 . . . . 0.0 109.93 179.408 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 41' ' ' LEU . . . . . 0.846 HD21 ' HAK' ' A' ' 91' ' ' SXK . 0.1 OUTLIER -67.68 -59.27 3.46 Favored 'General case' 0 N--CA 1.496 1.843 0 O-C-N 121.556 -0.715 . . . . 0.0 109.645 179.343 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 42' ' ' GLY . . . . . 0.56 ' HA2' ' HB2' ' A' ' 45' ' ' MET . . . -49.53 -33.48 17.79 Favored Glycine 0 N--CA 1.498 2.819 0 N-CA-C 110.527 -1.029 . . . . 0.0 110.527 179.661 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 43' ' ' LYS . . . . . . . . . . . . . 16.0 ttpt -55.12 -37.39 66.84 Favored 'General case' 0 N--CA 1.502 2.142 0 O-C-N 121.294 -1.121 . . . . 0.0 110.514 179.464 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 44' ' ' VAL . . . . . . . . . . . . . 42.6 t -90.81 -29.92 4.87 Favored 'Isoleucine or valine' 0 N--CA 1.497 1.912 0 O-C-N 121.277 -0.889 . . . . 0.0 109.815 179.165 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 45' ' ' MET . . . . . 0.56 ' HB2' ' HA2' ' A' ' 42' ' ' GLY . 5.4 mmt -57.57 -43.97 84.93 Favored 'General case' 0 N--CA 1.499 2.015 0 O-C-N 121.499 -0.75 . . . . 0.0 111.111 -179.949 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 46' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -53.3 -16.93 1.48 Allowed 'General case' 0 N--CA 1.504 2.261 0 O-C-N 121.35 -0.844 . . . . 0.0 112.298 -179.423 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 47' ' ' MET . . . . . . . . . . . . . 42.7 mtt -82.66 -30.39 29.33 Favored 'General case' 0 N--CA 1.499 2.022 0 O-C-N 120.833 -1.167 . . . . 0.0 111.072 179.717 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 48' ' ' LEU . . . . . . . . . . . . . 5.5 tp -143.43 -48.02 0.3 Allowed 'General case' 0 N--CA 1.495 1.786 0 O-C-N 121.134 -0.979 . . . . 0.0 111.453 -179.177 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 49' ' ' GLY . . . . . 0.534 ' HA3' HD11 ' B' ' 148' ' ' ILE . . . -95.11 102.48 2.86 Favored Glycine 0 N--CA 1.494 2.541 0 N-CA-C 110.09 -1.204 . . . . 0.0 110.09 -179.31 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 50' ' ' GLN . . . . . 0.591 ' HG2' ' HA ' ' B' ' 145' ' ' ARG . 0.9 OUTLIER -46.19 143.48 2.36 Favored 'General case' 0 N--CA 1.502 2.165 0 O-C-N 121.768 -0.842 . . . . 0.0 111.756 -179.941 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 51' ' ' ASN . . . . . . . . . . . . . 1.6 p-10 -130.59 92.69 34.14 Favored Pre-proline 0 N--CA 1.499 2.005 0 O-C-N 121.51 -0.744 . . . . 0.0 109.686 179.463 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 52' ' ' PRO . . . . . . . . . . . . . 43.6 Cg_endo -70.1 -38.67 6.75 Favored 'Trans proline' 0 N--CA 1.491 1.368 0 O-C-N 123.762 1.401 . . . . 0.0 111.4 -179.385 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 53' ' ' THR . . . . . 0.479 HG23 ' HB2' ' A' ' 56' ' ' GLU . 0.0 OUTLIER -145.16 153.54 52.99 Favored Pre-proline 0 N--CA 1.498 1.946 0 O-C-N 121.21 -0.931 . . . . 0.0 110.429 -179.862 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 54' ' ' PRO . . . . . . . . . . . . . 42.9 Cg_endo -68.59 -32.76 23.76 Favored 'Trans proline' 0 C--N 1.313 -1.332 0 O-C-N 124.126 1.593 . . . . 0.0 110.46 179.665 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 55' ' ' GLU . . . . . 0.449 ' HA ' ' HB2' ' A' ' 58' ' ' GLN . 33.7 mm-40 -61.26 -33.75 74.04 Favored 'General case' 0 N--CA 1.497 1.924 0 O-C-N 121.575 -0.703 . . . . 0.0 110.282 179.462 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 56' ' ' GLU . . . . . 0.479 ' HB2' HG23 ' A' ' 53' ' ' THR . 20.4 tt0 -57.06 -44.17 82.79 Favored 'General case' 0 N--CA 1.498 1.933 0 O-C-N 121.508 -0.745 . . . . 0.0 109.592 179.113 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 57' ' ' LEU . . . . . 0.546 ' H ' HD22 ' A' ' 57' ' ' LEU . 0.8 OUTLIER -77.1 -31.35 55.85 Favored 'General case' 0 N--CA 1.495 1.789 0 O-C-N 121.51 -0.744 . . . . 0.0 109.753 178.954 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 58' ' ' GLN . . . . . 0.449 ' HB2' ' HA ' ' A' ' 55' ' ' GLU . 0.0 OUTLIER -54.47 -49.94 68.92 Favored 'General case' 0 N--CA 1.496 1.842 0 O-C-N 121.341 -0.849 . . . . 0.0 109.014 179.076 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 59' ' ' GLU . . . . . . . . . . . . . 4.2 mt-10 -65.53 -34.69 78.86 Favored 'General case' 0 N--CA 1.496 1.872 0 O-C-N 121.712 -0.617 . . . . 0.0 109.432 178.16 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 60' ' ' MET . . . . . 0.456 ' HB2' ' O ' ' A' ' 57' ' ' LEU . 2.1 mmm -59.99 -47.05 87.43 Favored 'General case' 0 N--CA 1.498 1.931 0 O-C-N 121.649 -0.657 . . . . 0.0 110.071 179.449 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 61' ' ' ILE . . . . . 0.473 HG12 HG23 ' A' ' 72' ' ' VAL . 59.5 mt -72.79 -42.15 61.48 Favored 'Isoleucine or valine' 0 N--CA 1.498 1.962 0 O-C-N 121.332 -0.855 . . . . 0.0 110.046 179.437 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 62' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -57.58 -31.27 66.01 Favored 'General case' 0 N--CA 1.501 2.079 0 O-C-N 121.299 -0.876 . . . . 0.0 110.219 179.174 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 63' ' ' GLU . . . . . . . . . . . . . 1.3 tt0 -66.16 -33.03 74.85 Favored 'General case' 0 N--CA 1.496 1.841 0 O-C-N 121.183 -0.948 . . . . 0.0 109.471 178.697 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 64' ' ' VAL . . . . . 0.573 HG22 ' NH2' ' A' ' 83' ' ' ARG . 51.4 t -84.14 -37.01 12.59 Favored 'Isoleucine or valine' 0 N--CA 1.495 1.784 0 O-C-N 121.571 -0.706 . . . . 0.0 110.471 179.418 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 65' ' ' ASP . . . . . . . . . . . . . 0.0 OUTLIER -128.2 146.16 50.81 Favored 'General case' 0 N--CA 1.496 1.848 0 O-C-N 121.155 -0.966 . . . . 0.0 111.93 -179.39 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 66' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -139.79 46.29 1.88 Allowed 'General case' 0 N--CA 1.491 1.597 0 N-CA-C 108.301 -1.0 . . . . 0.0 108.301 178.331 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 67' ' ' ASP . . . . . . . . . . . . . 0.9 OUTLIER -104.59 43.8 1.07 Allowed 'General case' 0 N--CA 1.498 1.93 0 O-C-N 121.702 -0.624 . . . . 0.0 111.118 -178.844 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 68' ' ' GLY . . . . . . . . . . . . . . . 56.83 43.61 92.22 Favored Glycine 0 N--CA 1.499 2.895 0 N-CA-C 110.415 -1.074 . . . . 0.0 110.415 179.26 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 69' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -146.44 -52.2 0.23 Allowed 'General case' 0 N--CA 1.496 1.826 0 O-C-N 121.338 -1.096 . . . . 0.0 110.359 179.968 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 70' ' ' GLY . . . . . . . . . . . . . . . 69.31 23.91 76.2 Favored Glycine 0 N--CA 1.497 2.707 0 N-CA-C 109.95 -1.26 . . . . 0.0 109.95 -179.807 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 71' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -123.86 138.65 54.46 Favored 'General case' 0 N--CA 1.499 1.994 0 O-C-N 121.42 -1.047 . . . . 0.0 109.107 179.755 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 72' ' ' VAL . . . . . 0.473 HG23 HG12 ' A' ' 61' ' ' ILE . 26.1 t -76.17 126.67 37.11 Favored 'Isoleucine or valine' 0 N--CA 1.499 1.991 0 O-C-N 121.422 -0.798 . . . . 0.0 111.527 -178.985 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 73' ' ' ASP . . . . . 0.422 ' O ' ' HB2' ' A' ' 77' ' ' PHE . 0.2 OUTLIER -110.47 -168.0 1.26 Allowed 'General case' 0 N--CA 1.496 1.835 0 O-C-N 121.471 -0.768 . . . . 0.0 109.042 178.369 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 74' ' ' PHE . . . . . . . . . . . . . 25.8 t80 -66.66 -45.81 77.74 Favored 'General case' 0 N--CA 1.501 2.094 0 O-C-N 120.825 -1.172 . . . . 0.0 110.857 -179.83 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 75' ' ' ASP . . . . . . . . . . . . . 24.8 t70 -60.46 -53.95 51.37 Favored 'General case' 0 N--CA 1.5 2.039 0 O-C-N 121.405 -0.809 . . . . 0.0 110.482 179.867 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 76' ' ' GLU . . . . . . . . . . . . . 25.0 mt-10 -59.67 -40.66 88.51 Favored 'General case' 0 N--CA 1.499 1.99 0 O-C-N 121.484 -0.76 . . . . 0.0 110.252 179.572 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 77' ' ' PHE . . . . . 0.445 ' O ' ' HG2' ' A' ' 81' ' ' MET . 38.3 t80 -60.86 -41.37 95.75 Favored 'General case' 0 N--CA 1.496 1.853 0 O-C-N 121.472 -0.768 . . . . 0.0 110.317 179.718 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 78' ' ' LEU . . . . . 0.424 HD23 ' HA ' ' A' ' 78' ' ' LEU . 38.1 mt -60.28 -49.59 76.99 Favored 'General case' 0 N--CA 1.497 1.892 0 O-C-N 121.338 -0.851 . . . . 0.0 110.749 -179.849 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 79' ' ' VAL . . . . . 0.43 ' O ' ' HG3' ' A' ' 83' ' ' ARG . 3.5 m -73.45 -32.42 36.68 Favored 'Isoleucine or valine' 0 N--CA 1.501 2.092 0 O-C-N 121.119 -0.988 . . . . 0.0 109.782 179.626 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 80' ' ' MET . . . . . . . . . . . . . 9.6 ttt -59.03 -49.52 77.57 Favored 'General case' 0 N--CA 1.498 1.944 0 O-C-N 121.372 -0.83 . . . . 0.0 109.616 179.215 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 81' ' ' MET . . . . . 0.445 ' HG2' ' O ' ' A' ' 77' ' ' PHE . 83.8 mmm -62.64 -33.88 75.93 Favored 'General case' 0 N--CA 1.493 1.681 0 O-C-N 121.57 -0.706 . . . . 0.0 109.512 178.88 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 82' ' ' VAL . . . . . . . . . . . . . 3.2 t -66.34 -36.78 78.19 Favored 'Isoleucine or valine' 0 N--CA 1.497 1.893 0 O-C-N 121.6 -0.687 . . . . 0.0 109.985 179.13 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 83' ' ' ARG . . . . . 0.573 ' NH2' HG22 ' A' ' 64' ' ' VAL . 9.7 mtm180 -58.75 -39.5 81.12 Favored 'General case' 0 N--CA 1.502 2.136 0 O-C-N 121.431 -0.793 . . . . 0.0 110.328 179.511 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 84' ' ' CYS . . . . . . . . . . . . . 25.8 m -92.52 -15.88 26.46 Favored 'General case' 0 N--CA 1.499 1.992 0 O-C-N 121.367 -0.833 . . . . 0.0 111.118 179.71 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 85' ' ' MET . . . . . . . . . . . . . 30.7 ttp -95.23 -63.34 1.17 Allowed 'General case' 0 N--CA 1.498 1.957 0 O-C-N 121.196 -0.94 . . . . 0.0 110.405 -179.866 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 86' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -158.91 96.73 1.37 Allowed 'General case' 0 N--CA 1.496 1.845 0 O-C-N 121.125 -0.985 . . . . 0.0 110.755 179.99 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 87' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER -99.86 179.7 4.44 Favored 'General case' 0 N--CA 1.495 1.784 0 O-C-N 121.477 -0.765 . . . . 0.0 109.798 179.223 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 88' ' ' ASP . . . . . 0.465 ' HB2' ' CG2' ' A' ' 4' ' ' ILE . 12.5 m-20 -121.3 120.92 36.51 Favored 'General case' 0 N--CA 1.496 1.836 0 O-C-N 121.189 -0.944 . . . . 0.0 110.516 -179.682 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 89' ' ' SER . . . . . . . . . . . . . 27.0 m . . . . . 0 N--CA 1.502 2.16 0 CA-C-O 118.441 -0.79 . . . . 0.0 110.912 179.846 . . . . . . . . 0 0 . 1 . 004 nuclear build full ' B' B ' 144' ' ' ARG . . . . . . . . . . . . . 0.2 OUTLIER . . . . . 0 N--CA 1.497 1.897 0 CA-C-O 120.799 0.333 . . . . 0.0 110.742 . . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 145' ' ' ARG . . . . . 0.591 ' HA ' ' HG2' ' A' ' 50' ' ' GLN . 2.1 mmp_? -115.23 -150.18 0.46 Allowed 'General case' 0 N--CA 1.497 1.883 0 O-C-N 121.391 -0.818 . . . . 0.0 110.122 -179.79 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' B' B ' 146' ' ' VAL . . . . . . . . . . . . . 4.8 p -93.96 31.15 0.21 Allowed 'Isoleucine or valine' 0 N--CA 1.501 2.08 0 O-C-N 120.964 -1.085 . . . . 0.0 111.695 -179.274 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 147' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -96.89 86.03 3.92 Favored 'General case' 0 N--CA 1.497 1.885 0 O-C-N 120.783 -1.198 . . . . 0.0 109.84 179.264 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' B' B ' 148' ' ' ILE . . . . . 0.551 HD13 ' HAH' ' A' ' 91' ' ' SXK . 2.5 mp -92.79 119.76 40.99 Favored 'Isoleucine or valine' 0 N--CA 1.497 1.883 0 O-C-N 121.316 -0.865 . . . . 0.0 110.243 -179.683 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' B' B ' 149' ' ' SER . . . . . 0.463 ' HB3' ' HB3' ' B' ' 152' ' ' ALA . 13.3 t -100.28 149.89 23.13 Favored 'General case' 0 N--CA 1.497 1.881 0 O-C-N 121.521 -0.737 . . . . 0.0 110.103 179.551 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' B' B ' 150' ' ' ALA . . . . . . . . . . . . . . . -59.03 -40.13 84.07 Favored 'General case' 0 N--CA 1.499 2.017 0 O-C-N 121.442 -0.786 . . . . 0.0 110.721 179.926 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 151' ' ' ASP . . . . . . . . . . . . . 16.9 t70 -75.76 -49.33 18.49 Favored 'General case' 0 N--CA 1.497 1.88 0 O-C-N 121.318 -0.864 . . . . 0.0 110.256 179.648 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 152' ' ' ALA . . . . . 0.463 ' HB3' ' HB3' ' B' ' 149' ' ' SER . . . -58.58 -44.91 89.95 Favored 'General case' 0 N--CA 1.498 1.966 0 O-C-N 121.502 -0.749 . . . . 0.0 110.57 179.896 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' B' B ' 153' ' ' MET . . . . . 0.516 ' SD ' HG23 ' B' ' 148' ' ' ILE . 0.2 OUTLIER -65.83 -37.95 87.59 Favored 'General case' 0 N--CA 1.498 1.97 0 O-C-N 121.299 -0.876 . . . . 0.0 109.789 179.312 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' B' B ' 154' ' ' MET . . . . . . . . . . . . . 19.9 mmm -61.86 -42.27 98.85 Favored 'General case' 0 N--CA 1.497 1.915 0 O-C-N 121.454 -0.779 . . . . 0.0 109.635 178.862 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 155' ' ' GLN . . . . . . . . . . . . . 18.2 tt0 -67.02 -35.72 80.52 Favored 'General case' 0 N--CA 1.497 1.91 0 O-C-N 121.546 -0.721 . . . . 0.0 109.998 178.979 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 156' ' ' ALA . . . . . 0.425 ' HA ' ' HB2' ' B' ' 160' ' ' ALA . . . -67.72 -42.41 82.0 Favored 'General case' 0 N--CA 1.496 1.835 0 O-C-N 121.496 -0.753 . . . . 0.0 110.121 179.538 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' B' B ' 157' ' ' LEU . . . . . 0.758 HD11 ' HE2' ' A' ' 27' ' ' PHE . 2.4 mt -57.43 -33.76 68.25 Favored 'General case' 0 N--CA 1.499 1.981 0 O-C-N 121.615 -0.678 . . . . 0.0 111.031 179.705 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' B' B ' 158' ' ' LEU . . . . . . . . . . . . . 0.8 OUTLIER -127.45 58.92 1.45 Allowed 'General case' 0 N--CA 1.495 1.824 0 O-C-N 121.377 -0.827 . . . . 0.0 110.793 -179.592 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' B' B ' 159' ' ' GLY . . . . . . . . . . . . . . . 173.59 -52.93 0.15 Allowed Glycine 0 N--CA 1.498 2.786 0 C-N-CA 119.812 -1.185 . . . . 0.0 110.748 179.655 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 160' ' ' ALA . . . . . 0.425 ' HB2' ' HA ' ' B' ' 156' ' ' ALA . . . -59.59 -54.31 47.98 Favored 'General case' 0 N--CA 1.502 2.144 0 O-C-N 121.398 -1.06 . . . . 0.0 110.868 -179.394 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' B' B ' 161' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -135.59 39.5 2.83 Favored 'General case' 0 N--CA 1.495 1.797 0 O-C-N 121.356 -0.84 . . . . 0.0 110.147 -179.895 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' B' B ' 162' ' ' ALA . . . . . . . . . . . . . . . -156.23 96.94 1.74 Allowed 'General case' 0 N--CA 1.496 1.849 0 O-C-N 121.323 -0.861 . . . . 0.0 110.248 -179.873 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 163' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.497 1.91 0 CA-C-O 117.838 -1.077 . . . . 0.0 110.798 179.924 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 90' ' ' ' CA' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 004 nuclear build full ' A' A ' 91' ' ' SXK . . . . . 0.846 ' HAK' HD21 ' A' ' 41' ' ' LEU . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.495 1.823 0 CA-C-O 120.586 0.232 . . . . 0.0 110.401 . . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 2' ' ' ASP . . . . . . . . . . . . . 23.8 t70 58.99 -82.17 0.02 OUTLIER 'General case' 0 N--CA 1.505 2.295 0 O-C-N 121.992 -0.443 . . . . 0.0 111.631 179.668 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 3' ' ' ASP . . . . . 0.403 ' HA ' ' HB2' ' A' ' 6' ' ' LYS . 8.8 m-20 -57.03 -32.55 66.29 Favored 'General case' 0 N--CA 1.499 2.022 0 O-C-N 121.273 -0.892 . . . . 0.0 111.218 -179.489 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 4' ' ' ILE . . . . . 0.436 HG23 ' N ' ' A' ' 5' ' ' TYR . 6.1 tp -56.21 -41.79 71.18 Favored 'Isoleucine or valine' 0 N--CA 1.499 2.008 0 O-C-N 121.291 -0.88 . . . . 0.0 110.516 -179.89 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 5' ' ' TYR . . . . . 0.536 ' O ' HG23 ' A' ' 9' ' ' VAL . 42.1 m-85 -83.82 -32.15 25.47 Favored 'General case' 0 N--CA 1.496 1.868 0 O-C-N 121.33 -0.856 . . . . 0.0 109.289 178.596 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 6' ' ' LYS . . . . . 0.403 ' HB2' ' HA ' ' A' ' 3' ' ' ASP . 3.4 ttmt -59.73 -45.73 91.3 Favored 'General case' 0 N--CA 1.499 2.001 0 O-C-N 121.716 -0.615 . . . . 0.0 110.382 179.548 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 7' ' ' ALA . . . . . . . . . . . . . . . -54.25 -42.75 70.28 Favored 'General case' 0 N--CA 1.498 1.949 0 O-C-N 121.666 -0.646 . . . . 0.0 110.113 179.695 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 8' ' ' ALA . . . . . . . . . . . . . . . -66.32 -39.74 89.46 Favored 'General case' 0 N--CA 1.497 1.887 0 O-C-N 121.552 -0.717 . . . . 0.0 110.358 179.374 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 9' ' ' VAL . . . . . 0.672 HG21 HG22 ' A' ' 79' ' ' VAL . 97.7 t -60.89 -41.52 89.13 Favored 'Isoleucine or valine' 0 N--CA 1.502 2.165 0 O-C-N 121.474 -0.766 . . . . 0.0 110.447 179.834 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 10' ' ' GLU . . . . . . . . . . . . . 17.9 mt-10 -79.86 -44.13 21.04 Favored 'General case' 0 N--CA 1.495 1.808 0 O-C-N 121.495 -0.753 . . . . 0.0 111.02 -179.641 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 11' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -89.64 39.15 0.94 Allowed 'General case' 0 N--CA 1.499 1.996 0 O-C-N 121.289 -0.882 . . . . 0.0 111.49 -179.532 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 12' ' ' LEU . . . . . 0.54 ' HB3' ' HD3' ' A' ' 17' ' ' LYS . 0.8 OUTLIER -78.65 138.71 38.44 Favored 'General case' 0 N--CA 1.497 1.899 0 O-C-N 120.916 -1.115 . . . . 0.0 109.783 179.165 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 13' ' ' THR . . . . . 0.409 HG23 ' H ' ' A' ' 16' ' ' GLN . 14.9 t -69.66 164.15 24.02 Favored 'General case' 0 N--CA 1.501 2.079 0 O-C-N 121.264 -0.897 . . . . 0.0 111.396 -179.567 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 14' ' ' GLU . . . . . . . . . . . . . 17.7 tt0 -62.35 -35.89 80.52 Favored 'General case' 0 N--CA 1.495 1.8 0 O-C-N 121.844 -0.535 . . . . 0.0 110.897 -179.422 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 1.3 mp0 -56.89 -41.71 78.55 Favored 'General case' 0 N--CA 1.499 2.024 0 O-C-N 121.415 -0.803 . . . . 0.0 110.776 -179.838 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 16' ' ' GLN . . . . . 0.409 ' H ' HG23 ' A' ' 13' ' ' THR . 81.0 mt-30 -86.35 -44.94 11.67 Favored 'General case' 0 N--CA 1.497 1.907 0 O-C-N 121.333 -0.854 . . . . 0.0 110.796 -179.946 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 17' ' ' LYS . . . . . 0.54 ' HD3' ' HB3' ' A' ' 12' ' ' LEU . 0.2 OUTLIER -59.78 -47.21 86.58 Favored 'General case' 0 N--CA 1.5 2.031 0 O-C-N 121.81 -0.556 . . . . 0.0 110.611 -179.889 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 18' ' ' ASN . . . . . 0.626 ' HA ' ' HG2' ' A' ' 21' ' ' LYS . 32.5 t30 -67.72 -29.49 68.74 Favored 'General case' 0 N--CA 1.495 1.799 0 O-C-N 121.461 -0.775 . . . . 0.0 110.447 179.593 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 12.7 tt0 -73.65 -43.43 59.5 Favored 'General case' 0 N--CA 1.492 1.669 0 O-C-N 121.237 -0.915 . . . . 0.0 109.876 179.444 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 20' ' ' PHE . . . . . . . . . . . . . 16.9 m-85 -73.59 -35.74 65.44 Favored 'General case' 0 N--CA 1.498 1.925 0 O-C-N 121.354 -0.841 . . . . 0.0 110.784 179.869 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 21' ' ' LYS . . . . . 0.626 ' HG2' ' HA ' ' A' ' 18' ' ' ASN . 0.0 OUTLIER -64.13 -30.86 71.9 Favored 'General case' 0 N--CA 1.496 1.868 0 O-C-N 121.14 -0.975 . . . . 0.0 110.207 179.546 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 22' ' ' ALA . . . . . 0.515 ' N ' ' HG3' ' A' ' 21' ' ' LYS . . . -77.15 -31.69 55.76 Favored 'General case' 0 N--CA 1.5 2.034 0 O-C-N 121.401 -0.812 . . . . 0.0 109.603 178.701 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 23' ' ' ALA . . . . . . . . . . . . . . . -85.73 -8.69 58.01 Favored 'General case' 0 N--CA 1.494 1.773 0 O-C-N 121.416 -0.803 . . . . 0.0 110.328 178.96 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 24' ' ' PHE . . . . . . . . . . . . . 73.1 t80 -88.07 -52.05 5.46 Favored 'General case' 0 N--CA 1.494 1.773 0 O-C-N 121.179 -0.951 . . . . 0.0 110.382 -179.823 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 25' ' ' ASP . . . . . . . . . . . . . 3.1 p-10 -60.71 -36.18 78.16 Favored 'General case' 0 N--CA 1.501 2.077 0 O-C-N 121.26 -0.9 . . . . 0.0 110.348 179.85 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 26' ' ' ILE . . . . . 0.568 HD13 ' CB ' ' B' ' 162' ' ' ALA . 81.9 mt -70.1 -34.55 59.77 Favored 'Isoleucine or valine' 0 N--CA 1.5 2.039 0 O-C-N 121.063 -1.023 . . . . 0.0 109.34 178.669 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 27' ' ' PHE . . . . . . . . . . . . . 0.3 OUTLIER -62.09 -43.86 97.91 Favored 'General case' 0 N--CA 1.497 1.888 0 O-C-N 121.463 -0.773 . . . . 0.0 110.248 179.244 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 28' ' ' VAL . . . . . . . . . . . . . 32.6 m -84.9 43.67 0.06 OUTLIER 'Isoleucine or valine' 0 N--CA 1.5 2.051 0 O-C-N 121.503 -0.748 . . . . 0.0 111.443 -179.675 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 29' ' ' LEU . . . . . 0.458 HD12 ' O ' ' A' ' 26' ' ' ILE . 0.1 OUTLIER -63.11 -55.12 27.98 Favored 'General case' 0 N--CA 1.499 2.02 0 O-C-N 121.019 -1.05 . . . . 0.0 109.718 179.161 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 30' ' ' GLY . . . . . . . . . . . . . . . -103.1 52.89 0.77 Allowed Glycine 0 N--CA 1.497 2.721 0 N-CA-C 108.601 -1.8 . . . . 0.0 108.601 178.787 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 31' ' ' ALA . . . . . 0.528 ' O ' ' HB2' ' A' ' 32' ' ' GLU . . . -102.93 -23.49 13.73 Favored 'General case' 0 N--CA 1.496 1.847 0 O-C-N 121.632 -0.922 . . . . 0.0 111.172 -179.269 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 32' ' ' GLU . . . . . 0.528 ' HB2' ' O ' ' A' ' 31' ' ' ALA . 1.5 mp0 65.84 -68.22 0.13 Allowed 'General case' 0 N--CA 1.505 2.301 0 O-C-N 121.848 -0.533 . . . . 0.0 110.891 -179.674 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 1.6 m-20 -62.16 -38.74 90.16 Favored 'General case' 0 N--CA 1.497 1.922 0 O-C-N 121.264 -0.897 . . . . 0.0 110.553 179.723 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 34' ' ' GLY . . . . . . . . . . . . . . . 118.45 -24.58 8.53 Favored Glycine 0 N--CA 1.496 2.693 0 N-CA-C 110.391 -1.084 . . . . 0.0 110.391 179.858 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 35' ' ' CYS . . . . . 0.413 ' HB3' ' HB ' ' A' ' 71' ' ' THR . 99.6 m -88.8 152.52 21.72 Favored 'General case' 0 N--CA 1.499 2.001 0 O-C-N 121.252 -1.146 . . . . 0.0 110.524 -179.797 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 36' ' ' ILE . . . . . 0.423 ' HB ' ' HB ' ' A' ' 72' ' ' VAL . 66.8 mt -67.07 128.57 30.52 Favored 'Isoleucine or valine' 0 N--CA 1.502 2.152 0 O-C-N 121.323 -0.861 . . . . 0.0 110.462 -179.841 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 37' ' ' SER . . . . . . . . . . . . . 9.1 t -103.81 171.25 7.46 Favored 'General case' 0 N--CA 1.498 1.932 0 O-C-N 121.665 -0.647 . . . . 0.0 110.535 179.812 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 38' ' ' THR . . . . . 0.686 HG21 ' HG2' ' A' ' 58' ' ' GLN . 68.9 p -67.94 -48.75 65.06 Favored 'General case' 0 N--CA 1.502 2.143 0 O-C-N 121.278 -0.889 . . . . 0.0 110.4 -179.983 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 39' ' ' LYS . . . . . . . . . . . . . 0.7 OUTLIER -61.2 -37.97 84.89 Favored 'General case' 0 N--CA 1.5 2.063 0 O-C-N 121.295 -0.878 . . . . 0.0 109.316 178.98 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 12.9 tt0 -63.97 -46.52 84.26 Favored 'General case' 0 N--CA 1.495 1.802 0 CA-C-O 121.305 0.574 . . . . 0.0 109.479 178.874 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 41' ' ' LEU . . . . . 0.686 HD21 ' HAK' ' A' ' 91' ' ' SXK . 0.1 OUTLIER -65.56 -58.02 6.79 Favored 'General case' 0 N--CA 1.494 1.763 0 O-C-N 121.634 -0.666 . . . . 0.0 109.275 178.798 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 42' ' ' GLY . . . . . 0.404 ' O ' ' HB2' ' A' ' 45' ' ' MET . . . -47.27 -33.08 7.42 Favored Glycine 0 N--CA 1.502 3.057 0 N-CA-C 111.259 -0.737 . . . . 0.0 111.259 179.985 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 43' ' ' LYS . . . . . . . . . . . . . 1.8 tmtm? -58.98 -36.6 75.15 Favored 'General case' 0 N--CA 1.502 2.129 0 O-C-N 121.063 -1.257 . . . . 0.0 110.232 179.573 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 44' ' ' VAL . . . . . . . . . . . . . 93.9 t -85.05 -22.06 7.71 Favored 'Isoleucine or valine' 0 N--CA 1.498 1.961 0 O-C-N 121.499 -0.751 . . . . 0.0 109.911 179.335 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 45' ' ' MET . . . . . 0.404 ' HB2' ' O ' ' A' ' 42' ' ' GLY . 6.4 mmt -56.52 -36.9 69.73 Favored 'General case' 0 N--CA 1.499 2.02 0 O-C-N 121.262 -0.899 . . . . 0.0 110.326 179.35 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 46' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -62.21 -33.34 74.37 Favored 'General case' 0 N--CA 1.5 2.036 0 O-C-N 121.326 -0.858 . . . . 0.0 110.298 179.207 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 47' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -63.22 -32.28 73.64 Favored 'General case' 0 N--CA 1.501 2.102 0 O-C-N 121.342 -0.849 . . . . 0.0 110.141 179.332 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 48' ' ' LEU . . . . . . . . . . . . . 8.0 mt -93.2 -43.51 8.8 Favored 'General case' 0 N--CA 1.496 1.855 0 O-C-N 121.405 -0.81 . . . . 0.0 109.631 179.347 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 49' ' ' GLY . . . . . . . . . . . . . . . -143.73 -101.6 0.37 Allowed Glycine 0 N--CA 1.493 2.456 0 N-CA-C 109.082 -1.607 . . . . 0.0 109.082 179.557 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 50' ' ' GLN . . . . . . . . . . . . . 12.8 mt-30 -147.21 170.17 17.81 Favored 'General case' 0 N--CA 1.496 1.872 0 O-C-N 121.403 -1.057 . . . . 0.0 110.54 179.83 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 51' ' ' ASN . . . . . . . . . . . . . 44.7 t30 -138.79 104.76 7.49 Favored Pre-proline 0 N--CA 1.495 1.817 0 O-C-N 121.489 -0.757 . . . . 0.0 109.876 179.894 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 52' ' ' PRO . . . . . . . . . . . . . 48.9 Cg_endo -77.94 -50.74 0.08 OUTLIER 'Trans proline' 0 C--N 1.314 -1.267 0 O-C-N 123.771 1.406 . . . . 0.0 111.108 -179.614 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 53' ' ' THR . . . . . 0.478 ' OG1' ' HD2' ' A' ' 54' ' ' PRO . 0.1 OUTLIER -156.89 159.16 31.45 Favored Pre-proline 0 N--CA 1.498 1.931 0 O-C-N 121.142 -0.974 . . . . 0.0 110.739 -179.448 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 54' ' ' PRO . . . . . 0.478 ' HD2' ' OG1' ' A' ' 53' ' ' THR . 42.5 Cg_endo -67.12 -24.57 44.56 Favored 'Trans proline' 0 N--CA 1.49 1.296 0 O-C-N 123.932 1.49 . . . . 0.0 110.69 179.246 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 55' ' ' GLU . . . . . . . . . . . . . 0.9 OUTLIER -59.31 -36.5 75.74 Favored 'General case' 0 N--CA 1.498 1.958 0 O-C-N 121.319 -0.863 . . . . 0.0 109.971 179.178 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 1.2 mm-40 -59.85 -42.93 94.69 Favored 'General case' 0 N--CA 1.497 1.882 0 O-C-N 121.502 -0.749 . . . . 0.0 109.808 179.103 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 57' ' ' LEU . . . . . 0.562 HD22 ' N ' ' A' ' 57' ' ' LEU . 2.6 mm? -74.05 -28.89 61.63 Favored 'General case' 0 N--CA 1.494 1.761 0 O-C-N 121.367 -0.833 . . . . 0.0 109.769 178.988 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 58' ' ' GLN . . . . . 0.686 ' HG2' HG21 ' A' ' 38' ' ' THR . 0.0 OUTLIER -54.83 -53.36 56.24 Favored 'General case' 0 N--CA 1.5 2.027 0 O-C-N 121.28 -0.887 . . . . 0.0 109.056 179.127 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 59' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER -61.17 -33.71 73.87 Favored 'General case' 0 N--CA 1.495 1.804 0 N-CA-C 108.848 -0.797 . . . . 0.0 108.848 177.966 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 60' ' ' MET . . . . . 0.524 ' HB2' ' HA ' ' A' ' 57' ' ' LEU . 0.0 OUTLIER -64.65 -37.91 89.2 Favored 'General case' 0 N--CA 1.496 1.838 0 O-C-N 121.753 -0.592 . . . . 0.0 110.052 178.752 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 61' ' ' ILE . . . . . 0.673 HG12 HG23 ' A' ' 72' ' ' VAL . 1.0 OUTLIER -74.57 -43.84 47.79 Favored 'Isoleucine or valine' 0 N--CA 1.496 1.835 0 O-C-N 121.308 -0.87 . . . . 0.0 109.573 179.375 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 62' ' ' ASP . . . . . 0.411 ' N ' ' CG2' ' A' ' 61' ' ' ILE . 2.6 m-20 -55.6 -31.67 62.44 Favored 'General case' 0 N--CA 1.5 2.06 0 O-C-N 121.262 -0.899 . . . . 0.0 109.902 178.874 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 63' ' ' GLU . . . . . . . . . . . . . 7.4 tt0 -59.74 -35.07 73.82 Favored 'General case' 0 N--CA 1.497 1.92 0 O-C-N 121.737 -0.602 . . . . 0.0 110.672 179.226 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 64' ' ' VAL . . . . . 0.634 HG11 ' SD ' ' A' ' 80' ' ' MET . 9.9 p -124.11 23.38 3.87 Favored 'Isoleucine or valine' 0 N--CA 1.497 1.885 0 O-C-N 121.216 -0.927 . . . . 0.0 110.842 -179.75 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 65' ' ' ASP . . . . . . . . . . . . . 8.5 t70 -131.36 -82.44 0.52 Allowed 'General case' 0 N--CA 1.497 1.909 0 O-C-N 121.172 -0.955 . . . . 0.0 109.654 -179.918 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 66' ' ' GLU . . . . . . . . . . . . . 0.3 OUTLIER 40.81 48.46 2.71 Favored 'General case' 0 N--CA 1.505 2.315 0 O-C-N 121.42 -0.8 . . . . 0.0 112.366 178.734 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 67' ' ' ASP . . . . . . . . . . . . . 4.3 p-10 -117.46 7.39 12.73 Favored 'General case' 0 N--CA 1.501 2.08 0 O-C-N 120.982 -1.074 . . . . 0.0 111.079 179.532 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 68' ' ' GLY . . . . . . . . . . . . . . . 96.3 -5.46 65.35 Favored Glycine 0 N--CA 1.497 2.764 0 N-CA-C 110.521 -1.032 . . . . 0.0 110.521 -179.856 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 69' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -106.07 -43.82 4.74 Favored 'General case' 0 N--CA 1.496 1.838 0 O-C-N 121.049 -1.265 . . . . 0.0 110.496 -179.825 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 70' ' ' GLY . . . . . . . . . . . . . . . 78.78 19.84 72.25 Favored Glycine 0 N--CA 1.497 2.758 0 N-CA-C 109.527 -1.429 . . . . 0.0 109.527 -179.472 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 71' ' ' THR . . . . . 0.413 ' HB ' ' HB3' ' A' ' 35' ' ' CYS . 0.1 OUTLIER -132.22 124.01 28.11 Favored 'General case' 0 N--CA 1.492 1.643 0 O-C-N 121.601 -0.941 . . . . 0.0 108.652 -179.761 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 72' ' ' VAL . . . . . 0.673 HG23 HG12 ' A' ' 61' ' ' ILE . 4.9 t -75.59 124.54 33.79 Favored 'Isoleucine or valine' 0 N--CA 1.496 1.844 0 O-C-N 121.448 -0.783 . . . . 0.0 111.008 -178.68 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 73' ' ' ASP . . . . . . . . . . . . . 18.0 t70 -95.6 -176.84 3.87 Favored 'General case' 0 N--CA 1.495 1.791 0 O-C-N 121.673 -0.642 . . . . 0.0 109.399 179.145 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 74' ' ' PHE . . . . . . . . . . . . . 28.6 t80 -60.07 -44.62 94.63 Favored 'General case' 0 N--CA 1.498 1.945 0 O-C-N 120.957 -1.09 . . . . 0.0 109.784 179.61 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 75' ' ' ASP . . . . . . . . . . . . . 31.4 t70 -62.71 -48.03 81.02 Favored 'General case' 0 N--CA 1.496 1.864 0 O-C-N 121.543 -0.723 . . . . 0.0 110.287 179.32 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 76' ' ' GLU . . . . . . . . . . . . . 54.0 mt-10 -66.92 -32.67 74.07 Favored 'General case' 0 N--CA 1.498 1.933 0 O-C-N 121.444 -0.785 . . . . 0.0 109.656 179.342 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 77' ' ' PHE . . . . . . . . . . . . . 68.3 t80 -60.74 -39.16 87.64 Favored 'General case' 0 N--CA 1.493 1.708 0 O-C-N 121.513 -0.742 . . . . 0.0 109.44 178.642 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 78' ' ' LEU . . . . . . . . . . . . . 88.9 mt -63.77 -37.94 89.26 Favored 'General case' 0 N--CA 1.498 1.942 0 O-C-N 121.432 -0.792 . . . . 0.0 109.46 178.736 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 79' ' ' VAL . . . . . 0.672 HG22 HG21 ' A' ' 9' ' ' VAL . 85.0 t -64.17 -34.74 70.81 Favored 'Isoleucine or valine' 0 N--CA 1.499 2.014 0 O-C-N 121.36 -0.838 . . . . 0.0 109.13 178.405 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 80' ' ' MET . . . . . 0.634 ' SD ' HG11 ' A' ' 64' ' ' VAL . 1.5 ttt -67.88 -39.48 83.69 Favored 'General case' 0 N--CA 1.496 1.842 0 O-C-N 121.552 -0.718 . . . . 0.0 109.53 178.835 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 81' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -65.95 -50.23 65.12 Favored 'General case' 0 N--CA 1.497 1.913 0 O-C-N 121.562 -0.711 . . . . 0.0 110.684 179.702 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 82' ' ' VAL . . . . . 0.472 HG12 ' O ' ' A' ' 79' ' ' VAL . 9.4 p -62.19 -30.02 47.9 Favored 'Isoleucine or valine' 0 N--CA 1.5 2.035 0 O-C-N 121.25 -0.906 . . . . 0.0 110.189 179.774 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 83' ' ' ARG . . . . . . . . . . . . . 3.2 mtp-105 -69.24 -46.48 67.21 Favored 'General case' 0 N--CA 1.495 1.78 0 O-C-N 121.354 -0.842 . . . . 0.0 109.392 178.724 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 84' ' ' CYS . . . . . . . . . . . . . 88.6 m -66.92 -32.78 74.27 Favored 'General case' 0 N--CA 1.497 1.906 0 O-C-N 121.61 -0.681 . . . . 0.0 110.155 179.254 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 85' ' ' MET . . . . . . . . . . . . . 32.2 mtm -67.23 -31.3 71.56 Favored 'General case' 0 N--CA 1.5 2.033 0 O-C-N 121.453 -0.779 . . . . 0.0 110.249 179.216 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 86' ' ' LYS . . . . . . . . . . . . . 4.9 tptp 58.95 58.56 3.13 Favored 'General case' 0 N--CA 1.5 2.07 0 O-C-N 121.72 -0.613 . . . . 0.0 110.878 179.962 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 87' ' ' ASP . . . . . . . . . . . . . 15.6 m-20 54.3 -153.22 0.3 Allowed 'General case' 0 N--CA 1.502 2.166 0 O-C-N 121.691 -0.631 . . . . 0.0 111.205 179.206 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 88' ' ' ASP . . . . . . . . . . . . . 7.6 p-10 -152.65 -40.12 0.1 Allowed 'General case' 0 N--CA 1.499 1.987 0 O-C-N 121.373 -0.829 . . . . 0.0 110.909 -179.698 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 89' ' ' SER . . . . . . . . . . . . . 3.2 t . . . . . 0 N--CA 1.497 1.876 0 CA-C-O 117.813 -1.089 . . . . 0.0 110.678 179.974 . . . . . . . . 0 0 . 1 . 005 nuclear build full ' B' B ' 144' ' ' ARG . . . . . . . . . . . . . 1.3 ttt-85 . . . . . 0 N--CA 1.494 1.758 0 CA-C-O 121.118 0.485 . . . . 0.0 110.121 . . . . . . . . . 0 0 . 1 . 005 nuclear build full ' B' B ' 145' ' ' ARG . . . . . . . . . . . . . 13.3 ttt85 -76.45 141.57 41.3 Favored 'General case' 0 N--CA 1.495 1.821 0 O-C-N 121.454 -0.779 . . . . 0.0 110.466 -179.924 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 146' ' ' VAL . . . . . . . . . . . . . 16.2 m -130.5 154.51 40.68 Favored 'Isoleucine or valine' 0 N--CA 1.5 2.045 0 O-C-N 121.594 -0.692 . . . . 0.0 110.125 179.808 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 147' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -116.92 90.99 3.45 Favored 'General case' 0 N--CA 1.494 1.769 0 O-C-N 121.264 -0.898 . . . . 0.0 110.909 -179.63 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' B' B ' 148' ' ' ILE . . . . . 0.433 HG21 ' HE2' ' B' ' 153' ' ' MET . 1.8 mp -99.1 121.76 50.06 Favored 'Isoleucine or valine' 0 N--CA 1.497 1.884 0 O-C-N 121.261 -0.9 . . . . 0.0 109.447 179.428 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' B' B ' 149' ' ' SER . . . . . . . . . . . . . 27.5 m -100.33 170.48 8.4 Favored 'General case' 0 N--CA 1.498 1.965 0 O-C-N 121.504 -0.748 . . . . 0.0 110.772 -179.709 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 150' ' ' ALA . . . . . . . . . . . . . . . -60.47 -50.76 72.29 Favored 'General case' 0 N--CA 1.498 1.958 0 O-C-N 121.573 -0.704 . . . . 0.0 110.549 179.909 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 151' ' ' ASP . . . . . . . . . . . . . 7.5 p-10 -61.54 -34.79 76.16 Favored 'General case' 0 N--CA 1.5 2.029 0 O-C-N 121.453 -0.779 . . . . 0.0 110.68 179.771 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 152' ' ' ALA . . . . . . . . . . . . . . . -68.06 -54.4 18.55 Favored 'General case' 0 N--CA 1.497 1.878 0 O-C-N 121.316 -0.865 . . . . 0.0 110.44 179.995 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 153' ' ' MET . . . . . 0.433 ' HE2' HG21 ' B' ' 148' ' ' ILE . 1.1 tpt -66.16 -31.04 71.65 Favored 'General case' 0 N--CA 1.499 1.991 0 O-C-N 121.317 -0.865 . . . . 0.0 110.346 179.597 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' B' B ' 154' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -64.12 -41.21 97.31 Favored 'General case' 0 N--CA 1.499 2.009 0 O-C-N 121.348 -0.845 . . . . 0.0 110.326 179.486 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' B' B ' 155' ' ' GLN . . . . . . . . . . . . . 33.6 mt-30 -77.94 -31.75 51.16 Favored 'General case' 0 N--CA 1.499 1.98 0 O-C-N 121.346 -0.846 . . . . 0.0 110.83 179.878 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 156' ' ' ALA . . . . . . . . . . . . . . . -54.93 -45.85 74.87 Favored 'General case' 0 N--CA 1.501 2.11 0 O-C-N 121.386 -0.821 . . . . 0.0 110.959 -179.683 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 157' ' ' LEU . . . . . . . . . . . . . 1.2 tp -80.35 -46.35 16.22 Favored 'General case' 0 N--CA 1.496 1.83 0 O-C-N 121.173 -0.955 . . . . 0.0 110.208 179.71 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 158' ' ' LEU . . . . . . . . . . . . . 1.1 mp -79.74 86.12 5.36 Favored 'General case' 0 N--CA 1.495 1.816 0 O-C-N 121.34 -0.85 . . . . 0.0 109.308 179.207 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 159' ' ' GLY . . . . . . . . . . . . . . . 145.73 -41.49 1.03 Allowed Glycine 0 N--CA 1.494 2.547 0 N-CA-C 109.154 -1.578 . . . . 0.0 109.154 -179.157 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 160' ' ' ALA . . . . . . . . . . . . . . . -120.1 26.42 9.27 Favored 'General case' 0 N--CA 1.496 1.856 0 O-C-N 121.438 -1.036 . . . . 0.0 110.849 179.659 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 161' ' ' ARG . . . . . . . . . . . . . 0.4 OUTLIER -150.08 -58.06 0.19 Allowed 'General case' 0 N--CA 1.496 1.85 0 O-C-N 120.938 -1.101 . . . . 0.0 110.957 179.815 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' B' B ' 162' ' ' ALA . . . . . 0.568 ' CB ' HD13 ' A' ' 26' ' ' ILE . . . -118.67 -66.59 1.06 Allowed 'General case' 0 N--CA 1.495 1.796 0 O-C-N 121.375 -0.828 . . . . 0.0 110.733 -179.653 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' B' B ' 163' ' ' LYS . . . . . . . . . . . . . 3.3 mtpt . . . . . 0 N--CA 1.496 1.866 0 CA-C-O 117.883 -1.056 . . . . 0.0 110.284 -179.832 . . . . . . . . 0 0 . 1 . 005 nuclear build full ' A' A ' 90' ' ' ' CA' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 005 nuclear build full ' A' A ' 91' ' ' SXK . . . . . 0.686 ' HAK' HD21 ' A' ' 41' ' ' LEU . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 3.7 mmm . . . . . 0 N--CA 1.498 1.948 0 CA-C-O 120.905 0.383 . . . . 0.0 110.014 . . . . . . . . . 0 0 . 1 . 006 nuclear build full ' A' A ' 2' ' ' ASP . . . . . 0.431 ' HB3' ' HB2' ' A' ' 6' ' ' LYS . 32.1 t0 -160.33 157.43 27.96 Favored 'General case' 0 N--CA 1.497 1.898 0 O-C-N 121.464 -0.772 . . . . 0.0 110.842 -179.617 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 3' ' ' ASP . . . . . . . . . . . . . 23.8 t70 -141.82 -67.78 0.39 Allowed 'General case' 0 N--CA 1.494 1.77 0 O-C-N 121.49 -0.756 . . . . 0.0 110.499 179.924 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 4' ' ' ILE . . . . . 0.438 HG23 ' N ' ' A' ' 5' ' ' TYR . 1.1 tp -65.09 -41.81 92.83 Favored 'Isoleucine or valine' 0 N--CA 1.499 2.023 0 O-C-N 121.333 -0.854 . . . . 0.0 111.107 -179.549 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 5' ' ' TYR . . . . . 0.552 ' CD2' ' HG2' ' A' ' 83' ' ' ARG . 27.2 m-85 -78.84 -34.03 45.47 Favored 'General case' 0 N--CA 1.497 1.885 0 O-C-N 121.037 -1.039 . . . . 0.0 109.781 179.615 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 6' ' ' LYS . . . . . 0.431 ' HB2' ' HB3' ' A' ' 2' ' ' ASP . 11.7 ttpp -61.03 -43.54 98.73 Favored 'General case' 0 N--CA 1.493 1.722 0 O-C-N 121.564 -0.71 . . . . 0.0 109.929 179.159 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 7' ' ' ALA . . . . . . . . . . . . . . . -55.31 -38.94 69.33 Favored 'General case' 0 N--CA 1.5 2.075 0 O-C-N 121.47 -0.769 . . . . 0.0 110.083 179.325 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 8' ' ' ALA . . . . . . . . . . . . . . . -61.0 -39.1 88.42 Favored 'General case' 0 N--CA 1.497 1.915 0 O-C-N 121.481 -0.762 . . . . 0.0 109.614 178.91 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 9' ' ' VAL . . . . . 0.94 ' HA ' HD12 ' A' ' 12' ' ' LEU . 59.1 t -64.27 -39.11 84.35 Favored 'Isoleucine or valine' 0 N--CA 1.499 2.0 0 O-C-N 121.532 -0.73 . . . . 0.0 109.288 178.784 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 10' ' ' GLU . . . . . . . . . . . . . 3.4 mt-10 -64.98 -29.07 69.97 Favored 'General case' 0 N--CA 1.5 2.041 0 O-C-N 121.459 -0.776 . . . . 0.0 109.769 178.675 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 11' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -82.62 -19.05 39.09 Favored 'General case' 0 N--CA 1.498 1.972 0 O-C-N 121.445 -0.784 . . . . 0.0 110.69 179.417 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 12' ' ' LEU . . . . . 0.94 HD12 ' HA ' ' A' ' 9' ' ' VAL . 18.3 mt -62.99 116.14 5.05 Favored 'General case' 0 N--CA 1.497 1.887 0 O-C-N 121.255 -0.903 . . . . 0.0 110.057 179.857 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 13' ' ' THR . . . . . . . . . . . . . 71.3 p -74.62 167.49 21.66 Favored 'General case' 0 N--CA 1.497 1.902 0 O-C-N 121.297 -0.877 . . . . 0.0 109.888 179.75 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 14' ' ' GLU . . . . . . . . . . . . . 9.7 tp10 -58.23 -34.71 70.73 Favored 'General case' 0 N--CA 1.492 1.671 0 O-C-N 121.588 -0.695 . . . . 0.0 110.643 -179.421 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 17.9 tt0 -59.32 -46.39 88.7 Favored 'General case' 0 N--CA 1.498 1.968 0 O-C-N 121.338 -0.851 . . . . 0.0 109.44 178.981 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 16' ' ' GLN . . . . . . . . . . . . . 3.2 mt-30 -65.15 -37.58 87.87 Favored 'General case' 0 N--CA 1.498 1.949 0 O-C-N 121.531 -0.73 . . . . 0.0 109.871 178.826 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 17' ' ' LYS . . . . . 0.474 ' HD2' HD11 ' A' ' 78' ' ' LEU . 15.8 mtmt -60.58 -40.3 91.22 Favored 'General case' 0 N--CA 1.497 1.882 0 N-CA-C 109.163 -0.68 . . . . 0.0 109.163 178.795 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 18' ' ' ASN . . . . . 0.481 ' HA ' ' HB3' ' A' ' 21' ' ' LYS . 8.2 t30 -64.9 -39.32 93.34 Favored 'General case' 0 N--CA 1.497 1.884 0 O-C-N 121.588 -0.695 . . . . 0.0 109.894 179.107 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 14.9 mt-10 -57.49 -42.49 82.8 Favored 'General case' 0 N--CA 1.499 1.988 0 O-C-N 121.46 -0.775 . . . . 0.0 109.224 178.862 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 20' ' ' PHE . . . . . . . . . . . . . 3.8 m-85 -75.5 -30.11 59.74 Favored 'General case' 0 N--CA 1.494 1.76 0 O-C-N 121.581 -0.699 . . . . 0.0 109.49 178.543 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 21' ' ' LYS . . . . . 0.481 ' HB3' ' HA ' ' A' ' 18' ' ' ASN . 0.0 OUTLIER -57.43 -32.55 67.01 Favored 'General case' 0 N--CA 1.498 1.965 0 O-C-N 121.58 -0.7 . . . . 0.0 109.638 179.042 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 22' ' ' ALA . . . . . 0.433 ' N ' ' HG3' ' A' ' 21' ' ' LYS . . . -58.3 -52.98 63.3 Favored 'General case' 0 N--CA 1.497 1.876 0 O-C-N 121.394 -0.816 . . . . 0.0 109.408 178.787 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 23' ' ' ALA . . . . . . . . . . . . . . . -68.89 -35.88 77.38 Favored 'General case' 0 N--CA 1.496 1.865 0 O-C-N 121.602 -0.687 . . . . 0.0 109.548 178.622 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 24' ' ' PHE . . . . . 0.476 ' HB3' ' HA ' ' A' ' 21' ' ' LYS . 70.8 t80 -61.58 -51.06 70.09 Favored 'General case' 0 N--CA 1.497 1.911 0 O-C-N 121.721 -0.612 . . . . 0.0 110.404 179.446 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 25' ' ' ASP . . . . . . . . . . . . . 0.7 OUTLIER -62.33 -44.91 95.4 Favored 'General case' 0 N--CA 1.498 1.964 0 O-C-N 121.562 -0.711 . . . . 0.0 110.241 179.812 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 26' ' ' ILE . . . . . . . . . . . . . 22.1 mt -65.84 -29.53 47.22 Favored 'Isoleucine or valine' 0 N--CA 1.498 1.947 0 O-C-N 121.268 -0.895 . . . . 0.0 109.68 179.009 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 27' ' ' PHE . . . . . 0.406 ' HZ ' ' SD ' ' B' ' 153' ' ' MET . 0.1 OUTLIER -62.14 -42.58 99.39 Favored 'General case' 0 N--CA 1.498 1.945 0 O-C-N 121.372 -0.83 . . . . 0.0 110.13 179.033 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 28' ' ' VAL . . . . . 0.414 ' H ' HG22 ' A' ' 28' ' ' VAL . 34.0 m -88.24 37.01 0.07 OUTLIER 'Isoleucine or valine' 0 N--CA 1.5 2.046 0 O-C-N 121.29 -0.881 . . . . 0.0 111.137 -179.846 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 29' ' ' LEU . . . . . 0.412 HD13 ' HA ' ' B' ' 162' ' ' ALA . 2.7 mt -74.17 -44.89 51.77 Favored 'General case' 0 N--CA 1.498 1.957 0 O-C-N 120.954 -1.091 . . . . 0.0 109.58 178.944 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 30' ' ' GLY . . . . . . . . . . . . . . . -110.46 30.3 8.32 Favored Glycine 0 N--CA 1.494 2.533 0 N-CA-C 109.381 -1.488 . . . . 0.0 109.381 179.071 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 31' ' ' ALA . . . . . . . . . . . . . . . -93.21 101.0 13.27 Favored 'General case' 0 N--CA 1.497 1.901 0 O-C-N 121.363 -1.081 . . . . 0.0 110.585 -179.884 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 32' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -60.36 -25.1 65.6 Favored 'General case' 0 N--CA 1.501 2.118 0 O-C-N 121.409 -0.807 . . . . 0.0 110.683 179.552 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 14.2 m-20 -69.54 -28.77 66.29 Favored 'General case' 0 N--CA 1.499 1.991 0 O-C-N 121.384 -0.822 . . . . 0.0 110.461 179.511 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 34' ' ' GLY . . . . . . . . . . . . . . . 109.97 -35.82 4.64 Favored Glycine 0 N--CA 1.497 2.705 0 N-CA-C 109.503 -1.439 . . . . 0.0 109.503 -179.504 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 35' ' ' CYS . . . . . 0.413 ' SG ' ' HB ' ' A' ' 71' ' ' THR . 30.3 p -122.71 -172.3 2.45 Favored 'General case' 0 N--CA 1.499 1.989 0 O-C-N 121.482 -1.011 . . . . 0.0 109.807 179.623 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 36' ' ' ILE . . . . . 0.67 ' HA ' ' HG2' ' A' ' 40' ' ' GLU . 4.2 mt -81.15 104.07 9.13 Favored 'Isoleucine or valine' 0 N--CA 1.497 1.916 0 O-C-N 120.94 -1.1 . . . . 0.0 110.207 179.833 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 37' ' ' SER . . . . . . . . . . . . . 0.9 OUTLIER -107.95 -170.54 1.7 Allowed 'General case' 0 N--CA 1.494 1.752 0 O-C-N 121.644 -0.66 . . . . 0.0 110.014 179.758 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 38' ' ' THR . . . . . . . . . . . . . 23.9 p -63.45 -37.7 88.3 Favored 'General case' 0 N--CA 1.502 2.175 0 O-C-N 121.23 -0.919 . . . . 0.0 110.54 179.726 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 39' ' ' LYS . . . . . . . . . . . . . 9.8 mtmt -63.47 -47.39 82.01 Favored 'General case' 0 N--CA 1.5 2.032 0 O-C-N 121.557 -0.714 . . . . 0.0 111.173 -179.77 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 40' ' ' GLU . . . . . 0.67 ' HG2' ' HA ' ' A' ' 36' ' ' ILE . 0.0 OUTLIER -60.49 -33.66 72.93 Favored 'General case' 0 N--CA 1.502 2.133 0 O-C-N 121.391 -0.818 . . . . 0.0 111.529 -179.074 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 41' ' ' LEU . . . . . 0.765 HD12 ' HG ' ' A' ' 57' ' ' LEU . 3.1 tm? -69.36 -66.73 0.55 Allowed 'General case' 0 N--CA 1.495 1.782 0 O-C-N 121.32 -0.863 . . . . 0.0 110.18 -179.771 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 42' ' ' GLY . . . . . . . . . . . . . . . -44.84 -42.42 7.77 Favored Glycine 0 N--CA 1.5 2.934 0 N-CA-C 110.61 -0.996 . . . . 0.0 110.61 -179.729 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 43' ' ' LYS . . . . . . . . . . . . . 5.1 mttm -56.96 -49.9 74.28 Favored 'General case' 0 N--CA 1.501 2.077 0 O-C-N 121.476 -1.014 . . . . 0.0 110.348 179.617 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 44' ' ' VAL . . . . . . . . . . . . . 21.3 t -67.42 -36.32 76.11 Favored 'Isoleucine or valine' 0 N--CA 1.5 2.07 0 O-C-N 121.334 -0.854 . . . . 0.0 110.179 179.221 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 45' ' ' MET . . . . . . . . . . . . . 1.2 mtt -63.11 -32.34 73.7 Favored 'General case' 0 N--CA 1.499 2.006 0 O-C-N 121.472 -0.767 . . . . 0.0 111.21 -179.89 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 46' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -47.92 -41.64 25.14 Favored 'General case' 0 N--CA 1.503 2.179 0 O-C-N 121.212 -0.93 . . . . 0.0 111.365 -179.786 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 47' ' ' MET . . . . . . . . . . . . . 13.3 ptt? -90.66 -27.69 18.86 Favored 'General case' 0 N--CA 1.5 2.041 0 O-C-N 121.162 -0.961 . . . . 0.0 110.395 179.384 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 48' ' ' LEU . . . . . . . . . . . . . 14.6 tp -128.86 87.45 2.57 Favored 'General case' 0 N--CA 1.492 1.654 0 O-C-N 121.367 -0.833 . . . . 0.0 109.236 179.423 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 49' ' ' GLY . . . . . . . . . . . . . . . 93.53 70.34 1.12 Allowed Glycine 0 N--CA 1.497 2.758 0 N-CA-C 108.504 -1.838 . . . . 0.0 108.504 -178.767 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 50' ' ' GLN . . . . . . . . . . . . . 3.2 mm-40 -36.93 136.41 0.39 Allowed 'General case' 0 N--CA 1.504 2.272 0 CA-C-O 121.574 0.702 . . . . 0.0 112.865 -178.518 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 51' ' ' ASN . . . . . 0.819 ' OD1' HD21 ' A' ' 57' ' ' LEU . 37.2 t30 -100.75 116.28 64.34 Favored Pre-proline 0 N--CA 1.493 1.725 0 O-C-N 121.843 -0.536 . . . . 0.0 110.048 179.353 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 52' ' ' PRO . . . . . . . . . . . . . 42.8 Cg_endo -73.26 -64.31 0.03 OUTLIER 'Trans proline' 0 C--N 1.311 -1.407 0 O-C-N 123.928 1.488 . . . . 0.0 111.705 -179.829 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 53' ' ' THR . . . . . . . . . . . . . 1.0 OUTLIER -118.25 152.64 50.92 Favored Pre-proline 0 N--CA 1.498 1.964 0 O-C-N 121.111 -0.993 . . . . 0.0 110.942 -179.252 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 54' ' ' PRO . . . . . . . . . . . . . 45.0 Cg_endo -71.69 -37.2 5.51 Favored 'Trans proline' 0 N--CA 1.492 1.401 0 O-C-N 123.941 1.495 . . . . 0.0 111.267 179.983 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 55' ' ' GLU . . . . . . . . . . . . . 2.5 mp0 -62.8 -32.3 73.45 Favored 'General case' 0 N--CA 1.5 2.03 0 O-C-N 121.374 -0.829 . . . . 0.0 110.732 -179.895 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 2.5 tt0 -51.9 -40.25 60.38 Favored 'General case' 0 N--CA 1.499 2.023 0 O-C-N 121.604 -0.685 . . . . 0.0 111.117 -179.997 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 57' ' ' LEU . . . . . 0.819 HD21 ' OD1' ' A' ' 51' ' ' ASN . 0.4 OUTLIER -73.62 -31.51 63.58 Favored 'General case' 0 N--CA 1.499 2.016 0 O-C-N 121.082 -1.012 . . . . 0.0 110.153 179.778 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 58' ' ' GLN . . . . . 0.46 ' O ' HG22 ' A' ' 61' ' ' ILE . 0.0 OUTLIER -58.08 -44.19 87.43 Favored 'General case' 0 N--CA 1.496 1.842 0 O-C-N 121.191 -0.943 . . . . 0.0 108.465 178.951 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 59' ' ' GLU . . . . . . . . . . . . . 2.0 mp0 -61.12 -36.09 78.79 Favored 'General case' 0 N--CA 1.496 1.874 0 O-C-N 121.282 -0.887 . . . . 0.0 108.68 177.831 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 60' ' ' MET . . . . . 0.409 ' HB2' ' O ' ' A' ' 57' ' ' LEU . 0.4 OUTLIER -62.61 -36.89 84.2 Favored 'General case' 0 N--CA 1.497 1.907 0 O-C-N 121.725 -0.609 . . . . 0.0 109.867 178.618 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 61' ' ' ILE . . . . . 0.478 HG13 HG23 ' A' ' 72' ' ' VAL . 0.8 OUTLIER -83.77 -31.78 8.37 Favored 'Isoleucine or valine' 0 N--CA 1.498 1.946 0 O-C-N 121.41 -0.806 . . . . 0.0 111.039 -179.916 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 62' ' ' ASP . . . . . . . . . . . . . 2.7 m-20 -58.04 -47.57 82.72 Favored 'General case' 0 N--CA 1.5 2.065 0 O-C-N 121.289 -0.882 . . . . 0.0 111.233 -179.37 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 63' ' ' GLU . . . . . . . . . . . . . 0.9 OUTLIER -63.5 -36.21 83.02 Favored 'General case' 0 N--CA 1.5 2.028 0 O-C-N 121.274 -0.891 . . . . 0.0 110.799 -179.875 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 64' ' ' VAL . . . . . . . . . . . . . 84.4 t -84.36 -30.44 7.28 Favored 'Isoleucine or valine' 0 N--CA 1.498 1.944 0 O-C-N 121.33 -0.856 . . . . 0.0 111.465 -179.49 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 65' ' ' ASP . . . . . . . . . . . . . 16.9 t70 -133.72 137.78 45.44 Favored 'General case' 0 N--CA 1.497 1.885 0 O-C-N 121.006 -1.058 . . . . 0.0 111.76 -179.368 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 66' ' ' GLU . . . . . . . . . . . . . 0.3 OUTLIER -148.17 45.39 1.07 Allowed 'General case' 0 N--CA 1.495 1.796 0 CA-C-O 121.573 0.701 . . . . 0.0 109.245 178.694 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 67' ' ' ASP . . . . . . . . . . . . . 12.7 p-10 -102.78 13.18 35.03 Favored 'General case' 0 N--CA 1.499 1.992 0 O-C-N 121.448 -0.783 . . . . 0.0 111.567 -179.359 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 68' ' ' GLY . . . . . . . . . . . . . . . 107.79 -51.55 0.71 Allowed Glycine 0 N--CA 1.496 2.657 0 C-N-CA 120.039 -1.077 . . . . 0.0 110.497 179.422 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 69' ' ' SER . . . . . . . . . . . . . 82.3 p -64.07 -55.78 19.68 Favored 'General case' 0 N--CA 1.501 2.11 0 O-C-N 121.241 -1.152 . . . . 0.0 110.876 -179.418 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 70' ' ' GLY . . . . . . . . . . . . . . . 89.75 34.74 8.2 Favored Glycine 0 N--CA 1.495 2.595 0 N-CA-C 108.326 -1.91 . . . . 0.0 108.326 -179.283 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 71' ' ' THR . . . . . 0.413 ' HB ' ' SG ' ' A' ' 35' ' ' CYS . 3.1 p -131.0 143.03 50.41 Favored 'General case' 0 N--CA 1.489 1.49 0 O-C-N 122.029 -0.689 . . . . 0.0 109.694 -179.29 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 72' ' ' VAL . . . . . 0.534 HG11 ' HD1' ' A' ' 77' ' ' PHE . 93.3 t -75.59 107.37 6.32 Favored 'Isoleucine or valine' 0 N--CA 1.496 1.87 0 O-C-N 121.545 -0.722 . . . . 0.0 110.598 -179.724 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 73' ' ' ASP . . . . . 0.405 ' HB2' ' HB2' ' A' ' 76' ' ' GLU . 1.1 m-20 -75.25 -175.34 2.66 Favored 'General case' 0 N--CA 1.497 1.913 0 O-C-N 121.415 -0.803 . . . . 0.0 110.244 179.601 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 74' ' ' PHE . . . . . . . . . . . . . 39.0 t80 -65.16 -58.09 6.88 Favored 'General case' 0 N--CA 1.499 2.002 0 O-C-N 121.194 -0.941 . . . . 0.0 109.779 179.951 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 75' ' ' ASP . . . . . 0.694 ' HA ' HD12 ' A' ' 78' ' ' LEU . 0.5 OUTLIER -65.79 -34.64 78.65 Favored 'General case' 0 N--CA 1.495 1.783 0 O-C-N 121.553 -0.717 . . . . 0.0 109.86 179.174 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 76' ' ' GLU . . . . . 0.405 ' HB2' ' HB2' ' A' ' 73' ' ' ASP . 19.3 mt-10 -63.67 -40.42 96.78 Favored 'General case' 0 N--CA 1.497 1.903 0 O-C-N 121.451 -0.78 . . . . 0.0 109.502 178.715 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 77' ' ' PHE . . . . . 0.534 ' HD1' HG11 ' A' ' 72' ' ' VAL . 57.6 t80 -56.86 -40.46 76.17 Favored 'General case' 0 N--CA 1.498 1.972 0 O-C-N 121.621 -0.674 . . . . 0.0 110.541 179.48 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 78' ' ' LEU . . . . . 0.721 HD22 HD13 ' A' ' 12' ' ' LEU . 27.2 mt -55.45 -40.5 71.65 Favored 'General case' 0 N--CA 1.502 2.16 0 O-C-N 121.463 -0.773 . . . . 0.0 110.63 179.831 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 79' ' ' VAL . . . . . 0.75 HG22 HG21 ' A' ' 9' ' ' VAL . 77.8 t -62.5 -34.85 67.0 Favored 'Isoleucine or valine' 0 N--CA 1.502 2.125 0 O-C-N 121.497 -0.752 . . . . 0.0 110.033 179.496 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 80' ' ' MET . . . . . . . . . . . . . 18.9 ttp -73.58 -35.27 65.4 Favored 'General case' 0 N--CA 1.494 1.732 0 O-C-N 121.342 -0.849 . . . . 0.0 110.305 179.539 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 81' ' ' MET . . . . . 0.46 ' CE ' ' HB2' ' B' ' 150' ' ' ALA . 12.0 mmm -66.62 -46.76 74.8 Favored 'General case' 0 N--CA 1.499 1.979 0 O-C-N 121.424 -0.798 . . . . 0.0 110.715 -179.719 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 82' ' ' VAL . . . . . . . . . . . . . 33.2 m -62.81 -32.64 56.5 Favored 'Isoleucine or valine' 0 N--CA 1.504 2.243 0 O-C-N 121.128 -0.983 . . . . 0.0 110.441 179.88 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 83' ' ' ARG . . . . . 0.552 ' HG2' ' CD2' ' A' ' 5' ' ' TYR . 69.8 mtt180 -66.84 -34.52 77.99 Favored 'General case' 0 N--CA 1.497 1.908 0 O-C-N 121.38 -0.825 . . . . 0.0 109.835 179.132 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 84' ' ' CYS . . . . . . . . . . . . . 79.5 m -77.41 -28.93 52.81 Favored 'General case' 0 N--CA 1.496 1.856 0 O-C-N 121.502 -0.749 . . . . 0.0 109.983 178.914 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 85' ' ' MET . . . . . . . . . . . . . 42.0 mtm -76.62 -32.39 58.01 Favored 'General case' 0 N--CA 1.497 1.903 0 O-C-N 121.582 -0.699 . . . . 0.0 110.76 179.838 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 86' ' ' LYS . . . . . . . . . . . . . 5.8 tmtt? 59.91 75.69 0.39 Allowed 'General case' 0 N--CA 1.503 2.217 0 O-C-N 121.589 -0.695 . . . . 0.0 110.76 -179.961 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 87' ' ' ASP . . . . . . . . . . . . . 5.9 p-10 -76.88 -26.29 54.03 Favored 'General case' 0 N--CA 1.5 2.051 0 O-C-N 121.289 -0.882 . . . . 0.0 111.123 179.972 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 88' ' ' ASP . . . . . . . . . . . . . 7.9 p-10 -85.96 163.26 18.12 Favored 'General case' 0 N--CA 1.497 1.891 0 O-C-N 121.055 -1.028 . . . . 0.0 110.72 -179.902 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 89' ' ' SER . . . . . . . . . . . . . 67.2 m . . . . . 0 N--CA 1.499 2.017 0 CA-C-O 117.818 -1.087 . . . . 0.0 110.927 -179.622 . . . . . . . . 0 0 . 1 . 006 nuclear build full ' B' B ' 144' ' ' ARG . . . . . . . . . . . . . 2.0 ptt-85 . . . . . 0 N--CA 1.499 1.981 0 CA-C-O 120.69 0.281 . . . . 0.0 111.12 . . . . . . . . . 0 0 . 1 . 006 nuclear build full ' B' B ' 145' ' ' ARG . . . . . 0.523 ' O ' ' HB ' ' B' ' 146' ' ' VAL . 0.0 OUTLIER -91.03 98.58 11.86 Favored 'General case' 0 N--CA 1.494 1.747 0 O-C-N 121.094 -1.004 . . . . 0.0 110.059 179.444 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' B' B ' 146' ' ' VAL . . . . . 0.523 ' HB ' ' O ' ' B' ' 145' ' ' ARG . 3.0 t 65.57 143.24 0.01 OUTLIER 'Isoleucine or valine' 0 N--CA 1.507 2.39 0 CA-C-O 121.559 0.695 . . . . 0.0 110.87 -179.69 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' B' B ' 147' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -138.53 126.93 23.1 Favored 'General case' 0 N--CA 1.496 1.846 0 O-C-N 121.136 -0.977 . . . . 0.0 110.382 -179.755 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' B' B ' 148' ' ' ILE . . . . . . . . . . . . . 1.0 OUTLIER -108.3 -27.66 2.91 Favored 'Isoleucine or valine' 0 N--CA 1.501 2.089 0 O-C-N 121.354 -0.841 . . . . 0.0 111.243 -179.921 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' B' B ' 149' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER 64.59 109.66 0.03 OUTLIER 'General case' 0 N--CA 1.505 2.315 0 O-C-N 121.639 -0.663 . . . . 0.0 111.154 179.865 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' B' B ' 150' ' ' ALA . . . . . 0.46 ' HB2' ' CE ' ' A' ' 81' ' ' MET . . . -55.29 -42.76 74.08 Favored 'General case' 0 N--CA 1.501 2.118 0 O-C-N 121.412 -0.805 . . . . 0.0 110.824 179.955 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' B' B ' 151' ' ' ASP . . . . . . . . . . . . . 4.2 p-10 -53.92 -39.33 65.74 Favored 'General case' 0 N--CA 1.502 2.135 0 O-C-N 121.613 -0.679 . . . . 0.0 110.741 179.743 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 152' ' ' ALA . . . . . . . . . . . . . . . -87.14 -40.1 14.93 Favored 'General case' 0 N--CA 1.496 1.833 0 O-C-N 121.365 -0.834 . . . . 0.0 110.318 179.555 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 153' ' ' MET . . . . . 0.406 ' SD ' ' HZ ' ' A' ' 27' ' ' PHE . 5.7 ttt -60.09 -44.9 94.46 Favored 'General case' 0 N--CA 1.498 1.971 0 O-C-N 121.484 -0.76 . . . . 0.0 110.627 179.875 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' B' B ' 154' ' ' MET . . . . . . . . . . . . . 19.7 ttt -62.46 -43.63 98.34 Favored 'General case' 0 N--CA 1.497 1.917 0 O-C-N 121.474 -0.766 . . . . 0.0 110.428 179.773 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 155' ' ' GLN . . . . . . . . . . . . . 0.6 OUTLIER -65.42 -43.07 91.7 Favored 'General case' 0 N--CA 1.499 2.005 0 O-C-N 121.522 -0.737 . . . . 0.0 110.587 179.771 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' B' B ' 156' ' ' ALA . . . . . . . . . . . . . . . -63.43 -34.86 78.68 Favored 'General case' 0 N--CA 1.499 1.983 0 O-C-N 121.336 -0.853 . . . . 0.0 110.587 179.817 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 157' ' ' LEU . . . . . . . . . . . . . 24.8 tp -80.83 -49.46 11.05 Favored 'General case' 0 N--CA 1.495 1.809 0 O-C-N 121.301 -0.875 . . . . 0.0 110.611 179.849 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 158' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -71.69 106.29 4.03 Favored 'General case' 0 N--CA 1.499 2.009 0 O-C-N 121.287 -0.883 . . . . 0.0 110.069 179.825 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' B' B ' 159' ' ' GLY . . . . . . . . . . . . . . . 126.99 -33.56 3.33 Favored Glycine 0 N--CA 1.496 2.656 0 N-CA-C 109.939 -1.264 . . . . 0.0 109.939 -179.704 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 160' ' ' ALA . . . . . . . . . . . . . . . -110.75 -33.45 6.54 Favored 'General case' 0 N--CA 1.499 1.982 0 O-C-N 121.208 -1.172 . . . . 0.0 111.213 -179.69 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 161' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -116.14 -19.62 10.2 Favored 'General case' 0 N--CA 1.502 2.147 0 O-C-N 121.122 -0.987 . . . . 0.0 111.506 -179.453 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' B' B ' 162' ' ' ALA . . . . . 0.412 ' HA ' HD13 ' A' ' 29' ' ' LEU . . . -91.4 -51.84 5.08 Favored 'General case' 0 N--CA 1.497 1.904 0 O-C-N 121.115 -0.991 . . . . 0.0 111.1 -179.482 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' B' B ' 163' ' ' LYS . . . . . 0.492 ' HA ' ' HE3' ' B' ' 163' ' ' LYS . 0.1 OUTLIER . . . . . 0 N--CA 1.497 1.917 0 CA-C-O 117.801 -1.095 . . . . 0.0 110.543 179.943 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 90' ' ' ' CA' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 006 nuclear build full ' A' A ' 91' ' ' SXK . . . . . 0.422 ' HAK' HD23 ' A' ' 41' ' ' LEU . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.496 1.873 0 CA-C-O 120.705 0.288 . . . . 0.0 110.252 . . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 2' ' ' ASP . . . . . . . . . . . . . 3.6 m-20 -74.81 124.97 27.8 Favored 'General case' 0 N--CA 1.496 1.857 0 O-C-N 121.318 -0.864 . . . . 0.0 109.686 179.645 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 3' ' ' ASP . . . . . 0.621 ' HB3' ' HB2' ' A' ' 6' ' ' LYS . 5.8 t70 68.57 150.9 0.08 Allowed 'General case' 0 N--CA 1.503 2.205 0 CA-C-O 121.638 0.732 . . . . 0.0 110.4 -179.031 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 4' ' ' ILE . . . . . . . . . . . . . 5.3 mt -94.57 -47.39 13.33 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.682 0 O-C-N 121.316 -0.865 . . . . 0.0 109.294 179.704 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 5' ' ' TYR . . . . . . . . . . . . . 39.7 m-85 -68.77 -36.53 78.44 Favored 'General case' 0 N--CA 1.494 1.758 0 O-C-N 121.605 -0.684 . . . . 0.0 109.454 178.896 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 6' ' ' LYS . . . . . 0.621 ' HB2' ' HB3' ' A' ' 3' ' ' ASP . 0.3 OUTLIER -64.99 -42.7 94.28 Favored 'General case' 0 N--CA 1.496 1.846 0 O-C-N 121.451 -0.78 . . . . 0.0 109.031 178.483 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 7' ' ' ALA . . . . . . . . . . . . . . . -61.46 -35.99 79.18 Favored 'General case' 0 N--CA 1.496 1.868 0 O-C-N 121.464 -0.772 . . . . 0.0 109.338 178.306 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 8' ' ' ALA . . . . . . . . . . . . . . . -66.57 -26.39 67.1 Favored 'General case' 0 N--CA 1.498 1.938 0 O-C-N 121.497 -0.752 . . . . 0.0 110.232 179.03 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 9' ' ' VAL . . . . . 0.681 ' HA ' HD12 ' A' ' 12' ' ' LEU . 57.1 t -59.51 -40.27 81.46 Favored 'Isoleucine or valine' 0 N--CA 1.498 1.963 0 O-C-N 121.301 -0.874 . . . . 0.0 109.416 179.036 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 10' ' ' GLU . . . . . . . . . . . . . 0.9 OUTLIER -61.69 -30.28 70.64 Favored 'General case' 0 N--CA 1.496 1.848 0 O-C-N 121.417 -0.802 . . . . 0.0 110.01 178.828 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 11' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -60.04 -33.81 72.55 Favored 'General case' 0 N--CA 1.5 2.035 0 O-C-N 121.407 -0.808 . . . . 0.0 109.388 178.406 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 12' ' ' LEU . . . . . 0.688 ' HB3' ' CB ' ' A' ' 16' ' ' GLN . 19.4 mt -67.62 -23.76 65.39 Favored 'General case' 0 N--CA 1.498 1.959 0 O-C-N 121.687 -0.633 . . . . 0.0 109.703 178.494 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 13' ' ' THR . . . . . 0.646 HG23 ' C ' ' A' ' 12' ' ' LEU . 1.3 p 74.2 165.78 0.29 Allowed 'General case' 0 N--CA 1.51 2.555 0 C-N-CA 123.47 0.708 . . . . 0.0 110.86 -179.594 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 14' ' ' GLU . . . . . . . . . . . . . 1.1 tp10 -57.33 -30.63 64.96 Favored 'General case' 0 N--CA 1.494 1.751 0 O-C-N 121.645 -0.659 . . . . 0.0 110.779 -178.958 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER -57.53 -47.4 82.1 Favored 'General case' 0 N--CA 1.495 1.782 0 O-C-N 121.436 -0.79 . . . . 0.0 109.395 178.803 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 16' ' ' GLN . . . . . 0.688 ' CB ' ' HB3' ' A' ' 12' ' ' LEU . 27.3 mt-30 -72.79 -38.55 67.2 Favored 'General case' 0 N--CA 1.495 1.815 0 O-C-N 121.459 -0.776 . . . . 0.0 110.076 178.951 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 17' ' ' LYS . . . . . 0.407 ' HD2' HG12 ' A' ' 9' ' ' VAL . 0.0 OUTLIER -56.68 -45.99 81.39 Favored 'General case' 0 N--CA 1.498 1.943 0 N-CA-C 109.259 -0.645 . . . . 0.0 109.259 179.132 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 18' ' ' ASN . . . . . . . . . . . . . 21.2 m-80 -71.21 -36.48 71.91 Favored 'General case' 0 N--CA 1.494 1.766 0 O-C-N 121.603 -0.686 . . . . 0.0 109.249 178.281 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 19' ' ' GLU . . . . . 0.471 ' HB2' ' HA ' ' A' ' 16' ' ' GLN . 15.2 mt-10 -62.24 -52.13 64.98 Favored 'General case' 0 N--CA 1.498 1.96 0 O-C-N 121.568 -0.707 . . . . 0.0 109.95 179.108 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 20' ' ' PHE . . . . . 0.482 ' CE1' ' HG2' ' A' ' 81' ' ' MET . 17.7 m-85 -62.51 -40.03 95.42 Favored 'General case' 0 N--CA 1.497 1.921 0 O-C-N 121.497 -0.752 . . . . 0.0 109.841 179.467 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 21' ' ' LYS . . . . . . . . . . . . . 13.8 tptt -59.1 -46.16 89.01 Favored 'General case' 0 N--CA 1.499 1.993 0 O-C-N 121.433 -0.792 . . . . 0.0 109.534 178.93 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 22' ' ' ALA . . . . . . . . . . . . . . . -68.74 -46.42 68.93 Favored 'General case' 0 N--CA 1.496 1.829 0 O-C-N 121.626 -0.671 . . . . 0.0 109.918 179.436 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 23' ' ' ALA . . . . . . . . . . . . . . . -62.53 -34.72 77.47 Favored 'General case' 0 N--CA 1.498 1.963 0 O-C-N 121.432 -0.792 . . . . 0.0 109.538 178.808 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 24' ' ' PHE . . . . . 0.602 ' CE1' HD12 ' A' ' 36' ' ' ILE . 65.5 t80 -60.39 -48.25 82.55 Favored 'General case' 0 N--CA 1.496 1.829 0 N-CA-C 109.138 -0.69 . . . . 0.0 109.138 178.839 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 25' ' ' ASP . . . . . . . . . . . . . 0.9 OUTLIER -64.36 -34.42 78.12 Favored 'General case' 0 N--CA 1.496 1.852 0 O-C-N 121.54 -0.725 . . . . 0.0 109.361 178.663 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 26' ' ' ILE . . . . . 0.921 ' HA ' HD12 ' A' ' 29' ' ' LEU . 15.9 mm -67.06 -34.69 71.4 Favored 'Isoleucine or valine' 0 N--CA 1.498 1.926 0 O-C-N 121.328 -0.857 . . . . 0.0 109.112 178.372 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 27' ' ' PHE . . . . . . . . . . . . . 0.2 OUTLIER -65.4 -34.52 78.5 Favored 'General case' 0 N--CA 1.498 1.966 0 O-C-N 121.569 -0.707 . . . . 0.0 110.587 179.366 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 28' ' ' VAL . . . . . 0.551 ' HA ' ' HB2' ' A' ' 31' ' ' ALA . 32.9 m -93.4 1.5 9.47 Favored 'Isoleucine or valine' 0 N--CA 1.502 2.142 0 O-C-N 121.283 -0.886 . . . . 0.0 112.064 -179.39 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 29' ' ' LEU . . . . . 0.921 HD12 ' HA ' ' A' ' 26' ' ' ILE . 2.3 mt -63.28 -45.92 89.19 Favored 'General case' 0 N--CA 1.501 2.089 0 O-C-N 120.821 -1.174 . . . . 0.0 109.688 179.33 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 30' ' ' GLY . . . . . . . . . . . . . . . -103.66 43.66 1.63 Allowed Glycine 0 N--CA 1.492 2.414 0 N-CA-C 108.561 -1.815 . . . . 0.0 108.561 178.643 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 31' ' ' ALA . . . . . 0.551 ' HB2' ' HA ' ' A' ' 28' ' ' VAL . . . -104.44 130.85 52.31 Favored 'General case' 0 N--CA 1.496 1.838 0 O-C-N 121.528 -0.984 . . . . 0.0 111.197 -179.18 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 32' ' ' GLU . . . . . . . . . . . . . 2.7 mp0 -77.65 -31.09 52.48 Favored 'General case' 0 N--CA 1.498 1.93 0 O-C-N 121.568 -0.708 . . . . 0.0 110.076 179.205 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 1.2 m-20 -78.66 -36.4 43.87 Favored 'General case' 0 N--CA 1.496 1.85 0 O-C-N 121.513 -0.742 . . . . 0.0 110.54 -179.949 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 34' ' ' GLY . . . . . . . . . . . . . . . 120.65 -36.86 3.22 Favored Glycine 0 N--CA 1.497 2.71 0 N-CA-C 109.411 -1.476 . . . . 0.0 109.411 -179.52 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 35' ' ' CYS . . . . . . . . . . . . . 1.3 m -120.26 -171.31 2.14 Favored 'General case' 0 N--CA 1.497 1.881 0 O-C-N 121.595 -0.944 . . . . 0.0 109.965 179.57 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 36' ' ' ILE . . . . . 0.602 HD12 ' CE1' ' A' ' 24' ' ' PHE . 96.6 mt -90.27 101.64 12.49 Favored 'Isoleucine or valine' 0 N--CA 1.496 1.829 0 O-C-N 121.117 -0.99 . . . . 0.0 110.57 -179.781 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 37' ' ' SER . . . . . . . . . . . . . 83.8 p -113.55 -179.36 3.62 Favored 'General case' 0 N--CA 1.494 1.733 0 N-CA-C 108.983 -0.747 . . . . 0.0 108.983 178.854 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 38' ' ' THR . . . . . 0.65 HG21 ' HG2' ' A' ' 58' ' ' GLN . 8.6 p -62.6 -41.18 98.82 Favored 'General case' 0 N--CA 1.5 2.041 0 O-C-N 120.963 -1.086 . . . . 0.0 110.056 179.515 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 39' ' ' LYS . . . . . 0.528 ' HA ' ' HB3' ' A' ' 54' ' ' PRO . 1.0 OUTLIER -60.94 -35.16 76.01 Favored 'General case' 0 N--CA 1.501 2.079 0 O-C-N 121.485 -0.759 . . . . 0.0 110.018 179.263 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 1.1 tp10 -83.41 -39.2 20.93 Favored 'General case' 0 N--CA 1.493 1.709 0 O-C-N 121.507 -0.746 . . . . 0.0 109.636 179.041 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 41' ' ' LEU . . . . . 0.485 HD11 ' CG ' ' A' ' 45' ' ' MET . 9.1 tp -62.63 -49.0 76.91 Favored 'General case' 0 N--CA 1.498 1.957 0 O-C-N 121.623 -0.673 . . . . 0.0 110.588 179.72 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 42' ' ' GLY . . . . . . . . . . . . . . . -54.36 -38.41 62.23 Favored Glycine 0 N--CA 1.494 2.549 0 N-CA-C 110.84 -0.904 . . . . 0.0 110.84 -179.038 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 43' ' ' LYS . . . . . . . . . . . . . 0.4 OUTLIER -54.49 -41.48 69.62 Favored 'General case' 0 N--CA 1.503 2.199 0 O-C-N 121.309 -1.112 . . . . 0.0 110.298 179.686 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 44' ' ' VAL . . . . . . . . . . . . . 44.0 t -83.08 -36.65 13.09 Favored 'Isoleucine or valine' 0 N--CA 1.499 2.014 0 O-C-N 121.349 -0.844 . . . . 0.0 109.876 179.21 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 45' ' ' MET . . . . . 0.704 ' HB3' ' HB2' ' A' ' 51' ' ' ASN . 69.4 mmm -61.91 -41.22 97.67 Favored 'General case' 0 N--CA 1.501 2.098 0 O-C-N 121.527 -0.733 . . . . 0.0 110.47 179.815 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 46' ' ' ARG . . . . . . . . . . . . . 8.9 tpt180 -67.34 -36.98 82.52 Favored 'General case' 0 N--CA 1.497 1.885 0 O-C-N 121.304 -0.872 . . . . 0.0 109.592 179.153 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 47' ' ' MET . . . . . . . . . . . . . 43.2 ttp -75.59 -1.97 26.99 Favored 'General case' 0 N--CA 1.499 1.977 0 O-C-N 121.559 -0.713 . . . . 0.0 110.46 178.704 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 48' ' ' LEU . . . . . . . . . . . . . 4.2 tp -119.66 -54.74 2.15 Favored 'General case' 0 N--CA 1.493 1.702 0 O-C-N 121.024 -1.048 . . . . 0.0 109.728 179.95 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 49' ' ' GLY . . . . . . . . . . . . . . . -114.04 -116.62 3.25 Favored Glycine 0 N--CA 1.494 2.515 0 N-CA-C 109.221 -1.552 . . . . 0.0 109.221 179.426 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 50' ' ' GLN . . . . . 0.482 ' O ' ' HD3' ' A' ' 52' ' ' PRO . 0.8 OUTLIER -139.11 13.68 2.63 Favored 'General case' 0 N--CA 1.5 2.067 0 O-C-N 121.375 -1.074 . . . . 0.0 111.933 -179.866 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 51' ' ' ASN . . . . . 0.704 ' HB2' ' HB3' ' A' ' 45' ' ' MET . 8.2 m120 -78.0 108.88 8.35 Favored Pre-proline 0 N--CA 1.505 2.291 0 O-C-N 121.02 -1.05 . . . . 0.0 109.633 179.897 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 52' ' ' PRO . . . . . 0.482 ' HD3' ' O ' ' A' ' 50' ' ' GLN . 45.2 Cg_endo -93.15 -73.6 0.0 OUTLIER 'Trans proline' 0 C--N 1.313 -1.292 0 C-N-CA 121.728 1.619 . . . . 0.0 112.627 -177.983 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 53' ' ' THR . . . . . . . . . . . . . 11.7 p -67.9 142.55 95.61 Favored Pre-proline 0 N--CA 1.499 1.986 0 O-C-N 121.311 -0.868 . . . . 0.0 111.599 -178.298 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 54' ' ' PRO . . . . . 0.528 ' HB3' ' HA ' ' A' ' 39' ' ' LYS . 43.4 Cg_endo -67.41 -32.81 31.38 Favored 'Trans proline' 0 N--CA 1.491 1.359 0 O-C-N 124.285 1.676 . . . . 0.0 110.893 179.577 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 55' ' ' GLU . . . . . . . . . . . . . 1.6 mp0 -57.92 -31.95 67.29 Favored 'General case' 0 N--CA 1.502 2.144 0 O-C-N 121.4 -0.813 . . . . 0.0 109.988 179.508 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 1.0 OUTLIER -62.8 -38.48 90.86 Favored 'General case' 0 N--CA 1.496 1.874 0 O-C-N 121.543 -0.723 . . . . 0.0 110.13 179.408 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 57' ' ' LEU . . . . . 0.523 ' H ' HD22 ' A' ' 57' ' ' LEU . 0.5 OUTLIER -87.5 -12.55 45.6 Favored 'General case' 0 N--CA 1.495 1.801 0 O-C-N 121.291 -0.88 . . . . 0.0 110.66 179.624 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 58' ' ' GLN . . . . . 0.65 ' HG2' HG21 ' A' ' 38' ' ' THR . 0.0 OUTLIER -56.27 -38.09 70.68 Favored 'General case' 0 N--CA 1.502 2.154 0 O-C-N 121.218 -0.926 . . . . 0.0 110.55 179.838 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 59' ' ' GLU . . . . . . . . . . . . . 0.9 OUTLIER -58.95 -32.16 69.36 Favored 'General case' 0 N--CA 1.498 1.951 0 O-C-N 121.018 -1.052 . . . . 0.0 109.439 178.82 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 60' ' ' MET . . . . . 0.439 ' CE ' HD12 ' A' ' 57' ' ' LEU . 40.7 mtm -78.41 -47.47 17.51 Favored 'General case' 0 N--CA 1.495 1.786 0 O-C-N 121.586 -0.696 . . . . 0.0 110.244 179.03 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 61' ' ' ILE . . . . . 0.717 HG13 HG23 ' A' ' 72' ' ' VAL . 11.0 tt -62.36 -41.57 92.21 Favored 'Isoleucine or valine' 0 N--CA 1.501 2.108 0 O-C-N 121.219 -0.926 . . . . 0.0 110.39 179.812 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 62' ' ' ASP . . . . . . . . . . . . . 0.8 OUTLIER -64.77 -36.3 83.88 Favored 'General case' 0 N--CA 1.499 2.015 0 O-C-N 121.249 -0.907 . . . . 0.0 110.159 179.286 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 63' ' ' GLU . . . . . . . . . . . . . 3.1 tt0 -63.0 -28.56 70.18 Favored 'General case' 0 N--CA 1.498 1.954 0 O-C-N 121.48 -0.762 . . . . 0.0 110.435 179.196 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 64' ' ' VAL . . . . . . . . . . . . . 4.0 t -114.95 25.85 4.03 Favored 'Isoleucine or valine' 0 N--CA 1.498 1.971 0 O-C-N 121.203 -0.936 . . . . 0.0 110.567 179.838 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 65' ' ' ASP . . . . . 0.498 ' HB2' ' O ' ' A' ' 61' ' ' ILE . 16.9 t70 -110.64 -73.9 0.67 Allowed 'General case' 0 N--CA 1.5 2.03 0 O-C-N 120.966 -1.084 . . . . 0.0 110.551 179.973 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 66' ' ' GLU . . . . . . . . . . . . . 7.7 tt0 57.92 23.31 9.67 Favored 'General case' 0 N--CA 1.501 2.109 0 O-C-N 121.607 -0.683 . . . . 0.0 110.86 -179.396 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 67' ' ' ASP . . . . . . . . . . . . . 64.9 m-20 -111.85 5.29 18.9 Favored 'General case' 0 N--CA 1.496 1.853 0 O-C-N 121.257 -0.902 . . . . 0.0 110.948 179.669 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 68' ' ' GLY . . . . . . . . . . . . . . . 63.49 38.06 95.74 Favored Glycine 0 N--CA 1.495 2.599 0 N-CA-C 108.703 -1.759 . . . . 0.0 108.703 -178.931 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 69' ' ' SER . . . . . . . . . . . . . 71.0 p -139.11 -53.53 0.57 Allowed 'General case' 0 N--CA 1.495 1.8 0 O-C-N 121.626 -0.926 . . . . 0.0 110.73 -179.1 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 70' ' ' GLY . . . . . . . . . . . . . . . 90.25 45.35 4.43 Favored Glycine 0 N--CA 1.497 2.738 0 N-CA-C 108.639 -1.785 . . . . 0.0 108.639 -179.308 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 71' ' ' THR . . . . . . . . . . . . . 0.9 OUTLIER -140.44 126.1 19.17 Favored 'General case' 0 N--CA 1.493 1.72 0 O-C-N 121.861 -0.788 . . . . 0.0 109.993 -179.154 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 72' ' ' VAL . . . . . 0.717 HG23 HG13 ' A' ' 61' ' ' ILE . 53.9 t -80.66 105.88 11.06 Favored 'Isoleucine or valine' 0 N--CA 1.497 1.879 0 O-C-N 121.535 -0.728 . . . . 0.0 110.567 -179.98 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 73' ' ' ASP . . . . . 0.4 ' O ' ' HB2' ' A' ' 77' ' ' PHE . 1.1 t70 -85.29 -162.9 0.76 Allowed 'General case' 0 N--CA 1.495 1.799 0 O-C-N 121.366 -0.834 . . . . 0.0 109.854 179.287 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 74' ' ' PHE . . . . . . . . . . . . . 25.7 t80 -64.91 -50.86 64.84 Favored 'General case' 0 N--CA 1.499 1.988 0 O-C-N 121.085 -1.009 . . . . 0.0 110.278 -179.917 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 75' ' ' ASP . . . . . . . . . . . . . 25.0 t70 -60.19 -49.61 76.93 Favored 'General case' 0 N--CA 1.497 1.902 0 O-C-N 121.543 -0.723 . . . . 0.0 109.947 179.31 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 76' ' ' GLU . . . . . . . . . . . . . 30.5 mt-10 -60.73 -37.93 83.42 Favored 'General case' 0 N--CA 1.498 1.929 0 O-C-N 121.473 -0.767 . . . . 0.0 110.468 179.633 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 77' ' ' PHE . . . . . 0.4 ' HB2' ' O ' ' A' ' 73' ' ' ASP . 42.6 t80 -59.63 -48.29 82.24 Favored 'General case' 0 N--CA 1.498 1.973 0 O-C-N 121.317 -0.864 . . . . 0.0 110.142 179.445 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 78' ' ' LEU . . . . . . . . . . . . . 16.2 mt -66.84 -37.88 85.32 Favored 'General case' 0 N--CA 1.501 2.09 0 O-C-N 121.41 -0.806 . . . . 0.0 110.023 179.579 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 79' ' ' VAL . . . . . . . . . . . . . 39.2 t -59.71 -36.7 67.27 Favored 'Isoleucine or valine' 0 N--CA 1.499 2.025 0 O-C-N 121.49 -0.756 . . . . 0.0 110.012 179.192 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 80' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -69.99 -40.34 75.35 Favored 'General case' 0 N--CA 1.496 1.849 0 O-C-N 121.359 -0.838 . . . . 0.0 109.868 179.332 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 81' ' ' MET . . . . . 0.482 ' HG2' ' CE1' ' A' ' 20' ' ' PHE . 0.0 OUTLIER -62.53 -48.4 79.71 Favored 'General case' 0 N--CA 1.496 1.848 0 O-C-N 121.557 -0.714 . . . . 0.0 109.976 179.515 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 82' ' ' VAL . . . . . . . . . . . . . 34.3 m -67.44 -28.18 41.27 Favored 'Isoleucine or valine' 0 N--CA 1.499 2.018 0 O-C-N 121.251 -0.905 . . . . 0.0 109.805 179.016 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 83' ' ' ARG . . . . . . . . . . . . . 7.2 mtt85 -61.58 -39.97 93.08 Favored 'General case' 0 N--CA 1.497 1.91 0 O-C-N 121.348 -0.845 . . . . 0.0 109.518 178.779 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 84' ' ' CYS . . . . . . . . . . . . . 5.2 t -62.49 -35.57 79.77 Favored 'General case' 0 N--CA 1.498 1.95 0 O-C-N 121.542 -0.724 . . . . 0.0 110.002 178.882 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 85' ' ' MET . . . . . 0.431 ' O ' ' HB3' ' A' ' 86' ' ' LYS . 0.0 OUTLIER -75.75 -35.17 60.26 Favored 'General case' 0 N--CA 1.499 1.982 0 O-C-N 121.408 -0.807 . . . . 0.0 110.353 179.341 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 86' ' ' LYS . . . . . 0.527 ' HE2' ' HA ' ' A' ' 86' ' ' LYS . 0.0 OUTLIER 61.81 -85.09 0.02 OUTLIER 'General case' 0 N--CA 1.499 2.008 0 O-C-N 121.962 -0.461 . . . . 0.0 110.895 -179.611 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 87' ' ' ASP . . . . . . . . . . . . . 3.9 m-20 -129.45 62.79 1.52 Allowed 'General case' 0 N--CA 1.495 1.775 0 O-C-N 121.134 -0.979 . . . . 0.0 110.311 -179.84 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 88' ' ' ASP . . . . . . . . . . . . . 3.0 t70 -109.46 106.84 16.75 Favored 'General case' 0 N--CA 1.495 1.802 0 O-C-N 121.23 -0.918 . . . . 0.0 110.196 179.892 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 89' ' ' SER . . . . . . . . . . . . . 26.4 p . . . . . 0 N--CA 1.496 1.871 0 CA-C-O 118.265 -0.874 . . . . 0.0 110.527 -179.884 . . . . . . . . 0 0 . 1 . 007 nuclear build full ' B' B ' 144' ' ' ARG . . . . . . . . . . . . . 20.2 tpt85 . . . . . 0 N--CA 1.5 2.051 0 N-CA-C 110.155 -0.313 . . . . 0.0 110.155 . . . . . . . . . 0 0 . 1 . 007 nuclear build full ' B' B ' 145' ' ' ARG . . . . . . . . . . . . . 21.1 mtt85 -75.07 -56.66 4.51 Favored 'General case' 0 N--CA 1.498 1.97 0 O-C-N 121.223 -0.923 . . . . 0.0 109.808 179.372 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 146' ' ' VAL . . . . . 0.675 HG23 ' HAF' ' A' ' 91' ' ' SXK . 27.6 m -119.23 -177.01 1.12 Allowed 'Isoleucine or valine' 0 N--CA 1.498 1.964 0 O-C-N 121.687 -0.633 . . . . 0.0 109.325 179.138 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' B' B ' 147' ' ' ARG . . . . . 0.412 ' HD2' ' HA ' ' B' ' 147' ' ' ARG . 12.4 mmm180 -137.85 60.02 1.64 Allowed 'General case' 0 N--CA 1.498 1.927 0 O-C-N 121.049 -1.032 . . . . 0.0 111.118 -179.744 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' B' B ' 148' ' ' ILE . . . . . . . . . . . . . 1.8 mp -90.68 117.5 34.07 Favored 'Isoleucine or valine' 0 N--CA 1.496 1.859 0 O-C-N 121.29 -0.881 . . . . 0.0 109.475 179.078 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 149' ' ' SER . . . . . . . . . . . . . 34.8 p -84.95 164.89 18.05 Favored 'General case' 0 N--CA 1.497 1.91 0 O-C-N 121.506 -0.746 . . . . 0.0 110.957 -179.432 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 150' ' ' ALA . . . . . . . . . . . . . . . -67.94 -28.5 67.53 Favored 'General case' 0 N--CA 1.494 1.761 0 O-C-N 121.568 -0.707 . . . . 0.0 110.438 179.482 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 151' ' ' ASP . . . . . . . . . . . . . 22.9 t70 -75.27 -39.43 59.75 Favored 'General case' 0 N--CA 1.499 2.005 0 O-C-N 121.32 -0.863 . . . . 0.0 110.563 179.561 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 152' ' ' ALA . . . . . . . . . . . . . . . -52.47 -36.71 55.48 Favored 'General case' 0 N--CA 1.501 2.117 0 O-C-N 121.508 -0.745 . . . . 0.0 110.992 -179.871 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 153' ' ' MET . . . . . 0.477 ' O ' HD12 ' B' ' 157' ' ' LEU . 0.0 OUTLIER -77.47 -35.77 53.45 Favored 'General case' 0 N--CA 1.495 1.815 0 O-C-N 121.17 -0.956 . . . . 0.0 110.477 179.712 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' B' B ' 154' ' ' MET . . . . . . . . . . . . . 0.7 OUTLIER -62.91 -53.4 54.65 Favored 'General case' 0 N--CA 1.5 2.034 0 O-C-N 121.264 -0.898 . . . . 0.0 110.095 179.685 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' B' B ' 155' ' ' GLN . . . . . . . . . . . . . 2.1 pp0? -62.81 -22.15 66.43 Favored 'General case' 0 N--CA 1.5 2.075 0 O-C-N 121.187 -0.945 . . . . 0.0 110.379 179.101 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 156' ' ' ALA . . . . . . . . . . . . . . . -82.58 -40.96 20.17 Favored 'General case' 0 N--CA 1.495 1.79 0 O-C-N 121.235 -0.916 . . . . 0.0 110.448 179.266 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 157' ' ' LEU . . . . . 0.477 HD12 ' O ' ' B' ' 153' ' ' MET . 2.0 mt -91.69 -59.11 2.21 Favored 'General case' 0 N--CA 1.499 2.008 0 O-C-N 121.29 -0.882 . . . . 0.0 110.408 179.996 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' B' B ' 158' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -65.97 -42.11 90.33 Favored 'General case' 0 N--CA 1.499 2.014 0 O-C-N 121.305 -0.872 . . . . 0.0 110.46 179.745 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' B' B ' 159' ' ' GLY . . . . . . . . . . . . . . . -59.84 -27.62 64.59 Favored Glycine 0 N--CA 1.498 2.8 0 N-CA-C 110.154 -1.179 . . . . 0.0 110.154 179.718 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 160' ' ' ALA . . . . . . . . . . . . . . . -91.67 -30.25 16.42 Favored 'General case' 0 N--CA 1.496 1.829 0 O-C-N 121.286 -1.126 . . . . 0.0 111.404 -179.892 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 161' ' ' ARG . . . . . . . . . . . . . 77.6 mtt-85 -110.98 -61.33 1.71 Allowed 'General case' 0 N--CA 1.502 2.149 0 O-C-N 121.027 -1.045 . . . . 0.0 111.69 -179.193 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 162' ' ' ALA . . . . . . . . . . . . . . . -78.31 93.24 4.63 Favored 'General case' 0 N--CA 1.501 2.093 0 O-C-N 121.238 -0.914 . . . . 0.0 111.229 -179.036 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 163' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.498 1.938 0 O-C-N 121.379 -0.826 . . . . 0.0 110.721 179.568 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 90' ' ' ' CA' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 007 nuclear build full ' A' A ' 91' ' ' SXK . . . . . 0.675 ' HAF' HG23 ' B' ' 146' ' ' VAL . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 4.3 mtt . . . . . 0 N--CA 1.495 1.813 0 CA-C-O 120.984 0.421 . . . . 0.0 110.265 . . . . . . . . . 0 0 . 1 . 008 nuclear build full ' A' A ' 2' ' ' ASP . . . . . 0.668 ' HB3' ' HB2' ' A' ' 6' ' ' LYS . 5.2 t70 -92.9 163.82 13.55 Favored 'General case' 0 N--CA 1.496 1.861 0 O-C-N 121.384 -0.823 . . . . 0.0 110.335 -179.906 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 3' ' ' ASP . . . . . . . . . . . . . 2.4 p-10 -121.15 -42.76 2.46 Favored 'General case' 0 N--CA 1.497 1.923 0 O-C-N 121.525 -0.734 . . . . 0.0 111.459 -179.515 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 4' ' ' ILE . . . . . 0.428 HG23 ' N ' ' A' ' 5' ' ' TYR . 1.7 tt -94.15 -39.82 10.88 Favored 'Isoleucine or valine' 0 N--CA 1.501 2.108 0 O-C-N 121.087 -1.008 . . . . 0.0 111.615 -179.002 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 5' ' ' TYR . . . . . 0.51 ' CG ' ' HG2' ' A' ' 83' ' ' ARG . 57.5 m-85 -76.75 -38.8 53.52 Favored 'General case' 0 N--CA 1.5 2.026 0 O-C-N 121.098 -1.001 . . . . 0.0 110.156 179.989 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 6' ' ' LYS . . . . . 0.668 ' HB2' ' HB3' ' A' ' 2' ' ' ASP . 12.3 ttpp -66.37 -37.81 86.14 Favored 'General case' 0 N--CA 1.494 1.771 0 O-C-N 121.411 -0.806 . . . . 0.0 109.456 178.9 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 7' ' ' ALA . . . . . . . . . . . . . . . -56.17 -43.64 78.56 Favored 'General case' 0 N--CA 1.498 1.971 0 O-C-N 121.534 -0.729 . . . . 0.0 110.209 179.313 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 8' ' ' ALA . . . . . . . . . . . . . . . -61.09 -39.85 91.48 Favored 'General case' 0 N--CA 1.499 2.018 0 O-C-N 121.437 -0.789 . . . . 0.0 109.977 179.149 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 9' ' ' VAL . . . . . 0.807 HG21 ' HA ' ' A' ' 79' ' ' VAL . 53.0 t -75.36 -43.65 42.8 Favored 'Isoleucine or valine' 0 N--CA 1.496 1.864 0 O-C-N 121.483 -0.761 . . . . 0.0 110.32 179.587 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 10' ' ' GLU . . . . . 0.445 ' CD ' ' HG2' ' A' ' 6' ' ' LYS . 58.6 mt-10 -57.8 -36.73 72.6 Favored 'General case' 0 N--CA 1.498 1.935 0 O-C-N 121.437 -0.789 . . . . 0.0 109.701 179.383 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 11' ' ' GLN . . . . . . . . . . . . . 0.2 OUTLIER -108.19 47.83 0.88 Allowed 'General case' 0 N--CA 1.482 1.152 0 O-C-N 121.417 -0.802 . . . . 0.0 109.704 179.363 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 12' ' ' LEU . . . . . . . . . . . . . 1.5 mt -82.03 150.68 27.47 Favored 'General case' 0 N--CA 1.497 1.911 0 O-C-N 121.304 -0.873 . . . . 0.0 110.714 -179.748 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 13' ' ' THR . . . . . . . . . . . . . 45.4 p -83.12 152.69 25.19 Favored 'General case' 0 N--CA 1.498 1.956 0 O-C-N 121.462 -0.774 . . . . 0.0 109.922 179.396 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 14' ' ' GLU . . . . . 0.622 ' HA ' ' HD3' ' A' ' 17' ' ' LYS . 5.0 tp10 -56.71 -32.2 65.26 Favored 'General case' 0 N--CA 1.492 1.666 0 O-C-N 121.554 -0.716 . . . . 0.0 110.767 -179.415 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 1.5 mp0 -60.58 -47.85 84.38 Favored 'General case' 0 N--CA 1.497 1.889 0 O-C-N 121.355 -0.84 . . . . 0.0 109.805 179.351 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 16' ' ' GLN . . . . . 0.446 ' HA ' ' HB3' ' A' ' 19' ' ' GLU . 5.4 mt-30 -77.45 -27.89 52.28 Favored 'General case' 0 N--CA 1.496 1.832 0 O-C-N 121.259 -0.9 . . . . 0.0 110.607 179.347 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 17' ' ' LYS . . . . . 0.622 ' HD3' ' HA ' ' A' ' 14' ' ' GLU . 0.2 OUTLIER -60.53 -46.67 89.31 Favored 'General case' 0 N--CA 1.498 1.965 0 O-C-N 121.513 -0.742 . . . . 0.0 109.547 179.138 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 18' ' ' ASN . . . . . . . . . . . . . 50.5 t30 -72.77 -34.26 66.84 Favored 'General case' 0 N--CA 1.496 1.863 0 O-C-N 121.581 -0.699 . . . . 0.0 109.926 179.061 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 19' ' ' GLU . . . . . 0.446 ' HB3' ' HA ' ' A' ' 16' ' ' GLN . 3.6 tt0 -60.47 -49.15 78.72 Favored 'General case' 0 N--CA 1.497 1.903 0 O-C-N 121.477 -0.764 . . . . 0.0 109.578 179.265 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 20' ' ' PHE . . . . . . . . . . . . . 16.9 m-85 -68.1 -32.36 72.61 Favored 'General case' 0 N--CA 1.499 2.0 0 O-C-N 121.316 -0.865 . . . . 0.0 110.092 179.123 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 21' ' ' LYS . . . . . . . . . . . . . 13.9 tptp -58.42 -45.44 88.46 Favored 'General case' 0 N--CA 1.495 1.822 0 O-C-N 121.604 -0.685 . . . . 0.0 109.611 179.43 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 22' ' ' ALA . . . . . . . . . . . . . . . -59.43 -44.23 92.95 Favored 'General case' 0 N--CA 1.496 1.847 0 O-C-N 121.514 -0.742 . . . . 0.0 110.271 179.373 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 23' ' ' ALA . . . . . . . . . . . . . . . -64.87 -44.48 89.54 Favored 'General case' 0 N--CA 1.501 2.088 0 O-C-N 121.283 -0.886 . . . . 0.0 109.926 179.209 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 24' ' ' PHE . . . . . . . . . . . . . 40.8 t80 -66.75 -38.73 87.22 Favored 'General case' 0 N--CA 1.496 1.835 0 O-C-N 121.609 -0.682 . . . . 0.0 110.303 179.505 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 25' ' ' ASP . . . . . 0.414 ' O ' HG22 ' A' ' 28' ' ' VAL . 9.1 t70 -54.73 -52.36 62.73 Favored 'General case' 0 N--CA 1.501 2.115 0 O-C-N 121.606 -0.684 . . . . 0.0 111.012 -179.805 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 26' ' ' ILE . . . . . 0.424 ' HB ' HD12 ' B' ' 157' ' ' LEU . 19.7 mt -69.8 -27.8 34.61 Favored 'Isoleucine or valine' 0 N--CA 1.498 1.959 0 O-C-N 121.145 -0.972 . . . . 0.0 110.266 179.856 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 27' ' ' PHE . . . . . 0.469 ' CD2' HD21 ' B' ' 157' ' ' LEU . 0.3 OUTLIER -65.23 -32.75 74.58 Favored 'General case' 0 N--CA 1.498 1.956 0 O-C-N 121.244 -0.91 . . . . 0.0 111.05 179.81 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 28' ' ' VAL . . . . . 0.414 HG22 ' O ' ' A' ' 25' ' ' ASP . 33.0 m -91.75 34.02 0.11 Allowed 'Isoleucine or valine' 0 N--CA 1.501 2.12 0 O-C-N 121.121 -0.987 . . . . 0.0 110.816 179.945 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 29' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -67.02 -42.18 85.37 Favored 'General case' 0 N--CA 1.498 1.945 0 O-C-N 121.111 -0.993 . . . . 0.0 110.176 179.459 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 30' ' ' GLY . . . . . . . . . . . . . . . -105.92 40.2 2.58 Favored Glycine 0 N--CA 1.495 2.578 0 N-CA-C 109.488 -1.445 . . . . 0.0 109.488 179.475 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 31' ' ' ALA . . . . . . . . . . . . . . . -120.89 94.55 4.38 Favored 'General case' 0 N--CA 1.496 1.849 0 O-C-N 121.364 -1.08 . . . . 0.0 110.203 -179.982 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 32' ' ' GLU . . . . . . . . . . . . . 8.0 tt0 -63.02 -31.64 72.83 Favored 'General case' 0 N--CA 1.5 2.04 0 O-C-N 121.452 -0.78 . . . . 0.0 110.691 -179.921 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 8.9 p-10 -67.28 -30.05 69.83 Favored 'General case' 0 N--CA 1.496 1.872 0 O-C-N 121.403 -0.81 . . . . 0.0 110.501 179.435 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 34' ' ' GLY . . . . . . . . . . . . . . . 112.68 -35.32 4.67 Favored Glycine 0 N--CA 1.498 2.803 0 O-C-N 121.13 -0.981 . . . . 0.0 110.755 179.265 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 35' ' ' CYS . . . . . . . . . . . . . 58.2 m -87.4 -170.22 2.94 Favored 'General case' 0 N--CA 1.497 1.889 0 O-C-N 121.219 -1.165 . . . . 0.0 110.339 -179.863 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 36' ' ' ILE . . . . . . . . . . . . . 25.9 mt -102.13 129.26 53.79 Favored 'Isoleucine or valine' 0 N--CA 1.496 1.863 0 O-C-N 121.168 -0.957 . . . . 0.0 110.425 -179.685 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 37' ' ' SER . . . . . . . . . . . . . 3.4 t -107.17 163.68 12.8 Favored 'General case' 0 N--CA 1.495 1.795 0 O-C-N 121.484 -0.76 . . . . 0.0 109.722 179.133 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 38' ' ' THR . . . . . 0.725 HG21 ' HA ' ' A' ' 58' ' ' GLN . 77.1 p -63.05 -30.38 71.55 Favored 'General case' 0 N--CA 1.501 2.105 0 O-C-N 121.294 -0.879 . . . . 0.0 110.27 179.64 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 39' ' ' LYS . . . . . . . . . . . . . 1.6 mptp? -58.93 -42.96 91.02 Favored 'General case' 0 N--CA 1.497 1.912 0 O-C-N 121.535 -0.728 . . . . 0.0 109.837 179.343 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 40' ' ' GLU . . . . . 0.402 ' HA ' ' HD2' ' A' ' 43' ' ' LYS . 1.6 mp0 -74.25 -37.22 63.84 Favored 'General case' 0 N--CA 1.498 1.942 0 O-C-N 121.463 -0.773 . . . . 0.0 109.942 179.442 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 41' ' ' LEU . . . . . 0.504 HD22 ' HAK' ' A' ' 91' ' ' SXK . 6.2 tp -60.69 -47.56 85.7 Favored 'General case' 0 N--CA 1.495 1.789 0 O-C-N 121.499 -0.751 . . . . 0.0 109.807 179.499 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 42' ' ' GLY . . . . . . . . . . . . . . . -54.62 -39.84 68.22 Favored Glycine 0 N--CA 1.494 2.536 0 N-CA-C 109.887 -1.285 . . . . 0.0 109.887 179.688 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 43' ' ' LYS . . . . . 0.402 ' HD2' ' HA ' ' A' ' 40' ' ' GLU . 16.0 mttp -58.34 -40.19 81.49 Favored 'General case' 0 N--CA 1.501 2.084 0 O-C-N 121.34 -1.094 . . . . 0.0 110.033 179.171 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 44' ' ' VAL . . . . . . . . . . . . . 45.0 t -75.25 -38.45 41.11 Favored 'Isoleucine or valine' 0 N--CA 1.497 1.901 0 O-C-N 121.36 -0.838 . . . . 0.0 109.39 179.108 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 45' ' ' MET . . . . . 0.401 ' CE ' HD11 ' A' ' 41' ' ' LEU . 1.6 mmt -57.14 -43.29 82.28 Favored 'General case' 0 N--CA 1.498 1.936 0 O-C-N 121.713 -0.617 . . . . 0.0 110.031 179.343 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 46' ' ' ARG . . . . . . . . . . . . . 0.4 OUTLIER -63.12 -39.9 96.04 Favored 'General case' 0 N--CA 1.496 1.853 0 O-C-N 121.571 -0.706 . . . . 0.0 109.783 179.234 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 47' ' ' MET . . . . . . . . . . . . . 6.0 ttp -63.54 -29.35 70.63 Favored 'General case' 0 N--CA 1.497 1.875 0 O-C-N 121.569 -0.707 . . . . 0.0 110.188 179.036 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 48' ' ' LEU . . . . . . . . . . . . . 1.9 tt -72.13 -39.64 68.66 Favored 'General case' 0 N--CA 1.495 1.823 0 O-C-N 121.391 -0.818 . . . . 0.0 110.65 179.618 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 49' ' ' GLY . . . . . . . . . . . . . . . 144.29 -29.85 1.9 Allowed Glycine 0 N--CA 1.499 2.859 0 C-N-CA 120.113 -1.041 . . . . 0.0 110.627 179.982 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 50' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -127.07 129.8 48.69 Favored 'General case' 0 N--CA 1.501 2.082 0 O-C-N 121.21 -1.171 . . . . 0.0 111.166 -179.628 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 51' ' ' ASN . . . . . . . . . . . . . 43.3 t30 -172.15 104.87 0.35 Allowed Pre-proline 0 N--CA 1.496 1.845 0 O-C-N 121.549 -0.719 . . . . 0.0 110.363 179.319 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 52' ' ' PRO . . . . . . . . . . . . . 43.3 Cg_endo -76.95 -71.8 0.01 OUTLIER 'Trans proline' 0 C--N 1.311 -1.396 0 O-C-N 123.859 1.452 . . . . 0.0 110.565 179.562 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 53' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -139.96 150.77 63.47 Favored Pre-proline 0 N--CA 1.501 2.079 0 O-C-N 121.172 -0.955 . . . . 0.0 109.812 179.641 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 54' ' ' PRO . . . . . 0.465 ' O ' ' HB ' ' A' ' 38' ' ' THR . 45.3 Cg_endo -70.4 -48.17 0.63 Allowed 'Trans proline' 0 N--CA 1.491 1.368 0 O-C-N 123.837 1.44 . . . . 0.0 111.208 -179.483 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 55' ' ' GLU . . . . . 0.487 ' O ' ' HB2' ' A' ' 58' ' ' GLN . 11.3 mm-40 -66.63 -20.01 65.9 Favored 'General case' 0 N--CA 1.499 2.013 0 O-C-N 121.19 -0.944 . . . . 0.0 110.855 -179.983 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 7.6 tt0 -61.3 -25.41 67.1 Favored 'General case' 0 N--CA 1.499 1.976 0 O-C-N 121.149 -0.97 . . . . 0.0 110.321 178.981 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 57' ' ' LEU . . . . . 0.451 HD13 ' HG ' ' A' ' 41' ' ' LEU . 4.6 mt -85.78 -9.21 57.44 Favored 'General case' 0 N--CA 1.498 1.939 0 O-C-N 121.39 -0.819 . . . . 0.0 111.672 -179.875 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 58' ' ' GLN . . . . . 0.742 ' O ' HG22 ' A' ' 61' ' ' ILE . 1.7 mm100 -48.69 -53.86 17.1 Favored 'General case' 0 N--CA 1.505 2.302 0 O-C-N 121.136 -0.978 . . . . 0.0 111.38 -179.362 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 59' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -51.27 -33.91 30.55 Favored 'General case' 0 N--CA 1.502 2.153 0 O-C-N 121.299 -0.876 . . . . 0.0 110.881 179.868 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 60' ' ' MET . . . . . . . . . . . . . 1.5 ttp -75.31 -35.36 61.26 Favored 'General case' 0 N--CA 1.496 1.871 0 O-C-N 121.294 -0.879 . . . . 0.0 110.646 179.406 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 61' ' ' ILE . . . . . 0.742 HG22 ' O ' ' A' ' 58' ' ' GLN . 8.6 tt -65.22 -31.75 55.26 Favored 'Isoleucine or valine' 0 N--CA 1.501 2.083 0 O-C-N 121.021 -1.049 . . . . 0.0 110.276 179.62 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 62' ' ' ASP . . . . . . . . . . . . . 22.6 m-20 -76.99 -28.86 55.23 Favored 'General case' 0 N--CA 1.496 1.873 0 O-C-N 121.268 -0.895 . . . . 0.0 109.955 179.066 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 63' ' ' GLU . . . . . . . . . . . . . 6.6 mt-10 -59.11 -49.58 77.33 Favored 'General case' 0 N--CA 1.5 2.063 0 O-C-N 121.518 -0.739 . . . . 0.0 110.411 179.37 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 64' ' ' VAL . . . . . . . . . . . . . 14.6 p -84.33 -10.79 11.67 Favored 'Isoleucine or valine' 0 N--CA 1.497 1.9 0 O-C-N 121.661 -0.65 . . . . 0.0 111.122 -179.679 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 65' ' ' ASP . . . . . . . . . . . . . 24.9 t70 -69.13 133.72 48.39 Favored 'General case' 0 N--CA 1.497 1.887 0 O-C-N 120.945 -1.097 . . . . 0.0 110.032 179.553 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 66' ' ' GLU . . . . . . . . . . . . . 25.4 mt-10 -128.73 25.89 5.63 Favored 'General case' 0 N--CA 1.495 1.823 0 O-C-N 121.322 -0.861 . . . . 0.0 111.219 -179.493 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 67' ' ' ASP . . . . . . . . . . . . . 1.6 p-10 -124.97 -21.2 4.75 Favored 'General case' 0 N--CA 1.498 1.967 0 O-C-N 120.822 -1.174 . . . . 0.0 112.162 -179.878 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 68' ' ' GLY . . . . . . . . . . . . . . . 114.91 -37.13 3.62 Favored Glycine 0 N--CA 1.497 2.762 0 O-C-N 120.825 -1.172 . . . . 0.0 110.466 179.665 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 69' ' ' SER . . . . . . . . . . . . . 38.9 p -58.87 -32.0 69.08 Favored 'General case' 0 N--CA 1.502 2.162 0 O-C-N 121.361 -1.082 . . . . 0.0 110.996 -179.883 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 70' ' ' GLY . . . . . . . . . . . . . . . 93.27 -40.1 2.86 Favored Glycine 0 N--CA 1.499 2.845 0 N-CA-C 110.185 -1.166 . . . . 0.0 110.185 -179.824 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 71' ' ' THR . . . . . . . . . . . . . 14.0 m -64.34 144.69 56.97 Favored 'General case' 0 N--CA 1.501 2.113 0 O-C-N 121.262 -1.14 . . . . 0.0 110.273 -179.841 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 72' ' ' VAL . . . . . 0.666 HG23 ' CG1' ' A' ' 61' ' ' ILE . 2.1 t -77.62 119.36 26.16 Favored 'Isoleucine or valine' 0 N--CA 1.497 1.901 0 O-C-N 121.377 -0.827 . . . . 0.0 110.105 179.867 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 73' ' ' ASP . . . . . . . . . . . . . 45.6 m-20 -92.78 -173.31 3.28 Favored 'General case' 0 N--CA 1.496 1.831 0 O-C-N 121.616 -0.678 . . . . 0.0 109.887 179.839 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 74' ' ' PHE . . . . . . . . . . . . . 26.0 t80 -64.97 -48.45 73.99 Favored 'General case' 0 N--CA 1.495 1.821 0 O-C-N 121.195 -0.94 . . . . 0.0 110.052 179.602 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 75' ' ' ASP . . . . . 0.462 ' HA ' HD12 ' A' ' 78' ' ' LEU . 29.0 t70 -60.45 -49.82 76.02 Favored 'General case' 0 N--CA 1.498 1.927 0 O-C-N 121.579 -0.701 . . . . 0.0 109.97 179.323 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 76' ' ' GLU . . . . . . . . . . . . . 43.8 mt-10 -60.77 -41.6 95.82 Favored 'General case' 0 N--CA 1.498 1.973 0 O-C-N 121.592 -0.693 . . . . 0.0 109.8 179.135 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 77' ' ' PHE . . . . . 0.404 ' O ' ' HG2' ' A' ' 81' ' ' MET . 43.9 t80 -58.99 -45.57 90.31 Favored 'General case' 0 N--CA 1.498 1.945 0 O-C-N 121.575 -0.703 . . . . 0.0 109.528 178.888 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 78' ' ' LEU . . . . . 0.463 ' HB3' HG13 ' A' ' 9' ' ' VAL . 14.2 mt -56.92 -46.47 82.0 Favored 'General case' 0 N--CA 1.498 1.945 0 O-C-N 121.678 -0.639 . . . . 0.0 110.083 179.438 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 79' ' ' VAL . . . . . 0.807 ' HA ' HG21 ' A' ' 9' ' ' VAL . 86.3 t -61.7 -35.16 65.77 Favored 'Isoleucine or valine' 0 N--CA 1.501 2.119 0 O-C-N 121.463 -0.773 . . . . 0.0 109.835 179.453 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 80' ' ' MET . . . . . 0.486 ' CG ' ' HAI' ' A' ' 91' ' ' SXK . 12.4 ttp -70.66 -37.61 73.7 Favored 'General case' 0 N--CA 1.494 1.738 0 O-C-N 121.507 -0.745 . . . . 0.0 110.532 179.566 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 81' ' ' MET . . . . . 0.404 ' HG2' ' O ' ' A' ' 77' ' ' PHE . 68.4 mmm -62.77 -53.03 60.63 Favored 'General case' 0 N--CA 1.499 1.982 0 O-C-N 121.253 -0.904 . . . . 0.0 110.336 179.929 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 82' ' ' VAL . . . . . 0.426 HG11 HG23 ' A' ' 9' ' ' VAL . 13.4 p -63.26 -29.78 48.1 Favored 'Isoleucine or valine' 0 N--CA 1.501 2.113 0 O-C-N 121.302 -0.874 . . . . 0.0 110.132 179.333 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 83' ' ' ARG . . . . . 0.51 ' HG2' ' CG ' ' A' ' 5' ' ' TYR . 0.0 OUTLIER -62.24 -52.13 64.98 Favored 'General case' 0 N--CA 1.498 1.937 0 O-C-N 121.299 -0.876 . . . . 0.0 110.293 179.32 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 84' ' ' CYS . . . . . . . . . . . . . 0.1 OUTLIER -77.33 -22.79 51.33 Favored 'General case' 0 N--CA 1.498 1.956 0 O-C-N 121.495 -0.753 . . . . 0.0 110.88 179.928 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 85' ' ' MET . . . . . 0.43 ' HB2' ' HB2' ' B' ' 150' ' ' ALA . 22.9 ttp -66.3 -41.25 90.0 Favored 'General case' 0 N--CA 1.496 1.861 0 O-C-N 121.35 -0.844 . . . . 0.0 110.138 179.665 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 86' ' ' LYS . . . . . . . . . . . . . 1.4 tmtt? -140.8 90.3 2.33 Favored 'General case' 0 N--CA 1.493 1.717 0 O-C-N 121.438 -0.789 . . . . 0.0 110.241 -179.998 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 87' ' ' ASP . . . . . . . . . . . . . 4.6 m-20 -79.7 68.77 5.86 Favored 'General case' 0 N--CA 1.496 1.867 0 O-C-N 121.271 -0.893 . . . . 0.0 110.076 179.828 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 88' ' ' ASP . . . . . . . . . . . . . 18.1 t70 -160.73 157.59 27.23 Favored 'General case' 0 N--CA 1.495 1.803 0 O-C-N 121.416 -0.802 . . . . 0.0 109.993 -179.879 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 89' ' ' SER . . . . . . . . . . . . . 2.9 p . . . . . 0 N--CA 1.499 2.016 0 CA-C-O 117.849 -1.072 . . . . 0.0 110.449 179.911 . . . . . . . . 0 0 . 1 . 008 nuclear build full ' B' B ' 144' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.497 1.905 0 CA-C-O 121.109 0.481 . . . . 0.0 110.269 . . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 145' ' ' ARG . . . . . . . . . . . . . 6.3 tpt180 -74.97 -45.5 41.82 Favored 'General case' 0 N--CA 1.497 1.903 0 O-C-N 121.438 -0.789 . . . . 0.0 110.275 179.865 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 146' ' ' VAL . . . . . 0.73 HG12 HD11 ' B' ' 148' ' ' ILE . 2.2 t -92.63 136.83 23.73 Favored 'Isoleucine or valine' 0 N--CA 1.497 1.909 0 O-C-N 121.254 -0.904 . . . . 0.0 109.204 179.437 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' B' B ' 147' ' ' ARG . . . . . . . . . . . . . 1.5 mtm-85 -105.05 109.91 22.1 Favored 'General case' 0 N--CA 1.496 1.85 0 O-C-N 121.19 -0.944 . . . . 0.0 111.413 -178.843 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 148' ' ' ILE . . . . . 0.73 HD11 HG12 ' B' ' 146' ' ' VAL . 3.4 mp -133.22 -69.14 0.4 Allowed 'Isoleucine or valine' 0 N--CA 1.497 1.894 0 O-C-N 121.603 -0.686 . . . . 0.0 109.573 179.384 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' B' B ' 149' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER 57.13 -171.68 0.09 Allowed 'General case' 0 N--CA 1.501 2.112 0 O-C-N 121.753 -0.592 . . . . 0.0 111.188 179.674 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' B' B ' 150' ' ' ALA . . . . . 0.43 ' HB2' ' HB2' ' A' ' 85' ' ' MET . . . -108.68 -59.73 1.84 Allowed 'General case' 0 N--CA 1.495 1.809 0 O-C-N 121.299 -0.876 . . . . 0.0 110.162 179.898 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' B' B ' 151' ' ' ASP . . . . . . . . . . . . . 6.4 p-10 -58.34 -30.9 67.08 Favored 'General case' 0 N--CA 1.5 2.059 0 O-C-N 121.491 -0.755 . . . . 0.0 110.805 179.59 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 152' ' ' ALA . . . . . . . . . . . . . . . -71.81 -47.5 52.84 Favored 'General case' 0 N--CA 1.496 1.845 0 O-C-N 121.343 -0.848 . . . . 0.0 110.169 179.708 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 153' ' ' MET . . . . . . . . . . . . . 7.1 mmt -68.31 -37.43 80.6 Favored 'General case' 0 N--CA 1.499 1.988 0 O-C-N 121.333 -0.854 . . . . 0.0 110.482 179.679 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 154' ' ' MET . . . . . . . . . . . . . 39.7 mtp -58.68 -45.02 90.33 Favored 'General case' 0 N--CA 1.499 2.009 0 O-C-N 121.401 -0.812 . . . . 0.0 110.513 179.836 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 155' ' ' GLN . . . . . . . . . . . . . 6.7 tp-100 -60.37 -42.22 95.34 Favored 'General case' 0 N--CA 1.5 2.068 0 O-C-N 121.422 -0.799 . . . . 0.0 110.503 179.895 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 156' ' ' ALA . . . . . . . . . . . . . . . -66.68 -39.3 88.06 Favored 'General case' 0 N--CA 1.499 1.997 0 O-C-N 121.428 -0.795 . . . . 0.0 110.34 179.608 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 157' ' ' LEU . . . . . 0.469 HD21 ' CD2' ' A' ' 27' ' ' PHE . 0.2 OUTLIER -67.86 -35.93 79.41 Favored 'General case' 0 N--CA 1.499 2.013 0 O-C-N 121.449 -0.782 . . . . 0.0 110.782 179.872 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' B' B ' 158' ' ' LEU . . . . . . . . . . . . . 12.0 mt -69.57 -45.86 67.69 Favored 'General case' 0 N--CA 1.498 1.97 0 O-C-N 121.326 -0.859 . . . . 0.0 110.777 -179.862 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 159' ' ' GLY . . . . . . . . . . . . . . . -89.04 48.93 3.5 Favored Glycine 0 N--CA 1.498 2.829 0 N-CA-C 110.085 -1.206 . . . . 0.0 110.085 -179.878 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 160' ' ' ALA . . . . . . . . . . . . . . . -112.97 27.18 9.84 Favored 'General case' 0 N--CA 1.496 1.853 0 O-C-N 121.387 -1.066 . . . . 0.0 110.692 179.939 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 161' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER 55.41 62.34 2.5 Favored 'General case' 0 N--CA 1.503 2.182 0 O-C-N 121.469 -0.769 . . . . 0.0 111.145 179.913 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' B' B ' 162' ' ' ALA . . . . . . . . . . . . . . . -69.98 -34.15 72.98 Favored 'General case' 0 N--CA 1.499 2.017 0 O-C-N 121.149 -0.969 . . . . 0.0 110.041 179.238 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 163' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.493 1.71 0 CA-C-O 118.211 -0.899 . . . . 0.0 109.982 179.673 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 90' ' ' ' CA' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 008 nuclear build full ' A' A ' 91' ' ' SXK . . . . . 0.504 ' HAK' HD22 ' A' ' 41' ' ' LEU . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 1' ' ' MET . . . . . 0.444 ' O ' ' HB3' ' A' ' 2' ' ' ASP . 1.5 tpt . . . . . 0 N--CA 1.499 2.008 0 CA-C-O 120.757 0.313 . . . . 0.0 110.355 . . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 2' ' ' ASP . . . . . 0.444 ' HB3' ' O ' ' A' ' 1' ' ' MET . 17.9 t70 65.93 149.79 0.05 OUTLIER 'General case' 0 N--CA 1.505 2.301 0 CA-C-O 121.627 0.727 . . . . 0.0 111.355 -179.929 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 3' ' ' ASP . . . . . . . . . . . . . 0.9 OUTLIER -133.23 3.38 3.65 Favored 'General case' 0 N--CA 1.497 1.916 0 O-C-N 121.352 -0.843 . . . . 0.0 111.344 179.836 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 4' ' ' ILE . . . . . 0.412 HD12 ' OD1' ' A' ' 2' ' ' ASP . 11.7 mt -65.55 -49.67 76.6 Favored 'Isoleucine or valine' 0 N--CA 1.5 2.035 0 O-C-N 120.829 -1.169 . . . . 0.0 110.147 179.89 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 5' ' ' TYR . . . . . 0.415 ' HE1' ' HG3' ' A' ' 83' ' ' ARG . 13.0 m-85 -60.21 -36.4 77.58 Favored 'General case' 0 N--CA 1.499 2.007 0 O-C-N 121.248 -0.907 . . . . 0.0 110.668 179.778 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 6' ' ' LYS . . . . . 0.453 ' HB3' ' HE3' ' A' ' 6' ' ' LYS . 26.1 ttpp -79.77 -46.46 16.95 Favored 'General case' 0 N--CA 1.494 1.774 0 O-C-N 121.201 -0.937 . . . . 0.0 110.415 179.718 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 7' ' ' ALA . . . . . . . . . . . . . . . -56.55 -46.67 80.58 Favored 'General case' 0 N--CA 1.498 1.937 0 O-C-N 121.45 -0.781 . . . . 0.0 110.309 179.858 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 8' ' ' ALA . . . . . 0.482 ' O ' ' HG ' ' A' ' 12' ' ' LEU . . . -58.33 -44.27 88.59 Favored 'General case' 0 N--CA 1.498 1.959 0 O-C-N 121.286 -0.884 . . . . 0.0 109.532 179.1 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 9' ' ' VAL . . . . . . . . . . . . . 10.9 t -67.19 -40.91 86.12 Favored 'Isoleucine or valine' 0 N--CA 1.497 1.891 0 O-C-N 121.657 -0.652 . . . . 0.0 110.512 179.446 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 10' ' ' GLU . . . . . . . . . . . . . 55.2 mt-10 -67.85 -43.51 79.32 Favored 'General case' 0 N--CA 1.5 2.056 0 O-C-N 121.416 -0.802 . . . . 0.0 111.588 -179.348 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 11' ' ' GLN . . . . . . . . . . . . . 3.1 mp0 -86.24 -80.16 0.24 Allowed 'General case' 0 N--CA 1.496 1.844 0 O-C-N 121.308 -0.87 . . . . 0.0 111.091 -178.786 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 12' ' ' LEU . . . . . 0.482 ' HG ' ' O ' ' A' ' 8' ' ' ALA . 4.8 mt 57.33 -168.45 0.12 Allowed 'General case' 0 N--CA 1.504 2.271 0 O-C-N 121.476 -0.765 . . . . 0.0 109.981 -179.076 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 13' ' ' THR . . . . . 0.442 ' OG1' ' HB2' ' A' ' 16' ' ' GLN . 76.0 p -120.49 159.58 24.89 Favored 'General case' 0 N--CA 1.499 1.995 0 O-C-N 120.867 -1.146 . . . . 0.0 110.078 179.406 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 14' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -53.15 -43.08 66.71 Favored 'General case' 0 N--CA 1.493 1.703 0 C-N-CA 120.278 -0.569 . . . . 0.0 110.441 -179.632 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 1.2 mp0 -65.38 -59.23 4.24 Favored 'General case' 0 N--CA 1.496 1.83 0 O-C-N 121.56 -0.713 . . . . 0.0 110.31 -179.956 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 16' ' ' GLN . . . . . 0.476 ' HB3' HD22 ' A' ' 12' ' ' LEU . 0.9 OUTLIER -50.65 -52.73 36.95 Favored 'General case' 0 N--CA 1.501 2.098 0 O-C-N 121.352 -0.843 . . . . 0.0 111.257 -179.728 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 17' ' ' LYS . . . . . 0.438 ' O ' ' HB3' ' A' ' 21' ' ' LYS . 3.2 tttp -57.92 -41.25 82.3 Favored 'General case' 0 N--CA 1.501 2.09 0 O-C-N 121.827 -0.546 . . . . 0.0 110.7 179.847 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 18' ' ' ASN . . . . . . . . . . . . . 12.8 m-20 -70.95 -48.45 53.36 Favored 'General case' 0 N--CA 1.501 2.079 0 O-C-N 121.259 -0.9 . . . . 0.0 110.207 179.592 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 0.5 OUTLIER -59.12 -46.14 89.09 Favored 'General case' 0 N--CA 1.495 1.8 0 O-C-N 121.611 -0.68 . . . . 0.0 110.436 179.933 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 20' ' ' PHE . . . . . 0.499 ' CE1' ' HG2' ' A' ' 81' ' ' MET . 19.6 m-30 -64.54 -38.0 89.49 Favored 'General case' 0 N--CA 1.498 1.965 0 O-C-N 121.29 -0.881 . . . . 0.0 110.004 179.562 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 21' ' ' LYS . . . . . 0.516 ' HG3' ' N ' ' A' ' 22' ' ' ALA . 0.0 OUTLIER -62.9 -36.68 84.14 Favored 'General case' 0 N--CA 1.5 2.05 0 O-C-N 121.38 -0.825 . . . . 0.0 109.242 178.725 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 22' ' ' ALA . . . . . 0.516 ' N ' ' HG3' ' A' ' 21' ' ' LYS . . . -70.03 -49.39 51.77 Favored 'General case' 0 N--CA 1.494 1.736 0 O-C-N 121.47 -0.769 . . . . 0.0 109.382 178.841 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 23' ' ' ALA . . . . . 0.492 ' HA ' HD11 ' B' ' 157' ' ' LEU . . . -61.74 -41.59 97.86 Favored 'General case' 0 N--CA 1.496 1.835 0 O-C-N 121.685 -0.635 . . . . 0.0 109.848 179.087 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 24' ' ' PHE . . . . . 0.695 ' CE1' HD11 ' A' ' 36' ' ' ILE . 82.7 t80 -61.33 -45.65 93.53 Favored 'General case' 0 N--CA 1.498 1.941 0 O-C-N 121.69 -0.631 . . . . 0.0 110.257 179.582 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 25' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -53.73 -51.47 63.21 Favored 'General case' 0 N--CA 1.498 1.973 0 O-C-N 121.661 -0.649 . . . . 0.0 110.504 179.87 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 26' ' ' ILE . . . . . 0.724 HG21 ' HB2' ' B' ' 157' ' ' LEU . 2.8 mt -69.07 -31.63 51.03 Favored 'Isoleucine or valine' 0 N--CA 1.498 1.975 0 O-C-N 121.221 -0.924 . . . . 0.0 110.148 179.532 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 27' ' ' PHE . . . . . 0.531 ' CZ ' HG21 ' A' ' 44' ' ' VAL . 0.2 OUTLIER -67.15 -43.2 82.92 Favored 'General case' 0 N--CA 1.497 1.898 0 O-C-N 121.126 -0.984 . . . . 0.0 110.259 179.505 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 28' ' ' VAL . . . . . 0.439 HG11 ' CZ ' ' A' ' 24' ' ' PHE . 12.8 m -81.72 -16.69 11.99 Favored 'Isoleucine or valine' 0 N--CA 1.502 2.14 0 O-C-N 121.182 -0.948 . . . . 0.0 110.397 179.322 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 29' ' ' LEU . . . . . . . . . . . . . 1.5 tp -61.13 118.52 6.91 Favored 'General case' 0 N--CA 1.49 1.528 0 N-CA-C 108.354 -0.98 . . . . 0.0 108.354 178.979 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 30' ' ' GLY . . . . . . . . . . . . . . . 99.68 22.97 11.38 Favored Glycine 0 N--CA 1.496 2.683 0 N-CA-C 109.678 -1.369 . . . . 0.0 109.678 -178.206 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 31' ' ' ALA . . . . . . . . . . . . . . . -110.14 133.07 53.59 Favored 'General case' 0 N--CA 1.496 1.857 0 O-C-N 121.349 -1.089 . . . . 0.0 109.516 179.596 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 32' ' ' GLU . . . . . . . . . . . . . 2.0 mp0 -85.02 82.78 8.3 Favored 'General case' 0 N--CA 1.497 1.885 0 O-C-N 121.259 -0.901 . . . . 0.0 110.716 -179.143 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 3.2 m-20 49.16 43.64 22.68 Favored 'General case' 0 N--CA 1.503 2.224 0 O-C-N 121.875 -0.516 . . . . 0.0 111.391 179.658 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 34' ' ' GLY . . . . . . . . . . . . . . . -137.7 26.96 2.86 Favored Glycine 0 N--CA 1.496 2.679 0 C-N-CA 120.019 -1.086 . . . . 0.0 110.56 179.774 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 35' ' ' CYS . . . . . . . . . . . . . 59.1 m 43.39 -100.06 0.03 OUTLIER 'General case' 0 N--CA 1.504 2.274 0 CA-C-N 117.928 0.864 . . . . 0.0 111.131 179.592 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 36' ' ' ILE . . . . . 0.695 HD11 ' CE1' ' A' ' 24' ' ' PHE . 69.1 mt -129.31 92.52 1.82 Allowed 'Isoleucine or valine' 0 N--CA 1.495 1.804 0 O-C-N 120.99 -1.069 . . . . 0.0 109.987 179.478 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 37' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -95.08 -173.77 3.05 Favored 'General case' 0 N--CA 1.495 1.794 0 O-C-N 121.277 -0.889 . . . . 0.0 109.345 179.283 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 38' ' ' THR . . . . . 0.8 HG21 ' HG2' ' A' ' 58' ' ' GLN . 1.6 p -59.72 -33.52 71.73 Favored 'General case' 0 N--CA 1.499 2.001 0 O-C-N 121.062 -1.024 . . . . 0.0 109.792 179.376 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 39' ' ' LYS . . . . . . . . . . . . . 23.5 ttpp -62.69 -38.6 91.02 Favored 'General case' 0 N--CA 1.499 1.981 0 O-C-N 121.526 -0.734 . . . . 0.0 109.708 178.755 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 0.6 OUTLIER -66.7 -33.6 75.99 Favored 'General case' 0 N--CA 1.498 1.929 0 O-C-N 121.661 -0.65 . . . . 0.0 109.839 179.355 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 41' ' ' LEU . . . . . 0.691 ' C ' HD13 ' A' ' 41' ' ' LEU . 2.8 tm? -66.21 -63.73 1.01 Allowed 'General case' 0 N--CA 1.497 1.875 0 O-C-N 121.385 -0.822 . . . . 0.0 108.946 178.464 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 42' ' ' GLY . . . . . 0.596 ' N ' HD13 ' A' ' 41' ' ' LEU . . . -46.96 -28.03 3.73 Favored Glycine 0 N--CA 1.499 2.876 0 N-CA-C 111.08 -0.808 . . . . 0.0 111.08 179.911 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 43' ' ' LYS . . . . . 0.485 ' HA ' ' HD2' ' A' ' 46' ' ' ARG . 0.0 OUTLIER -49.96 -50.93 45.06 Favored 'General case' 0 N--CA 1.501 2.115 0 O-C-N 121.364 -1.08 . . . . 0.0 110.389 179.733 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 44' ' ' VAL . . . . . 0.649 HG23 ' SD ' ' A' ' 45' ' ' MET . 13.6 m -75.68 -35.89 32.39 Favored 'Isoleucine or valine' 0 N--CA 1.502 2.129 0 O-C-N 121.376 -0.828 . . . . 0.0 109.732 179.106 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 45' ' ' MET . . . . . 0.649 ' SD ' HG23 ' A' ' 44' ' ' VAL . 0.0 OUTLIER -57.27 -30.23 64.51 Favored 'General case' 0 N--CA 1.498 1.927 0 O-C-N 121.215 -0.928 . . . . 0.0 110.757 178.679 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 46' ' ' ARG . . . . . 0.485 ' HD2' ' HA ' ' A' ' 43' ' ' LYS . 43.5 mtt85 -58.46 -47.56 83.61 Favored 'General case' 0 N--CA 1.501 2.107 0 O-C-N 121.276 -0.89 . . . . 0.0 109.547 179.135 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 47' ' ' MET . . . . . . . . . . . . . 45.7 mtm -66.05 -30.42 70.94 Favored 'General case' 0 N--CA 1.499 2.014 0 O-C-N 121.59 -0.694 . . . . 0.0 109.687 178.866 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 48' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -71.63 -46.63 58.52 Favored 'General case' 0 N--CA 1.497 1.887 0 O-C-N 121.538 -0.726 . . . . 0.0 110.186 179.334 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 49' ' ' GLY . . . . . . . . . . . . . . . 117.05 -17.14 12.91 Favored Glycine 0 N--CA 1.497 2.765 0 C-N-CA 120.51 -0.852 . . . . 0.0 111.176 179.543 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 50' ' ' GLN . . . . . . . . . . . . . 2.3 mt-30 -109.83 104.38 13.32 Favored 'General case' 0 N--CA 1.499 2.016 0 O-C-N 120.886 -1.361 . . . . 0.0 111.122 -179.427 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 51' ' ' ASN . . . . . . . . . . . . . 31.7 t30 -154.92 101.58 2.32 Favored Pre-proline 0 N--CA 1.496 1.873 0 O-C-N 121.465 -0.772 . . . . 0.0 110.003 179.283 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 52' ' ' PRO . . . . . 0.479 ' HD3' ' HD3' ' B' ' 144' ' ' ARG . 50.5 Cg_endo -77.1 -91.46 0.0 OUTLIER 'Trans proline' 0 C--N 1.315 -1.207 0 O-C-N 123.787 1.414 . . . . 0.0 111.268 -179.411 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 53' ' ' THR . . . . . . . . . . . . . 3.1 p -130.91 163.67 47.31 Favored Pre-proline 0 N--CA 1.493 1.691 0 O-C-N 120.93 -1.106 . . . . 0.0 110.774 -179.228 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 54' ' ' PRO . . . . . . . . . . . . . 43.0 Cg_endo -72.48 -33.76 8.31 Favored 'Trans proline' 0 C--N 1.314 -1.28 0 O-C-N 123.955 1.503 . . . . 0.0 110.266 179.487 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 55' ' ' GLU . . . . . . . . . . . . . 3.5 mp0 -61.68 -30.46 70.76 Favored 'General case' 0 N--CA 1.497 1.886 0 O-C-N 121.564 -0.71 . . . . 0.0 110.653 179.751 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 3.0 tt0 -61.17 -39.52 90.45 Favored 'General case' 0 N--CA 1.498 1.941 0 O-C-N 121.384 -0.823 . . . . 0.0 110.639 179.559 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 57' ' ' LEU . . . . . 0.536 HD23 ' CE ' ' A' ' 60' ' ' MET . 1.1 mt -90.25 -9.68 47.1 Favored 'General case' 0 N--CA 1.497 1.911 0 O-C-N 121.249 -0.907 . . . . 0.0 111.379 -179.878 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 58' ' ' GLN . . . . . 0.848 ' O ' HG22 ' A' ' 61' ' ' ILE . 9.8 mm-40 -59.43 -47.06 86.91 Favored 'General case' 0 N--CA 1.501 2.107 0 O-C-N 120.999 -1.063 . . . . 0.0 110.056 179.665 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 59' ' ' GLU . . . . . . . . . . . . . 0.5 OUTLIER -63.95 -32.84 74.52 Favored 'General case' 0 N--CA 1.502 2.157 0 O-C-N 121.07 -1.019 . . . . 0.0 109.89 178.912 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 60' ' ' MET . . . . . 0.536 ' CE ' HD23 ' A' ' 57' ' ' LEU . 4.2 tmm? -65.92 -35.96 82.05 Favored 'General case' 0 N--CA 1.496 1.862 0 O-C-N 121.424 -0.798 . . . . 0.0 110.32 179.428 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 61' ' ' ILE . . . . . 0.848 HG22 ' O ' ' A' ' 58' ' ' GLN . 1.1 tt -63.26 -29.12 46.44 Favored 'Isoleucine or valine' 0 N--CA 1.499 1.992 0 O-C-N 121.326 -0.859 . . . . 0.0 110.708 179.645 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 62' ' ' ASP . . . . . . . . . . . . . 3.7 m-20 -62.21 -45.25 94.18 Favored 'General case' 0 N--CA 1.498 1.933 0 O-C-N 121.185 -0.947 . . . . 0.0 110.145 179.644 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 63' ' ' GLU . . . . . . . . . . . . . 4.0 tm-20 -69.51 -42.61 74.48 Favored 'General case' 0 N--CA 1.498 1.956 0 O-C-N 121.537 -0.727 . . . . 0.0 110.247 179.431 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 64' ' ' VAL . . . . . . . . . . . . . 77.0 t -72.19 -23.96 22.02 Favored 'Isoleucine or valine' 0 N--CA 1.498 1.952 0 O-C-N 121.383 -0.823 . . . . 0.0 110.901 -179.947 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 65' ' ' ASP . . . . . 0.464 ' O ' ' HG2' ' A' ' 66' ' ' GLU . 17.1 t70 -86.93 -68.17 0.77 Allowed 'General case' 0 N--CA 1.497 1.882 0 O-C-N 121.079 -1.013 . . . . 0.0 110.298 -179.878 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 66' ' ' GLU . . . . . 0.464 ' HG2' ' O ' ' A' ' 65' ' ' ASP . 0.4 OUTLIER 44.02 28.76 0.28 Allowed 'General case' 0 N--CA 1.507 2.414 0 N-CA-C 112.615 0.598 . . . . 0.0 112.615 179.903 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 67' ' ' ASP . . . . . . . . . . . . . 0.0 OUTLIER -110.57 -23.53 11.06 Favored 'General case' 0 N--CA 1.498 1.932 0 O-C-N 120.723 -1.236 . . . . 0.0 111.236 179.623 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 68' ' ' GLY . . . . . . . . . . . . . . . 131.22 -50.19 0.9 Allowed Glycine 0 N--CA 1.495 2.59 0 N-CA-C 110.255 -1.138 . . . . 0.0 110.255 -179.981 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 69' ' ' SER . . . . . . . . . . . . . 5.4 p -66.84 -37.2 84.02 Favored 'General case' 0 N--CA 1.499 1.979 0 O-C-N 121.392 -1.063 . . . . 0.0 111.192 -179.491 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 70' ' ' GLY . . . . . . . . . . . . . . . 99.42 -43.73 1.78 Allowed Glycine 0 N--CA 1.496 2.691 0 N-CA-C 110.365 -1.094 . . . . 0.0 110.365 179.781 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 71' ' ' THR . . . . . . . . . . . . . 0.6 OUTLIER -71.82 139.3 48.88 Favored 'General case' 0 N--CA 1.503 2.205 0 O-C-N 121.197 -1.178 . . . . 0.0 110.443 -179.63 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 72' ' ' VAL . . . . . 0.824 HG23 HG13 ' A' ' 61' ' ' ILE . 6.6 t -75.88 131.34 35.11 Favored 'Isoleucine or valine' 0 N--CA 1.498 1.964 0 O-C-N 121.543 -0.723 . . . . 0.0 110.395 179.844 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 73' ' ' ASP . . . . . . . . . . . . . 29.5 m-20 -117.29 -164.11 0.97 Allowed 'General case' 0 N--CA 1.5 2.03 0 O-C-N 121.373 -0.83 . . . . 0.0 110.55 -179.935 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 74' ' ' PHE . . . . . 0.459 ' HA ' ' CE1' ' A' ' 24' ' ' PHE . 87.9 t80 -66.2 -45.83 79.41 Favored 'General case' 0 N--CA 1.502 2.156 0 O-C-N 121.38 -0.825 . . . . 0.0 110.305 179.849 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 75' ' ' ASP . . . . . . . . . . . . . 1.1 m-20 -58.56 -47.8 83.01 Favored 'General case' 0 N--CA 1.497 1.887 0 O-C-N 121.58 -0.7 . . . . 0.0 109.886 179.441 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 76' ' ' GLU . . . . . . . . . . . . . 2.1 mt-10 -67.65 -33.96 76.0 Favored 'General case' 0 N--CA 1.496 1.844 0 O-C-N 121.501 -0.749 . . . . 0.0 109.821 179.044 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 77' ' ' PHE . . . . . . . . . . . . . 47.9 t80 -56.82 -40.27 75.71 Favored 'General case' 0 N--CA 1.5 2.071 0 O-C-N 121.409 -0.807 . . . . 0.0 108.915 178.324 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 78' ' ' LEU . . . . . . . . . . . . . 66.6 mt -69.36 -42.88 74.65 Favored 'General case' 0 N--CA 1.495 1.779 0 N-CA-C 109.041 -0.725 . . . . 0.0 109.041 178.21 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 79' ' ' VAL . . . . . 0.539 HG12 ' HD2' ' A' ' 83' ' ' ARG . 71.9 t -63.71 -34.97 71.18 Favored 'Isoleucine or valine' 0 N--CA 1.501 2.085 0 O-C-N 121.588 -0.695 . . . . 0.0 109.924 178.984 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 80' ' ' MET . . . . . . . . . . . . . 0.5 OUTLIER -69.07 -43.07 75.33 Favored 'General case' 0 N--CA 1.495 1.807 0 O-C-N 121.344 -0.848 . . . . 0.0 109.685 179.223 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 81' ' ' MET . . . . . 0.499 ' HG2' ' CE1' ' A' ' 20' ' ' PHE . 12.9 tpp -65.09 -49.39 70.17 Favored 'General case' 0 N--CA 1.497 1.919 0 O-C-N 121.556 -0.715 . . . . 0.0 109.949 179.556 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 82' ' ' VAL . . . . . 0.898 HG23 ' HB3' ' A' ' 87' ' ' ASP . 7.2 p -61.57 -27.95 43.08 Favored 'Isoleucine or valine' 0 N--CA 1.501 2.115 0 O-C-N 121.256 -0.902 . . . . 0.0 109.492 178.549 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 83' ' ' ARG . . . . . 0.539 ' HD2' HG12 ' A' ' 79' ' ' VAL . 1.6 mtt180 -71.65 -39.63 70.2 Favored 'General case' 0 N--CA 1.499 1.989 0 O-C-N 121.427 -0.796 . . . . 0.0 109.54 178.466 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 84' ' ' CYS . . . . . . . . . . . . . 0.0 OUTLIER -69.08 -50.69 46.06 Favored 'General case' 0 N--CA 1.5 2.053 0 O-C-N 121.499 -0.751 . . . . 0.0 110.47 179.872 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 85' ' ' MET . . . . . 0.524 ' HG3' ' HB2' ' A' ' 87' ' ' ASP . 2.5 ptt? -77.2 -3.41 39.44 Favored 'General case' 0 N--CA 1.499 2.025 0 O-C-N 121.259 -0.901 . . . . 0.0 111.202 179.85 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 86' ' ' LYS . . . . . . . . . . . . . 1.4 ttpp 56.97 45.05 21.91 Favored 'General case' 0 N--CA 1.5 2.049 0 O-C-N 121.336 -0.853 . . . . 0.0 111.215 179.672 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 87' ' ' ASP . . . . . 0.898 ' HB3' HG23 ' A' ' 82' ' ' VAL . 17.3 t70 -84.87 87.03 7.3 Favored 'General case' 0 N--CA 1.494 1.733 0 O-C-N 121.12 -0.987 . . . . 0.0 109.376 179.15 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 88' ' ' ASP . . . . . . . . . . . . . 19.6 m-20 -83.39 76.64 9.9 Favored 'General case' 0 N--CA 1.494 1.77 0 O-C-N 121.332 -0.855 . . . . 0.0 110.132 -179.538 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 89' ' ' SER . . . . . . . . . . . . . 4.2 m . . . . . 0 N--CA 1.496 1.85 0 CA-C-O 117.918 -1.039 . . . . 0.0 110.393 -179.837 . . . . . . . . 0 0 . 1 . 009 nuclear build full ' B' B ' 144' ' ' ARG . . . . . 0.479 ' HD3' ' HD3' ' A' ' 52' ' ' PRO . 10.3 ttp-105 . . . . . 0 N--CA 1.495 1.808 0 CA-C-O 121.002 0.43 . . . . 0.0 110.148 . . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 145' ' ' ARG . . . . . . . . . . . . . 16.8 mmt180 -91.21 147.73 22.85 Favored 'General case' 0 N--CA 1.497 1.917 0 O-C-N 121.356 -0.84 . . . . 0.0 109.923 179.737 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 146' ' ' VAL . . . . . . . . . . . . . 11.3 p -150.04 145.77 17.1 Favored 'Isoleucine or valine' 0 N--CA 1.498 1.926 0 O-C-N 121.37 -0.831 . . . . 0.0 110.515 -179.788 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 147' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -92.17 -27.58 17.6 Favored 'General case' 0 N--CA 1.498 1.974 0 O-C-N 121.399 -0.813 . . . . 0.0 111.38 -179.595 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' B' B ' 148' ' ' ILE . . . . . . . . . . . . . 21.2 mm 61.64 80.34 0.07 OUTLIER 'Isoleucine or valine' 0 N--CA 1.506 2.341 0 O-C-N 121.559 -0.713 . . . . 0.0 110.413 -179.695 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 149' ' ' SER . . . . . 0.519 ' HB3' ' HB3' ' B' ' 152' ' ' ALA . 0.1 OUTLIER -80.79 112.78 18.48 Favored 'General case' 0 N--CA 1.496 1.867 0 O-C-N 121.157 -0.964 . . . . 0.0 109.994 179.756 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' B' B ' 150' ' ' ALA . . . . . . . . . . . . . . . -58.58 -41.01 84.76 Favored 'General case' 0 N--CA 1.499 1.977 0 O-C-N 121.603 -0.686 . . . . 0.0 110.749 -179.644 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 151' ' ' ASP . . . . . . . . . . . . . 7.2 p-10 -64.3 -38.1 89.84 Favored 'General case' 0 N--CA 1.5 2.03 0 O-C-N 121.46 -0.775 . . . . 0.0 110.599 179.574 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 152' ' ' ALA . . . . . 0.519 ' HB3' ' HB3' ' B' ' 149' ' ' SER . . . -78.06 -46.78 19.93 Favored 'General case' 0 N--CA 1.496 1.852 0 O-C-N 121.368 -0.833 . . . . 0.0 110.295 179.742 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' B' B ' 153' ' ' MET . . . . . . . . . . . . . 8.5 tpp -56.69 -43.7 80.75 Favored 'General case' 0 N--CA 1.499 1.992 0 O-C-N 121.494 -0.754 . . . . 0.0 110.332 179.728 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 154' ' ' MET . . . . . 0.526 ' O ' ' HB2' ' B' ' 158' ' ' LEU . 9.0 mmm -58.01 -52.75 64.21 Favored 'General case' 0 N--CA 1.498 1.946 0 O-C-N 121.442 -0.786 . . . . 0.0 110.448 179.88 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' B' B ' 155' ' ' GLN . . . . . . . . . . . . . 0.9 OUTLIER -62.44 -32.64 73.53 Favored 'General case' 0 N--CA 1.499 1.993 0 O-C-N 121.434 -0.791 . . . . 0.0 111.001 -179.959 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' B' B ' 156' ' ' ALA . . . . . . . . . . . . . . . -55.52 -34.92 65.08 Favored 'General case' 0 N--CA 1.501 2.094 0 O-C-N 121.38 -0.825 . . . . 0.0 111.095 179.954 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 157' ' ' LEU . . . . . 0.724 ' HB2' HG21 ' A' ' 26' ' ' ILE . 1.6 pp -112.43 8.22 19.37 Favored 'General case' 0 N--CA 1.5 2.054 0 O-C-N 121.17 -0.956 . . . . 0.0 111.796 -179.709 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' B' B ' 158' ' ' LEU . . . . . 0.526 ' HB2' ' O ' ' B' ' 154' ' ' MET . 0.0 OUTLIER -117.23 -46.68 2.69 Favored 'General case' 0 N--CA 1.498 1.968 0 O-C-N 120.922 -1.111 . . . . 0.0 110.682 179.682 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' B' B ' 159' ' ' GLY . . . . . . . . . . . . . . . -135.04 63.7 0.6 Allowed Glycine 0 N--CA 1.497 2.709 0 N-CA-C 110.273 -1.131 . . . . 0.0 110.273 -179.587 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 160' ' ' ALA . . . . . . . . . . . . . . . -138.92 -74.31 0.38 Allowed 'General case' 0 N--CA 1.498 1.955 0 O-C-N 121.423 -1.045 . . . . 0.0 110.297 179.556 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 161' ' ' ARG . . . . . . . . . . . . . 2.8 tpt180 -159.85 51.89 0.34 Allowed 'General case' 0 N--CA 1.498 1.95 0 O-C-N 121.298 -0.876 . . . . 0.0 110.088 179.83 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 162' ' ' ALA . . . . . . . . . . . . . . . -138.89 116.53 11.39 Favored 'General case' 0 N--CA 1.494 1.766 0 O-C-N 121.302 -0.874 . . . . 0.0 110.14 -179.9 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 163' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.496 1.825 0 CA-C-O 117.914 -1.041 . . . . 0.0 110.531 -179.75 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 90' ' ' ' CA' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 009 nuclear build full ' A' A ' 91' ' ' SXK . . . . . 0.549 ' CAK' HD23 ' A' ' 41' ' ' LEU . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 13.8 mmt . . . . . 0 N--CA 1.499 2.005 0 N-CA-C 109.627 -0.509 . . . . 0.0 109.627 . . . . . . . . . 0 0 . 1 . 010 nuclear build full ' A' A ' 2' ' ' ASP . . . . . . . . . . . . . 7.3 m-20 -128.38 112.48 14.45 Favored 'General case' 0 N--CA 1.495 1.787 0 O-C-N 121.36 -0.837 . . . . 0.0 110.722 -179.033 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 3' ' ' ASP . . . . . 0.467 ' O ' ' HB2' ' A' ' 7' ' ' ALA . 0.2 OUTLIER 52.69 60.33 3.87 Favored 'General case' 0 N--CA 1.502 2.142 0 CA-C-O 121.42 0.628 . . . . 0.0 111.653 179.554 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 4' ' ' ILE . . . . . 0.417 HG22 ' HD1' ' A' ' 5' ' ' TYR . 23.6 mm -93.19 -52.55 9.7 Favored 'Isoleucine or valine' 0 N--CA 1.497 1.882 0 O-C-N 121.201 -0.937 . . . . 0.0 109.661 179.412 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 5' ' ' TYR . . . . . 0.417 ' HD1' HG22 ' A' ' 4' ' ' ILE . 1.2 m-85 -96.14 -36.85 10.82 Favored 'General case' 0 N--CA 1.494 1.773 0 O-C-N 121.473 -0.767 . . . . 0.0 109.471 179.124 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 2.0 tmmt? -63.22 -28.36 69.98 Favored 'General case' 0 N--CA 1.497 1.893 0 O-C-N 121.433 -0.792 . . . . 0.0 109.819 178.664 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 7' ' ' ALA . . . . . 0.467 ' HB2' ' O ' ' A' ' 3' ' ' ASP . . . -53.58 -44.83 69.66 Favored 'General case' 0 N--CA 1.497 1.923 0 O-C-N 121.609 -0.682 . . . . 0.0 109.287 178.948 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 8' ' ' ALA . . . . . . . . . . . . . . . -67.29 -43.65 81.23 Favored 'General case' 0 N--CA 1.495 1.802 0 O-C-N 121.533 -0.729 . . . . 0.0 109.256 178.331 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 9' ' ' VAL . . . . . 0.533 HG13 ' CB ' ' A' ' 78' ' ' LEU . 53.0 t -56.62 -40.42 69.07 Favored 'Isoleucine or valine' 0 N--CA 1.5 2.075 0 O-C-N 121.8 -0.563 . . . . 0.0 110.404 179.585 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 10' ' ' GLU . . . . . . . . . . . . . 0.7 OUTLIER -63.77 -44.41 93.47 Favored 'General case' 0 N--CA 1.496 1.853 0 O-C-N 121.437 -0.789 . . . . 0.0 111.333 -179.604 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 11' ' ' GLN . . . . . . . . . . . . . 4.3 mt-30 -139.69 82.84 1.9 Allowed 'General case' 0 N--CA 1.496 1.839 0 O-C-N 121.138 -0.976 . . . . 0.0 111.184 -179.704 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 12' ' ' LEU . . . . . . . . . . . . . 36.1 mt -70.79 -74.23 0.15 Allowed 'General case' 0 N--CA 1.498 1.956 0 O-C-N 121.197 -0.94 . . . . 0.0 108.792 178.703 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 13' ' ' THR . . . . . 0.507 ' HB ' ' HB2' ' A' ' 16' ' ' GLN . 2.1 m -157.21 156.55 32.75 Favored 'General case' 0 N--CA 1.494 1.731 0 N-CA-C 108.657 -0.868 . . . . 0.0 108.657 178.55 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 14' ' ' GLU . . . . . . . . . . . . . 2.7 tp10 -53.97 -33.06 55.92 Favored 'General case' 0 N--CA 1.494 1.741 0 O-C-N 121.531 -0.73 . . . . 0.0 110.825 -179.394 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 1.7 mp0 -90.72 -44.37 9.52 Favored 'General case' 0 N--CA 1.495 1.78 0 O-C-N 121.316 -0.865 . . . . 0.0 110.649 179.973 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 16' ' ' GLN . . . . . 0.507 ' HB2' ' HB ' ' A' ' 13' ' ' THR . 0.8 OUTLIER -48.24 -59.89 3.07 Favored 'General case' 0 N--CA 1.503 2.194 0 O-C-N 121.503 -0.748 . . . . 0.0 111.123 -179.408 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 17' ' ' LYS . . . . . . . . . . . . . 1.0 OUTLIER -56.91 -39.73 74.99 Favored 'General case' 0 N--CA 1.498 1.962 0 O-C-N 121.891 -0.506 . . . . 0.0 110.375 179.898 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 18' ' ' ASN . . . . . . . . . . . . . 2.1 t-20 -66.56 -39.63 88.6 Favored 'General case' 0 N--CA 1.499 2.022 0 O-C-N 121.302 -0.874 . . . . 0.0 110.129 179.26 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 17.0 mt-10 -62.23 -40.41 96.04 Favored 'General case' 0 N--CA 1.497 1.916 0 O-C-N 121.327 -0.858 . . . . 0.0 109.673 179.078 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 20' ' ' PHE . . . . . . . . . . . . . 33.9 m-85 -66.35 -31.53 72.37 Favored 'General case' 0 N--CA 1.498 1.936 0 O-C-N 121.482 -0.761 . . . . 0.0 109.559 178.728 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 21' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -60.22 -43.69 95.79 Favored 'General case' 0 N--CA 1.497 1.92 0 O-C-N 121.438 -0.789 . . . . 0.0 109.05 178.836 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 22' ' ' ALA . . . . . . . . . . . . . . . -72.18 -39.91 68.31 Favored 'General case' 0 N--CA 1.495 1.804 0 O-C-N 121.637 -0.664 . . . . 0.0 109.394 178.681 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 23' ' ' ALA . . . . . 0.839 ' HB1' HD23 ' B' ' 157' ' ' LEU . . . -65.7 -28.67 69.24 Favored 'General case' 0 N--CA 1.498 1.971 0 O-C-N 121.345 -0.847 . . . . 0.0 109.778 178.821 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 24' ' ' PHE . . . . . 0.651 ' O ' HG22 ' A' ' 28' ' ' VAL . 23.7 t80 -69.53 -34.03 73.65 Favored 'General case' 0 N--CA 1.495 1.787 0 O-C-N 121.581 -0.7 . . . . 0.0 110.188 179.514 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 25' ' ' ASP . . . . . . . . . . . . . 21.5 m-20 -52.26 -53.11 47.99 Favored 'General case' 0 N--CA 1.501 2.12 0 O-C-N 121.367 -0.833 . . . . 0.0 111.024 179.875 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 26' ' ' ILE . . . . . 0.527 ' HA ' HD23 ' A' ' 29' ' ' LEU . 1.1 pt -75.01 -20.46 16.48 Favored 'Isoleucine or valine' 0 N--CA 1.503 2.179 0 O-C-N 121.256 -0.902 . . . . 0.0 111.077 -179.866 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 27' ' ' PHE . . . . . 0.639 ' CZ ' HG21 ' A' ' 44' ' ' VAL . 0.1 OUTLIER -75.83 -17.5 59.81 Favored 'General case' 0 N--CA 1.496 1.848 0 O-C-N 120.933 -1.104 . . . . 0.0 110.196 179.169 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 28' ' ' VAL . . . . . 0.651 HG22 ' O ' ' A' ' 24' ' ' PHE . 20.6 m -129.25 26.27 1.92 Allowed 'Isoleucine or valine' 0 N--CA 1.499 1.997 0 O-C-N 121.305 -0.872 . . . . 0.0 110.74 179.93 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 29' ' ' LEU . . . . . 0.527 HD23 ' HA ' ' A' ' 26' ' ' ILE . 3.5 pp -74.29 -27.32 60.67 Favored 'General case' 0 N--CA 1.501 2.094 0 O-C-N 120.996 -1.065 . . . . 0.0 111.068 -179.854 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 30' ' ' GLY . . . . . . . . . . . . . . . -105.72 42.27 1.95 Allowed Glycine 0 N--CA 1.495 2.607 0 N-CA-C 109.784 -1.326 . . . . 0.0 109.784 179.866 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 31' ' ' ALA . . . . . 0.47 ' HB2' ' HG3' ' A' ' 40' ' ' GLU . . . -145.74 127.45 15.25 Favored 'General case' 0 N--CA 1.494 1.756 0 O-C-N 121.395 -1.062 . . . . 0.0 110.426 -179.847 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 32' ' ' GLU . . . . . . . . . . . . . 1.7 mp0 -76.84 -15.17 59.79 Favored 'General case' 0 N--CA 1.501 2.09 0 O-C-N 121.391 -0.818 . . . . 0.0 110.622 179.678 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 7.6 m-20 -69.63 -30.14 67.79 Favored 'General case' 0 N--CA 1.497 1.894 0 O-C-N 121.302 -0.874 . . . . 0.0 110.792 -179.949 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 34' ' ' GLY . . . . . . . . . . . . . . . 87.51 12.11 67.64 Favored Glycine 0 N--CA 1.496 2.681 0 N-CA-C 109.996 -1.242 . . . . 0.0 109.996 -179.511 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 35' ' ' CYS . . . . . . . . . . . . . 64.2 m -136.47 168.78 18.81 Favored 'General case' 0 N--CA 1.495 1.818 0 O-C-N 121.301 -1.117 . . . . 0.0 110.116 -179.921 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 36' ' ' ILE . . . . . . . . . . . . . 78.7 mt -81.34 105.07 10.81 Favored 'Isoleucine or valine' 0 N--CA 1.498 1.946 0 O-C-N 121.142 -0.974 . . . . 0.0 110.21 -179.907 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 37' ' ' SER . . . . . . . . . . . . . 89.2 p -96.14 -177.24 3.92 Favored 'General case' 0 N--CA 1.495 1.809 0 O-C-N 121.502 -0.749 . . . . 0.0 110.237 179.773 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 38' ' ' THR . . . . . 0.448 ' HB ' ' O ' ' A' ' 54' ' ' PRO . 1.8 p -59.38 -43.94 92.83 Favored 'General case' 0 N--CA 1.502 2.129 0 O-C-N 121.438 -0.789 . . . . 0.0 110.459 179.789 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 39' ' ' LYS . . . . . 0.558 ' HA ' ' HB3' ' A' ' 54' ' ' PRO . 0.0 OUTLIER -62.98 -45.52 92.02 Favored 'General case' 0 N--CA 1.496 1.85 0 O-C-N 121.57 -0.706 . . . . 0.0 110.092 179.527 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 40' ' ' GLU . . . . . 0.47 ' HG3' ' HB2' ' A' ' 31' ' ' ALA . 19.0 mm-40 -69.42 -29.03 66.66 Favored 'General case' 0 N--CA 1.498 1.947 0 O-C-N 121.414 -0.804 . . . . 0.0 110.39 179.647 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 41' ' ' LEU . . . . . 0.966 HD21 ' HAK' ' A' ' 91' ' ' SXK . 0.1 OUTLIER -73.32 -61.29 1.88 Allowed 'General case' 0 N--CA 1.497 1.904 0 O-C-N 121.253 -0.904 . . . . 0.0 108.833 178.603 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 42' ' ' GLY . . . . . 0.552 ' HA2' ' HB2' ' A' ' 45' ' ' MET . . . -49.53 -30.96 13.75 Favored Glycine 0 N--CA 1.499 2.856 0 N-CA-C 109.933 -1.267 . . . . 0.0 109.933 179.112 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 43' ' ' LYS . . . . . 0.45 ' HB3' ' O ' ' A' ' 40' ' ' GLU . 0.9 OUTLIER -48.98 -48.87 42.9 Favored 'General case' 0 N--CA 1.502 2.145 0 O-C-N 121.623 -0.928 . . . . 0.0 110.653 179.344 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 44' ' ' VAL . . . . . 0.639 HG21 ' CZ ' ' A' ' 27' ' ' PHE . 28.5 m -82.87 -23.86 8.54 Favored 'Isoleucine or valine' 0 N--CA 1.501 2.092 0 O-C-N 121.373 -0.83 . . . . 0.0 110.461 179.563 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 45' ' ' MET . . . . . 0.552 ' HB2' ' HA2' ' A' ' 42' ' ' GLY . 0.0 OUTLIER -65.43 -38.27 89.4 Favored 'General case' 0 N--CA 1.499 1.997 0 O-C-N 121.337 -0.852 . . . . 0.0 110.321 179.404 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 46' ' ' ARG . . . . . 0.456 ' CB ' ' HB3' ' A' ' 51' ' ' ASN . 13.2 ttt180 -62.19 -51.58 67.23 Favored 'General case' 0 N--CA 1.5 2.039 0 O-C-N 121.626 -0.671 . . . . 0.0 110.962 -179.746 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 47' ' ' MET . . . . . 0.413 ' CE ' ' HB1' ' B' ' 156' ' ' ALA . 4.9 ptm -67.25 -28.23 67.88 Favored 'General case' 0 N--CA 1.498 1.971 0 O-C-N 121.296 -0.877 . . . . 0.0 111.186 -179.661 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 48' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -79.83 -46.01 17.69 Favored 'General case' 0 N--CA 1.497 1.879 0 O-C-N 121.051 -1.031 . . . . 0.0 110.708 179.932 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 49' ' ' GLY . . . . . . . . . . . . . . . -147.21 -77.83 0.02 OUTLIER Glycine 0 N--CA 1.496 2.679 0 N-CA-C 110.107 -1.197 . . . . 0.0 110.107 -179.875 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 50' ' ' GLN . . . . . . . . . . . . . 2.4 pp0? -147.98 160.72 42.53 Favored 'General case' 0 N--CA 1.498 1.946 0 O-C-N 121.306 -1.114 . . . . 0.0 111.083 -179.822 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 51' ' ' ASN . . . . . 0.456 ' HB3' ' CB ' ' A' ' 46' ' ' ARG . 24.7 t30 -175.0 93.44 0.29 Allowed Pre-proline 0 N--CA 1.494 1.764 0 O-C-N 121.779 -0.576 . . . . 0.0 109.641 179.467 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 52' ' ' PRO . . . . . . . . . . . . . 42.1 Cg_endo -73.17 -65.95 0.03 OUTLIER 'Trans proline' 0 C--N 1.312 -1.387 0 O-C-N 123.658 1.346 . . . . 0.0 110.187 -179.943 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 53' ' ' THR . . . . . . . . . . . . . 1.8 p -129.94 155.76 80.1 Favored Pre-proline 0 N--CA 1.489 1.512 0 O-C-N 121.4 -0.813 . . . . 0.0 109.579 179.29 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 54' ' ' PRO . . . . . 0.565 ' HA ' HD23 ' A' ' 57' ' ' LEU . 40.4 Cg_endo -66.29 -28.3 47.43 Favored 'Trans proline' 0 C--N 1.31 -1.475 0 O-C-N 123.742 1.39 . . . . 0.0 111.071 -179.982 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 55' ' ' GLU . . . . . . . . . . . . . 1.1 mp0 -60.03 -34.85 73.94 Favored 'General case' 0 N--CA 1.501 2.117 0 O-C-N 121.218 -0.926 . . . . 0.0 110.684 179.559 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 27.1 tt0 -62.52 -21.75 65.77 Favored 'General case' 0 N--CA 1.5 2.059 0 O-C-N 121.404 -0.81 . . . . 0.0 111.529 -179.886 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 57' ' ' LEU . . . . . 0.646 HD22 ' N ' ' A' ' 57' ' ' LEU . 3.4 mm? -79.44 -12.51 59.89 Favored 'General case' 0 N--CA 1.499 2.018 0 O-C-N 121.022 -1.049 . . . . 0.0 111.115 -179.916 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 58' ' ' GLN . . . . . 0.681 ' HA ' HG22 ' A' ' 61' ' ' ILE . 5.0 pt20 -52.65 -35.36 54.75 Favored 'General case' 0 N--CA 1.5 2.041 0 O-C-N 121.072 -1.018 . . . . 0.0 110.445 -179.712 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 59' ' ' GLU . . . . . . . . . . . . . 6.8 mm-40 -56.22 -34.4 66.27 Favored 'General case' 0 N--CA 1.5 2.038 0 O-C-N 121.02 -1.05 . . . . 0.0 109.891 178.834 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 60' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -82.22 -33.17 29.44 Favored 'General case' 0 N--CA 1.495 1.813 0 O-C-N 121.68 -0.637 . . . . 0.0 110.625 179.522 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 61' ' ' ILE . . . . . 0.907 HG13 HG23 ' A' ' 72' ' ' VAL . 3.4 tt -81.4 -31.69 11.57 Favored 'Isoleucine or valine' 0 N--CA 1.498 1.955 0 O-C-N 121.17 -0.956 . . . . 0.0 111.044 -179.505 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 62' ' ' ASP . . . . . . . . . . . . . 6.7 m-20 -69.44 -44.85 70.45 Favored 'General case' 0 N--CA 1.496 1.849 0 O-C-N 121.125 -0.984 . . . . 0.0 111.032 -179.679 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 63' ' ' GLU . . . . . 0.739 ' HG3' HG23 ' A' ' 64' ' ' VAL . 0.6 OUTLIER -62.47 -23.49 66.94 Favored 'General case' 0 N--CA 1.501 2.076 0 O-C-N 121.333 -0.854 . . . . 0.0 111.714 -179.43 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 64' ' ' VAL . . . . . 0.739 HG23 ' HG3' ' A' ' 63' ' ' GLU . 44.2 t -107.85 -24.9 3.83 Favored 'Isoleucine or valine' 0 N--CA 1.501 2.096 0 O-C-N 121.014 -1.054 . . . . 0.0 111.648 -179.235 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 65' ' ' ASP . . . . . . . . . . . . . 22.4 t70 -75.91 -91.39 0.03 OUTLIER 'General case' 0 N--CA 1.5 2.028 0 O-C-N 120.949 -1.094 . . . . 0.0 110.456 -179.627 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 66' ' ' GLU . . . . . . . . . . . . . 3.6 mm-40 49.28 33.37 5.14 Favored 'General case' 0 N--CA 1.502 2.174 0 O-C-N 121.333 -0.854 . . . . 0.0 111.544 179.958 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 67' ' ' ASP . . . . . . . . . . . . . 1.9 p-10 -115.24 -22.7 9.3 Favored 'General case' 0 N--CA 1.499 2.018 0 O-C-N 120.968 -1.082 . . . . 0.0 111.475 -179.932 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 68' ' ' GLY . . . . . . . . . . . . . . . 127.68 -30.78 3.91 Favored Glycine 0 N--CA 1.495 2.592 0 N-CA-C 110.074 -1.21 . . . . 0.0 110.074 -179.849 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 69' ' ' SER . . . . . . . . . . . . . 0.9 OUTLIER -78.24 -35.36 48.38 Favored 'General case' 0 N--CA 1.497 1.916 0 O-C-N 121.289 -1.124 . . . . 0.0 111.033 -179.786 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 70' ' ' GLY . . . . . . . . . . . . . . . 91.26 -50.49 3.04 Favored Glycine 0 N--CA 1.499 2.883 0 N-CA-C 110.197 -1.161 . . . . 0.0 110.197 179.89 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 71' ' ' THR . . . . . . . . . . . . . 54.9 m -79.13 154.58 29.23 Favored 'General case' 0 N--CA 1.502 2.13 0 O-C-N 121.298 -1.119 . . . . 0.0 110.977 -179.417 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 72' ' ' VAL . . . . . 0.907 HG23 HG13 ' A' ' 61' ' ' ILE . 2.4 t -81.57 128.82 38.39 Favored 'Isoleucine or valine' 0 N--CA 1.498 1.974 0 O-C-N 121.727 -0.608 . . . . 0.0 110.453 179.728 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 73' ' ' ASP . . . . . . . . . . . . . 1.4 p30 -102.44 -161.07 0.82 Allowed 'General case' 0 N--CA 1.498 1.927 0 O-C-N 121.574 -0.704 . . . . 0.0 109.881 179.263 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 74' ' ' PHE . . . . . . . . . . . . . 45.5 t80 -67.99 -53.06 28.84 Favored 'General case' 0 N--CA 1.499 1.983 0 O-C-N 121.129 -0.982 . . . . 0.0 110.69 -179.577 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 75' ' ' ASP . . . . . . . . . . . . . 1.0 OUTLIER -59.5 -43.01 93.44 Favored 'General case' 0 N--CA 1.498 1.927 0 O-C-N 121.498 -0.751 . . . . 0.0 110.473 179.91 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 76' ' ' GLU . . . . . 0.455 ' HG2' HG12 ' A' ' 64' ' ' VAL . 1.5 mt-10 -65.13 -42.2 94.08 Favored 'General case' 0 N--CA 1.497 1.917 0 O-C-N 121.498 -0.751 . . . . 0.0 109.961 179.335 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 77' ' ' PHE . . . . . . . . . . . . . 25.4 t80 -59.26 -37.34 77.38 Favored 'General case' 0 N--CA 1.497 1.886 0 O-C-N 121.483 -0.761 . . . . 0.0 109.658 179.155 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 78' ' ' LEU . . . . . 0.533 ' CB ' HG13 ' A' ' 9' ' ' VAL . 41.4 mt -66.36 -34.18 77.39 Favored 'General case' 0 N--CA 1.497 1.893 0 O-C-N 121.411 -0.806 . . . . 0.0 109.914 178.987 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 79' ' ' VAL . . . . . 0.509 HG23 HG11 ' A' ' 9' ' ' VAL . 55.3 t -64.25 -42.93 96.96 Favored 'Isoleucine or valine' 0 N--CA 1.498 1.955 0 O-C-N 121.359 -0.838 . . . . 0.0 109.699 179.056 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 80' ' ' MET . . . . . 0.522 ' HG3' HG21 ' A' ' 64' ' ' VAL . 0.0 OUTLIER -60.48 -34.14 73.62 Favored 'General case' 0 N--CA 1.498 1.937 0 O-C-N 121.4 -0.813 . . . . 0.0 110.034 179.318 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 81' ' ' MET . . . . . . . . . . . . . 8.9 mmt -62.92 -53.44 53.98 Favored 'General case' 0 N--CA 1.498 1.955 0 O-C-N 121.459 -0.776 . . . . 0.0 110.34 179.732 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 82' ' ' VAL . . . . . . . . . . . . . 0.6 OUTLIER -66.7 -24.55 33.01 Favored 'Isoleucine or valine' 0 N--CA 1.503 2.189 0 O-C-N 121.165 -0.959 . . . . 0.0 110.035 179.236 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 83' ' ' ARG . . . . . . . . . . . . . 0.6 OUTLIER -78.38 -35.18 47.64 Favored 'General case' 0 N--CA 1.497 1.921 0 O-C-N 121.248 -0.907 . . . . 0.0 109.613 178.829 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 84' ' ' CYS . . . . . . . . . . . . . 1.0 OUTLIER -70.03 -28.91 65.87 Favored 'General case' 0 N--CA 1.498 1.942 0 O-C-N 121.504 -0.747 . . . . 0.0 110.645 179.531 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 85' ' ' MET . . . . . . . . . . . . . 34.0 mtt -51.17 -49.29 61.2 Favored 'General case' 0 N--CA 1.502 2.158 0 O-C-N 121.68 -0.637 . . . . 0.0 110.759 179.867 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 86' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER 66.91 -68.4 0.15 Allowed 'General case' 0 N--CA 1.504 2.275 0 O-C-N 121.872 -0.517 . . . . 0.0 111.331 179.695 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 87' ' ' ASP . . . . . . . . . . . . . 21.2 t70 -114.19 -65.28 1.2 Allowed 'General case' 0 N--CA 1.496 1.856 0 O-C-N 121.195 -0.941 . . . . 0.0 110.509 -179.832 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 88' ' ' ASP . . . . . . . . . . . . . 1.4 t70 -91.04 167.83 12.1 Favored 'General case' 0 N--CA 1.497 1.884 0 O-C-N 121.17 -0.956 . . . . 0.0 110.346 179.876 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 89' ' ' SER . . . . . . . . . . . . . 72.4 m . . . . . 0 N--CA 1.496 1.853 0 CA-C-O 118.24 -0.886 . . . . 0.0 110.515 179.957 . . . . . . . . 0 0 . 1 . 010 nuclear build full ' B' B ' 144' ' ' ARG . . . . . . . . . . . . . 10.5 ttt85 . . . . . 0 N--CA 1.494 1.759 0 CA-C-O 120.992 0.425 . . . . 0.0 110.308 . . . . . . . . . 0 0 . 1 . 010 nuclear build full ' B' B ' 145' ' ' ARG . . . . . . . . . . . . . 4.3 tpt180 -155.51 132.54 10.75 Favored 'General case' 0 N--CA 1.494 1.75 0 O-C-N 121.403 -0.81 . . . . 0.0 110.29 -179.746 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 146' ' ' VAL . . . . . . . . . . . . . 30.3 t -121.23 147.61 25.03 Favored 'Isoleucine or valine' 0 N--CA 1.496 1.861 0 O-C-N 121.391 -0.818 . . . . 0.0 109.909 179.946 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 147' ' ' ARG . . . . . 0.455 ' O ' ' HB ' ' B' ' 148' ' ' ILE . 0.1 OUTLIER -77.38 -46.97 21.07 Favored 'General case' 0 N--CA 1.499 2.002 0 O-C-N 121.492 -0.755 . . . . 0.0 110.946 -179.619 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' B' B ' 148' ' ' ILE . . . . . 0.47 HG13 ' HE1' ' A' ' 45' ' ' MET . 41.0 mm 63.88 161.01 0.0 OUTLIER 'Isoleucine or valine' 0 N--CA 1.507 2.421 0 CA-C-O 121.276 0.56 . . . . 0.0 110.303 -179.444 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' B' B ' 149' ' ' SER . . . . . . . . . . . . . 6.5 t -153.98 144.08 22.04 Favored 'General case' 0 N--CA 1.498 1.97 0 O-C-N 120.91 -1.119 . . . . 0.0 110.728 179.911 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 150' ' ' ALA . . . . . . . . . . . . . . . -56.35 -43.15 78.82 Favored 'General case' 0 N--CA 1.498 1.944 0 O-C-N 121.494 -0.754 . . . . 0.0 110.543 179.767 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 151' ' ' ASP . . . . . . . . . . . . . 4.8 m-20 -71.11 -48.11 54.15 Favored 'General case' 0 N--CA 1.498 1.95 0 O-C-N 121.406 -0.809 . . . . 0.0 110.28 179.786 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 152' ' ' ALA . . . . . . . . . . . . . . . -60.53 -48.3 82.38 Favored 'General case' 0 N--CA 1.498 1.949 0 O-C-N 121.544 -0.723 . . . . 0.0 110.648 179.88 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 153' ' ' MET . . . . . 0.444 ' SD ' HG23 ' B' ' 148' ' ' ILE . 0.5 OUTLIER -63.25 -37.72 88.35 Favored 'General case' 0 N--CA 1.499 1.985 0 O-C-N 121.364 -0.835 . . . . 0.0 110.195 179.693 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' B' B ' 154' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -65.47 -42.76 91.89 Favored 'General case' 0 N--CA 1.497 1.922 0 O-C-N 121.285 -0.884 . . . . 0.0 110.144 179.461 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' B' B ' 155' ' ' GLN . . . . . . . . . . . . . 14.3 mt-30 -62.92 -42.0 99.65 Favored 'General case' 0 N--CA 1.5 2.053 0 O-C-N 121.54 -0.725 . . . . 0.0 110.32 179.424 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 156' ' ' ALA . . . . . 0.413 ' HB1' ' CE ' ' A' ' 47' ' ' MET . . . -70.0 -36.26 75.0 Favored 'General case' 0 N--CA 1.496 1.858 0 O-C-N 121.438 -0.789 . . . . 0.0 110.171 179.73 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' B' B ' 157' ' ' LEU . . . . . 0.839 HD23 ' HB1' ' A' ' 23' ' ' ALA . 4.1 mp -71.05 -61.74 1.65 Allowed 'General case' 0 N--CA 1.496 1.841 0 O-C-N 121.645 -0.659 . . . . 0.0 110.351 -179.967 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' B' B ' 158' ' ' LEU . . . . . 0.588 HD11 ' HB2' ' A' ' 23' ' ' ALA . 17.5 mt -108.0 62.58 0.61 Allowed 'General case' 0 N--CA 1.497 1.918 0 O-C-N 121.261 -0.899 . . . . 0.0 109.971 179.821 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' B' B ' 159' ' ' GLY . . . . . . . . . . . . . . . -170.74 -43.11 0.03 OUTLIER Glycine 0 N--CA 1.496 2.682 0 N-CA-C 110.248 -1.141 . . . . 0.0 110.248 -179.831 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 160' ' ' ALA . . . . . . . . . . . . . . . -59.77 97.55 0.04 OUTLIER 'General case' 0 N--CA 1.499 1.999 0 O-C-N 121.435 -1.038 . . . . 0.0 110.362 179.969 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 161' ' ' ARG . . . . . . . . . . . . . 1.8 ttm-85 69.99 -61.12 0.46 Allowed 'General case' 0 N--CA 1.505 2.289 0 O-C-N 121.863 -0.523 . . . . 0.0 111.102 -179.641 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 162' ' ' ALA . . . . . . . . . . . . . . . -93.73 163.63 13.46 Favored 'General case' 0 N--CA 1.497 1.895 0 O-C-N 121.172 -0.955 . . . . 0.0 110.611 -179.929 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 163' ' ' LYS . . . . . . . . . . . . . 0.3 OUTLIER . . . . . 0 N--CA 1.497 1.925 0 CA-C-O 117.821 -1.085 . . . . 0.0 110.431 179.84 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 90' ' ' ' CA' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 010 nuclear build full ' A' A ' 91' ' ' SXK . . . . . 0.966 ' HAK' HD21 ' A' ' 41' ' ' LEU . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 1' ' ' MET . . . . . 0.501 ' O ' HD12 ' A' ' 4' ' ' ILE . 0.0 OUTLIER . . . . . 0 N--CA 1.497 1.895 0 CA-C-O 121.111 0.481 . . . . 0.0 110.635 . . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 2' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -99.51 -27.68 13.6 Favored 'General case' 0 N--CA 1.499 1.975 0 O-C-N 121.453 -0.779 . . . . 0.0 110.938 -179.961 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 3' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -59.46 -22.5 61.62 Favored 'General case' 0 N--CA 1.501 2.098 0 O-C-N 121.391 -0.818 . . . . 0.0 111.817 -179.481 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 4' ' ' ILE . . . . . 0.501 HD12 ' O ' ' A' ' 1' ' ' MET . 11.6 mt -49.93 -53.72 9.87 Favored 'Isoleucine or valine' 0 N--CA 1.503 2.219 0 O-C-N 121.277 -0.889 . . . . 0.0 110.267 179.762 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 5' ' ' TYR . . . . . 0.413 ' CE1' ' HG2' ' A' ' 83' ' ' ARG . 6.8 m-85 -73.52 -34.31 65.18 Favored 'General case' 0 N--CA 1.5 2.051 0 O-C-N 121.288 -0.883 . . . . 0.0 109.967 179.155 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 6' ' ' LYS . . . . . 0.52 ' O ' HG12 ' A' ' 9' ' ' VAL . 0.0 OUTLIER -59.78 -32.34 70.51 Favored 'General case' 0 N--CA 1.497 1.924 0 O-C-N 121.44 -0.787 . . . . 0.0 110.214 179.576 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' A' A ' 7' ' ' ALA . . . . . . . . . . . . . . . -55.88 -34.32 65.39 Favored 'General case' 0 N--CA 1.497 1.912 0 O-C-N 121.282 -0.886 . . . . 0.0 109.693 178.865 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 8' ' ' ALA . . . . . 0.563 ' CB ' HG11 ' A' ' 82' ' ' VAL . . . -71.72 -45.42 61.84 Favored 'General case' 0 N--CA 1.497 1.892 0 O-C-N 121.523 -0.736 . . . . 0.0 110.331 179.375 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 9' ' ' VAL . . . . . 0.633 ' HA ' HD12 ' A' ' 12' ' ' LEU . 0.3 OUTLIER -63.66 -28.98 46.1 Favored 'Isoleucine or valine' 0 N--CA 1.5 2.064 0 O-C-N 121.152 -0.967 . . . . 0.0 109.999 179.398 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' A' A ' 10' ' ' GLU . . . . . . . . . . . . . 1.1 tt0 -73.26 -31.98 64.41 Favored 'General case' 0 N--CA 1.493 1.677 0 O-C-N 121.606 -0.684 . . . . 0.0 110.366 179.299 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 11' ' ' GLN . . . . . . . . . . . . . 27.4 mt-30 -85.22 2.81 42.2 Favored 'General case' 0 N--CA 1.499 2.008 0 O-C-N 121.331 -0.856 . . . . 0.0 111.577 -179.84 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 12' ' ' LEU . . . . . 0.633 HD12 ' HA ' ' A' ' 9' ' ' VAL . 4.5 mt -73.2 136.83 44.75 Favored 'General case' 0 N--CA 1.5 2.033 0 O-C-N 120.877 -1.14 . . . . 0.0 110.197 179.823 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 13' ' ' THR . . . . . . . . . . . . . 3.2 m -92.26 157.6 16.58 Favored 'General case' 0 N--CA 1.503 2.196 0 O-C-N 121.323 -0.861 . . . . 0.0 111.008 -179.602 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 14' ' ' GLU . . . . . . . . . . . . . 8.5 tp10 -51.96 -41.75 62.35 Favored 'General case' 0 N--CA 1.496 1.847 0 O-C-N 121.809 -0.557 . . . . 0.0 110.607 -179.918 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 23.5 mt-10 -58.5 -43.78 89.22 Favored 'General case' 0 N--CA 1.498 1.967 0 O-C-N 121.544 -0.723 . . . . 0.0 110.512 179.56 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 16' ' ' GLN . . . . . . . . . . . . . 0.8 OUTLIER -70.5 -37.07 74.11 Favored 'General case' 0 N--CA 1.498 1.931 0 O-C-N 121.491 -0.755 . . . . 0.0 110.284 179.745 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 17' ' ' LYS . . . . . . . . . . . . . 2.6 tptt -62.98 -45.68 91.28 Favored 'General case' 0 N--CA 1.496 1.873 0 N-CA-C 109.083 -0.71 . . . . 0.0 109.083 178.756 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 18' ' ' ASN . . . . . . . . . . . . . 15.7 m-80 -70.07 -27.98 65.06 Favored 'General case' 0 N--CA 1.497 1.901 0 O-C-N 121.439 -0.788 . . . . 0.0 109.757 178.642 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 7.3 tt0 -67.33 -51.42 52.56 Favored 'General case' 0 N--CA 1.495 1.776 0 O-C-N 121.445 -0.784 . . . . 0.0 109.247 178.967 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 20' ' ' PHE . . . . . . . . . . . . . 30.6 m-85 -67.19 -27.4 67.23 Favored 'General case' 0 N--CA 1.497 1.877 0 O-C-N 121.328 -0.858 . . . . 0.0 109.798 178.936 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 21' ' ' LYS . . . . . . . . . . . . . 3.1 tptt -58.04 -46.82 84.73 Favored 'General case' 0 N--CA 1.499 1.995 0 O-C-N 121.377 -0.827 . . . . 0.0 109.62 178.885 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 22' ' ' ALA . . . . . . . . . . . . . . . -63.27 -46.67 85.71 Favored 'General case' 0 N--CA 1.496 1.832 0 O-C-N 121.541 -0.725 . . . . 0.0 109.745 179.235 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 23' ' ' ALA . . . . . . . . . . . . . . . -60.65 -42.88 97.87 Favored 'General case' 0 N--CA 1.498 1.962 0 O-C-N 121.516 -0.74 . . . . 0.0 109.625 178.946 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 24' ' ' PHE . . . . . 0.518 ' O ' HG22 ' A' ' 28' ' ' VAL . 59.4 t80 -59.38 -47.92 83.6 Favored 'General case' 0 N--CA 1.494 1.766 0 O-C-N 121.567 -0.708 . . . . 0.0 109.666 179.139 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 25' ' ' ASP . . . . . . . . . . . . . 1.1 m-20 -56.39 -41.41 76.21 Favored 'General case' 0 N--CA 1.498 1.955 0 O-C-N 121.692 -0.63 . . . . 0.0 110.393 179.475 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 26' ' ' ILE . . . . . . . . . . . . . 38.1 mm -64.87 -30.12 49.39 Favored 'Isoleucine or valine' 0 N--CA 1.501 2.109 0 O-C-N 121.389 -0.819 . . . . 0.0 110.047 179.262 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 27' ' ' PHE . . . . . 0.455 ' CE1' ' HB ' ' A' ' 44' ' ' VAL . 0.1 OUTLIER -75.38 -28.98 59.71 Favored 'General case' 0 N--CA 1.496 1.833 0 O-C-N 121.435 -0.791 . . . . 0.0 111.115 -179.954 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' A' A ' 28' ' ' VAL . . . . . 0.518 HG22 ' O ' ' A' ' 24' ' ' PHE . 0.0 OUTLIER -113.75 -79.17 0.38 Allowed 'Isoleucine or valine' 0 N--CA 1.498 1.95 0 O-C-N 121.138 -0.976 . . . . 0.0 110.748 179.859 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' A' A ' 29' ' ' LEU . . . . . 0.42 ' H ' HG23 ' A' ' 28' ' ' VAL . 0.2 OUTLIER 67.19 -68.89 0.14 Allowed 'General case' 0 N--CA 1.504 2.262 0 O-C-N 121.644 -0.66 . . . . 0.0 110.407 -179.615 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' A' A ' 30' ' ' GLY . . . . . . . . . . . . . . . -98.36 40.84 2.37 Favored Glycine 0 N--CA 1.494 2.545 0 N-CA-C 109.538 -1.425 . . . . 0.0 109.538 179.138 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 31' ' ' ALA . . . . . 0.433 ' HB2' ' HB ' ' A' ' 28' ' ' VAL . . . -77.57 178.66 7.09 Favored 'General case' 0 N--CA 1.499 2.017 0 O-C-N 121.306 -1.114 . . . . 0.0 110.681 -179.892 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 32' ' ' GLU . . . . . . . . . . . . . 1.2 mp0 -88.5 -56.89 3.12 Favored 'General case' 0 N--CA 1.5 2.027 0 O-C-N 121.348 -0.845 . . . . 0.0 110.422 -179.676 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 2.5 m-20 -116.22 33.64 5.43 Favored 'General case' 0 N--CA 1.494 1.761 0 O-C-N 121.414 -0.804 . . . . 0.0 110.523 -179.855 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 34' ' ' GLY . . . . . . . . . . . . . . . 63.12 44.72 96.79 Favored Glycine 0 N--CA 1.497 2.761 0 N-CA-C 109.842 -1.303 . . . . 0.0 109.842 179.991 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 35' ' ' CYS . . . . . . . . . . . . . 12.9 p -140.99 142.66 34.26 Favored 'General case' 0 N--CA 1.496 1.835 0 O-C-N 121.408 -1.054 . . . . 0.0 110.4 -179.551 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 36' ' ' ILE . . . . . 0.424 HG12 HG13 ' A' ' 28' ' ' VAL . 69.5 mt -78.05 96.42 1.85 Allowed 'Isoleucine or valine' 0 N--CA 1.496 1.86 0 O-C-N 121.416 -0.802 . . . . 0.0 110.059 -179.988 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 37' ' ' SER . . . . . . . . . . . . . 91.5 p -87.92 -176.79 5.6 Favored 'General case' 0 N--CA 1.496 1.833 0 O-C-N 121.407 -0.808 . . . . 0.0 109.766 179.452 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 38' ' ' THR . . . . . 0.547 HG21 ' HG2' ' A' ' 58' ' ' GLN . 7.3 p -55.45 -36.98 67.14 Favored 'General case' 0 N--CA 1.5 2.032 0 O-C-N 121.361 -0.837 . . . . 0.0 110.487 179.819 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 39' ' ' LYS . . . . . . . . . . . . . 4.2 mtmp? -71.23 -44.92 64.41 Favored 'General case' 0 N--CA 1.499 1.983 0 O-C-N 121.416 -0.802 . . . . 0.0 110.583 179.818 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 40' ' ' GLU . . . . . 0.422 ' HG3' HG12 ' A' ' 28' ' ' VAL . 9.9 mm-40 -63.61 -38.61 91.76 Favored 'General case' 0 N--CA 1.501 2.094 0 O-C-N 121.393 -0.817 . . . . 0.0 110.647 -179.811 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 41' ' ' LEU . . . . . 0.861 HD12 HD13 ' A' ' 57' ' ' LEU . 1.8 tm? -66.14 -66.39 0.56 Allowed 'General case' 0 N--CA 1.499 2.0 0 O-C-N 121.297 -0.877 . . . . 0.0 109.346 179.124 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 42' ' ' GLY . . . . . 0.605 ' HA2' ' HB2' ' A' ' 45' ' ' MET . . . -48.03 -33.28 10.08 Favored Glycine 0 N--CA 1.501 3.011 0 N-CA-C 110.873 -0.891 . . . . 0.0 110.873 179.881 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 43' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -52.52 -46.24 66.61 Favored 'General case' 0 N--CA 1.503 2.178 0 O-C-N 121.383 -1.069 . . . . 0.0 110.566 179.54 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 44' ' ' VAL . . . . . 0.462 HG11 HD11 ' B' ' 157' ' ' LEU . 60.4 t -87.99 -21.61 7.02 Favored 'Isoleucine or valine' 0 N--CA 1.499 1.992 0 O-C-N 121.446 -0.784 . . . . 0.0 110.673 179.828 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 45' ' ' MET . . . . . 0.605 ' HB2' ' HA2' ' A' ' 42' ' ' GLY . 0.2 OUTLIER -57.44 -24.91 58.41 Favored 'General case' 0 N--CA 1.502 2.165 0 O-C-N 121.214 -0.929 . . . . 0.0 111.55 -179.957 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' A' A ' 46' ' ' ARG . . . . . 0.527 ' HA ' ' HG3' ' A' ' 50' ' ' GLN . 4.9 mtm180 -50.33 -36.06 30.39 Favored 'General case' 0 N--CA 1.502 2.13 0 O-C-N 121.321 -0.862 . . . . 0.0 111.119 179.989 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 47' ' ' MET . . . . . . . . . . . . . 20.3 mtm -80.15 -30.86 38.99 Favored 'General case' 0 N--CA 1.497 1.899 0 O-C-N 121.359 -0.838 . . . . 0.0 110.889 -179.96 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 48' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -134.47 84.43 2.11 Favored 'General case' 0 N--CA 1.485 1.287 0 O-C-N 121.211 -0.93 . . . . 0.0 110.872 -179.457 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 49' ' ' GLY . . . . . . . . . . . . . . . 81.02 89.95 0.55 Allowed Glycine 0 N--CA 1.495 2.614 0 N-CA-C 109.828 -1.309 . . . . 0.0 109.828 179.722 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 50' ' ' GLN . . . . . 0.527 ' HG3' ' HA ' ' A' ' 46' ' ' ARG . 7.9 mp0 -65.83 152.49 44.29 Favored 'General case' 0 N--CA 1.498 1.953 0 O-C-N 121.525 -0.985 . . . . 0.0 110.661 -179.943 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 51' ' ' ASN . . . . . 0.432 ' HA ' ' HD2' ' A' ' 52' ' ' PRO . 16.3 p-10 -97.41 110.84 56.47 Favored Pre-proline 0 N--CA 1.494 1.76 0 O-C-N 121.535 -0.728 . . . . 0.0 110.125 179.551 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 52' ' ' PRO . . . . . 0.432 ' HD2' ' HA ' ' A' ' 51' ' ' ASN . 41.7 Cg_endo -69.21 -43.33 3.19 Favored 'Trans proline' 0 C--N 1.312 -1.343 0 O-C-N 123.676 1.356 . . . . 0.0 110.832 -179.885 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 53' ' ' THR . . . . . . . . . . . . . 0.6 OUTLIER -126.93 146.78 58.78 Favored Pre-proline 0 N--CA 1.495 1.824 0 O-C-N 121.336 -0.853 . . . . 0.0 110.282 -179.991 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 54' ' ' PRO . . . . . . . . . . . . . 40.9 Cg_endo -67.37 -36.96 18.91 Favored 'Trans proline' 0 N--CA 1.491 1.371 0 O-C-N 123.729 1.384 . . . . 0.0 110.781 179.811 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 55' ' ' GLU . . . . . 0.478 ' HG2' ' N ' ' A' ' 56' ' ' GLU . 3.1 pm0 -64.29 -24.6 67.72 Favored 'General case' 0 N--CA 1.498 1.965 0 O-C-N 121.365 -0.834 . . . . 0.0 110.748 179.432 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 56' ' ' GLU . . . . . 0.478 ' N ' ' HG2' ' A' ' 55' ' ' GLU . 27.0 tt0 -65.35 -25.41 67.57 Favored 'General case' 0 N--CA 1.498 1.951 0 O-C-N 121.174 -0.954 . . . . 0.0 110.401 179.399 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 57' ' ' LEU . . . . . 0.861 HD13 HD12 ' A' ' 41' ' ' LEU . 4.7 mt -94.13 -18.79 21.41 Favored 'General case' 0 N--CA 1.496 1.85 0 O-C-N 121.155 -0.966 . . . . 0.0 110.189 179.362 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 58' ' ' GLN . . . . . 0.547 ' HG2' HG21 ' A' ' 38' ' ' THR . 4.0 mm100 -59.78 -39.84 86.27 Favored 'General case' 0 N--CA 1.499 2.016 0 O-C-N 121.059 -1.026 . . . . 0.0 109.966 179.638 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 59' ' ' GLU . . . . . 0.529 ' O ' ' HB2' ' A' ' 63' ' ' GLU . 0.0 OUTLIER -59.82 -29.39 68.21 Favored 'General case' 0 N--CA 1.5 2.052 0 O-C-N 121.359 -0.838 . . . . 0.0 109.392 178.576 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' A' A ' 60' ' ' MET . . . . . 0.435 ' HB2' ' O ' ' A' ' 57' ' ' LEU . 0.0 OUTLIER -72.87 -20.69 61.05 Favored 'General case' 0 N--CA 1.493 1.716 0 O-C-N 121.586 -0.696 . . . . 0.0 109.596 178.207 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' A' A ' 61' ' ' ILE . . . . . 0.539 HG23 HG23 ' A' ' 72' ' ' VAL . 28.9 mm -85.14 -59.21 2.89 Favored 'Isoleucine or valine' 0 N--CA 1.496 1.874 0 O-C-N 121.514 -0.741 . . . . 0.0 110.468 179.941 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 62' ' ' ASP . . . . . 0.446 ' HA ' ' HB3' ' A' ' 65' ' ' ASP . 25.2 m-20 -60.16 -33.44 72.19 Favored 'General case' 0 N--CA 1.501 2.11 0 O-C-N 121.736 -0.602 . . . . 0.0 112.115 -178.58 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 63' ' ' GLU . . . . . 0.529 ' HB2' ' O ' ' A' ' 59' ' ' GLU . 0.6 OUTLIER -56.35 -42.36 77.63 Favored 'General case' 0 N--CA 1.504 2.266 0 O-C-N 121.169 -0.957 . . . . 0.0 110.939 -179.492 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' A' A ' 64' ' ' VAL . . . . . 0.736 HG11 ' HB3' ' A' ' 80' ' ' MET . 34.5 m -99.79 -18.0 6.49 Favored 'Isoleucine or valine' 0 N--CA 1.501 2.094 0 O-C-N 121.308 -0.87 . . . . 0.0 111.224 179.872 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 65' ' ' ASP . . . . . 0.476 ' HA ' ' CD ' ' A' ' 76' ' ' GLU . 23.6 t70 -68.37 -87.12 0.02 OUTLIER 'General case' 0 N--CA 1.496 1.831 0 O-C-N 121.371 -0.831 . . . . 0.0 110.521 -179.596 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 66' ' ' GLU . . . . . . . . . . . . . 7.6 mm-40 48.51 33.28 3.91 Favored 'General case' 0 N--CA 1.502 2.135 0 O-C-N 121.35 -0.843 . . . . 0.0 111.171 -179.971 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 67' ' ' ASP . . . . . . . . . . . . . 0.7 OUTLIER -116.88 -18.29 10.21 Favored 'General case' 0 N--CA 1.499 1.995 0 O-C-N 121.104 -0.998 . . . . 0.0 111.601 -179.633 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 68' ' ' GLY . . . . . . . . . . . . . . . 123.05 -30.07 5.14 Favored Glycine 0 N--CA 1.498 2.804 0 N-CA-C 110.42 -1.072 . . . . 0.0 110.42 179.782 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 69' ' ' SER . . . . . . . . . . . . . 1.0 OUTLIER -78.93 -35.58 43.08 Favored 'General case' 0 N--CA 1.499 2.001 0 O-C-N 121.23 -1.159 . . . . 0.0 110.891 -179.635 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 70' ' ' GLY . . . . . . . . . . . . . . . 76.39 28.02 60.57 Favored Glycine 0 N--CA 1.498 2.8 0 N-CA-C 110.391 -1.084 . . . . 0.0 110.391 179.951 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 71' ' ' THR . . . . . . . . . . . . . 2.3 m -144.18 140.67 29.48 Favored 'General case' 0 N--CA 1.499 2.008 0 O-C-N 121.24 -1.153 . . . . 0.0 109.45 179.448 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 72' ' ' VAL . . . . . 0.539 HG23 HG23 ' A' ' 61' ' ' ILE . 24.7 t -75.69 124.49 33.82 Favored 'Isoleucine or valine' 0 N--CA 1.497 1.909 0 O-C-N 121.58 -0.7 . . . . 0.0 110.734 -179.586 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 73' ' ' ASP . . . . . . . . . . . . . 1.1 p30 -111.45 -161.38 0.75 Allowed 'General case' 0 N--CA 1.498 1.949 0 O-C-N 121.539 -0.726 . . . . 0.0 110.037 179.258 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 74' ' ' PHE . . . . . . . . . . . . . 16.9 t80 -66.72 -47.99 70.6 Favored 'General case' 0 N--CA 1.5 2.063 0 O-C-N 121.063 -1.023 . . . . 0.0 111.328 -178.91 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 75' ' ' ASP . . . . . 0.469 ' HA ' HD12 ' A' ' 78' ' ' LEU . 0.4 OUTLIER -68.25 -42.65 79.34 Favored 'General case' 0 N--CA 1.496 1.828 0 O-C-N 121.136 -0.978 . . . . 0.0 110.632 -179.621 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' A' A ' 76' ' ' GLU . . . . . 0.476 ' CD ' ' HA ' ' A' ' 65' ' ' ASP . 2.6 mt-10 -64.86 -30.45 71.45 Favored 'General case' 0 N--CA 1.498 1.935 0 O-C-N 121.207 -0.933 . . . . 0.0 109.742 178.767 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 77' ' ' PHE . . . . . 0.537 ' HA ' ' SD ' ' A' ' 80' ' ' MET . 67.4 t80 -58.96 -28.1 65.98 Favored 'General case' 0 N--CA 1.5 2.056 0 O-C-N 121.539 -0.725 . . . . 0.0 109.835 178.575 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 78' ' ' LEU . . . . . 0.469 HD12 ' HA ' ' A' ' 75' ' ' ASP . 20.0 mt -77.31 -35.36 54.98 Favored 'General case' 0 N--CA 1.495 1.797 0 O-C-N 121.352 -0.843 . . . . 0.0 110.257 179.297 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 79' ' ' VAL . . . . . . . . . . . . . 61.8 t -56.67 -57.21 10.21 Favored 'Isoleucine or valine' 0 N--CA 1.502 2.151 0 O-C-N 121.395 -0.816 . . . . 0.0 110.253 179.795 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 80' ' ' MET . . . . . 0.736 ' HB3' HG11 ' A' ' 64' ' ' VAL . 0.0 OUTLIER -57.17 -34.92 68.96 Favored 'General case' 0 N--CA 1.502 2.135 0 O-C-N 121.425 -0.797 . . . . 0.0 110.402 179.626 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' A' A ' 81' ' ' MET . . . . . . . . . . . . . 12.3 mmt -65.58 -43.87 88.44 Favored 'General case' 0 N--CA 1.498 1.967 0 O-C-N 121.365 -0.834 . . . . 0.0 110.063 179.129 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 82' ' ' VAL . . . . . 0.563 HG11 ' CB ' ' A' ' 8' ' ' ALA . 55.0 t -63.96 -34.62 69.58 Favored 'Isoleucine or valine' 0 N--CA 1.503 2.184 0 O-C-N 121.425 -0.797 . . . . 0.0 110.146 179.317 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 83' ' ' ARG . . . . . 0.413 ' HG2' ' CE1' ' A' ' 5' ' ' TYR . 31.7 mtt180 -66.5 -44.39 82.72 Favored 'General case' 0 N--CA 1.497 1.915 0 O-C-N 121.548 -0.72 . . . . 0.0 110.381 179.864 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 84' ' ' CYS . . . . . . . . . . . . . 84.1 m -71.95 -39.31 69.47 Favored 'General case' 0 N--CA 1.498 1.953 0 O-C-N 121.434 -0.791 . . . . 0.0 110.003 179.439 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 85' ' ' MET . . . . . 0.417 ' O ' ' CB ' ' A' ' 86' ' ' LYS . 38.1 ttp -76.19 -13.92 60.17 Favored 'General case' 0 N--CA 1.497 1.925 0 O-C-N 121.502 -0.749 . . . . 0.0 110.797 179.527 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 86' ' ' LYS . . . . . 0.417 ' CB ' ' O ' ' A' ' 85' ' ' MET . 0.2 OUTLIER 71.67 113.07 0.06 Allowed 'General case' 0 N--CA 1.502 2.146 0 O-C-N 121.581 -0.7 . . . . 0.0 110.429 -179.757 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' A' A ' 87' ' ' ASP . . . . . . . . . . . . . 8.4 p-10 -62.22 -34.98 77.53 Favored 'General case' 0 N--CA 1.5 2.036 0 O-C-N 121.554 -0.716 . . . . 0.0 110.814 179.989 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 88' ' ' ASP . . . . . . . . . . . . . 14.5 t70 -71.43 123.53 22.58 Favored 'General case' 0 N--CA 1.495 1.787 0 O-C-N 121.313 -0.867 . . . . 0.0 110.061 179.634 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 89' ' ' SER . . . . . . . . . . . . . 0.5 OUTLIER . . . . . 0 N--CA 1.498 1.944 0 CA-C-O 118.139 -0.934 . . . . 0.0 110.404 179.994 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' B' B ' 144' ' ' ARG . . . . . . . . . . . . . 1.7 ttt85 . . . . . 0 N--CA 1.497 1.921 0 CA-C-O 120.888 0.375 . . . . 0.0 110.068 . . . . . . . . . 0 0 . 1 . 011 nuclear build full ' B' B ' 145' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -71.23 97.36 1.53 Allowed 'General case' 0 N--CA 1.498 1.95 0 O-C-N 121.361 -0.837 . . . . 0.0 110.26 -179.966 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' B' B ' 146' ' ' VAL . . . . . 0.461 ' O ' HG13 ' B' ' 146' ' ' VAL . 9.5 p -110.05 41.51 0.34 Allowed 'Isoleucine or valine' 0 N--CA 1.498 1.928 0 O-C-N 121.465 -0.772 . . . . 0.0 110.715 -179.674 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' B' B ' 147' ' ' ARG . . . . . 0.455 ' NH1' HG13 ' B' ' 146' ' ' VAL . 0.1 OUTLIER -97.5 80.18 2.82 Favored 'General case' 0 N--CA 1.496 1.85 0 O-C-N 121.13 -0.981 . . . . 0.0 109.766 179.394 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' B' B ' 148' ' ' ILE . . . . . . . . . . . . . 1.1 mp -83.39 151.87 3.93 Favored 'Isoleucine or valine' 0 N--CA 1.497 1.889 0 O-C-N 121.565 -0.709 . . . . 0.0 110.407 -179.673 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' B' B ' 149' ' ' SER . . . . . . . . . . . . . 78.9 p -103.85 -177.07 3.26 Favored 'General case' 0 N--CA 1.497 1.9 0 O-C-N 121.367 -0.833 . . . . 0.0 110.449 179.667 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' B' B ' 150' ' ' ALA . . . . . . . . . . . . . . . -88.75 -45.46 9.77 Favored 'General case' 0 N--CA 1.498 1.944 0 O-C-N 121.258 -0.901 . . . . 0.0 110.523 -179.955 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' B' B ' 151' ' ' ASP . . . . . . . . . . . . . 8.0 p-10 -56.8 -41.64 78.1 Favored 'General case' 0 N--CA 1.503 2.188 0 O-C-N 121.537 -0.727 . . . . 0.0 111.076 -179.977 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' B' B ' 152' ' ' ALA . . . . . . . . . . . . . . . -66.35 -43.09 87.05 Favored 'General case' 0 N--CA 1.498 1.94 0 O-C-N 121.293 -0.879 . . . . 0.0 110.286 179.78 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' B' B ' 153' ' ' MET . . . . . . . . . . . . . 7.3 mmt -63.17 -48.32 78.9 Favored 'General case' 0 N--CA 1.496 1.867 0 O-C-N 121.553 -0.717 . . . . 0.0 109.968 179.516 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' B' B ' 154' ' ' MET . . . . . . . . . . . . . 22.9 mmm -59.99 -37.57 80.05 Favored 'General case' 0 N--CA 1.498 1.957 0 O-C-N 121.566 -0.709 . . . . 0.0 110.092 179.309 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' B' B ' 155' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -69.47 -38.91 77.94 Favored 'General case' 0 N--CA 1.499 2.021 0 O-C-N 121.537 -0.727 . . . . 0.0 110.938 179.696 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' B' B ' 156' ' ' ALA . . . . . 0.611 ' HA ' ' HB3' ' B' ' 160' ' ' ALA . . . -75.91 -45.34 35.81 Favored 'General case' 0 N--CA 1.498 1.945 0 O-C-N 121.249 -0.907 . . . . 0.0 110.777 -179.507 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' B' B ' 157' ' ' LEU . . . . . 0.462 HD11 HG11 ' A' ' 44' ' ' VAL . 1.4 mp -60.08 -37.08 78.84 Favored 'General case' 0 N--CA 1.499 2.024 0 O-C-N 121.469 -0.77 . . . . 0.0 111.142 -179.737 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' B' B ' 158' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -131.61 55.09 1.88 Allowed 'General case' 0 N--CA 1.496 1.829 0 O-C-N 121.254 -0.904 . . . . 0.0 110.297 -179.886 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' B' B ' 159' ' ' GLY . . . . . 0.484 ' HA2' ' HG2' ' B' ' 163' ' ' LYS . . . -174.08 -59.03 0.05 OUTLIER Glycine 0 N--CA 1.497 2.766 0 C-N-CA 119.973 -1.108 . . . . 0.0 110.433 -179.982 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' B' B ' 160' ' ' ALA . . . . . 0.611 ' HB3' ' HA ' ' B' ' 156' ' ' ALA . . . -76.45 107.7 8.9 Favored 'General case' 0 N--CA 1.497 1.918 0 O-C-N 121.334 -1.098 . . . . 0.0 110.638 -179.56 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' B' B ' 161' ' ' ARG . . . . . 0.536 ' HA ' ' NH2' ' B' ' 161' ' ' ARG . 0.0 OUTLIER 71.28 -40.91 0.49 Allowed 'General case' 0 N--CA 1.507 2.389 0 O-C-N 121.82 -0.55 . . . . 0.0 112.242 179.826 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' B' B ' 162' ' ' ALA . . . . . . . . . . . . . . . -50.55 -33.03 20.2 Favored 'General case' 0 N--CA 1.504 2.257 0 O-C-N 120.885 -1.134 . . . . 0.0 110.633 179.691 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' B' B ' 163' ' ' LYS . . . . . 0.484 ' HG2' ' HA2' ' B' ' 159' ' ' GLY . 0.0 OUTLIER . . . . . 0 N--CA 1.497 1.911 0 CA-C-O 117.877 -1.059 . . . . 0.0 110.456 178.994 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 90' ' ' ' CA' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 011 nuclear build full ' A' A ' 91' ' ' SXK . . . . . 0.494 ' CAK' HD23 ' A' ' 41' ' ' LEU . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 2.5 tpt . . . . . 0 N--CA 1.495 1.805 0 CA-C-O 120.915 0.388 . . . . 0.0 110.351 . . . . . . . . . 0 0 . 1 . 012 nuclear build full ' A' A ' 2' ' ' ASP . . . . . . . . . . . . . 0.6 OUTLIER -126.44 147.81 49.74 Favored 'General case' 0 N--CA 1.496 1.848 0 O-C-N 121.522 -0.736 . . . . 0.0 110.564 179.933 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 3' ' ' ASP . . . . . . . . . . . . . 7.2 p-10 -127.42 -21.63 3.81 Favored 'General case' 0 N--CA 1.494 1.766 0 O-C-N 121.725 -0.609 . . . . 0.0 111.08 179.756 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 4' ' ' ILE . . . . . . . . . . . . . 2.0 mp -82.92 -57.27 4.7 Favored 'Isoleucine or valine' 0 N--CA 1.501 2.099 0 O-C-N 121.013 -1.054 . . . . 0.0 110.316 -179.873 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 5' ' ' TYR . . . . . . . . . . . . . 0.4 OUTLIER -55.88 -31.5 62.87 Favored 'General case' 0 N--CA 1.502 2.135 0 O-C-N 121.333 -0.854 . . . . 0.0 110.181 179.448 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -58.02 -38.35 76.02 Favored 'General case' 0 N--CA 1.497 1.886 0 O-C-N 121.602 -0.686 . . . . 0.0 110.589 179.408 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 7' ' ' ALA . . . . . . . . . . . . . . . -61.42 -44.16 97.62 Favored 'General case' 0 N--CA 1.499 2.024 0 O-C-N 121.396 -0.815 . . . . 0.0 110.643 179.644 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 8' ' ' ALA . . . . . . . . . . . . . . . -74.73 -12.26 60.37 Favored 'General case' 0 N--CA 1.499 2.018 0 O-C-N 121.302 -0.874 . . . . 0.0 111.371 179.988 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 9' ' ' VAL . . . . . 0.774 HG13 ' HB3' ' A' ' 78' ' ' LEU . 48.1 t -101.58 -52.68 8.23 Favored 'Isoleucine or valine' 0 N--CA 1.498 1.961 0 O-C-N 121.142 -0.974 . . . . 0.0 110.601 -179.684 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 10' ' ' GLU . . . . . . . . . . . . . 21.9 mm-40 -86.77 -18.62 30.65 Favored 'General case' 0 N--CA 1.494 1.765 0 O-C-N 121.303 -0.873 . . . . 0.0 111.163 -179.544 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 11' ' ' GLN . . . . . . . . . . . . . 0.6 OUTLIER -120.27 59.29 0.9 Allowed 'General case' 0 N--CA 1.496 1.86 0 O-C-N 120.974 -1.078 . . . . 0.0 111.088 -179.933 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 12' ' ' LEU . . . . . 0.571 HD13 ' HB3' ' A' ' 16' ' ' GLN . 0.0 OUTLIER -92.99 -73.14 0.57 Allowed 'General case' 0 N--CA 1.501 2.121 0 O-C-N 120.988 -1.07 . . . . 0.0 108.721 178.33 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' A' A ' 13' ' ' THR . . . . . 0.476 ' HB ' ' HB2' ' A' ' 16' ' ' GLN . 1.6 m -152.23 147.53 26.49 Favored 'General case' 0 N--CA 1.498 1.945 0 O-C-N 121.528 -0.732 . . . . 0.0 109.346 179.034 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 14' ' ' GLU . . . . . . . . . . . . . 0.3 OUTLIER -54.07 -46.24 71.95 Favored 'General case' 0 N--CA 1.494 1.728 0 O-C-N 121.714 -0.616 . . . . 0.0 111.013 -179.238 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 7.0 tp10 -76.87 -26.72 54.54 Favored 'General case' 0 N--CA 1.496 1.839 0 O-C-N 121.297 -0.877 . . . . 0.0 111.048 179.96 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 16' ' ' GLN . . . . . 0.571 ' HB3' HD13 ' A' ' 12' ' ' LEU . 2.5 mt-30 -56.23 -42.44 77.3 Favored 'General case' 0 N--CA 1.503 2.191 0 O-C-N 121.156 -0.965 . . . . 0.0 110.711 -179.897 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 17' ' ' LYS . . . . . 0.46 ' NZ ' HD13 ' A' ' 78' ' ' LEU . 6.7 mttm -65.95 -45.7 80.83 Favored 'General case' 0 N--CA 1.496 1.863 0 N-CA-C 109.245 -0.65 . . . . 0.0 109.245 179.145 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 18' ' ' ASN . . . . . . . . . . . . . 61.9 t30 -64.07 -37.28 86.88 Favored 'General case' 0 N--CA 1.497 1.906 0 O-C-N 121.779 -0.576 . . . . 0.0 109.628 178.736 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 5.6 tt0 -67.07 -52.62 39.87 Favored 'General case' 0 N--CA 1.495 1.799 0 O-C-N 121.543 -0.723 . . . . 0.0 109.363 179.108 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 20' ' ' PHE . . . . . . . . . . . . . 4.0 m-85 -58.58 -34.16 70.78 Favored 'General case' 0 N--CA 1.499 2.012 0 O-C-N 121.419 -0.801 . . . . 0.0 109.699 179.121 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 21' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -61.43 -46.51 89.8 Favored 'General case' 0 N--CA 1.498 1.925 0 O-C-N 121.439 -0.788 . . . . 0.0 109.19 178.852 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 22' ' ' ALA . . . . . . . . . . . . . . . -59.77 -47.9 83.82 Favored 'General case' 0 N--CA 1.499 1.978 0 O-C-N 121.387 -0.82 . . . . 0.0 109.532 179.107 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 23' ' ' ALA . . . . . . . . . . . . . . . -61.02 -41.02 95.75 Favored 'General case' 0 N--CA 1.497 1.919 0 O-C-N 121.455 -0.778 . . . . 0.0 109.412 178.563 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 24' ' ' PHE . . . . . 0.413 ' CE2' HD12 ' A' ' 36' ' ' ILE . 37.7 t80 -67.12 -45.98 75.53 Favored 'General case' 0 N--CA 1.497 1.891 0 O-C-N 121.767 -0.583 . . . . 0.0 110.112 179.339 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 25' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER -53.38 -46.38 69.6 Favored 'General case' 0 N--CA 1.5 2.071 0 O-C-N 121.606 -0.684 . . . . 0.0 110.26 179.72 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 26' ' ' ILE . . . . . 0.542 ' HB ' HD21 ' B' ' 157' ' ' LEU . 51.0 mt -72.45 -30.27 34.05 Favored 'Isoleucine or valine' 0 N--CA 1.497 1.909 0 O-C-N 121.465 -0.772 . . . . 0.0 109.68 179.171 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 27' ' ' PHE . . . . . . . . . . . . . 0.8 OUTLIER -63.52 -38.82 92.59 Favored 'General case' 0 N--CA 1.498 1.932 0 O-C-N 121.434 -0.791 . . . . 0.0 110.299 179.363 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 28' ' ' VAL . . . . . . . . . . . . . 34.9 m -93.78 36.68 0.1 Allowed 'Isoleucine or valine' 0 N--CA 1.501 2.11 0 O-C-N 121.265 -0.897 . . . . 0.0 110.811 179.838 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 29' ' ' LEU . . . . . . . . . . . . . 0.9 OUTLIER -70.22 106.45 3.32 Favored 'General case' 0 N--CA 1.499 1.996 0 O-C-N 121.012 -1.055 . . . . 0.0 109.816 179.476 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 30' ' ' GLY . . . . . . . . . . . . . . . 109.9 -30.87 7.97 Favored Glycine 0 N--CA 1.494 2.556 0 N-CA-C 109.352 -1.499 . . . . 0.0 109.352 -179.228 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 31' ' ' ALA . . . . . . . . . . . . . . . -82.85 94.78 7.75 Favored 'General case' 0 N--CA 1.495 1.779 0 O-C-N 121.411 -1.052 . . . . 0.0 109.642 179.549 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 32' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -62.03 -19.52 62.97 Favored 'General case' 0 N--CA 1.503 2.206 0 O-C-N 121.431 -0.793 . . . . 0.0 111.445 -179.627 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 15.7 t70 -54.48 -37.43 65.25 Favored 'General case' 0 N--CA 1.498 1.938 0 O-C-N 121.459 -0.776 . . . . 0.0 110.901 179.931 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 34' ' ' GLY . . . . . . . . . . . . . . . 88.93 24.91 30.91 Favored Glycine 0 N--CA 1.496 2.657 0 N-CA-C 110.148 -1.181 . . . . 0.0 110.148 -179.927 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 35' ' ' CYS . . . . . . . . . . . . . 56.3 m -138.4 167.73 21.26 Favored 'General case' 0 N--CA 1.496 1.848 0 O-C-N 121.231 -1.158 . . . . 0.0 110.656 -179.984 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 36' ' ' ILE . . . . . 0.49 ' O ' HG22 ' A' ' 36' ' ' ILE . 0.5 OUTLIER -102.28 112.58 36.02 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.613 0 CA-C-O 121.44 0.638 . . . . 0.0 109.361 179.596 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' A' A ' 37' ' ' SER . . . . . . . . . . . . . 0.2 OUTLIER -108.57 -173.18 2.21 Favored 'General case' 0 N--CA 1.494 1.728 0 O-C-N 121.413 -0.805 . . . . 0.0 110.628 -179.417 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 38' ' ' THR . . . . . . . . . . . . . 57.2 p -66.21 -42.17 89.12 Favored 'General case' 0 N--CA 1.499 1.99 0 O-C-N 121.486 -0.759 . . . . 0.0 110.911 -179.73 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 39' ' ' LYS . . . . . . . . . . . . . 47.9 mtmt -58.43 -45.57 88.21 Favored 'General case' 0 N--CA 1.502 2.13 0 O-C-N 121.45 -0.781 . . . . 0.0 110.731 -179.87 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 1.1 mp0 -71.86 -27.94 63.21 Favored 'General case' 0 N--CA 1.499 2.005 0 O-C-N 121.551 -0.718 . . . . 0.0 110.522 -179.855 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 41' ' ' LEU . . . . . 0.594 ' HG ' HD13 ' A' ' 57' ' ' LEU . 6.9 tp -72.58 -53.48 11.82 Favored 'General case' 0 N--CA 1.497 1.894 0 O-C-N 121.208 -0.932 . . . . 0.0 110.452 179.72 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 42' ' ' GLY . . . . . . . . . . . . . . . -56.44 -35.89 67.98 Favored Glycine 0 N--CA 1.496 2.666 0 N-CA-C 110.4 -1.08 . . . . 0.0 110.4 -179.406 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 43' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -56.56 -37.16 70.17 Favored 'General case' 0 N--CA 1.5 2.052 0 O-C-N 121.345 -1.091 . . . . 0.0 109.907 179.218 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 44' ' ' VAL . . . . . . . . . . . . . 88.6 t -85.18 -31.8 7.06 Favored 'Isoleucine or valine' 0 N--CA 1.497 1.917 0 O-C-N 121.483 -0.76 . . . . 0.0 109.761 178.837 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 45' ' ' MET . . . . . 0.543 ' HE1' HD13 ' B' ' 148' ' ' ILE . 0.0 OUTLIER -58.52 -53.33 59.5 Favored 'General case' 0 N--CA 1.5 2.034 0 O-C-N 121.398 -0.814 . . . . 0.0 109.96 179.496 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' A' A ' 46' ' ' ARG . . . . . 0.492 ' HA ' ' HB2' ' A' ' 51' ' ' ASN . 1.9 ppt_? -64.25 -28.72 69.93 Favored 'General case' 0 N--CA 1.499 2.011 0 O-C-N 121.377 -0.827 . . . . 0.0 109.938 179.125 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 47' ' ' MET . . . . . . . . . . . . . 13.9 ttp -66.95 -36.22 81.72 Favored 'General case' 0 N--CA 1.495 1.824 0 O-C-N 121.455 -0.778 . . . . 0.0 109.501 178.856 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 48' ' ' LEU . . . . . . . . . . . . . 28.5 mt -75.28 -40.35 58.77 Favored 'General case' 0 N--CA 1.498 1.959 0 O-C-N 121.516 -0.74 . . . . 0.0 110.0 179.151 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 49' ' ' GLY . . . . . . . . . . . . . . . 139.02 -50.81 0.78 Allowed Glycine 0 N--CA 1.495 2.575 0 N-CA-C 109.96 -1.256 . . . . 0.0 109.96 -179.773 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 50' ' ' GLN . . . . . . . . . . . . . 0.6 OUTLIER -84.89 99.69 11.11 Favored 'General case' 0 N--CA 1.498 1.939 0 O-C-N 121.331 -1.1 . . . . 0.0 110.739 -179.662 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 51' ' ' ASN . . . . . 0.492 ' HB2' ' HA ' ' A' ' 46' ' ' ARG . 14.2 t30 -129.69 101.08 18.84 Favored Pre-proline 0 N--CA 1.496 1.856 0 O-C-N 121.473 -0.767 . . . . 0.0 109.992 179.723 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 52' ' ' PRO . . . . . . . . . . . . . 46.1 Cg_endo -73.56 -92.3 0.01 OUTLIER 'Trans proline' 0 C--N 1.314 -1.252 0 O-C-N 123.821 1.432 . . . . 0.0 111.23 -179.569 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 53' ' ' THR . . . . . 0.665 HG22 ' HD2' ' A' ' 54' ' ' PRO . 0.1 OUTLIER -139.54 151.1 65.77 Favored Pre-proline 0 N--CA 1.502 2.164 0 O-C-N 120.918 -1.114 . . . . 0.0 110.432 -179.375 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' A' A ' 54' ' ' PRO . . . . . 0.665 ' HD2' HG22 ' A' ' 53' ' ' THR . 41.8 Cg_endo -69.21 -40.31 6.37 Favored 'Trans proline' 0 N--CA 1.489 1.247 0 O-C-N 123.841 1.443 . . . . 0.0 110.667 179.807 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 55' ' ' GLU . . . . . . . . . . . . . 3.6 mp0 -66.48 -31.14 71.69 Favored 'General case' 0 N--CA 1.496 1.832 0 O-C-N 121.449 -0.782 . . . . 0.0 109.869 179.375 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 16.0 tt0 -63.7 -34.62 78.28 Favored 'General case' 0 N--CA 1.496 1.838 0 O-C-N 121.528 -0.733 . . . . 0.0 110.231 179.291 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 57' ' ' LEU . . . . . 0.594 HD13 ' HG ' ' A' ' 41' ' ' LEU . 56.7 mt -67.25 -25.63 66.17 Favored 'General case' 0 N--CA 1.496 1.853 0 O-C-N 121.186 -0.946 . . . . 0.0 110.273 179.491 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 58' ' ' GLN . . . . . 0.566 ' O ' HG22 ' A' ' 61' ' ' ILE . 0.0 OUTLIER -64.31 -29.77 70.84 Favored 'General case' 0 N--CA 1.498 1.958 0 O-C-N 121.064 -1.022 . . . . 0.0 108.969 178.793 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' A' A ' 59' ' ' GLU . . . . . 0.504 ' N ' ' HG3' ' A' ' 58' ' ' GLN . 17.8 mm-40 -81.28 -32.22 33.29 Favored 'General case' 0 N--CA 1.492 1.632 0 N-CA-C 107.89 -1.152 . . . . 0.0 107.89 177.415 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 60' ' ' MET . . . . . 0.48 ' HE3' HD23 ' A' ' 57' ' ' LEU . 0.3 OUTLIER -68.86 -44.4 73.41 Favored 'General case' 0 N--CA 1.495 1.793 0 O-C-N 121.91 -0.494 . . . . 0.0 109.953 178.799 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' A' A ' 61' ' ' ILE . . . . . 0.566 HG22 ' O ' ' A' ' 58' ' ' GLN . 12.6 tt -62.71 -31.34 51.84 Favored 'Isoleucine or valine' 0 N--CA 1.497 1.915 0 O-C-N 121.493 -0.754 . . . . 0.0 110.201 179.631 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 62' ' ' ASP . . . . . 0.573 ' HA ' ' HB3' ' A' ' 65' ' ' ASP . 17.6 t70 -64.41 -35.47 81.01 Favored 'General case' 0 N--CA 1.499 1.987 0 O-C-N 121.459 -0.776 . . . . 0.0 110.838 179.675 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 63' ' ' GLU . . . . . . . . . . . . . 5.1 tt0 -51.31 -38.51 53.34 Favored 'General case' 0 N--CA 1.503 2.225 0 O-C-N 121.399 -0.813 . . . . 0.0 110.291 179.571 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 64' ' ' VAL . . . . . . . . . . . . . 65.0 t -100.3 -24.67 4.06 Favored 'Isoleucine or valine' 0 N--CA 1.497 1.883 0 O-C-N 121.516 -0.74 . . . . 0.0 109.966 179.015 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 65' ' ' ASP . . . . . 0.573 ' HB3' ' HA ' ' A' ' 62' ' ' ASP . 18.4 t70 -79.57 -93.03 0.04 OUTLIER 'General case' 0 N--CA 1.494 1.728 0 O-C-N 121.529 -0.732 . . . . 0.0 110.58 -179.595 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 66' ' ' GLU . . . . . . . . . . . . . 0.5 OUTLIER 47.05 32.31 1.89 Allowed 'General case' 0 N--CA 1.501 2.12 0 O-C-N 121.389 -0.819 . . . . 0.0 111.073 -179.592 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 67' ' ' ASP . . . . . . . . . . . . . 4.9 p-10 -118.31 1.63 11.85 Favored 'General case' 0 N--CA 1.498 1.926 0 O-C-N 121.135 -0.978 . . . . 0.0 111.695 -179.559 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 68' ' ' GLY . . . . . . . . . . . . . . . 106.13 -41.33 2.2 Favored Glycine 0 N--CA 1.495 2.605 0 N-CA-C 109.908 -1.277 . . . . 0.0 109.908 179.949 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 69' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -60.9 -51.24 70.11 Favored 'General case' 0 N--CA 1.501 2.095 0 O-C-N 121.482 -1.01 . . . . 0.0 110.778 -179.732 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 70' ' ' GLY . . . . . . . . . . . . . . . 100.06 -28.04 17.54 Favored Glycine 0 N--CA 1.498 2.783 0 C-N-CA 120.152 -1.023 . . . . 0.0 110.959 179.535 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 71' ' ' THR . . . . . . . . . . . . . 11.7 t -104.89 159.89 15.44 Favored 'General case' 0 N--CA 1.5 2.025 0 O-C-N 120.997 -1.296 . . . . 0.0 111.389 -179.533 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 72' ' ' VAL . . . . . 0.541 HG23 HG13 ' A' ' 61' ' ' ILE . 2.5 t -94.35 118.44 40.35 Favored 'Isoleucine or valine' 0 N--CA 1.497 1.884 0 O-C-N 121.751 -0.593 . . . . 0.0 110.239 179.922 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 73' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -91.8 -166.76 1.63 Allowed 'General case' 0 N--CA 1.495 1.809 0 O-C-N 121.165 -0.96 . . . . 0.0 110.012 179.519 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 74' ' ' PHE . . . . . . . . . . . . . 77.3 t80 -61.57 -45.23 95.03 Favored 'General case' 0 N--CA 1.499 2.02 0 O-C-N 121.17 -0.956 . . . . 0.0 110.558 179.827 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 75' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -62.88 -46.2 88.96 Favored 'General case' 0 N--CA 1.499 1.989 0 O-C-N 121.432 -0.793 . . . . 0.0 110.536 179.819 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 76' ' ' GLU . . . . . . . . . . . . . 27.3 mt-10 -63.98 -36.97 85.72 Favored 'General case' 0 N--CA 1.501 2.084 0 O-C-N 121.441 -0.787 . . . . 0.0 109.807 179.35 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 77' ' ' PHE . . . . . . . . . . . . . 5.9 t80 -55.67 -43.43 76.35 Favored 'General case' 0 N--CA 1.494 1.772 0 O-C-N 121.759 -0.588 . . . . 0.0 109.818 179.266 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 78' ' ' LEU . . . . . 0.774 ' HB3' HG13 ' A' ' 9' ' ' VAL . 35.0 mt -70.41 -45.05 66.71 Favored 'General case' 0 N--CA 1.497 1.881 0 O-C-N 121.467 -0.771 . . . . 0.0 110.491 179.553 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 79' ' ' VAL . . . . . . . . . . . . . 24.1 t -58.59 -34.13 50.45 Favored 'Isoleucine or valine' 0 N--CA 1.502 2.138 0 O-C-N 121.335 -0.853 . . . . 0.0 109.202 178.968 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 80' ' ' MET . . . . . 0.43 ' CE ' ' HAI' ' A' ' 91' ' ' SXK . 0.8 OUTLIER -73.77 -42.27 61.28 Favored 'General case' 0 N--CA 1.493 1.693 0 O-C-N 121.526 -0.734 . . . . 0.0 109.238 178.489 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' A' A ' 81' ' ' MET . . . . . 0.516 ' HG3' ' CB ' ' B' ' 150' ' ' ALA . 0.0 OUTLIER -55.11 -51.25 67.0 Favored 'General case' 0 N--CA 1.499 2.014 0 O-C-N 121.76 -0.588 . . . . 0.0 110.559 179.576 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' A' A ' 82' ' ' VAL . . . . . 0.439 HG21 ' CG2' ' A' ' 9' ' ' VAL . 33.7 m -65.99 -29.07 45.68 Favored 'Isoleucine or valine' 0 N--CA 1.502 2.156 0 O-C-N 121.453 -0.779 . . . . 0.0 110.671 179.931 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 83' ' ' ARG . . . . . . . . . . . . . 2.1 mtt180 -64.95 -43.0 94.15 Favored 'General case' 0 N--CA 1.496 1.827 0 O-C-N 121.255 -0.903 . . . . 0.0 109.395 179.237 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 84' ' ' CYS . . . . . . . . . . . . . 0.0 OUTLIER -72.05 -42.63 66.05 Favored 'General case' 0 N--CA 1.495 1.777 0 O-C-N 121.549 -0.719 . . . . 0.0 110.123 179.17 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 85' ' ' MET . . . . . . . . . . . . . 70.7 mtm -74.01 -6.82 49.72 Favored 'General case' 0 N--CA 1.499 2.019 0 O-C-N 121.473 -0.767 . . . . 0.0 111.225 179.834 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 86' ' ' LYS . . . . . . . . . . . . . 47.9 mmtm 58.69 65.61 1.21 Allowed 'General case' 0 N--CA 1.501 2.079 0 O-C-N 121.377 -0.827 . . . . 0.0 110.84 -179.978 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 87' ' ' ASP . . . . . 0.447 ' O ' ' CB ' ' A' ' 88' ' ' ASP . 5.0 m-20 -93.74 -166.2 1.46 Allowed 'General case' 0 N--CA 1.496 1.836 0 O-C-N 121.558 -0.714 . . . . 0.0 110.104 179.595 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 88' ' ' ASP . . . . . 0.447 ' CB ' ' O ' ' A' ' 87' ' ' ASP . 0.4 OUTLIER 72.34 -60.99 0.51 Allowed 'General case' 0 N--CA 1.506 2.344 0 O-C-N 121.653 -0.654 . . . . 0.0 110.995 179.959 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' A' A ' 89' ' ' SER . . . . . . . . . . . . . 0.6 OUTLIER . . . . . 0 N--CA 1.497 1.896 0 CA-C-O 118.205 -0.902 . . . . 0.0 110.428 -179.962 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' B' B ' 144' ' ' ARG . . . . . . . . . . . . . 0.6 OUTLIER . . . . . 0 N--CA 1.497 1.882 0 CA-C-O 120.901 0.382 . . . . 0.0 110.122 . . . . . . . . . 1 1 . 1 . 012 nuclear build full ' B' B ' 145' ' ' ARG . . . . . 0.445 ' O ' HG13 ' B' ' 146' ' ' VAL . 0.7 OUTLIER -112.42 -63.22 1.46 Allowed 'General case' 0 N--CA 1.495 1.808 0 O-C-N 121.386 -0.821 . . . . 0.0 109.489 179.357 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' B' B ' 146' ' ' VAL . . . . . 0.655 ' HB ' ' HAF' ' A' ' 91' ' ' SXK . 0.0 OUTLIER -155.91 -81.64 0.0 OUTLIER 'Isoleucine or valine' 0 N--CA 1.502 2.156 0 O-C-N 121.628 -0.67 . . . . 0.0 109.355 179.225 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' B' B ' 147' ' ' ARG . . . . . . . . . . . . . 28.8 mtt-85 43.13 50.57 5.59 Favored 'General case' 0 N--CA 1.504 2.246 0 O-C-N 121.55 -0.719 . . . . 0.0 112.183 178.864 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' B' B ' 148' ' ' ILE . . . . . 0.543 HD13 ' HE1' ' A' ' 45' ' ' MET . 1.1 mp -81.81 124.26 38.86 Favored 'Isoleucine or valine' 0 N--CA 1.497 1.911 0 O-C-N 121.011 -1.056 . . . . 0.0 109.766 179.371 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' B' B ' 149' ' ' SER . . . . . . . . . . . . . 6.8 t -88.31 171.43 10.17 Favored 'General case' 0 N--CA 1.496 1.874 0 O-C-N 121.43 -0.794 . . . . 0.0 111.246 -179.417 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' B' B ' 150' ' ' ALA . . . . . 0.516 ' CB ' ' HG3' ' A' ' 81' ' ' MET . . . -61.54 -51.67 67.64 Favored 'General case' 0 N--CA 1.497 1.901 0 O-C-N 121.73 -0.606 . . . . 0.0 110.509 179.732 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' B' B ' 151' ' ' ASP . . . . . . . . . . . . . 6.8 p-10 -61.57 -31.92 71.98 Favored 'General case' 0 N--CA 1.499 2.018 0 O-C-N 121.627 -0.671 . . . . 0.0 110.717 179.685 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' B' B ' 152' ' ' ALA . . . . . . . . . . . . . . . -70.16 -46.52 64.5 Favored 'General case' 0 N--CA 1.497 1.902 0 O-C-N 121.21 -0.931 . . . . 0.0 110.545 179.987 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' B' B ' 153' ' ' MET . . . . . 0.404 ' SD ' HG21 ' B' ' 148' ' ' ILE . 1.5 tpt -75.2 -37.65 61.08 Favored 'General case' 0 N--CA 1.498 1.947 0 O-C-N 121.287 -0.883 . . . . 0.0 110.848 -179.99 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' B' B ' 154' ' ' MET . . . . . . . . . . . . . 2.7 ttp -70.6 -50.54 36.05 Favored 'General case' 0 N--CA 1.498 1.938 0 O-C-N 121.302 -0.874 . . . . 0.0 110.918 -179.652 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' B' B ' 155' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -64.39 -35.77 81.98 Favored 'General case' 0 N--CA 1.5 2.052 0 O-C-N 121.273 -0.892 . . . . 0.0 110.801 -179.752 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' B' B ' 156' ' ' ALA . . . . . 0.694 ' HA ' ' HB3' ' B' ' 160' ' ' ALA . . . -59.31 -46.91 87.3 Favored 'General case' 0 N--CA 1.498 1.933 0 O-C-N 121.303 -0.873 . . . . 0.0 110.112 179.604 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' B' B ' 157' ' ' LEU . . . . . 0.542 HD21 ' HB ' ' A' ' 26' ' ' ILE . 14.8 tp -61.22 -53.79 52.38 Favored 'General case' 0 N--CA 1.496 1.859 0 O-C-N 121.586 -0.696 . . . . 0.0 110.4 179.653 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' B' B ' 158' ' ' LEU . . . . . . . . . . . . . 1.6 mt -104.54 94.27 5.23 Favored 'General case' 0 N--CA 1.495 1.79 0 O-C-N 121.451 -0.781 . . . . 0.0 109.792 179.624 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' B' B ' 159' ' ' GLY . . . . . . . . . . . . . . . 137.99 -58.11 0.63 Allowed Glycine 0 N--CA 1.494 2.567 0 N-CA-C 109.422 -1.471 . . . . 0.0 109.422 -179.631 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' B' B ' 160' ' ' ALA . . . . . 0.694 ' HB3' ' HA ' ' B' ' 156' ' ' ALA . . . -88.35 -16.27 33.44 Favored 'General case' 0 N--CA 1.498 1.969 0 O-C-N 121.471 -1.017 . . . . 0.0 110.892 179.841 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' B' B ' 161' ' ' ARG . . . . . . . . . . . . . 2.8 mmp_? -125.19 -65.39 1.02 Allowed 'General case' 0 N--CA 1.497 1.922 0 O-C-N 121.15 -0.969 . . . . 0.0 110.71 -179.86 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' B' B ' 162' ' ' ALA . . . . . . . . . . . . . . . -115.57 164.57 14.12 Favored 'General case' 0 N--CA 1.497 1.884 0 O-C-N 121.329 -0.857 . . . . 0.0 110.374 179.994 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' B' B ' 163' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.495 1.777 0 CA-C-O 118.2 -0.905 . . . . 0.0 110.018 179.953 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 90' ' ' ' CA' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 012 nuclear build full ' A' A ' 91' ' ' SXK . . . . . 0.655 ' HAF' ' HB ' ' B' ' 146' ' ' VAL . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.496 1.84 0 CA-C-O 120.932 0.396 . . . . 0.0 110.352 . . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 2' ' ' ASP . . . . . . . . . . . . . 15.0 t70 -107.79 -63.4 1.32 Allowed 'General case' 0 N--CA 1.495 1.788 0 O-C-N 121.448 -0.783 . . . . 0.0 110.624 -179.916 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 3' ' ' ASP . . . . . 0.594 ' HB3' ' CB ' ' A' ' 6' ' ' LYS . 3.8 t0 -152.6 140.72 20.34 Favored 'General case' 0 N--CA 1.494 1.752 0 O-C-N 121.283 -0.886 . . . . 0.0 111.45 -178.942 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 4' ' ' ILE . . . . . . . . . . . . . 7.8 mt -94.56 -37.3 7.8 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.72 0 N-CA-C 108.975 -0.75 . . . . 0.0 108.975 178.479 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 5' ' ' TYR . . . . . 0.411 ' HB3' HG13 ' A' ' 82' ' ' VAL . 47.8 m-85 -73.56 -30.61 63.16 Favored 'General case' 0 N--CA 1.496 1.853 0 O-C-N 121.644 -0.66 . . . . 0.0 109.92 179.124 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 6' ' ' LYS . . . . . 0.594 ' CB ' ' HB3' ' A' ' 3' ' ' ASP . 0.3 OUTLIER -56.67 -34.24 67.18 Favored 'General case' 0 N--CA 1.498 1.939 0 O-C-N 121.613 -0.679 . . . . 0.0 109.855 179.041 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' A' A ' 7' ' ' ALA . . . . . . . . . . . . . . . -61.76 -43.05 99.61 Favored 'General case' 0 N--CA 1.496 1.859 0 O-C-N 121.519 -0.738 . . . . 0.0 109.965 179.187 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 8' ' ' ALA . . . . . . . . . . . . . . . -60.66 -34.01 73.67 Favored 'General case' 0 N--CA 1.501 2.081 0 O-C-N 121.438 -0.789 . . . . 0.0 110.829 179.521 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 9' ' ' VAL . . . . . 0.641 HG13 ' HB3' ' A' ' 78' ' ' LEU . 72.9 t -58.73 -43.84 88.73 Favored 'Isoleucine or valine' 0 N--CA 1.501 2.09 0 O-C-N 121.437 -0.79 . . . . 0.0 111.064 -179.92 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 10' ' ' GLU . . . . . . . . . . . . . 12.0 mm-40 -89.76 -1.9 58.11 Favored 'General case' 0 N--CA 1.496 1.842 0 O-C-N 121.257 -0.902 . . . . 0.0 111.166 -179.949 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 11' ' ' GLN . . . . . . . . . . . . . 4.1 mt-30 -99.63 -22.76 15.29 Favored 'General case' 0 N--CA 1.496 1.839 0 O-C-N 121.086 -1.009 . . . . 0.0 110.978 179.78 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 12' ' ' LEU . . . . . 0.556 ' C ' HD12 ' A' ' 12' ' ' LEU . 4.6 pp -67.2 171.9 5.28 Favored 'General case' 0 N--CA 1.505 2.287 0 O-C-N 121.069 -1.019 . . . . 0.0 110.998 -179.811 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 13' ' ' THR . . . . . . . . . . . . . 76.4 p -92.84 159.97 15.14 Favored 'General case' 0 N--CA 1.501 2.092 0 O-C-N 121.332 -0.855 . . . . 0.0 110.854 -179.572 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 14' ' ' GLU . . . . . . . . . . . . . 0.8 OUTLIER -56.77 -28.76 61.78 Favored 'General case' 0 N--CA 1.493 1.716 0 O-C-N 121.643 -0.661 . . . . 0.0 110.653 -179.967 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 1.3 mp0 -60.6 -41.33 94.53 Favored 'General case' 0 N--CA 1.498 1.973 0 O-C-N 121.439 -0.788 . . . . 0.0 110.167 179.419 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 16' ' ' GLN . . . . . 0.471 ' HG2' ' HB2' ' A' ' 12' ' ' LEU . 0.0 OUTLIER -80.24 -33.59 37.85 Favored 'General case' 0 N--CA 1.491 1.591 0 O-C-N 121.423 -0.798 . . . . 0.0 110.087 179.539 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' A' A ' 17' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -70.78 -40.11 72.79 Favored 'General case' 0 N--CA 1.498 1.961 0 O-C-N 121.552 -0.718 . . . . 0.0 110.054 179.305 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 18' ' ' ASN . . . . . . . . . . . . . 3.9 t30 -61.24 -34.6 75.41 Favored 'General case' 0 N--CA 1.497 1.878 0 O-C-N 121.513 -0.742 . . . . 0.0 109.995 179.331 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -62.98 -49.2 75.62 Favored 'General case' 0 N--CA 1.498 1.966 0 O-C-N 121.497 -0.752 . . . . 0.0 109.809 179.295 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 20' ' ' PHE . . . . . . . . . . . . . 12.9 m-85 -64.55 -34.64 78.71 Favored 'General case' 0 N--CA 1.5 2.055 0 O-C-N 121.419 -0.8 . . . . 0.0 110.005 179.098 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 21' ' ' LYS . . . . . . . . . . . . . 1.6 tptp -55.23 -47.35 75.48 Favored 'General case' 0 N--CA 1.498 1.956 0 O-C-N 121.566 -0.709 . . . . 0.0 110.201 179.591 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 22' ' ' ALA . . . . . . . . . . . . . . . -56.07 -44.87 79.33 Favored 'General case' 0 N--CA 1.499 1.996 0 O-C-N 121.598 -0.689 . . . . 0.0 110.082 179.575 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 23' ' ' ALA . . . . . 0.449 ' HA ' HD12 ' A' ' 26' ' ' ILE . . . -66.99 -35.89 80.95 Favored 'General case' 0 N--CA 1.497 1.887 0 O-C-N 121.353 -0.842 . . . . 0.0 109.66 178.726 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 24' ' ' PHE . . . . . 0.422 ' HE1' HD12 ' A' ' 36' ' ' ILE . 76.9 t80 -65.69 -37.85 87.62 Favored 'General case' 0 N--CA 1.497 1.917 0 O-C-N 121.582 -0.699 . . . . 0.0 110.223 179.309 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 25' ' ' ASP . . . . . . . . . . . . . 51.5 m-20 -56.18 -39.72 72.82 Favored 'General case' 0 N--CA 1.501 2.083 0 O-C-N 121.549 -0.719 . . . . 0.0 110.733 179.903 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 26' ' ' ILE . . . . . 0.752 ' HA ' HD12 ' A' ' 29' ' ' LEU . 6.7 mt -71.02 -31.68 45.87 Favored 'Isoleucine or valine' 0 N--CA 1.499 1.986 0 O-C-N 121.174 -0.954 . . . . 0.0 109.846 179.379 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 27' ' ' PHE . . . . . 0.59 ' HB3' HD11 ' A' ' 36' ' ' ILE . 0.2 OUTLIER -71.09 -39.68 71.97 Favored 'General case' 0 N--CA 1.496 1.846 0 O-C-N 121.359 -0.838 . . . . 0.0 110.291 179.522 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' A' A ' 28' ' ' VAL . . . . . 0.465 HG12 HG13 ' A' ' 36' ' ' ILE . 23.5 m -87.99 9.07 2.27 Favored 'Isoleucine or valine' 0 N--CA 1.501 2.086 0 O-C-N 121.365 -0.834 . . . . 0.0 111.281 179.862 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 29' ' ' LEU . . . . . 0.752 HD12 ' HA ' ' A' ' 26' ' ' ILE . 0.7 OUTLIER -61.08 105.82 0.53 Allowed 'General case' 0 N--CA 1.497 1.907 0 O-C-N 121.022 -1.049 . . . . 0.0 110.058 -179.936 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' A' A ' 30' ' ' GLY . . . . . . . . . . . . . . . 96.09 16.62 37.58 Favored Glycine 0 N--CA 1.495 2.623 0 N-CA-C 110.366 -1.094 . . . . 0.0 110.366 -179.577 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 31' ' ' ALA . . . . . . . . . . . . . . . -125.17 87.8 2.77 Favored 'General case' 0 N--CA 1.493 1.719 0 O-C-N 121.024 -1.28 . . . . 0.0 109.959 179.768 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 32' ' ' GLU . . . . . . . . . . . . . 4.0 mt-10 53.46 -91.69 0.03 OUTLIER 'General case' 0 N--CA 1.502 2.153 0 O-C-N 122.001 -0.437 . . . . 0.0 111.19 -179.899 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 7.5 p-10 -143.36 -40.51 0.31 Allowed 'General case' 0 N--CA 1.498 1.96 0 O-C-N 121.132 -0.98 . . . . 0.0 111.277 -179.679 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 34' ' ' GLY . . . . . . . . . . . . . . . -164.26 56.24 0.27 Allowed Glycine 0 N--CA 1.497 2.728 0 N-CA-C 110.104 -1.198 . . . . 0.0 110.104 -179.585 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 35' ' ' CYS . . . . . . . . . . . . . 25.8 p -132.92 149.52 52.24 Favored 'General case' 0 N--CA 1.499 1.99 0 O-C-N 121.456 -1.026 . . . . 0.0 110.359 179.659 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 36' ' ' ILE . . . . . 0.59 HD11 ' HB3' ' A' ' 27' ' ' PHE . 31.0 mt -123.85 130.35 73.97 Favored 'Isoleucine or valine' 0 N--CA 1.497 1.888 0 O-C-N 121.369 -0.832 . . . . 0.0 110.618 -179.826 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 37' ' ' SER . . . . . . . . . . . . . 1.7 t -122.51 -176.49 3.39 Favored 'General case' 0 N--CA 1.496 1.871 0 O-C-N 121.64 -0.662 . . . . 0.0 109.877 179.307 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 38' ' ' THR . . . . . 0.557 ' HB ' ' HA ' ' A' ' 54' ' ' PRO . 54.7 p -65.12 -36.45 84.31 Favored 'General case' 0 N--CA 1.503 2.216 0 O-C-N 121.329 -0.857 . . . . 0.0 110.617 179.891 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 39' ' ' LYS . . . . . . . . . . . . . 7.1 mttm -66.73 -44.47 81.46 Favored 'General case' 0 N--CA 1.498 1.95 0 O-C-N 121.39 -0.818 . . . . 0.0 110.476 179.761 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 1.2 mp0 -71.81 -23.3 61.53 Favored 'General case' 0 N--CA 1.497 1.916 0 O-C-N 121.494 -0.754 . . . . 0.0 110.935 -179.864 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 41' ' ' LEU . . . . . 0.809 HD21 HD22 ' A' ' 57' ' ' LEU . 5.4 tp -63.2 -47.51 82.26 Favored 'General case' 0 N--CA 1.498 1.944 0 O-C-N 121.079 -1.013 . . . . 0.0 110.157 179.774 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 42' ' ' GLY . . . . . 0.495 ' HA2' ' HB2' ' A' ' 45' ' ' MET . . . -55.94 -28.81 54.06 Favored Glycine 0 N--CA 1.495 2.614 0 N-CA-C 110.478 -1.049 . . . . 0.0 110.478 -179.951 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 43' ' ' LYS . . . . . . . . . . . . . 13.5 ttmt -50.99 -47.89 61.42 Favored 'General case' 0 N--CA 1.501 2.079 0 O-C-N 121.374 -1.074 . . . . 0.0 109.984 179.039 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 44' ' ' VAL . . . . . 0.415 HG22 HD21 ' B' ' 157' ' ' LEU . 38.1 t -80.5 -29.14 11.93 Favored 'Isoleucine or valine' 0 N--CA 1.498 1.954 0 O-C-N 121.557 -0.714 . . . . 0.0 110.03 179.053 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 45' ' ' MET . . . . . 0.539 ' HE2' HD11 ' A' ' 41' ' ' LEU . 5.1 mmt -57.09 -40.63 77.34 Favored 'General case' 0 N--CA 1.501 2.093 0 O-C-N 121.345 -0.847 . . . . 0.0 110.268 179.654 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 46' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -59.32 -40.61 86.84 Favored 'General case' 0 N--CA 1.501 2.109 0 O-C-N 121.411 -0.805 . . . . 0.0 110.224 179.383 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 47' ' ' MET . . . . . . . . . . . . . 0.2 OUTLIER -59.76 -43.09 94.48 Favored 'General case' 0 N--CA 1.499 1.981 0 O-C-N 121.493 -0.755 . . . . 0.0 110.185 179.552 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 48' ' ' LEU . . . . . . . . . . . . . 83.9 mt -78.21 -37.49 45.33 Favored 'General case' 0 N--CA 1.498 1.931 0 O-C-N 121.443 -0.785 . . . . 0.0 109.875 179.153 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 49' ' ' GLY . . . . . . . . . . . . . . . 115.92 50.56 0.43 Allowed Glycine 0 N--CA 1.495 2.629 0 N-CA-C 109.582 -1.407 . . . . 0.0 109.582 179.792 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 50' ' ' GLN . . . . . . . . . . . . . 25.1 mt-30 -132.6 145.59 51.22 Favored 'General case' 0 N--CA 1.497 1.923 0 O-C-N 121.408 -1.054 . . . . 0.0 110.111 -179.829 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 51' ' ' ASN . . . . . . . . . . . . . 1.2 t30 -132.36 62.56 63.86 Favored Pre-proline 0 N--CA 1.497 1.919 0 O-C-N 121.273 -0.892 . . . . 0.0 110.959 -179.887 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 52' ' ' PRO . . . . . 0.714 ' HG2' HD11 ' A' ' 57' ' ' LEU . 51.3 Cg_endo -78.16 157.43 30.06 Favored 'Trans proline' 0 C--N 1.314 -1.255 0 O-C-N 123.656 1.345 . . . . 0.0 110.624 179.569 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 53' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -85.14 153.82 59.92 Favored Pre-proline 0 N--CA 1.499 1.98 0 O-C-N 121.235 -0.916 . . . . 0.0 110.191 179.728 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 54' ' ' PRO . . . . . 0.557 ' HA ' ' HB ' ' A' ' 38' ' ' THR . 39.9 Cg_endo -66.15 -47.44 3.43 Favored 'Trans proline' 0 C--N 1.313 -1.303 0 O-C-N 123.686 1.361 . . . . 0.0 110.623 -179.693 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 55' ' ' GLU . . . . . . . . . . . . . 1.3 tt0 -61.45 -30.49 70.62 Favored 'General case' 0 N--CA 1.498 1.95 0 O-C-N 121.307 -0.87 . . . . 0.0 109.834 178.917 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 1.7 tm-20 -73.6 -45.8 50.96 Favored 'General case' 0 N--CA 1.495 1.781 0 O-C-N 121.461 -0.774 . . . . 0.0 110.029 179.252 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 57' ' ' LEU . . . . . 0.809 HD22 HD21 ' A' ' 41' ' ' LEU . 15.6 mt -69.63 -18.16 63.57 Favored 'General case' 0 N--CA 1.497 1.898 0 O-C-N 121.246 -0.908 . . . . 0.0 110.813 179.736 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 58' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -52.68 -51.23 61.16 Favored 'General case' 0 N--CA 1.497 1.921 0 O-C-N 121.084 -1.01 . . . . 0.0 110.538 179.723 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 59' ' ' GLU . . . . . . . . . . . . . 6.8 mm-40 -56.86 -32.23 65.61 Favored 'General case' 0 N--CA 1.499 1.987 0 O-C-N 121.603 -0.686 . . . . 0.0 110.138 179.386 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 60' ' ' MET . . . . . . . . . . . . . 11.5 tpp -59.14 -38.56 79.97 Favored 'General case' 0 N--CA 1.497 1.894 0 O-C-N 121.386 -0.821 . . . . 0.0 109.685 178.863 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 61' ' ' ILE . . . . . 0.449 HG12 ' CG2' ' A' ' 72' ' ' VAL . 15.9 mt -70.73 -41.65 77.59 Favored 'Isoleucine or valine' 0 N--CA 1.497 1.885 0 O-C-N 121.433 -0.792 . . . . 0.0 109.353 178.862 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 62' ' ' ASP . . . . . 0.53 ' HA ' ' HB3' ' A' ' 65' ' ' ASP . 17.8 m-20 -54.84 -32.37 60.51 Favored 'General case' 0 N--CA 1.5 2.036 0 O-C-N 121.596 -0.69 . . . . 0.0 110.719 179.522 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 63' ' ' GLU . . . . . . . . . . . . . 1.4 tm-20 -50.27 -43.35 53.28 Favored 'General case' 0 N--CA 1.5 2.072 0 O-C-N 121.641 -0.662 . . . . 0.0 110.878 179.914 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 64' ' ' VAL . . . . . . . . . . . . . 27.2 m -113.08 0.2 9.08 Favored 'Isoleucine or valine' 0 N--CA 1.501 2.092 0 O-C-N 121.265 -0.897 . . . . 0.0 111.219 179.631 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 65' ' ' ASP . . . . . 0.53 ' HB3' ' HA ' ' A' ' 62' ' ' ASP . 19.7 t70 -86.32 -95.18 0.08 Allowed 'General case' 0 N--CA 1.498 1.949 0 O-C-N 121.211 -0.931 . . . . 0.0 110.37 179.927 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 66' ' ' GLU . . . . . . . . . . . . . 2.3 tp10 50.89 35.21 11.86 Favored 'General case' 0 N--CA 1.502 2.161 0 O-C-N 121.214 -0.929 . . . . 0.0 111.253 -179.759 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 67' ' ' ASP . . . . . . . . . . . . . 3.8 p-10 -117.2 -5.45 11.35 Favored 'General case' 0 N--CA 1.501 2.084 0 O-C-N 121.1 -1.0 . . . . 0.0 111.673 -179.946 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 68' ' ' GLY . . . . . . . . . . . . . . . 109.66 -26.46 14.37 Favored Glycine 0 N--CA 1.496 2.64 0 N-CA-C 110.239 -1.145 . . . . 0.0 110.239 179.822 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 69' ' ' SER . . . . . . . . . . . . . 0.5 OUTLIER -79.68 -41.22 27.29 Favored 'General case' 0 N--CA 1.498 1.955 0 O-C-N 121.227 -1.161 . . . . 0.0 110.731 -179.769 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 70' ' ' GLY . . . . . . . . . . . . . . . 74.0 26.57 68.51 Favored Glycine 0 N--CA 1.497 2.756 0 N-CA-C 109.643 -1.383 . . . . 0.0 109.643 -179.578 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 71' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -140.11 148.29 41.49 Favored 'General case' 0 N--CA 1.497 1.879 0 O-C-N 121.527 -0.984 . . . . 0.0 109.193 179.931 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 72' ' ' VAL . . . . . 0.542 ' HB ' ' HB ' ' A' ' 36' ' ' ILE . 59.4 t -75.34 114.78 15.83 Favored 'Isoleucine or valine' 0 N--CA 1.498 1.957 0 O-C-N 121.367 -0.833 . . . . 0.0 110.539 -179.553 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 73' ' ' ASP . . . . . . . . . . . . . 4.6 m-20 -86.23 -166.32 1.51 Allowed 'General case' 0 N--CA 1.498 1.973 0 O-C-N 121.331 -0.856 . . . . 0.0 109.242 179.263 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 74' ' ' PHE . . . . . . . . . . . . . 53.4 t80 -74.25 -58.38 3.33 Favored 'General case' 0 N--CA 1.498 1.964 0 O-C-N 120.841 -1.162 . . . . 0.0 109.714 179.328 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 75' ' ' ASP . . . . . 0.804 ' HA ' HD12 ' A' ' 78' ' ' LEU . 0.4 OUTLIER -63.84 -33.82 76.54 Favored 'General case' 0 N--CA 1.496 1.864 0 O-C-N 121.452 -0.78 . . . . 0.0 110.162 179.552 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' A' A ' 76' ' ' GLU . . . . . . . . . . . . . 6.1 tt0 -62.16 -38.67 89.93 Favored 'General case' 0 N--CA 1.497 1.893 0 O-C-N 121.23 -0.918 . . . . 0.0 108.884 178.507 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 77' ' ' PHE . . . . . . . . . . . . . 65.2 t80 -62.72 -38.63 91.22 Favored 'General case' 0 N--CA 1.494 1.753 0 O-C-N 121.69 -0.631 . . . . 0.0 109.355 178.347 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 78' ' ' LEU . . . . . 0.804 HD12 ' HA ' ' A' ' 75' ' ' ASP . 14.3 mt -60.86 -36.59 79.54 Favored 'General case' 0 N--CA 1.498 1.967 0 O-C-N 121.475 -0.765 . . . . 0.0 110.049 178.899 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 79' ' ' VAL . . . . . 0.564 HG22 HG21 ' A' ' 9' ' ' VAL . 45.0 t -62.67 -43.56 98.7 Favored 'Isoleucine or valine' 0 N--CA 1.501 2.099 0 O-C-N 121.43 -0.794 . . . . 0.0 109.067 179.205 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 80' ' ' MET . . . . . . . . . . . . . 13.6 ttm -65.58 -36.11 82.79 Favored 'General case' 0 N--CA 1.494 1.753 0 O-C-N 121.542 -0.724 . . . . 0.0 109.355 178.593 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 81' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -58.43 -53.11 61.98 Favored 'General case' 0 N--CA 1.497 1.899 0 O-C-N 121.531 -0.731 . . . . 0.0 110.115 179.403 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 82' ' ' VAL . . . . . 0.523 HG23 ' HE3' ' A' ' 85' ' ' MET . 14.2 p -69.88 -26.51 30.37 Favored 'Isoleucine or valine' 0 N--CA 1.499 2.002 0 O-C-N 121.242 -0.911 . . . . 0.0 110.289 179.213 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 83' ' ' ARG . . . . . 0.519 ' HD2' HG12 ' A' ' 79' ' ' VAL . 27.2 mtt-85 -69.41 -45.18 69.82 Favored 'General case' 0 N--CA 1.498 1.967 0 O-C-N 121.282 -0.886 . . . . 0.0 110.111 179.387 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 84' ' ' CYS . . . . . 0.495 ' HB3' ' HA ' ' B' ' 149' ' ' SER . 86.3 m -98.69 27.08 5.09 Favored 'General case' 0 N--CA 1.498 1.928 0 O-C-N 121.392 -0.818 . . . . 0.0 110.584 179.593 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 85' ' ' MET . . . . . 0.523 ' HE3' HG23 ' A' ' 82' ' ' VAL . 0.0 OUTLIER -76.75 -25.69 53.74 Favored 'General case' 0 N--CA 1.498 1.939 0 O-C-N 121.252 -0.905 . . . . 0.0 110.59 179.646 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' A' A ' 86' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER 59.72 37.48 22.18 Favored 'General case' 0 N--CA 1.502 2.144 0 O-C-N 121.583 -0.698 . . . . 0.0 111.038 179.778 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 87' ' ' ASP . . . . . . . . . . . . . 17.9 t70 -89.97 139.47 30.57 Favored 'General case' 0 N--CA 1.496 1.863 0 O-C-N 121.296 -0.878 . . . . 0.0 110.149 179.677 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 88' ' ' ASP . . . . . . . . . . . . . 11.4 m-20 -109.7 74.23 0.88 Allowed 'General case' 0 N--CA 1.497 1.908 0 O-C-N 121.408 -0.807 . . . . 0.0 110.489 -179.55 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 89' ' ' SER . . . . . . . . . . . . . 28.0 m . . . . . 0 N--CA 1.498 1.951 0 O-C-N 121.171 -0.956 . . . . 0.0 110.337 179.663 . . . . . . . . 0 0 . 1 . 013 nuclear build full ' B' B ' 144' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.497 1.885 0 CA-C-O 120.946 0.403 . . . . 0.0 110.228 . . . . . . . . . 1 1 . 1 . 013 nuclear build full ' B' B ' 145' ' ' ARG . . . . . 0.443 ' NH2' ' HA ' ' B' ' 145' ' ' ARG . 0.2 OUTLIER -142.16 -61.78 0.45 Allowed 'General case' 0 N--CA 1.497 1.878 0 O-C-N 121.404 -0.81 . . . . 0.0 110.623 -179.798 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' B' B ' 146' ' ' VAL . . . . . . . . . . . . . 4.8 t 52.6 44.45 0.37 Allowed 'Isoleucine or valine' 0 N--CA 1.503 2.21 0 CA-C-O 121.378 0.609 . . . . 0.0 110.799 179.922 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' B' B ' 147' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -130.2 121.07 25.52 Favored 'General case' 0 N--CA 1.495 1.81 0 O-C-N 121.184 -0.947 . . . . 0.0 109.977 179.664 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' B' B ' 148' ' ' ILE . . . . . . . . . . . . . 0.9 OUTLIER -133.36 138.59 50.9 Favored 'Isoleucine or valine' 0 N--CA 1.496 1.871 0 O-C-N 121.271 -0.893 . . . . 0.0 110.772 -179.342 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' B' B ' 149' ' ' SER . . . . . 0.495 ' HA ' ' HB3' ' A' ' 84' ' ' CYS . 86.3 p -105.9 169.3 8.56 Favored 'General case' 0 N--CA 1.496 1.86 0 O-C-N 121.581 -0.699 . . . . 0.0 110.096 179.434 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' B' B ' 150' ' ' ALA . . . . . . . . . . . . . . . -74.65 -42.3 58.77 Favored 'General case' 0 N--CA 1.497 1.907 0 O-C-N 121.302 -0.874 . . . . 0.0 110.871 -179.731 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' B' B ' 151' ' ' ASP . . . . . . . . . . . . . 31.2 t70 -61.39 -52.62 63.86 Favored 'General case' 0 N--CA 1.498 1.97 0 O-C-N 121.462 -0.773 . . . . 0.0 110.882 -179.732 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' B' B ' 152' ' ' ALA . . . . . . . . . . . . . . . -52.33 -45.22 65.56 Favored 'General case' 0 N--CA 1.504 2.232 0 O-C-N 121.3 -0.875 . . . . 0.0 111.047 -179.918 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' B' B ' 153' ' ' MET . . . . . . . . . . . . . 1.3 ttt -73.16 -44.05 60.59 Favored 'General case' 0 N--CA 1.499 1.985 0 O-C-N 121.281 -0.887 . . . . 0.0 110.655 179.984 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' B' B ' 154' ' ' MET . . . . . 0.575 ' HG3' HD12 ' B' ' 158' ' ' LEU . 0.0 OUTLIER -59.4 -37.97 79.36 Favored 'General case' 0 N--CA 1.501 2.113 0 O-C-N 121.467 -0.771 . . . . 0.0 110.457 179.792 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' B' B ' 155' ' ' GLN . . . . . . . . . . . . . 47.5 mt-30 -67.11 -38.4 85.57 Favored 'General case' 0 N--CA 1.499 1.998 0 O-C-N 121.539 -0.726 . . . . 0.0 110.908 179.859 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' B' B ' 156' ' ' ALA . . . . . . . . . . . . . . . -79.03 -34.39 43.94 Favored 'General case' 0 N--CA 1.498 1.951 0 O-C-N 121.321 -0.862 . . . . 0.0 110.971 -179.713 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' B' B ' 157' ' ' LEU . . . . . 0.452 HD22 ' HB ' ' A' ' 26' ' ' ILE . 17.6 mt -75.27 -42.03 55.88 Favored 'General case' 0 N--CA 1.499 1.978 0 O-C-N 121.244 -0.91 . . . . 0.0 111.211 -179.497 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' B' B ' 158' ' ' LEU . . . . . 0.575 HD12 ' HG3' ' B' ' 154' ' ' MET . 95.9 mt -93.24 165.9 12.58 Favored 'General case' 0 N--CA 1.499 2.005 0 O-C-N 121.137 -0.977 . . . . 0.0 110.941 -179.366 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' B' B ' 159' ' ' GLY . . . . . . . . . . . . . . . 100.79 -58.61 0.69 Allowed Glycine 0 N--CA 1.496 2.645 0 N-CA-C 109.749 -1.341 . . . . 0.0 109.749 179.894 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' B' B ' 160' ' ' ALA . . . . . . . . . . . . . . . -110.69 -48.84 3.1 Favored 'General case' 0 N--CA 1.498 1.965 0 O-C-N 121.473 -1.016 . . . . 0.0 110.875 -179.694 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' B' B ' 161' ' ' ARG . . . . . 0.569 ' HD3' HG12 ' A' ' 26' ' ' ILE . 0.0 OUTLIER -70.5 -42.9 70.71 Favored 'General case' 0 N--CA 1.5 2.042 0 O-C-N 121.24 -0.913 . . . . 0.0 110.474 -179.953 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' B' B ' 162' ' ' ALA . . . . . 0.738 ' HB3' HD11 ' A' ' 26' ' ' ILE . . . -144.07 -174.64 4.33 Favored 'General case' 0 N--CA 1.498 1.957 0 O-C-N 121.453 -0.779 . . . . 0.0 110.433 -179.936 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' B' B ' 163' ' ' LYS . . . . . 0.405 ' OXT' HD22 ' B' ' 158' ' ' LEU . 6.6 mtmt . . . . . 0 N--CA 1.498 1.951 0 CA-C-O 117.833 -1.08 . . . . 0.0 110.092 179.517 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 90' ' ' ' CA' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 013 nuclear build full ' A' A ' 91' ' ' SXK . . . . . 0.536 ' CAK' HD13 ' A' ' 41' ' ' LEU . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.496 1.87 0 CA-C-O 121.269 0.557 . . . . 0.0 109.928 . . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 2' ' ' ASP . . . . . . . . . . . . . 8.0 m-20 -134.52 -152.08 0.46 Allowed 'General case' 0 N--CA 1.494 1.77 0 O-C-N 121.396 -0.815 . . . . 0.0 109.942 -179.45 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 3' ' ' ASP . . . . . 0.436 ' HB3' ' HE3' ' A' ' 6' ' ' LYS . 30.3 m-20 55.08 31.98 17.34 Favored 'General case' 0 N--CA 1.503 2.205 0 O-C-N 121.562 -0.711 . . . . 0.0 111.436 179.379 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 4' ' ' ILE . . . . . . . . . . . . . 4.9 mt -68.61 -54.35 21.7 Favored 'Isoleucine or valine' 0 N--CA 1.499 1.988 0 O-C-N 121.229 -0.919 . . . . 0.0 110.589 -179.797 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 5' ' ' TYR . . . . . . . . . . . . . 1.6 m-85 -63.93 -29.78 70.92 Favored 'General case' 0 N--CA 1.502 2.142 0 O-C-N 121.26 -0.9 . . . . 0.0 110.703 179.691 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 6' ' ' LYS . . . . . 0.436 ' HE3' ' HB3' ' A' ' 3' ' ' ASP . 27.7 ttpt -65.11 -36.86 85.63 Favored 'General case' 0 N--CA 1.497 1.907 0 O-C-N 121.24 -0.913 . . . . 0.0 110.057 179.182 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 7' ' ' ALA . . . . . . . . . . . . . . . -58.13 -38.66 76.96 Favored 'General case' 0 N--CA 1.497 1.882 0 O-C-N 121.6 -0.688 . . . . 0.0 110.13 179.505 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 8' ' ' ALA . . . . . . . . . . . . . . . -66.42 -44.03 84.07 Favored 'General case' 0 N--CA 1.497 1.906 0 O-C-N 121.507 -0.746 . . . . 0.0 110.182 179.454 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 9' ' ' VAL . . . . . . . . . . . . . 19.6 t -64.89 -44.01 96.25 Favored 'Isoleucine or valine' 0 N--CA 1.5 2.051 0 O-C-N 121.352 -0.843 . . . . 0.0 110.015 179.362 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 10' ' ' GLU . . . . . . . . . . . . . 31.1 mm-40 -74.09 -19.66 60.52 Favored 'General case' 0 N--CA 1.496 1.849 0 O-C-N 121.346 -0.846 . . . . 0.0 110.356 179.42 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 11' ' ' GLN . . . . . . . . . . . . . 0.2 OUTLIER -58.98 -49.38 78.12 Favored 'General case' 0 N--CA 1.498 1.947 0 O-C-N 121.412 -0.805 . . . . 0.0 109.906 179.425 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 12' ' ' LEU . . . . . 0.711 HD11 ' HG3' ' A' ' 17' ' ' LYS . 0.9 OUTLIER -72.18 134.45 45.69 Favored 'General case' 0 N--CA 1.495 1.812 0 O-C-N 121.314 -0.866 . . . . 0.0 109.003 178.953 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' A' A ' 13' ' ' THR . . . . . 0.477 HG23 ' HB2' ' A' ' 15' ' ' GLU . 13.3 t -60.76 166.16 3.5 Favored 'General case' 0 N--CA 1.501 2.116 0 O-C-N 121.277 -0.889 . . . . 0.0 112.12 -178.009 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 14' ' ' GLU . . . . . 0.558 ' HA ' ' HD3' ' A' ' 17' ' ' LYS . 4.5 tp10 -61.51 -26.21 67.77 Favored 'General case' 0 N--CA 1.493 1.695 0 CA-C-N 116.213 -0.449 . . . . 0.0 110.921 -179.538 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 15' ' ' GLU . . . . . 0.477 ' HB2' HG23 ' A' ' 13' ' ' THR . 1.4 mp0 -57.54 -44.06 84.86 Favored 'General case' 0 N--CA 1.498 1.973 0 O-C-N 121.279 -0.888 . . . . 0.0 109.068 179.049 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 16' ' ' GLN . . . . . 0.494 ' HB2' HD12 ' A' ' 12' ' ' LEU . 44.1 mt-30 -68.82 -38.46 79.88 Favored 'General case' 0 N--CA 1.497 1.889 0 CA-C-O 121.743 0.782 . . . . 0.0 109.033 178.168 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 17' ' ' LYS . . . . . 0.711 ' HG3' HD11 ' A' ' 12' ' ' LEU . 0.0 OUTLIER -61.84 -29.54 70.24 Favored 'General case' 0 N--CA 1.497 1.898 0 N-CA-C 109.608 -0.516 . . . . 0.0 109.608 178.734 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' A' A ' 18' ' ' ASN . . . . . . . . . . . . . 4.6 t-20 -59.45 -43.34 93.19 Favored 'General case' 0 N--CA 1.499 1.976 0 O-C-N 121.592 -0.693 . . . . 0.0 110.154 179.357 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 19' ' ' GLU . . . . . 0.596 ' HB3' ' HE2' ' B' ' 154' ' ' MET . 1.2 mp0 -56.82 -41.86 78.56 Favored 'General case' 0 N--CA 1.497 1.911 0 O-C-N 121.381 -0.825 . . . . 0.0 109.499 179.138 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 20' ' ' PHE . . . . . . . . . . . . . 14.9 m-85 -70.19 -37.4 75.11 Favored 'General case' 0 N--CA 1.494 1.757 0 O-C-N 121.445 -0.784 . . . . 0.0 109.32 178.413 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 21' ' ' LYS . . . . . 0.553 ' HG3' ' N ' ' A' ' 22' ' ' ALA . 0.0 OUTLIER -63.82 -31.7 72.97 Favored 'General case' 0 N--CA 1.495 1.806 0 O-C-N 121.489 -0.757 . . . . 0.0 109.188 178.677 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' A' A ' 22' ' ' ALA . . . . . 0.553 ' N ' ' HG3' ' A' ' 21' ' ' LYS . . . -69.13 -43.58 74.1 Favored 'General case' 0 N--CA 1.495 1.778 0 O-C-N 121.402 -0.811 . . . . 0.0 109.007 178.154 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 23' ' ' ALA . . . . . . . . . . . . . . . -68.84 -43.45 75.45 Favored 'General case' 0 N--CA 1.497 1.885 0 O-C-N 121.558 -0.714 . . . . 0.0 109.369 178.672 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 24' ' ' PHE . . . . . . . . . . . . . 20.1 t80 -60.53 -37.63 81.82 Favored 'General case' 0 N--CA 1.497 1.876 0 O-C-N 121.64 -0.662 . . . . 0.0 109.851 179.027 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 25' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -54.1 -45.59 71.86 Favored 'General case' 0 N--CA 1.5 2.038 0 O-C-N 121.675 -0.641 . . . . 0.0 110.769 179.547 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 26' ' ' ILE . . . . . 0.498 HG22 ' NH1' ' B' ' 161' ' ' ARG . 2.3 mt -87.07 -9.84 11.07 Favored 'Isoleucine or valine' 0 N--CA 1.499 2.01 0 O-C-N 121.304 -0.872 . . . . 0.0 110.485 179.844 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 27' ' ' PHE . . . . . 0.56 ' CE1' HD22 ' A' ' 41' ' ' LEU . 0.1 OUTLIER -73.83 -32.24 63.59 Favored 'General case' 0 N--CA 1.496 1.857 0 O-C-N 121.145 -0.972 . . . . 0.0 109.994 179.386 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' A' A ' 28' ' ' VAL . . . . . . . . . . . . . 15.7 m -100.23 48.56 0.12 Allowed 'Isoleucine or valine' 0 N--CA 1.499 1.989 0 O-C-N 121.52 -0.738 . . . . 0.0 110.246 179.55 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 29' ' ' LEU . . . . . . . . . . . . . 7.0 mt -67.1 -48.51 67.94 Favored 'General case' 0 N--CA 1.5 2.069 0 O-C-N 121.287 -0.883 . . . . 0.0 109.911 179.653 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 30' ' ' GLY . . . . . . . . . . . . . . . -109.24 28.63 10.69 Favored Glycine 0 N--CA 1.495 2.578 0 N-CA-C 109.392 -1.483 . . . . 0.0 109.392 179.117 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 31' ' ' ALA . . . . . . . . . . . . . . . -103.65 90.79 3.77 Favored 'General case' 0 N--CA 1.493 1.723 0 O-C-N 121.308 -1.113 . . . . 0.0 110.053 179.953 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 32' ' ' GLU . . . . . . . . . . . . . 3.3 mp0 -81.86 3.33 26.53 Favored 'General case' 0 N--CA 1.498 1.958 0 O-C-N 121.313 -0.867 . . . . 0.0 111.013 -179.991 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 5.9 p-10 -78.74 -25.95 44.6 Favored 'General case' 0 N--CA 1.497 1.888 0 O-C-N 121.217 -0.927 . . . . 0.0 110.862 179.585 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 34' ' ' GLY . . . . . . . . . . . . . . . 124.83 -22.77 6.37 Favored Glycine 0 N--CA 1.498 2.789 0 C-N-CA 120.058 -1.067 . . . . 0.0 110.804 179.493 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 35' ' ' CYS . . . . . 0.49 ' HB3' ' HA ' ' A' ' 73' ' ' ASP . 0.1 OUTLIER -140.92 -168.59 2.63 Favored 'General case' 0 N--CA 1.498 1.931 0 O-C-N 121.028 -1.278 . . . . 0.0 110.426 -179.706 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' A' A ' 36' ' ' ILE . . . . . 0.573 ' O ' HG22 ' A' ' 71' ' ' THR . 38.2 mt -75.87 122.49 29.98 Favored 'Isoleucine or valine' 0 N--CA 1.497 1.922 0 O-C-N 121.115 -0.99 . . . . 0.0 110.537 -179.478 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 37' ' ' SER . . . . . . . . . . . . . 41.6 t -92.5 159.84 15.33 Favored 'General case' 0 N--CA 1.495 1.787 0 O-C-N 121.58 -0.7 . . . . 0.0 110.041 179.516 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 38' ' ' THR . . . . . 0.567 HG21 ' HA ' ' A' ' 58' ' ' GLN . 11.4 p -63.2 -37.21 86.32 Favored 'General case' 0 N--CA 1.501 2.106 0 O-C-N 121.337 -0.852 . . . . 0.0 110.556 179.954 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 39' ' ' LYS . . . . . . . . . . . . . 2.4 tttp -59.35 -42.79 92.35 Favored 'General case' 0 N--CA 1.498 1.969 0 O-C-N 121.357 -0.839 . . . . 0.0 109.903 179.322 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 1.6 mm-40 -69.1 -42.88 75.52 Favored 'General case' 0 N--CA 1.497 1.913 0 O-C-N 121.525 -0.735 . . . . 0.0 109.92 179.28 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 41' ' ' LEU . . . . . 0.813 HD21 ' HAK' ' A' ' 91' ' ' SXK . 0.1 OUTLIER -60.34 -63.94 1.13 Allowed 'General case' 0 N--CA 1.499 1.997 0 O-C-N 121.655 -0.653 . . . . 0.0 110.23 179.647 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' A' A ' 42' ' ' GLY . . . . . . . . . . . . . . . -48.02 -42.11 22.72 Favored Glycine 0 N--CA 1.502 3.098 0 N-CA-C 110.098 -1.201 . . . . 0.0 110.098 179.655 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 43' ' ' LYS . . . . . . . . . . . . . 66.3 tttt -62.93 -38.05 89.49 Favored 'General case' 0 N--CA 1.501 2.103 0 O-C-N 121.301 -1.117 . . . . 0.0 110.356 179.184 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 44' ' ' VAL . . . . . . . . . . . . . 5.3 t -66.91 -26.62 37.33 Favored 'Isoleucine or valine' 0 N--CA 1.502 2.127 0 O-C-N 121.469 -0.769 . . . . 0.0 110.752 179.589 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 45' ' ' MET . . . . . 0.451 ' HE1' HG12 ' B' ' 148' ' ' ILE . 4.9 mmt -58.79 -29.52 66.9 Favored 'General case' 0 N--CA 1.503 2.222 0 O-C-N 121.192 -0.942 . . . . 0.0 111.455 -179.82 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 46' ' ' ARG . . . . . . . . . . . . . 18.0 ttp180 -56.01 -38.24 70.24 Favored 'General case' 0 N--CA 1.503 2.181 0 O-C-N 121.212 -0.93 . . . . 0.0 110.931 -179.91 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 47' ' ' MET . . . . . . . . . . . . . 14.5 ttp -89.13 4.76 47.41 Favored 'General case' 0 N--CA 1.501 2.087 0 O-C-N 121.27 -0.894 . . . . 0.0 111.148 179.716 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 48' ' ' LEU . . . . . . . . . . . . . 11.9 tp -117.14 -53.73 2.45 Favored 'General case' 0 N--CA 1.494 1.768 0 O-C-N 120.978 -1.076 . . . . 0.0 110.33 -179.824 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 49' ' ' GLY . . . . . 0.461 ' O ' ' HB2' ' A' ' 50' ' ' GLN . . . 170.51 119.4 0.5 Allowed Glycine 0 N--CA 1.493 2.466 0 N-CA-C 109.69 -1.364 . . . . 0.0 109.69 -179.976 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 50' ' ' GLN . . . . . 0.461 ' HB2' ' O ' ' A' ' 49' ' ' GLY . 64.3 mt-30 60.29 -177.7 0.1 Allowed 'General case' 0 N--CA 1.505 2.292 0 O-C-N 121.913 -0.757 . . . . 0.0 111.251 -179.97 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 51' ' ' ASN . . . . . . . . . . . . . 8.7 t-20 -159.35 105.37 1.51 Allowed Pre-proline 0 N--CA 1.496 1.858 0 O-C-N 121.231 -0.918 . . . . 0.0 110.274 -179.769 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 52' ' ' PRO . . . . . 0.71 ' HG2' HD11 ' A' ' 57' ' ' LEU . 52.6 Cg_endo -78.57 165.8 24.63 Favored 'Trans proline' 0 C--N 1.314 -1.252 0 O-C-N 123.819 1.431 . . . . 0.0 110.287 179.98 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 53' ' ' THR . . . . . 0.554 ' HB ' ' HD2' ' A' ' 54' ' ' PRO . 41.5 p -73.76 166.78 41.2 Favored Pre-proline 0 N--CA 1.5 2.042 0 O-C-N 121.103 -0.998 . . . . 0.0 110.448 179.938 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 54' ' ' PRO . . . . . 0.554 ' HD2' ' HB ' ' A' ' 53' ' ' THR . 39.6 Cg_endo -65.52 -40.87 16.8 Favored 'Trans proline' 0 N--CA 1.493 1.452 0 O-C-N 123.707 1.372 . . . . 0.0 111.051 -179.78 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 55' ' ' GLU . . . . . . . . . . . . . 27.3 mm-40 -69.43 -30.3 68.2 Favored 'General case' 0 N--CA 1.496 1.846 0 O-C-N 121.393 -0.817 . . . . 0.0 110.075 179.41 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 1.4 tt0 -54.86 -50.45 68.65 Favored 'General case' 0 N--CA 1.498 1.957 0 O-C-N 121.455 -0.778 . . . . 0.0 110.248 179.643 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 57' ' ' LEU . . . . . 0.71 HD11 ' HG2' ' A' ' 52' ' ' PRO . 1.2 mt -77.58 -22.66 50.6 Favored 'General case' 0 N--CA 1.495 1.796 0 O-C-N 121.36 -0.838 . . . . 0.0 110.825 179.754 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 58' ' ' GLN . . . . . 0.567 ' HA ' HG21 ' A' ' 38' ' ' THR . 0.0 OUTLIER -60.61 -34.62 74.5 Favored 'General case' 0 N--CA 1.499 2.008 0 O-C-N 120.978 -1.076 . . . . 0.0 109.297 179.289 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' A' A ' 59' ' ' GLU . . . . . 0.552 ' N ' ' HG3' ' A' ' 58' ' ' GLN . 12.9 mm-40 -79.77 -33.76 40.36 Favored 'General case' 0 N--CA 1.493 1.695 0 O-C-N 121.289 -0.882 . . . . 0.0 108.697 177.91 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 60' ' ' MET . . . . . . . . . . . . . 16.3 ttm -67.91 -41.42 82.69 Favored 'General case' 0 N--CA 1.495 1.808 0 O-C-N 121.714 -0.616 . . . . 0.0 109.836 178.681 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 61' ' ' ILE . . . . . 0.673 HG13 HG23 ' A' ' 72' ' ' VAL . 3.2 tt -68.04 -36.96 77.39 Favored 'Isoleucine or valine' 0 N--CA 1.495 1.824 0 O-C-N 121.561 -0.712 . . . . 0.0 109.839 179.53 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 62' ' ' ASP . . . . . 0.44 ' HA ' ' HB2' ' A' ' 65' ' ' ASP . 0.4 OUTLIER -68.68 -32.34 72.1 Favored 'General case' 0 N--CA 1.498 1.934 0 O-C-N 121.374 -0.829 . . . . 0.0 110.233 179.009 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' A' A ' 63' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER -59.88 -44.27 94.3 Favored 'General case' 0 N--CA 1.498 1.962 0 O-C-N 121.363 -0.836 . . . . 0.0 110.16 179.534 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 64' ' ' VAL . . . . . 0.567 HG11 ' SD ' ' A' ' 80' ' ' MET . 11.9 p -103.86 24.32 1.83 Allowed 'Isoleucine or valine' 0 N--CA 1.496 1.846 0 O-C-N 121.432 -0.793 . . . . 0.0 110.768 179.839 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 65' ' ' ASP . . . . . 0.44 ' HB2' ' HA ' ' A' ' 62' ' ' ASP . 2.7 t70 -84.41 153.62 23.3 Favored 'General case' 0 N--CA 1.495 1.803 0 O-C-N 120.971 -1.081 . . . . 0.0 110.256 179.756 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 66' ' ' GLU . . . . . . . . . . . . . 32.4 mt-10 -121.11 11.15 10.86 Favored 'General case' 0 N--CA 1.495 1.787 0 O-C-N 121.423 -0.798 . . . . 0.0 111.828 -179.263 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 67' ' ' ASP . . . . . . . . . . . . . 1.1 p30 -146.84 0.51 0.75 Allowed 'General case' 0 N--CA 1.502 2.16 0 O-C-N 120.753 -1.217 . . . . 0.0 113.205 -179.692 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 68' ' ' GLY . . . . . . . . . . . . . . . 89.02 -24.63 12.29 Favored Glycine 0 N--CA 1.497 2.702 0 O-C-N 120.576 -1.328 . . . . 0.0 111.1 179.14 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 69' ' ' SER . . . . . . . . . . . . . 4.2 p -54.45 -29.75 50.66 Favored 'General case' 0 N--CA 1.503 2.181 0 O-C-N 121.107 -1.231 . . . . 0.0 110.403 179.943 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 70' ' ' GLY . . . . . . . . . . . . . . . 71.32 41.89 58.16 Favored Glycine 0 N--CA 1.497 2.712 0 N-CA-C 109.419 -1.472 . . . . 0.0 109.419 -179.761 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 71' ' ' THR . . . . . 0.573 HG22 ' O ' ' A' ' 36' ' ' ILE . 0.2 OUTLIER -142.67 139.04 31.04 Favored 'General case' 0 N--CA 1.498 1.932 0 O-C-N 121.513 -0.992 . . . . 0.0 109.017 179.85 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' A' A ' 72' ' ' VAL . . . . . 0.673 HG23 HG13 ' A' ' 61' ' ' ILE . 38.5 t -75.41 111.44 11.71 Favored 'Isoleucine or valine' 0 N--CA 1.499 1.991 0 O-C-N 121.337 -0.852 . . . . 0.0 111.178 -178.899 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 73' ' ' ASP . . . . . 0.49 ' HA ' ' HB3' ' A' ' 35' ' ' CYS . 8.6 m-20 -87.53 -173.01 4.15 Favored 'General case' 0 N--CA 1.494 1.728 0 O-C-N 121.711 -0.618 . . . . 0.0 109.405 178.941 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 74' ' ' PHE . . . . . . . . . . . . . 87.2 t80 -61.95 -48.47 80.26 Favored 'General case' 0 N--CA 1.5 2.054 0 O-C-N 121.071 -1.018 . . . . 0.0 110.237 179.804 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 75' ' ' ASP . . . . . . . . . . . . . 0.1 OUTLIER -69.36 -45.11 70.15 Favored 'General case' 0 N--CA 1.496 1.852 0 O-C-N 121.457 -0.777 . . . . 0.0 110.355 179.786 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 76' ' ' GLU . . . . . . . . . . . . . 3.2 mt-10 -59.6 -34.73 73.12 Favored 'General case' 0 N--CA 1.499 1.998 0 O-C-N 121.433 -0.792 . . . . 0.0 110.073 179.38 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 77' ' ' PHE . . . . . . . . . . . . . 48.2 t80 -62.25 -43.96 97.63 Favored 'General case' 0 N--CA 1.496 1.86 0 O-C-N 121.48 -0.763 . . . . 0.0 109.644 178.866 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 78' ' ' LEU . . . . . . . . . . . . . 67.5 mt -66.39 -40.94 89.96 Favored 'General case' 0 N--CA 1.499 1.986 0 O-C-N 121.516 -0.74 . . . . 0.0 109.742 179.11 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 79' ' ' VAL . . . . . . . . . . . . . 5.2 t -62.98 -35.0 69.58 Favored 'Isoleucine or valine' 0 N--CA 1.501 2.082 0 O-C-N 121.502 -0.749 . . . . 0.0 110.11 179.355 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 80' ' ' MET . . . . . 0.567 ' SD ' HG11 ' A' ' 64' ' ' VAL . 0.0 OUTLIER -73.58 -31.85 63.82 Favored 'General case' 0 N--CA 1.497 1.891 0 O-C-N 121.308 -0.87 . . . . 0.0 110.341 179.647 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' A' A ' 81' ' ' MET . . . . . . . . . . . . . 12.0 mmt -63.54 -50.5 69.32 Favored 'General case' 0 N--CA 1.498 1.965 0 O-C-N 121.419 -0.801 . . . . 0.0 110.465 179.857 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 82' ' ' VAL . . . . . . . . . . . . . 10.9 p -66.87 -29.14 45.33 Favored 'Isoleucine or valine' 0 N--CA 1.498 1.953 0 O-C-N 121.368 -0.833 . . . . 0.0 110.29 179.606 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 83' ' ' ARG . . . . . . . . . . . . . 3.0 mtt85 -56.92 -41.16 77.68 Favored 'General case' 0 N--CA 1.501 2.103 0 O-C-N 121.307 -0.87 . . . . 0.0 109.777 178.99 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 84' ' ' CYS . . . . . . . . . . . . . 84.4 m -85.45 -33.9 21.78 Favored 'General case' 0 N--CA 1.497 1.893 0 O-C-N 121.477 -0.764 . . . . 0.0 109.584 178.857 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 85' ' ' MET . . . . . . . . . . . . . 36.2 ttp -88.7 83.95 6.72 Favored 'General case' 0 N--CA 1.496 1.864 0 O-C-N 121.46 -0.775 . . . . 0.0 109.88 179.403 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 86' ' ' LYS . . . . . . . . . . . . . 1.6 mttt -110.28 137.1 48.46 Favored 'General case' 0 N--CA 1.499 1.994 0 O-C-N 121.23 -0.919 . . . . 0.0 110.89 -179.695 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 87' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -109.88 55.27 0.64 Allowed 'General case' 0 N--CA 1.497 1.888 0 O-C-N 121.51 -0.744 . . . . 0.0 109.786 179.125 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 88' ' ' ASP . . . . . . . . . . . . . 2.2 m-20 -78.63 125.67 29.68 Favored 'General case' 0 N--CA 1.498 1.957 0 O-C-N 121.217 -0.927 . . . . 0.0 110.647 -179.45 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 89' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER . . . . . 0 N--CA 1.498 1.932 0 CA-C-O 118.126 -0.94 . . . . 0.0 110.272 179.858 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' B' B ' 144' ' ' ARG . . . . . . . . . . . . . 17.9 ptt180 . . . . . 0 N--CA 1.498 1.941 0 CA-C-O 121.193 0.521 . . . . 0.0 110.527 . . . . . . . . . 0 0 . 1 . 014 nuclear build full ' B' B ' 145' ' ' ARG . . . . . . . . . . . . . 27.4 mtt85 51.01 50.88 18.23 Favored 'General case' 0 N--CA 1.504 2.245 0 O-C-N 121.364 -0.835 . . . . 0.0 110.698 -179.917 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' B' B ' 146' ' ' VAL . . . . . 0.515 HG13 ' CD1' ' B' ' 148' ' ' ILE . 9.9 p -114.98 149.43 17.2 Favored 'Isoleucine or valine' 0 N--CA 1.498 1.954 0 O-C-N 121.194 -0.941 . . . . 0.0 110.607 -179.698 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' B' B ' 147' ' ' ARG . . . . . 0.436 ' C ' HD12 ' B' ' 148' ' ' ILE . 3.9 mtm180 -111.88 119.61 39.15 Favored 'General case' 0 N--CA 1.498 1.961 0 O-C-N 121.242 -0.911 . . . . 0.0 110.917 -179.675 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' B' B ' 148' ' ' ILE . . . . . 0.515 ' CD1' HG13 ' B' ' 146' ' ' VAL . 2.2 mp -116.83 -43.45 3.26 Favored 'Isoleucine or valine' 0 N--CA 1.498 1.968 0 O-C-N 121.521 -0.737 . . . . 0.0 110.131 179.571 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' B' B ' 149' ' ' SER . . . . . . . . . . . . . 8.8 t 59.69 -160.21 0.29 Allowed 'General case' 0 N--CA 1.502 2.159 0 O-C-N 121.519 -0.738 . . . . 0.0 110.766 179.899 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' B' B ' 150' ' ' ALA . . . . . . . . . . . . . . . -111.36 -43.64 3.67 Favored 'General case' 0 N--CA 1.496 1.84 0 O-C-N 121.259 -0.9 . . . . 0.0 110.403 -179.974 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' B' B ' 151' ' ' ASP . . . . . . . . . . . . . 8.0 p-10 -58.09 -42.87 86.57 Favored 'General case' 0 N--CA 1.499 1.993 0 O-C-N 121.541 -0.725 . . . . 0.0 111.287 -179.771 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' B' B ' 152' ' ' ALA . . . . . 0.446 ' HB3' ' O ' ' B' ' 148' ' ' ILE . . . -58.49 -50.02 75.25 Favored 'General case' 0 N--CA 1.499 2.009 0 O-C-N 121.149 -0.969 . . . . 0.0 110.239 179.8 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' B' B ' 153' ' ' MET . . . . . . . . . . . . . 1.5 ttt -68.33 -36.58 79.49 Favored 'General case' 0 N--CA 1.497 1.905 0 O-C-N 121.431 -0.793 . . . . 0.0 109.908 179.233 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' B' B ' 154' ' ' MET . . . . . 0.596 ' HE2' ' HB3' ' A' ' 19' ' ' GLU . 4.1 mtt -61.5 -47.83 83.83 Favored 'General case' 0 N--CA 1.497 1.912 0 O-C-N 121.501 -0.75 . . . . 0.0 110.063 179.523 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' B' B ' 155' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -63.33 -28.51 70.06 Favored 'General case' 0 N--CA 1.499 1.99 0 O-C-N 121.462 -0.774 . . . . 0.0 110.962 179.739 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' B' B ' 156' ' ' ALA . . . . . 0.514 ' O ' ' HB3' ' B' ' 160' ' ' ALA . . . -89.66 -22.23 22.37 Favored 'General case' 0 N--CA 1.501 2.078 0 O-C-N 121.236 -0.915 . . . . 0.0 111.724 -179.439 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' B' B ' 157' ' ' LEU . . . . . . . . . . . . . 9.3 mt -99.12 -43.56 6.6 Favored 'General case' 0 N--CA 1.499 2.012 0 O-C-N 120.893 -1.129 . . . . 0.0 111.203 -179.486 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' B' B ' 158' ' ' LEU . . . . . . . . . . . . . 5.9 mp -76.35 107.19 8.43 Favored 'General case' 0 N--CA 1.499 1.999 0 O-C-N 121.201 -0.937 . . . . 0.0 110.49 -179.66 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' B' B ' 159' ' ' GLY . . . . . . . . . . . . . . . 90.13 -60.14 3.43 Favored Glycine 0 N--CA 1.495 2.629 0 N-CA-C 109.856 -1.298 . . . . 0.0 109.856 179.918 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' B' B ' 160' ' ' ALA . . . . . 0.514 ' HB3' ' O ' ' B' ' 156' ' ' ALA . . . -55.47 -54.16 47.25 Favored 'General case' 0 N--CA 1.499 1.993 0 O-C-N 121.747 -0.855 . . . . 0.0 110.972 -179.697 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' B' B ' 161' ' ' ARG . . . . . 0.498 ' NH1' HG22 ' A' ' 26' ' ' ILE . 7.0 ttt-85 -108.8 50.98 0.76 Allowed 'General case' 0 N--CA 1.497 1.876 0 O-C-N 121.232 -0.917 . . . . 0.0 110.066 179.485 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' B' B ' 162' ' ' ALA . . . . . . . . . . . . . . . -132.08 62.8 1.63 Allowed 'General case' 0 N--CA 1.495 1.817 0 O-C-N 121.335 -0.853 . . . . 0.0 110.341 -179.831 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' B' B ' 163' ' ' LYS . . . . . . . . . . . . . 0.5 OUTLIER . . . . . 0 N--CA 1.496 1.871 0 O-C-N 121.265 -0.897 . . . . 0.0 110.648 -179.795 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 90' ' ' ' CA' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 014 nuclear build full ' A' A ' 91' ' ' SXK . . . . . 0.813 ' HAK' HD21 ' A' ' 41' ' ' LEU . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 3.0 ptt? . . . . . 0 N--CA 1.499 1.978 0 CA-C-O 121.009 0.433 . . . . 0.0 110.408 . . . . . . . . . 0 0 . 1 . 015 nuclear build full ' A' A ' 2' ' ' ASP . . . . . . . . . . . . . 1.2 t70 -100.82 63.36 1.04 Allowed 'General case' 0 N--CA 1.495 1.781 0 O-C-N 121.352 -0.843 . . . . 0.0 110.501 -179.919 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 3' ' ' ASP . . . . . . . . . . . . . 2.0 m-20 -98.09 51.32 1.03 Allowed 'General case' 0 N--CA 1.495 1.803 0 O-C-N 121.238 -0.914 . . . . 0.0 109.955 179.642 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 4' ' ' ILE . . . . . . . . . . . . . 2.7 mp -88.65 -49.11 14.48 Favored 'Isoleucine or valine' 0 N--CA 1.497 1.919 0 O-C-N 121.349 -0.844 . . . . 0.0 110.417 -179.777 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 5' ' ' TYR . . . . . . . . . . . . . 12.2 m-85 -62.3 -40.56 96.69 Favored 'General case' 0 N--CA 1.499 2.013 0 O-C-N 121.303 -0.873 . . . . 0.0 110.306 179.842 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 9.7 ttmt -69.95 -37.59 75.88 Favored 'General case' 0 N--CA 1.496 1.846 0 O-C-N 121.4 -0.813 . . . . 0.0 110.061 179.326 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 7' ' ' ALA . . . . . . . . . . . . . . . -51.81 -49.57 62.52 Favored 'General case' 0 N--CA 1.5 2.049 0 O-C-N 121.577 -0.702 . . . . 0.0 110.258 179.632 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 8' ' ' ALA . . . . . . . . . . . . . . . -61.0 -42.89 99.3 Favored 'General case' 0 N--CA 1.497 1.92 0 O-C-N 121.501 -0.749 . . . . 0.0 109.977 179.23 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 9' ' ' VAL . . . . . 0.408 ' HA ' HD12 ' A' ' 12' ' ' LEU . 38.3 t -60.07 -38.19 75.89 Favored 'Isoleucine or valine' 0 N--CA 1.501 2.123 0 O-C-N 121.48 -0.763 . . . . 0.0 110.135 179.414 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 10' ' ' GLU . . . . . . . . . . . . . 36.8 mt-10 -81.57 -31.66 32.51 Favored 'General case' 0 N--CA 1.497 1.877 0 O-C-N 121.51 -0.744 . . . . 0.0 110.192 179.633 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 11' ' ' GLN . . . . . 0.463 ' NE2' ' HB3' ' A' ' 89' ' ' SER . 41.0 mt-30 -63.04 -32.03 73.3 Favored 'General case' 0 N--CA 1.5 2.063 0 O-C-N 121.588 -0.695 . . . . 0.0 111.027 179.923 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 12' ' ' LEU . . . . . 0.408 HD12 ' HA ' ' A' ' 9' ' ' VAL . 30.5 mt -54.54 139.49 37.8 Favored 'General case' 0 N--CA 1.501 2.112 0 O-C-N 121.292 -0.88 . . . . 0.0 110.397 179.85 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 13' ' ' THR . . . . . . . . . . . . . 72.1 p -77.55 165.01 24.86 Favored 'General case' 0 N--CA 1.499 1.979 0 O-C-N 121.216 -0.927 . . . . 0.0 110.025 179.643 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 14' ' ' GLU . . . . . 0.503 ' HA ' ' HD3' ' A' ' 17' ' ' LYS . 0.5 OUTLIER -55.22 -27.51 46.62 Favored 'General case' 0 N--CA 1.493 1.697 0 O-C-N 121.507 -0.746 . . . . 0.0 110.788 -179.6 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 1.5 mp0 -61.31 -47.49 85.69 Favored 'General case' 0 N--CA 1.496 1.848 0 O-C-N 121.351 -0.843 . . . . 0.0 109.329 178.828 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 16' ' ' GLN . . . . . . . . . . . . . 1.2 mt-30 -67.02 -41.65 86.26 Favored 'General case' 0 N--CA 1.498 1.953 0 CA-C-O 121.581 0.705 . . . . 0.0 109.614 178.784 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 17' ' ' LYS . . . . . 0.503 ' HD3' ' HA ' ' A' ' 14' ' ' GLU . 0.2 OUTLIER -59.42 -45.14 92.37 Favored 'General case' 0 N--CA 1.499 1.999 0 CA-C-O 121.119 0.485 . . . . 0.0 109.786 179.202 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' A' A ' 18' ' ' ASN . . . . . . . . . . . . . 0.8 OUTLIER -69.35 -41.08 77.08 Favored 'General case' 0 N--CA 1.496 1.863 0 O-C-N 121.593 -0.692 . . . . 0.0 109.945 179.316 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 0.3 OUTLIER -60.39 -45.49 93.37 Favored 'General case' 0 N--CA 1.5 2.036 0 O-C-N 121.416 -0.802 . . . . 0.0 109.694 179.083 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 20' ' ' PHE . . . . . 0.456 ' CE1' ' HG2' ' A' ' 81' ' ' MET . 8.4 m-85 -64.73 -35.29 80.59 Favored 'General case' 0 N--CA 1.497 1.882 0 O-C-N 121.531 -0.731 . . . . 0.0 109.77 178.94 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 21' ' ' LYS . . . . . 0.467 ' HG3' ' N ' ' A' ' 22' ' ' ALA . 0.0 OUTLIER -60.82 -39.89 90.69 Favored 'General case' 0 N--CA 1.497 1.885 0 O-C-N 121.439 -0.788 . . . . 0.0 109.6 179.173 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' A' A ' 22' ' ' ALA . . . . . 0.467 ' N ' ' HG3' ' A' ' 21' ' ' LYS . . . -62.99 -46.84 85.78 Favored 'General case' 0 N--CA 1.498 1.943 0 O-C-N 121.386 -0.821 . . . . 0.0 109.816 179.136 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 23' ' ' ALA . . . . . . . . . . . . . . . -66.81 -39.3 87.66 Favored 'General case' 0 N--CA 1.497 1.891 0 O-C-N 121.497 -0.752 . . . . 0.0 110.145 179.259 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 24' ' ' PHE . . . . . 0.447 ' CZ ' HG11 ' A' ' 28' ' ' VAL . 73.1 t80 -68.41 -39.83 81.49 Favored 'General case' 0 N--CA 1.498 1.941 0 O-C-N 121.516 -0.74 . . . . 0.0 110.297 179.607 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 25' ' ' ASP . . . . . . . . . . . . . 0.9 OUTLIER -54.24 -43.51 70.95 Favored 'General case' 0 N--CA 1.498 1.974 0 O-C-N 121.5 -0.75 . . . . 0.0 110.047 179.733 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 26' ' ' ILE . . . . . 0.718 ' HA ' HD23 ' A' ' 29' ' ' LEU . 12.9 mt -74.57 -28.07 21.75 Favored 'Isoleucine or valine' 0 N--CA 1.498 1.929 0 O-C-N 121.424 -0.797 . . . . 0.0 109.478 178.564 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 27' ' ' PHE . . . . . . . . . . . . . 0.2 OUTLIER -73.36 -10.54 59.85 Favored 'General case' 0 N--CA 1.498 1.953 0 O-C-N 121.285 -0.884 . . . . 0.0 111.239 179.452 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 28' ' ' VAL . . . . . 0.691 HG12 HG13 ' A' ' 36' ' ' ILE . 21.2 m -125.26 3.17 4.57 Favored 'Isoleucine or valine' 0 N--CA 1.501 2.103 0 O-C-N 121.036 -1.04 . . . . 0.0 111.25 179.841 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 29' ' ' LEU . . . . . 0.718 HD23 ' HA ' ' A' ' 26' ' ' ILE . 2.1 pp -65.64 -32.49 74.09 Favored 'General case' 0 N--CA 1.5 2.033 0 O-C-N 120.913 -1.117 . . . . 0.0 110.154 179.666 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 30' ' ' GLY . . . . . . . . . . . . . . . -114.58 28.05 8.44 Favored Glycine 0 N--CA 1.495 2.628 0 N-CA-C 109.283 -1.527 . . . . 0.0 109.283 178.939 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 31' ' ' ALA . . . . . 0.539 ' HB3' ' HA ' ' A' ' 28' ' ' VAL . . . -124.17 -127.73 0.25 Allowed 'General case' 0 N--CA 1.493 1.725 0 O-C-N 121.516 -0.99 . . . . 0.0 109.668 -179.994 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 32' ' ' GLU . . . . . . . . . . . . . 2.8 mp0 -96.94 -176.09 3.46 Favored 'General case' 0 N--CA 1.497 1.887 0 O-C-N 121.011 -1.056 . . . . 0.0 109.82 179.499 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 3.8 m-20 -68.44 83.33 0.26 Allowed 'General case' 0 N--CA 1.5 2.045 0 O-C-N 121.33 -0.856 . . . . 0.0 110.449 -179.946 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 34' ' ' GLY . . . . . . . . . . . . . . . 73.49 35.16 56.26 Favored Glycine 0 N--CA 1.495 2.608 0 N-CA-C 109.649 -1.38 . . . . 0.0 109.649 -179.448 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 35' ' ' CYS . . . . . . . . . . . . . 1.1 m -146.9 160.22 42.59 Favored 'General case' 0 N--CA 1.497 1.895 0 O-C-N 121.374 -1.074 . . . . 0.0 110.777 -179.692 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 36' ' ' ILE . . . . . 0.691 HG13 HG12 ' A' ' 28' ' ' VAL . 4.1 mt -129.12 126.12 63.72 Favored 'Isoleucine or valine' 0 N--CA 1.498 1.954 0 O-C-N 121.506 -0.746 . . . . 0.0 110.33 -179.983 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 37' ' ' SER . . . . . 0.559 ' C ' HG23 ' A' ' 38' ' ' THR . 1.1 t -125.1 66.33 1.12 Allowed 'General case' 0 N--CA 1.496 1.867 0 O-C-N 121.406 -0.809 . . . . 0.0 110.265 179.755 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 38' ' ' THR . . . . . 0.559 HG23 ' C ' ' A' ' 37' ' ' SER . 1.2 p 66.25 -43.59 0.4 Allowed 'General case' 0 N--CA 1.518 2.958 0 N-CA-C 112.866 0.691 . . . . 0.0 112.866 179.69 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 39' ' ' LYS . . . . . . . . . . . . . 3.7 ttpp -46.59 -64.84 0.66 Allowed 'General case' 0 N--CA 1.505 2.31 0 O-C-N 121.045 -1.035 . . . . 0.0 111.826 -178.941 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 40' ' ' GLU . . . . . 0.427 ' HB2' ' HB2' ' A' ' 31' ' ' ALA . 0.4 OUTLIER -71.44 -32.0 67.84 Favored 'General case' 0 N--CA 1.5 2.033 0 O-C-N 121.076 -1.015 . . . . 0.0 110.245 179.916 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' A' A ' 41' ' ' LEU . . . . . 0.499 ' O ' HD12 ' A' ' 41' ' ' LEU . 4.8 tp -59.08 -50.95 72.13 Favored 'General case' 0 N--CA 1.497 1.919 0 O-C-N 121.5 -0.75 . . . . 0.0 110.377 179.737 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 42' ' ' GLY . . . . . . . . . . . . . . . -59.93 -38.06 93.56 Favored Glycine 0 N--CA 1.493 2.475 0 N-CA-C 110.033 -1.227 . . . . 0.0 110.033 -179.922 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 43' ' ' LYS . . . . . . . . . . . . . 1.9 ttpt -54.23 -44.32 71.61 Favored 'General case' 0 N--CA 1.5 2.036 0 O-C-N 121.439 -1.036 . . . . 0.0 109.832 179.251 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 44' ' ' VAL . . . . . . . . . . . . . 92.7 t -76.31 -39.46 34.58 Favored 'Isoleucine or valine' 0 N--CA 1.496 1.851 0 O-C-N 121.521 -0.737 . . . . 0.0 109.788 179.153 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 45' ' ' MET . . . . . 0.49 ' HE1' HG13 ' B' ' 148' ' ' ILE . 8.7 mmt -61.3 -36.74 80.91 Favored 'General case' 0 N--CA 1.501 2.089 0 O-C-N 121.393 -0.817 . . . . 0.0 109.944 179.222 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 46' ' ' ARG . . . . . . . . . . . . . 0.9 OUTLIER -64.02 -34.44 78.01 Favored 'General case' 0 N--CA 1.5 2.037 0 O-C-N 121.487 -0.758 . . . . 0.0 109.949 179.122 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 47' ' ' MET . . . . . . . . . . . . . 3.1 ttp -77.48 -35.16 53.95 Favored 'General case' 0 N--CA 1.496 1.852 0 O-C-N 121.484 -0.76 . . . . 0.0 109.777 179.401 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 48' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -136.04 89.89 2.53 Favored 'General case' 0 N--CA 1.495 1.794 0 O-C-N 121.407 -0.808 . . . . 0.0 109.57 179.295 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 49' ' ' GLY . . . . . 0.456 ' C ' ' HG3' ' A' ' 50' ' ' GLN . . . 147.36 -114.63 0.72 Allowed Glycine 0 N--CA 1.497 2.701 0 N-CA-C 109.617 -1.393 . . . . 0.0 109.617 -179.503 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 50' ' ' GLN . . . . . 0.456 ' HG3' ' C ' ' A' ' 49' ' ' GLY . 0.0 OUTLIER -149.21 -52.93 0.16 Allowed 'General case' 0 N--CA 1.502 2.163 0 O-C-N 121.575 -0.956 . . . . 0.0 109.818 179.914 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' A' A ' 51' ' ' ASN . . . . . . . . . . . . . 45.3 t30 54.72 78.75 0.37 Allowed Pre-proline 0 N--CA 1.502 2.134 0 O-C-N 121.8 -0.562 . . . . 0.0 112.11 179.317 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 52' ' ' PRO . . . . . . . . . . . . . 44.8 Cg_endo -78.64 -61.55 0.03 OUTLIER 'Trans proline' 0 C--N 1.315 -1.224 0 O-C-N 123.601 1.316 . . . . 0.0 110.0 178.573 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 53' ' ' THR . . . . . . . . . . . . . 3.3 p -134.67 162.29 58.58 Favored Pre-proline 0 N--CA 1.492 1.639 0 O-C-N 121.297 -0.877 . . . . 0.0 109.623 179.611 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 54' ' ' PRO . . . . . . . . . . . . . 43.4 Cg_endo -68.42 -31.06 28.59 Favored 'Trans proline' 0 N--CA 1.491 1.381 0 O-C-N 123.498 1.262 . . . . 0.0 110.515 179.555 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 55' ' ' GLU . . . . . . . . . . . . . 28.9 mp0 -67.39 -29.4 68.9 Favored 'General case' 0 N--CA 1.496 1.853 0 O-C-N 121.548 -0.72 . . . . 0.0 110.227 179.381 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -60.57 -32.74 71.82 Favored 'General case' 0 N--CA 1.499 2.015 0 O-C-N 121.519 -0.738 . . . . 0.0 111.45 -179.754 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 57' ' ' LEU . . . . . 0.46 ' HB3' ' CD2' ' A' ' 41' ' ' LEU . 9.0 mt -89.17 -12.65 40.36 Favored 'General case' 0 N--CA 1.496 1.85 0 O-C-N 121.043 -1.036 . . . . 0.0 111.413 -179.408 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 58' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -66.3 -47.95 71.94 Favored 'General case' 0 N--CA 1.492 1.662 0 O-C-N 120.912 -1.118 . . . . 0.0 108.69 179.234 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 59' ' ' GLU . . . . . . . . . . . . . 8.5 pt-20 -61.15 -31.38 71.1 Favored 'General case' 0 N--CA 1.495 1.819 0 O-C-N 121.548 -0.72 . . . . 0.0 109.601 178.69 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 60' ' ' MET . . . . . 0.427 ' HB2' ' O ' ' A' ' 57' ' ' LEU . 1.9 mmm -61.08 -42.14 97.95 Favored 'General case' 0 N--CA 1.497 1.878 0 O-C-N 121.5 -0.75 . . . . 0.0 109.663 178.811 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 61' ' ' ILE . . . . . 0.848 HG23 HG23 ' A' ' 72' ' ' VAL . 10.9 mt -72.75 -45.42 57.01 Favored 'Isoleucine or valine' 0 N--CA 1.497 1.89 0 O-C-N 121.355 -0.841 . . . . 0.0 109.658 178.982 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 62' ' ' ASP . . . . . . . . . . . . . 10.4 m-20 -54.11 -35.09 61.77 Favored 'General case' 0 N--CA 1.499 1.989 0 O-C-N 121.675 -0.641 . . . . 0.0 111.064 -179.735 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 63' ' ' GLU . . . . . . . . . . . . . 3.5 tm-20 -58.47 -39.93 81.3 Favored 'General case' 0 N--CA 1.501 2.089 0 O-C-N 121.217 -0.927 . . . . 0.0 110.068 179.459 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 64' ' ' VAL . . . . . 0.512 HG12 ' NH2' ' A' ' 83' ' ' ARG . 23.1 m -107.23 23.81 3.04 Favored 'Isoleucine or valine' 0 N--CA 1.497 1.913 0 O-C-N 121.404 -0.81 . . . . 0.0 110.709 179.5 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 65' ' ' ASP . . . . . . . . . . . . . 11.3 t0 -98.2 97.15 8.6 Favored 'General case' 0 N--CA 1.495 1.806 0 O-C-N 121.104 -0.998 . . . . 0.0 110.074 179.648 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 66' ' ' GLU . . . . . . . . . . . . . 3.3 mp0 -91.88 28.67 1.75 Allowed 'General case' 0 N--CA 1.495 1.803 0 O-C-N 121.416 -0.802 . . . . 0.0 109.264 178.818 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 67' ' ' ASP . . . . . . . . . . . . . 1.0 OUTLIER -107.61 -29.58 9.09 Favored 'General case' 0 N--CA 1.492 1.65 0 O-C-N 121.593 -0.692 . . . . 0.0 110.361 -179.477 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 68' ' ' GLY . . . . . . . . . . . . . . . 80.08 19.39 69.91 Favored Glycine 0 N--CA 1.492 2.398 0 N-CA-C 108.215 -1.954 . . . . 0.0 108.215 -177.548 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 69' ' ' SER . . . . . . . . . . . . . 59.9 p -109.81 -44.9 3.73 Favored 'General case' 0 N--CA 1.493 1.704 0 O-C-N 121.609 -0.936 . . . . 0.0 110.393 -179.592 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 70' ' ' GLY . . . . . 0.417 ' O ' HG21 ' A' ' 61' ' ' ILE . . . 118.06 -40.21 2.38 Favored Glycine 0 N--CA 1.499 2.89 0 C-N-CA 119.927 -1.13 . . . . 0.0 110.881 179.518 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 71' ' ' THR . . . . . . . . . . . . . 4.7 m -76.45 144.21 40.05 Favored 'General case' 0 N--CA 1.505 2.276 0 O-C-N 121.002 -1.293 . . . . 0.0 110.342 -179.686 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 72' ' ' VAL . . . . . 0.848 HG23 HG23 ' A' ' 61' ' ' ILE . 0.7 OUTLIER -98.69 136.93 27.76 Favored 'Isoleucine or valine' 0 N--CA 1.497 1.888 0 O-C-N 121.496 -0.753 . . . . 0.0 110.373 179.919 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' A' A ' 73' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER -113.81 -165.37 1.0 Allowed 'General case' 0 N--CA 1.496 1.874 0 O-C-N 121.371 -0.831 . . . . 0.0 110.05 179.814 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 74' ' ' PHE . . . . . . . . . . . . . 23.6 t80 -64.37 -44.85 90.09 Favored 'General case' 0 N--CA 1.499 1.984 0 O-C-N 121.174 -0.953 . . . . 0.0 110.475 179.893 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 75' ' ' ASP . . . . . . . . . . . . . 30.2 t70 -57.72 -51.9 67.64 Favored 'General case' 0 N--CA 1.497 1.909 0 O-C-N 121.412 -0.805 . . . . 0.0 109.881 179.447 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 76' ' ' GLU . . . . . 0.627 ' HB3' HG22 ' A' ' 72' ' ' VAL . 35.0 mt-10 -60.49 -37.09 79.95 Favored 'General case' 0 N--CA 1.499 1.989 0 O-C-N 121.576 -0.702 . . . . 0.0 109.771 178.9 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 77' ' ' PHE . . . . . 0.522 ' HA ' ' CE ' ' A' ' 80' ' ' MET . 2.4 t80 -57.63 -36.64 72.08 Favored 'General case' 0 N--CA 1.496 1.849 0 O-C-N 121.691 -0.63 . . . . 0.0 110.279 179.362 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 78' ' ' LEU . . . . . . . . . . . . . 12.5 mt -75.29 -37.12 61.04 Favored 'General case' 0 N--CA 1.496 1.84 0 O-C-N 121.512 -0.742 . . . . 0.0 110.943 -179.945 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 79' ' ' VAL . . . . . . . . . . . . . 66.1 t -62.11 -49.26 84.81 Favored 'Isoleucine or valine' 0 N--CA 1.503 2.196 0 O-C-N 121.23 -0.919 . . . . 0.0 111.21 -179.504 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 80' ' ' MET . . . . . 0.522 ' CE ' ' HA ' ' A' ' 77' ' ' PHE . 16.2 ptt? -69.67 -24.27 63.58 Favored 'General case' 0 N--CA 1.502 2.147 0 O-C-N 120.872 -1.143 . . . . 0.0 110.727 -179.806 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 81' ' ' MET . . . . . 0.456 ' HG2' ' CE1' ' A' ' 20' ' ' PHE . 24.9 tpp -73.89 -50.46 20.12 Favored 'General case' 0 N--CA 1.494 1.757 0 O-C-N 121.098 -1.002 . . . . 0.0 109.825 179.2 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 82' ' ' VAL . . . . . . . . . . . . . 30.1 m -62.25 -26.08 39.33 Favored 'Isoleucine or valine' 0 N--CA 1.503 2.19 0 O-C-N 121.174 -0.954 . . . . 0.0 109.846 178.905 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 83' ' ' ARG . . . . . 0.512 ' NH2' HG12 ' A' ' 64' ' ' VAL . 19.6 mtt180 -66.1 -52.32 49.72 Favored 'General case' 0 N--CA 1.496 1.858 0 O-C-N 121.283 -0.886 . . . . 0.0 108.936 178.601 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 84' ' ' CYS . . . . . . . . . . . . . 37.7 t -64.74 -23.36 67.22 Favored 'General case' 0 N--CA 1.499 2.009 0 O-C-N 121.648 -0.658 . . . . 0.0 110.397 178.964 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 85' ' ' MET . . . . . 0.462 ' O ' ' HB2' ' A' ' 86' ' ' LYS . 9.5 mtt -66.37 -16.98 64.5 Favored 'General case' 0 N--CA 1.499 1.991 0 O-C-N 121.301 -0.874 . . . . 0.0 110.647 179.257 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 86' ' ' LYS . . . . . 0.462 ' HB2' ' O ' ' A' ' 85' ' ' MET . 18.3 mtmm 67.44 -72.82 0.09 Allowed 'General case' 0 N--CA 1.505 2.277 0 O-C-N 121.849 -0.532 . . . . 0.0 110.837 -179.991 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 87' ' ' ASP . . . . . . . . . . . . . 4.8 t70 -123.27 126.53 47.09 Favored 'General case' 0 N--CA 1.495 1.776 0 O-C-N 121.114 -0.991 . . . . 0.0 110.599 179.959 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 88' ' ' ASP . . . . . . . . . . . . . 12.9 t70 -157.19 152.51 26.33 Favored 'General case' 0 N--CA 1.496 1.85 0 O-C-N 121.436 -0.79 . . . . 0.0 110.288 179.884 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 89' ' ' SER . . . . . 0.463 ' HB3' ' NE2' ' A' ' 11' ' ' GLN . 16.5 m . . . . . 0 N--CA 1.503 2.178 0 CA-C-O 118.016 -0.993 . . . . 0.0 110.822 179.933 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' B' B ' 144' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.496 1.839 0 CA-C-O 121.157 0.503 . . . . 0.0 110.487 . . . . . . . . . 1 1 . 1 . 015 nuclear build full ' B' B ' 145' ' ' ARG . . . . . . . . . . . . . 0.3 OUTLIER -137.53 119.83 15.76 Favored 'General case' 0 N--CA 1.495 1.792 0 O-C-N 121.467 -0.771 . . . . 0.0 110.096 179.875 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' B' B ' 146' ' ' VAL . . . . . . . . . . . . . 3.3 p -92.26 164.76 2.03 Favored 'Isoleucine or valine' 0 N--CA 1.498 1.936 0 O-C-N 121.44 -0.788 . . . . 0.0 110.667 -179.937 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' B' B ' 147' ' ' ARG . . . . . . . . . . . . . 3.2 mpt_? -120.02 -53.72 2.15 Favored 'General case' 0 N--CA 1.498 1.963 0 O-C-N 121.493 -0.755 . . . . 0.0 110.375 -179.777 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' B' B ' 148' ' ' ILE . . . . . 0.49 HG13 ' HE1' ' A' ' 45' ' ' MET . 30.1 mm 60.01 81.28 0.06 OUTLIER 'Isoleucine or valine' 0 N--CA 1.502 2.134 0 CA-C-O 121.386 0.613 . . . . 0.0 110.646 -179.926 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' B' B ' 149' ' ' SER . . . . . . . . . . . . . 30.1 t -78.86 137.47 37.69 Favored 'General case' 0 N--CA 1.499 1.994 0 O-C-N 121.248 -0.907 . . . . 0.0 110.477 179.691 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' B' B ' 150' ' ' ALA . . . . . . . . . . . . . . . -58.24 -41.86 85.08 Favored 'General case' 0 N--CA 1.499 2.002 0 O-C-N 121.556 -0.715 . . . . 0.0 110.582 179.765 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' B' B ' 151' ' ' ASP . . . . . . . . . . . . . 20.7 t70 -67.16 -47.14 71.89 Favored 'General case' 0 N--CA 1.497 1.909 0 O-C-N 121.317 -0.864 . . . . 0.0 110.308 179.677 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' B' B ' 152' ' ' ALA . . . . . . . . . . . . . . . -60.01 -47.36 86.17 Favored 'General case' 0 N--CA 1.499 1.978 0 O-C-N 121.511 -0.743 . . . . 0.0 110.731 -179.94 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' B' B ' 153' ' ' MET . . . . . . . . . . . . . 0.1 OUTLIER -64.74 -40.05 94.65 Favored 'General case' 0 N--CA 1.498 1.932 0 O-C-N 121.328 -0.858 . . . . 0.0 110.239 179.769 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' B' B ' 154' ' ' MET . . . . . . . . . . . . . 3.1 tpp -63.18 -47.69 81.55 Favored 'General case' 0 N--CA 1.499 1.976 0 O-C-N 121.434 -0.791 . . . . 0.0 110.16 179.501 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' B' B ' 155' ' ' GLN . . . . . . . . . . . . . 0.8 OUTLIER -68.7 -36.95 79.14 Favored 'General case' 0 N--CA 1.5 2.032 0 O-C-N 121.388 -0.82 . . . . 0.0 110.494 179.573 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' B' B ' 156' ' ' ALA . . . . . . . . . . . . . . . -69.65 -29.79 67.34 Favored 'General case' 0 N--CA 1.499 2.005 0 O-C-N 121.306 -0.871 . . . . 0.0 110.934 179.881 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' B' B ' 157' ' ' LEU . . . . . 0.542 HD21 ' HB ' ' A' ' 26' ' ' ILE . 4.8 tp -84.9 -33.99 22.65 Favored 'General case' 0 N--CA 1.497 1.877 0 O-C-N 121.319 -0.863 . . . . 0.0 110.501 179.981 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' B' B ' 158' ' ' LEU . . . . . . . . . . . . . 4.2 mm? -95.53 47.19 1.11 Allowed 'General case' 0 N--CA 1.496 1.862 0 O-C-N 121.297 -0.877 . . . . 0.0 110.308 -179.748 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' B' B ' 159' ' ' GLY . . . . . . . . . . . . . . . 155.75 -149.48 20.56 Favored Glycine 0 N--CA 1.495 2.574 0 N-CA-C 109.674 -1.371 . . . . 0.0 109.674 179.866 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' B' B ' 160' ' ' ALA . . . . . . . . . . . . . . . 50.43 -98.21 0.06 Allowed 'General case' 0 N--CA 1.5 2.073 0 O-C-N 121.823 -0.81 . . . . 0.0 110.706 -179.888 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' B' B ' 161' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -154.35 53.48 0.68 Allowed 'General case' 0 N--CA 1.495 1.818 0 O-C-N 121.017 -1.052 . . . . 0.0 110.187 179.587 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' B' B ' 162' ' ' ALA . . . . . . . . . . . . . . . -99.89 -58.84 1.83 Allowed 'General case' 0 N--CA 1.494 1.734 0 O-C-N 121.245 -0.909 . . . . 0.0 109.514 179.394 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' B' B ' 163' ' ' LYS . . . . . 0.45 ' HA ' ' CE ' ' B' ' 163' ' ' LYS . 0.0 OUTLIER . . . . . 0 N--CA 1.494 1.737 0 CA-C-O 118.205 -0.902 . . . . 0.0 110.227 179.374 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 90' ' ' ' CA' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 015 nuclear build full ' A' A ' 91' ' ' SXK . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 016 nuclear build full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 6.1 ptt? . . . . . 0 N--CA 1.5 2.041 0 CA-C-O 121.429 0.633 . . . . 0.0 110.248 . . . . . . . . . 0 0 . 1 . 016 nuclear build full ' A' A ' 2' ' ' ASP . . . . . . . . . . . . . 0.0 OUTLIER -150.11 -68.63 0.2 Allowed 'General case' 0 N--CA 1.497 1.875 0 O-C-N 121.36 -0.838 . . . . 0.0 109.637 -179.717 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 3' ' ' ASP . . . . . . . . . . . . . 10.3 m-20 46.95 58.79 4.45 Favored 'General case' 0 N--CA 1.502 2.164 0 O-C-N 121.734 -0.604 . . . . 0.0 111.576 178.547 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 4' ' ' ILE . . . . . . . . . . . . . 9.5 mt -72.89 -48.82 43.35 Favored 'Isoleucine or valine' 0 N--CA 1.499 1.977 0 O-C-N 121.046 -1.034 . . . . 0.0 109.945 179.981 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 5' ' ' TYR . . . . . 0.413 ' HB3' ' CG2' ' A' ' 79' ' ' VAL . 0.9 OUTLIER -66.92 -39.54 87.4 Favored 'General case' 0 N--CA 1.496 1.831 0 O-C-N 121.369 -0.832 . . . . 0.0 109.563 179.125 . . . . . . . . 3 3 . 1 . 016 nuclear build full ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 0.4 OUTLIER -68.07 -32.73 73.27 Favored 'General case' 0 N--CA 1.495 1.818 0 O-C-N 121.562 -0.712 . . . . 0.0 109.81 178.946 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 7' ' ' ALA . . . . . . . . . . . . . . . -63.4 -34.65 78.2 Favored 'General case' 0 N--CA 1.499 1.975 0 O-C-N 121.233 -0.917 . . . . 0.0 109.483 178.728 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 8' ' ' ALA . . . . . 0.502 ' HB1' ' HA ' ' A' ' 88' ' ' ASP . . . -66.02 -28.05 68.58 Favored 'General case' 0 N--CA 1.495 1.808 0 O-C-N 121.496 -0.753 . . . . 0.0 110.229 178.892 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 9' ' ' VAL . . . . . 0.434 HG13 ' HB3' ' A' ' 78' ' ' LEU . 68.6 t -64.52 -32.75 59.09 Favored 'Isoleucine or valine' 0 N--CA 1.5 2.069 0 O-C-N 121.318 -0.864 . . . . 0.0 110.338 179.475 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 10' ' ' GLU . . . . . . . . . . . . . 15.4 mt-10 -65.58 -25.45 67.41 Favored 'General case' 0 N--CA 1.499 2.01 0 O-C-N 121.301 -0.874 . . . . 0.0 110.665 179.871 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 11' ' ' GLN . . . . . . . . . . . . . 0.3 OUTLIER -65.45 -24.47 67.18 Favored 'General case' 0 N--CA 1.5 2.065 0 O-C-N 121.407 -0.808 . . . . 0.0 110.991 179.635 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 12' ' ' LEU . . . . . . . . . . . . . 10.2 mt -61.47 135.83 57.81 Favored 'General case' 0 N--CA 1.499 2.023 0 O-C-N 121.256 -0.902 . . . . 0.0 110.45 -179.935 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 13' ' ' THR . . . . . . . . . . . . . 27.9 p -77.97 165.02 24.57 Favored 'General case' 0 N--CA 1.498 1.966 0 O-C-N 121.275 -0.891 . . . . 0.0 110.357 179.623 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 14' ' ' GLU . . . . . . . . . . . . . 0.6 OUTLIER -56.52 -31.49 64.17 Favored 'General case' 0 N--CA 1.494 1.739 0 O-C-N 121.678 -0.639 . . . . 0.0 110.407 -179.879 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 1.4 mp0 -62.07 -52.79 62.47 Favored 'General case' 0 N--CA 1.498 1.933 0 O-C-N 121.467 -0.771 . . . . 0.0 109.761 179.306 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 16' ' ' GLN . . . . . 0.433 ' HA ' ' HB3' ' A' ' 19' ' ' GLU . 38.9 mt-30 -65.02 -33.18 75.44 Favored 'General case' 0 N--CA 1.497 1.888 0 O-C-N 121.627 -0.671 . . . . 0.0 110.111 179.448 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 17' ' ' LYS . . . . . . . . . . . . . 15.4 mttp -63.56 -49.0 75.15 Favored 'General case' 0 N--CA 1.497 1.904 0 N-CA-C 109.47 -0.567 . . . . 0.0 109.47 179.009 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 18' ' ' ASN . . . . . 0.554 ' HA ' ' HG2' ' A' ' 21' ' ' LYS . 41.7 t30 -71.47 -32.21 68.02 Favored 'General case' 0 N--CA 1.497 1.894 0 O-C-N 121.537 -0.727 . . . . 0.0 109.225 178.398 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 19' ' ' GLU . . . . . 0.433 ' HB3' ' HA ' ' A' ' 16' ' ' GLN . 2.4 tt0 -66.73 -41.78 87.33 Favored 'General case' 0 N--CA 1.496 1.848 0 O-C-N 121.539 -0.726 . . . . 0.0 109.425 178.925 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 20' ' ' PHE . . . . . . . . . . . . . 3.0 m-85 -70.68 -34.72 72.3 Favored 'General case' 0 N--CA 1.497 1.877 0 O-C-N 121.497 -0.752 . . . . 0.0 110.301 179.477 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 21' ' ' LYS . . . . . 0.592 ' HG3' ' N ' ' A' ' 22' ' ' ALA . 0.0 OUTLIER -64.47 -28.03 69.39 Favored 'General case' 0 N--CA 1.497 1.921 0 O-C-N 121.33 -0.856 . . . . 0.0 110.158 179.524 . . . . . . . . 3 3 . 1 . 016 nuclear build full ' A' A ' 22' ' ' ALA . . . . . 0.592 ' N ' ' HG3' ' A' ' 21' ' ' LYS . . . -65.44 -44.49 87.13 Favored 'General case' 0 N--CA 1.498 1.963 0 O-C-N 121.143 -0.973 . . . . 0.0 108.96 178.401 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 23' ' ' ALA . . . . . 0.485 ' HB2' HD11 ' B' ' 158' ' ' LEU . . . -71.71 -40.44 69.48 Favored 'General case' 0 N--CA 1.493 1.7 0 N-CA-C 109.086 -0.709 . . . . 0.0 109.086 178.33 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 24' ' ' PHE . . . . . . . . . . . . . 65.2 t80 -59.37 -43.63 92.83 Favored 'General case' 0 N--CA 1.499 1.999 0 O-C-N 121.65 -0.656 . . . . 0.0 110.511 179.448 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 25' ' ' ASP . . . . . . . . . . . . . 16.3 m-20 -61.15 -45.51 94.34 Favored 'General case' 0 N--CA 1.499 2.004 0 O-C-N 121.4 -0.813 . . . . 0.0 110.67 179.997 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 26' ' ' ILE . . . . . . . . . . . . . 54.4 mt -73.56 -21.25 18.46 Favored 'Isoleucine or valine' 0 N--CA 1.501 2.081 0 O-C-N 121.419 -0.801 . . . . 0.0 110.96 179.971 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 27' ' ' PHE . . . . . 0.65 ' CE1' HG21 ' A' ' 44' ' ' VAL . 0.2 OUTLIER -70.29 -11.24 60.77 Favored 'General case' 0 N--CA 1.502 2.15 0 O-C-N 120.991 -1.068 . . . . 0.0 111.878 -179.691 . . . . . . . . 3 3 . 1 . 016 nuclear build full ' A' A ' 28' ' ' VAL . . . . . . . . . . . . . 6.8 m -127.63 -46.83 1.2 Allowed 'Isoleucine or valine' 0 N--CA 1.499 1.984 0 O-C-N 120.949 -1.094 . . . . 0.0 111.049 179.859 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 29' ' ' LEU . . . . . . . . . . . . . 12.7 mt 47.78 39.53 10.63 Favored 'General case' 0 N--CA 1.504 2.238 0 O-C-N 121.364 -0.835 . . . . 0.0 110.629 -179.7 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 30' ' ' GLY . . . . . . . . . . . . . . . 85.13 39.96 8.24 Favored Glycine 0 N--CA 1.494 2.535 0 N-CA-C 109.588 -1.405 . . . . 0.0 109.588 -179.322 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 31' ' ' ALA . . . . . . . . . . . . . . . -56.39 -64.47 0.86 Allowed 'General case' 0 N--CA 1.501 2.107 0 O-C-N 121.535 -0.979 . . . . 0.0 110.456 -179.881 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 32' ' ' GLU . . . . . . . . . . . . . 1.1 mt-10 -129.47 -52.23 1.17 Allowed 'General case' 0 N--CA 1.495 1.813 0 O-C-N 121.618 -0.677 . . . . 0.0 109.495 179.559 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 0.0 OUTLIER -145.95 -54.83 0.28 Allowed 'General case' 0 N--CA 1.496 1.838 0 O-C-N 121.614 -0.678 . . . . 0.0 109.661 179.662 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 34' ' ' GLY . . . . . . . . . . . . . . . -179.93 38.86 0.07 OUTLIER Glycine 0 N--CA 1.495 2.603 0 N-CA-C 109.682 -1.367 . . . . 0.0 109.682 179.497 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 35' ' ' CYS . . . . . . . . . . . . . 68.1 m -149.26 163.61 37.18 Favored 'General case' 0 N--CA 1.497 1.875 0 O-C-N 121.333 -1.098 . . . . 0.0 110.514 -179.617 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 36' ' ' ILE . . . . . . . . . . . . . 55.7 mt -97.16 135.31 31.8 Favored 'Isoleucine or valine' 0 N--CA 1.498 1.931 0 O-C-N 121.374 -0.829 . . . . 0.0 109.869 179.502 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 37' ' ' SER . . . . . . . . . . . . . 7.5 p -115.12 -177.77 3.21 Favored 'General case' 0 N--CA 1.496 1.857 0 O-C-N 121.288 -0.883 . . . . 0.0 110.442 179.821 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 38' ' ' THR . . . . . . . . . . . . . 42.9 p -65.38 -37.45 87.03 Favored 'General case' 0 N--CA 1.502 2.125 0 O-C-N 121.498 -0.752 . . . . 0.0 110.463 179.754 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 39' ' ' LYS . . . . . . . . . . . . . 2.6 mtmp? -63.0 -36.95 85.28 Favored 'General case' 0 N--CA 1.501 2.082 0 O-C-N 121.521 -0.737 . . . . 0.0 110.055 179.598 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 40' ' ' GLU . . . . . 0.424 ' HA ' ' HD2' ' A' ' 43' ' ' LYS . 1.1 mp0 -76.45 -26.82 55.84 Favored 'General case' 0 N--CA 1.496 1.845 0 O-C-N 121.545 -0.722 . . . . 0.0 110.664 -179.902 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 41' ' ' LEU . . . . . 0.653 HD13 ' CAK' ' A' ' 91' ' ' SXK . 4.9 tp -69.56 -49.94 49.49 Favored 'General case' 0 N--CA 1.498 1.972 0 O-C-N 121.1 -1.0 . . . . 0.0 110.135 179.591 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 42' ' ' GLY . . . . . 0.555 ' HA2' ' HB2' ' A' ' 45' ' ' MET . . . -55.02 -32.53 56.63 Favored Glycine 0 N--CA 1.497 2.734 0 N-CA-C 110.798 -0.921 . . . . 0.0 110.798 -179.423 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 43' ' ' LYS . . . . . 0.424 ' HD2' ' HA ' ' A' ' 40' ' ' GLU . 5.4 mttt -54.27 -47.96 71.73 Favored 'General case' 0 N--CA 1.501 2.081 0 O-C-N 121.419 -1.047 . . . . 0.0 110.378 179.822 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 44' ' ' VAL . . . . . 0.65 HG21 ' CE1' ' A' ' 27' ' ' PHE . 61.9 t -82.26 -28.26 9.13 Favored 'Isoleucine or valine' 0 N--CA 1.5 2.04 0 O-C-N 121.287 -0.883 . . . . 0.0 110.064 179.367 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 45' ' ' MET . . . . . 0.555 ' HB2' ' HA2' ' A' ' 42' ' ' GLY . 0.5 OUTLIER -56.95 -31.05 64.59 Favored 'General case' 0 N--CA 1.502 2.156 0 O-C-N 121.308 -0.87 . . . . 0.0 110.991 179.612 . . . . . . . . 3 3 . 1 . 016 nuclear build full ' A' A ' 46' ' ' ARG . . . . . 0.592 ' HA ' ' HG3' ' A' ' 50' ' ' GLN . 7.0 mmm180 -53.5 -27.47 25.67 Favored 'General case' 0 N--CA 1.505 2.296 0 O-C-N 121.35 -0.844 . . . . 0.0 111.729 -179.586 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 47' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -81.6 -39.73 24.07 Favored 'General case' 0 N--CA 1.496 1.871 0 O-C-N 121.101 -0.999 . . . . 0.0 110.812 -179.825 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 48' ' ' LEU . . . . . 0.611 ' O ' HD11 ' B' ' 148' ' ' ILE . 1.1 mt -153.31 104.8 2.81 Favored 'General case' 0 N--CA 1.491 1.613 0 O-C-N 121.264 -0.897 . . . . 0.0 110.17 -179.83 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 49' ' ' GLY . . . . . 0.559 ' HA3' HD11 ' B' ' 148' ' ' ILE . . . 124.48 -67.13 0.52 Allowed Glycine 0 N--CA 1.498 2.833 0 N-CA-C 109.677 -1.369 . . . . 0.0 109.677 -179.996 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 50' ' ' GLN . . . . . 0.592 ' HG3' ' HA ' ' A' ' 46' ' ' ARG . 0.5 OUTLIER 66.53 131.56 0.02 OUTLIER 'General case' 0 N--CA 1.504 2.244 0 CA-C-O 121.582 0.706 . . . . 0.0 111.186 179.935 . . . . . . . . 3 3 . 1 . 016 nuclear build full ' A' A ' 51' ' ' ASN . . . . . 0.613 ' CB ' HD11 ' A' ' 57' ' ' LEU . 14.6 p-10 -97.82 114.82 65.52 Favored Pre-proline 0 N--CA 1.493 1.719 0 O-C-N 121.279 -0.888 . . . . 0.0 109.653 179.367 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 52' ' ' PRO . . . . . . . . . . . . . 43.0 Cg_endo -69.29 -39.16 7.78 Favored 'Trans proline' 0 C--N 1.313 -1.334 0 O-C-N 123.613 1.323 . . . . 0.0 111.084 -179.419 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 53' ' ' THR . . . . . 0.851 HG22 ' HD2' ' A' ' 54' ' ' PRO . 0.2 OUTLIER -126.37 152.88 74.61 Favored Pre-proline 0 N--CA 1.497 1.92 0 O-C-N 121.406 -0.808 . . . . 0.0 109.956 -179.962 . . . . . . . . 3 3 . 1 . 016 nuclear build full ' A' A ' 54' ' ' PRO . . . . . 0.851 ' HD2' HG22 ' A' ' 53' ' ' THR . 42.6 Cg_endo -70.82 -44.85 1.18 Allowed 'Trans proline' 0 C--N 1.314 -1.262 0 O-C-N 123.793 1.417 . . . . 0.0 110.392 179.761 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 55' ' ' GLU . . . . . . . . . . . . . 0.9 OUTLIER -68.98 -19.85 64.16 Favored 'General case' 0 N--CA 1.497 1.881 0 O-C-N 121.441 -0.787 . . . . 0.0 110.33 179.151 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 0.6 OUTLIER -56.99 -41.61 78.73 Favored 'General case' 0 N--CA 1.498 1.939 0 O-C-N 121.361 -0.837 . . . . 0.0 110.269 179.592 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 57' ' ' LEU . . . . . 0.621 ' HB3' HD23 ' A' ' 41' ' ' LEU . 19.7 mt -78.49 -23.54 46.33 Favored 'General case' 0 N--CA 1.495 1.816 0 O-C-N 121.444 -0.785 . . . . 0.0 110.183 179.51 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 58' ' ' GLN . . . . . 0.578 ' O ' HG22 ' A' ' 61' ' ' ILE . 0.0 OUTLIER -59.41 -31.82 69.61 Favored 'General case' 0 N--CA 1.497 1.914 0 O-C-N 121.193 -0.942 . . . . 0.0 109.165 179.13 . . . . . . . . 3 3 . 1 . 016 nuclear build full ' A' A ' 59' ' ' GLU . . . . . 0.544 ' N ' ' HG3' ' A' ' 58' ' ' GLN . 0.8 OUTLIER -72.62 -41.71 65.26 Favored 'General case' 0 N--CA 1.491 1.603 0 N-CA-C 108.508 -0.923 . . . . 0.0 108.508 177.85 . . . . . . . . 3 3 . 1 . 016 nuclear build full ' A' A ' 60' ' ' MET . . . . . . . . . . . . . 2.3 mtp -60.57 -38.56 84.98 Favored 'General case' 0 N--CA 1.495 1.806 0 O-C-N 121.77 -0.581 . . . . 0.0 109.853 178.513 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 61' ' ' ILE . . . . . 0.595 HG13 HG23 ' A' ' 72' ' ' VAL . 3.5 tt -73.17 -33.13 41.01 Favored 'Isoleucine or valine' 0 N--CA 1.497 1.921 0 O-C-N 121.397 -0.814 . . . . 0.0 110.492 179.659 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 62' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -74.9 -29.86 61.11 Favored 'General case' 0 N--CA 1.498 1.941 0 O-C-N 121.334 -0.854 . . . . 0.0 110.501 179.552 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 63' ' ' GLU . . . . . . . . . . . . . 26.7 mt-10 -61.14 -26.23 67.55 Favored 'General case' 0 N--CA 1.502 2.155 0 O-C-N 121.381 -0.824 . . . . 0.0 110.939 179.72 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 64' ' ' VAL . . . . . 0.514 HG11 ' HG3' ' A' ' 80' ' ' MET . 14.0 m -112.35 -12.55 11.61 Favored 'Isoleucine or valine' 0 N--CA 1.501 2.078 0 O-C-N 121.42 -0.8 . . . . 0.0 111.195 -179.665 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 65' ' ' ASP . . . . . 0.416 ' HA ' ' CD ' ' A' ' 76' ' ' GLU . 22.3 t70 -60.17 150.69 29.09 Favored 'General case' 0 N--CA 1.498 1.946 0 O-C-N 121.362 -0.836 . . . . 0.0 110.701 -179.8 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 66' ' ' GLU . . . . . . . . . . . . . 2.1 tt0 -140.07 18.12 2.45 Favored 'General case' 0 N--CA 1.494 1.772 0 O-C-N 121.45 -0.782 . . . . 0.0 111.522 -179.482 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 67' ' ' ASP . . . . . . . . . . . . . 5.9 p30 -140.17 1.22 1.8 Allowed 'General case' 0 N--CA 1.503 2.178 0 O-C-N 120.776 -1.202 . . . . 0.0 112.546 -179.787 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 68' ' ' GLY . . . . . . . . . . . . . . . 86.04 -16.04 45.12 Favored Glycine 0 N--CA 1.496 2.644 0 O-C-N 120.649 -1.282 . . . . 0.0 110.657 179.956 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 69' ' ' SER . . . . . . . . . . . . . 1.1 p -66.96 -27.29 67.33 Favored 'General case' 0 N--CA 1.498 1.934 0 O-C-N 121.013 -1.287 . . . . 0.0 110.224 179.693 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 70' ' ' GLY . . . . . . . . . . . . . . . 87.17 -57.73 4.56 Favored Glycine 0 N--CA 1.499 2.834 0 N-CA-C 110.289 -1.124 . . . . 0.0 110.289 179.441 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 71' ' ' THR . . . . . . . . . . . . . 1.0 OUTLIER -47.99 137.94 9.63 Favored 'General case' 0 N--CA 1.506 2.339 0 O-C-N 121.585 -0.95 . . . . 0.0 110.506 -179.7 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 72' ' ' VAL . . . . . 0.595 HG23 HG13 ' A' ' 61' ' ' ILE . 0.9 OUTLIER -75.91 125.55 35.7 Favored 'Isoleucine or valine' 0 N--CA 1.499 2.0 0 CA-C-O 121.7 0.762 . . . . 0.0 111.631 -178.787 . . . . . . . . 3 3 . 1 . 016 nuclear build full ' A' A ' 73' ' ' ASP . . . . . 0.401 ' H ' ' HB2' ' A' ' 76' ' ' GLU . 1.0 OUTLIER -97.1 -170.55 2.05 Favored 'General case' 0 N--CA 1.495 1.797 0 N-CA-C 109.172 -0.677 . . . . 0.0 109.172 178.724 . . . . . . . . 3 3 . 1 . 016 nuclear build full ' A' A ' 74' ' ' PHE . . . . . . . . . . . . . 28.3 t80 -67.0 -47.72 70.64 Favored 'General case' 0 N--CA 1.499 2.024 0 O-C-N 120.826 -1.171 . . . . 0.0 110.263 179.64 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 75' ' ' ASP . . . . . . . . . . . . . 10.6 t70 -63.64 -44.5 93.68 Favored 'General case' 0 N--CA 1.498 1.967 0 O-C-N 121.412 -0.805 . . . . 0.0 110.146 179.406 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 76' ' ' GLU . . . . . 0.591 ' O ' HG12 ' A' ' 79' ' ' VAL . 95.5 mt-10 -65.77 -35.12 79.82 Favored 'General case' 0 N--CA 1.498 1.929 0 O-C-N 121.464 -0.772 . . . . 0.0 110.277 179.843 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 77' ' ' PHE . . . . . . . . . . . . . 71.2 t80 -67.19 -38.55 85.57 Favored 'General case' 0 N--CA 1.494 1.755 0 O-C-N 121.112 -0.993 . . . . 0.0 109.496 178.978 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 78' ' ' LEU . . . . . 0.434 ' HB3' HG13 ' A' ' 9' ' ' VAL . 41.3 mt -66.29 -43.82 85.27 Favored 'General case' 0 N--CA 1.498 1.955 0 O-C-N 121.542 -0.724 . . . . 0.0 110.38 179.46 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 79' ' ' VAL . . . . . 0.591 HG12 ' O ' ' A' ' 76' ' ' GLU . 7.6 p -69.34 -15.64 19.78 Favored 'Isoleucine or valine' 0 N--CA 1.502 2.165 0 O-C-N 121.185 -0.947 . . . . 0.0 110.314 179.119 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 80' ' ' MET . . . . . 0.514 ' HG3' HG11 ' A' ' 64' ' ' VAL . 15.8 ttp -76.73 -37.43 56.01 Favored 'General case' 0 N--CA 1.493 1.71 0 O-C-N 121.116 -0.99 . . . . 0.0 109.383 178.849 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 81' ' ' MET . . . . . . . . . . . . . 3.8 mmm -69.23 -45.44 69.77 Favored 'General case' 0 N--CA 1.499 2.008 0 O-C-N 121.473 -0.767 . . . . 0.0 110.343 179.696 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 82' ' ' VAL . . . . . 0.455 ' HA ' ' HB2' ' A' ' 85' ' ' MET . 35.6 m -59.51 -28.72 40.66 Favored 'Isoleucine or valine' 0 N--CA 1.505 2.316 0 O-C-N 121.388 -0.82 . . . . 0.0 110.844 -179.985 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 83' ' ' ARG . . . . . 0.493 ' HD2' HG12 ' A' ' 64' ' ' VAL . 4.0 mtp-105 -57.86 -37.07 73.24 Favored 'General case' 0 N--CA 1.502 2.132 0 O-C-N 121.131 -0.981 . . . . 0.0 109.61 178.817 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 84' ' ' CYS . . . . . . . . . . . . . 9.9 t -83.25 -28.54 29.11 Favored 'General case' 0 N--CA 1.495 1.783 0 O-C-N 121.625 -0.672 . . . . 0.0 109.833 178.868 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 85' ' ' MET . . . . . 0.455 ' HB2' ' HA ' ' A' ' 82' ' ' VAL . 66.9 mtm -83.56 53.82 2.65 Favored 'General case' 0 N--CA 1.497 1.887 0 O-C-N 121.431 -0.793 . . . . 0.0 110.876 179.887 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 86' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER 54.57 51.17 14.48 Favored 'General case' 0 N--CA 1.502 2.129 0 O-C-N 121.59 -0.694 . . . . 0.0 111.748 179.223 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 87' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER 61.02 -80.51 0.02 OUTLIER 'General case' 0 N--CA 1.505 2.286 0 O-C-N 121.724 -0.61 . . . . 0.0 111.479 179.213 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 88' ' ' ASP . . . . . 0.502 ' HA ' ' HB1' ' A' ' 8' ' ' ALA . 1.9 t70 -97.91 155.76 16.92 Favored 'General case' 0 N--CA 1.495 1.8 0 O-C-N 120.989 -1.069 . . . . 0.0 110.682 -179.784 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 89' ' ' SER . . . . . . . . . . . . . 0.6 OUTLIER . . . . . 0 N--CA 1.497 1.887 0 CA-C-O 118.251 -0.88 . . . . 0.0 110.198 179.767 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' B' B ' 144' ' ' ARG . . . . . . . . . . . . . 2.5 ttp180 . . . . . 0 N--CA 1.496 1.855 0 CA-C-O 121.084 0.469 . . . . 0.0 110.259 . . . . . . . . . 0 0 . 1 . 016 nuclear build full ' B' B ' 145' ' ' ARG . . . . . . . . . . . . . 2.7 ptm180 -82.44 -176.81 6.42 Favored 'General case' 0 N--CA 1.498 1.958 0 O-C-N 121.346 -0.846 . . . . 0.0 110.412 179.751 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' B' B ' 146' ' ' VAL . . . . . . . . . . . . . 22.4 m -110.61 149.72 13.38 Favored 'Isoleucine or valine' 0 N--CA 1.499 1.998 0 O-C-N 121.345 -0.847 . . . . 0.0 110.625 179.984 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' B' B ' 147' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -129.75 110.77 12.02 Favored 'General case' 0 N--CA 1.498 1.953 0 O-C-N 121.579 -0.701 . . . . 0.0 109.843 179.83 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' B' B ' 148' ' ' ILE . . . . . 0.611 HD11 ' O ' ' A' ' 48' ' ' LEU . 1.4 tp -103.44 -4.95 9.4 Favored 'Isoleucine or valine' 0 N--CA 1.498 1.937 0 O-C-N 121.403 -0.81 . . . . 0.0 111.755 -179.134 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' B' B ' 149' ' ' SER . . . . . . . . . . . . . 20.1 t 59.63 93.68 0.04 OUTLIER 'General case' 0 N--CA 1.505 2.324 0 O-C-N 121.423 -0.798 . . . . 0.0 110.934 179.939 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' B' B ' 150' ' ' ALA . . . . . . . . . . . . . . . -57.57 -42.71 83.65 Favored 'General case' 0 N--CA 1.5 2.045 0 O-C-N 121.5 -0.75 . . . . 0.0 110.93 179.952 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' B' B ' 151' ' ' ASP . . . . . . . . . . . . . 5.4 m-20 -62.73 -49.81 73.58 Favored 'General case' 0 N--CA 1.5 2.041 0 O-C-N 121.4 -0.812 . . . . 0.0 110.644 -179.973 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' B' B ' 152' ' ' ALA . . . . . . . . . . . . . . . -63.35 -44.93 93.44 Favored 'General case' 0 N--CA 1.497 1.918 0 O-C-N 121.379 -0.826 . . . . 0.0 110.149 179.631 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' B' B ' 153' ' ' MET . . . . . . . . . . . . . 0.2 OUTLIER -63.62 -44.66 93.29 Favored 'General case' 0 N--CA 1.497 1.877 0 O-C-N 121.512 -0.743 . . . . 0.0 109.991 179.361 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' B' B ' 154' ' ' MET . . . . . 0.585 ' HG2' HD12 ' B' ' 158' ' ' LEU . 3.8 ttm -60.25 -44.26 95.42 Favored 'General case' 0 N--CA 1.497 1.916 0 O-C-N 121.419 -0.801 . . . . 0.0 110.014 179.308 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' B' B ' 155' ' ' GLN . . . . . . . . . . . . . 1.0 OUTLIER -62.5 -33.14 74.29 Favored 'General case' 0 N--CA 1.498 1.975 0 O-C-N 121.511 -0.743 . . . . 0.0 110.221 179.299 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' B' B ' 156' ' ' ALA . . . . . 0.579 ' O ' ' HB3' ' B' ' 160' ' ' ALA . . . -71.78 -26.68 62.52 Favored 'General case' 0 N--CA 1.497 1.889 0 O-C-N 121.523 -0.736 . . . . 0.0 110.723 179.511 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' B' B ' 157' ' ' LEU . . . . . 0.439 ' O ' ' HB3' ' B' ' 162' ' ' ALA . 13.9 mt -92.87 -41.97 9.77 Favored 'General case' 0 N--CA 1.495 1.82 0 O-C-N 121.273 -0.892 . . . . 0.0 111.326 -179.338 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' B' B ' 158' ' ' LEU . . . . . 0.585 HD12 ' HG2' ' B' ' 154' ' ' MET . 66.0 mt -97.36 2.21 50.29 Favored 'General case' 0 N--CA 1.5 2.06 0 O-C-N 121.198 -0.939 . . . . 0.0 111.597 -179.393 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' B' B ' 159' ' ' GLY . . . . . . . . . . . . . . . -139.59 42.34 1.24 Allowed Glycine 0 N--CA 1.496 2.689 0 N-CA-C 110.02 -1.232 . . . . 0.0 110.02 -179.973 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' B' B ' 160' ' ' ALA . . . . . 0.579 ' HB3' ' O ' ' B' ' 156' ' ' ALA . . . -165.4 -60.74 0.03 OUTLIER 'General case' 0 N--CA 1.496 1.857 0 O-C-N 121.41 -1.053 . . . . 0.0 110.081 179.841 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' B' B ' 161' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -106.38 -23.87 12.4 Favored 'General case' 0 N--CA 1.498 1.937 0 O-C-N 121.604 -0.685 . . . . 0.0 111.105 179.878 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' B' B ' 162' ' ' ALA . . . . . 0.439 ' HB3' ' O ' ' B' ' 157' ' ' LEU . . . -140.9 -172.14 3.4 Favored 'General case' 0 N--CA 1.496 1.83 0 O-C-N 121.126 -0.983 . . . . 0.0 110.008 179.7 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' B' B ' 163' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.497 1.921 0 O-C-N 121.361 -0.837 . . . . 0.0 110.654 179.898 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 90' ' ' ' CA' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 016 nuclear build full ' A' A ' 91' ' ' SXK . . . . . 0.653 ' CAK' HD13 ' A' ' 41' ' ' LEU . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 0.1 OUTLIER . . . . . 0 N--CA 1.496 1.872 0 CA-C-O 121.045 0.45 . . . . 0.0 109.875 . . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 2' ' ' ASP . . . . . . . . . . . . . 0.7 OUTLIER -163.45 -113.55 0.01 OUTLIER 'General case' 0 N--CA 1.495 1.825 0 O-C-N 121.45 -0.781 . . . . 0.0 110.443 -179.265 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 3' ' ' ASP . . . . . . . . . . . . . 1.3 m-20 -95.27 27.92 3.09 Favored 'General case' 0 N--CA 1.499 2.0 0 O-C-N 120.809 -1.182 . . . . 0.0 110.904 -179.94 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 4' ' ' ILE . . . . . . . . . . . . . 15.4 mt -62.3 -53.37 48.3 Favored 'Isoleucine or valine' 0 N--CA 1.501 2.095 0 O-C-N 121.176 -0.952 . . . . 0.0 110.51 -179.865 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 5' ' ' TYR . . . . . 0.568 ' CE1' ' HG2' ' A' ' 83' ' ' ARG . 6.3 m-85 -70.86 -34.76 71.97 Favored 'General case' 0 N--CA 1.498 1.932 0 O-C-N 121.351 -0.843 . . . . 0.0 110.686 -179.987 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -68.57 -30.41 69.18 Favored 'General case' 0 N--CA 1.498 1.969 0 O-C-N 121.251 -0.906 . . . . 0.0 110.53 179.614 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 7' ' ' ALA . . . . . . . . . . . . . . . -55.12 -36.27 65.55 Favored 'General case' 0 N--CA 1.5 2.033 0 O-C-N 121.236 -0.915 . . . . 0.0 109.784 179.146 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 8' ' ' ALA . . . . . 0.63 ' HB1' ' HB ' ' A' ' 82' ' ' VAL . . . -65.24 -35.3 80.62 Favored 'General case' 0 N--CA 1.496 1.842 0 O-C-N 121.586 -0.697 . . . . 0.0 109.778 178.768 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 9' ' ' VAL . . . . . 0.458 ' HA ' HG11 ' A' ' 82' ' ' VAL . 43.7 t -62.62 -32.96 57.23 Favored 'Isoleucine or valine' 0 N--CA 1.502 2.128 0 O-C-N 121.456 -0.777 . . . . 0.0 109.523 178.827 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 10' ' ' GLU . . . . . . . . . . . . . 9.3 mt-10 -88.57 -5.84 57.93 Favored 'General case' 0 N--CA 1.498 1.943 0 O-C-N 121.408 -0.808 . . . . 0.0 110.732 179.273 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 11' ' ' GLN . . . . . . . . . . . . . 1.4 mt-30 -87.97 -29.6 20.66 Favored 'General case' 0 N--CA 1.496 1.865 0 O-C-N 121.105 -0.997 . . . . 0.0 111.063 -179.809 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 12' ' ' LEU . . . . . 0.408 ' HB2' ' CB ' ' A' ' 16' ' ' GLN . 3.7 pp -66.98 153.11 44.43 Favored 'General case' 0 N--CA 1.5 2.065 0 O-C-N 121.104 -0.997 . . . . 0.0 110.739 -179.71 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 13' ' ' THR . . . . . . . . . . . . . 22.2 p -99.48 -177.55 3.62 Favored 'General case' 0 N--CA 1.501 2.105 0 O-C-N 121.416 -0.803 . . . . 0.0 111.368 -179.147 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 14' ' ' GLU . . . . . 0.44 ' O ' ' HB2' ' A' ' 18' ' ' ASN . 12.8 tp10 -53.86 -39.32 65.56 Favored 'General case' 0 N--CA 1.492 1.669 0 O-C-N 121.912 -0.492 . . . . 0.0 110.697 -179.683 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 1.5 mp0 -54.53 -36.95 64.82 Favored 'General case' 0 N--CA 1.5 2.055 0 O-C-N 121.463 -0.773 . . . . 0.0 110.783 179.766 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 16' ' ' GLN . . . . . 0.408 ' CB ' ' HB2' ' A' ' 12' ' ' LEU . 0.8 OUTLIER -72.18 -63.84 1.06 Allowed 'General case' 0 N--CA 1.497 1.897 0 O-C-N 121.292 -0.88 . . . . 0.0 111.146 -179.716 . . . . . . . . 3 3 . 1 . 017 nuclear build full ' A' A ' 17' ' ' LYS . . . . . 0.427 ' HG3' ' O ' ' A' ' 14' ' ' GLU . 5.3 ptmt -54.81 -32.54 60.47 Favored 'General case' 0 N--CA 1.503 2.194 0 O-C-N 121.839 -0.538 . . . . 0.0 111.347 -179.456 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 18' ' ' ASN . . . . . 0.44 ' HB2' ' O ' ' A' ' 14' ' ' GLU . 7.6 t-20 -70.02 -49.45 51.19 Favored 'General case' 0 N--CA 1.494 1.775 0 O-C-N 121.269 -0.894 . . . . 0.0 110.308 179.999 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 0.3 OUTLIER -62.91 -43.48 98.69 Favored 'General case' 0 N--CA 1.497 1.922 0 O-C-N 121.3 -0.875 . . . . 0.0 109.545 179.187 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 20' ' ' PHE . . . . . . . . . . . . . 12.7 m-85 -59.41 -33.79 71.66 Favored 'General case' 0 N--CA 1.497 1.918 0 O-C-N 121.447 -0.783 . . . . 0.0 109.769 178.941 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 21' ' ' LYS . . . . . 0.505 ' HG3' ' N ' ' A' ' 22' ' ' ALA . 0.0 OUTLIER -65.65 -41.78 92.16 Favored 'General case' 0 N--CA 1.496 1.832 0 O-C-N 121.538 -0.726 . . . . 0.0 109.233 178.629 . . . . . . . . 3 3 . 1 . 017 nuclear build full ' A' A ' 22' ' ' ALA . . . . . 0.658 ' O ' HD12 ' A' ' 26' ' ' ILE . . . -69.69 -45.45 68.27 Favored 'General case' 0 N--CA 1.496 1.828 0 O-C-N 121.286 -0.884 . . . . 0.0 109.589 179.181 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 23' ' ' ALA . . . . . . . . . . . . . . . -63.35 -49.73 72.74 Favored 'General case' 0 N--CA 1.497 1.897 0 O-C-N 121.648 -0.658 . . . . 0.0 110.455 179.412 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 24' ' ' PHE . . . . . 0.425 ' CD2' HD12 ' A' ' 36' ' ' ILE . 27.4 t80 -55.92 -43.55 77.45 Favored 'General case' 0 N--CA 1.5 2.069 0 O-C-N 121.507 -0.746 . . . . 0.0 110.47 179.724 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 25' ' ' ASP . . . . . . . . . . . . . 20.2 t70 -62.79 -52.14 64.36 Favored 'General case' 0 N--CA 1.496 1.841 0 O-C-N 121.625 -0.672 . . . . 0.0 110.387 179.815 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 26' ' ' ILE . . . . . 0.658 HD12 ' O ' ' A' ' 22' ' ' ALA . 1.9 mt -64.55 -28.29 44.52 Favored 'Isoleucine or valine' 0 N--CA 1.498 1.963 0 O-C-N 121.334 -0.854 . . . . 0.0 110.495 179.584 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 27' ' ' PHE . . . . . 0.482 ' CZ ' HG21 ' A' ' 44' ' ' VAL . 0.1 OUTLIER -63.9 -42.86 97.32 Favored 'General case' 0 N--CA 1.498 1.947 0 O-C-N 121.194 -0.942 . . . . 0.0 110.511 179.68 . . . . . . . . 3 3 . 1 . 017 nuclear build full ' A' A ' 28' ' ' VAL . . . . . . . . . . . . . 19.5 m -91.38 -35.7 7.32 Favored 'Isoleucine or valine' 0 N--CA 1.499 2.004 0 O-C-N 121.317 -0.864 . . . . 0.0 110.772 -179.975 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 29' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER 57.24 -87.64 0.02 OUTLIER 'General case' 0 N--CA 1.501 2.082 0 O-C-N 121.672 -0.643 . . . . 0.0 110.631 -179.63 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 30' ' ' GLY . . . . . . . . . . . . . . . -89.73 -16.99 55.68 Favored Glycine 0 N--CA 1.496 2.656 0 N-CA-C 110.14 -1.184 . . . . 0.0 110.14 179.421 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 31' ' ' ALA . . . . . . . . . . . . . . . -92.16 46.53 1.27 Allowed 'General case' 0 N--CA 1.499 1.984 0 O-C-N 121.095 -1.238 . . . . 0.0 110.322 179.747 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 32' ' ' GLU . . . . . . . . . . . . . 3.1 tt0 -63.56 -43.85 95.85 Favored 'General case' 0 N--CA 1.499 2.016 0 O-C-N 121.228 -0.92 . . . . 0.0 110.68 -179.824 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 19.9 t70 -70.26 -42.36 72.26 Favored 'General case' 0 N--CA 1.496 1.855 0 O-C-N 121.476 -0.765 . . . . 0.0 110.414 179.818 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 34' ' ' GLY . . . . . 0.442 ' O ' ' HB2' ' A' ' 35' ' ' CYS . . . -72.51 -14.83 77.43 Favored Glycine 0 N--CA 1.497 2.709 0 N-CA-C 110.674 -0.97 . . . . 0.0 110.674 179.867 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 35' ' ' CYS . . . . . 0.442 ' HB2' ' O ' ' A' ' 34' ' ' GLY . 12.7 m 60.45 -171.06 0.14 Allowed 'General case' 0 N--CA 1.502 2.139 0 O-C-N 121.467 -1.019 . . . . 0.0 111.08 -179.867 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 36' ' ' ILE . . . . . 0.425 HD12 ' CD2' ' A' ' 24' ' ' PHE . 65.2 mt -79.36 123.26 36.05 Favored 'Isoleucine or valine' 0 N--CA 1.499 2.009 0 O-C-N 121.191 -0.943 . . . . 0.0 111.059 -179.175 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 37' ' ' SER . . . . . 0.42 ' HB2' HG23 ' A' ' 71' ' ' THR . 18.3 t -125.08 -178.84 4.32 Favored 'General case' 0 N--CA 1.494 1.762 0 O-C-N 121.632 -0.667 . . . . 0.0 109.613 178.948 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 38' ' ' THR . . . . . . . . . . . . . 3.2 p -61.55 -36.34 80.34 Favored 'General case' 0 N--CA 1.501 2.117 0 O-C-N 121.324 -0.86 . . . . 0.0 110.597 179.709 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 39' ' ' LYS . . . . . . . . . . . . . 4.1 tptt -68.3 -34.28 75.86 Favored 'General case' 0 N--CA 1.498 1.951 0 O-C-N 121.529 -0.732 . . . . 0.0 110.804 179.843 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 40' ' ' GLU . . . . . 0.575 ' HA ' ' HD2' ' A' ' 43' ' ' LYS . 25.7 mm-40 -83.58 -24.14 31.65 Favored 'General case' 0 N--CA 1.499 1.978 0 O-C-N 121.299 -0.876 . . . . 0.0 111.083 -179.643 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 41' ' ' LEU . . . . . 0.754 HD12 HD22 ' A' ' 57' ' ' LEU . 3.4 tm? -70.22 -64.66 0.85 Allowed 'General case' 0 N--CA 1.499 1.99 0 O-C-N 121.135 -0.978 . . . . 0.0 109.711 179.519 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 42' ' ' GLY . . . . . . . . . . . . . . . -47.59 -31.85 7.44 Favored Glycine 0 N--CA 1.501 3.025 0 N-CA-C 110.621 -0.992 . . . . 0.0 110.621 179.836 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 43' ' ' LYS . . . . . 0.575 ' HD2' ' HA ' ' A' ' 40' ' ' GLU . 11.1 mttp -49.22 -49.29 43.73 Favored 'General case' 0 N--CA 1.503 2.187 0 O-C-N 121.572 -0.958 . . . . 0.0 110.91 179.602 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 44' ' ' VAL . . . . . 0.606 HG22 ' O ' ' A' ' 41' ' ' LEU . 33.6 m -81.76 -22.02 10.16 Favored 'Isoleucine or valine' 0 N--CA 1.503 2.204 0 O-C-N 121.322 -0.862 . . . . 0.0 111.204 -179.878 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 45' ' ' MET . . . . . 0.605 ' HE1' HG12 ' B' ' 148' ' ' ILE . 19.6 mmt -59.27 -38.74 80.87 Favored 'General case' 0 N--CA 1.502 2.13 0 O-C-N 121.121 -0.987 . . . . 0.0 110.258 179.672 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 46' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -57.7 -41.91 82.65 Favored 'General case' 0 N--CA 1.498 1.939 0 O-C-N 121.572 -0.705 . . . . 0.0 110.454 179.704 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 47' ' ' MET . . . . . . . . . . . . . 29.9 ttp -68.23 -36.05 78.88 Favored 'General case' 0 N--CA 1.498 1.937 0 O-C-N 121.494 -0.754 . . . . 0.0 110.562 179.693 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 48' ' ' LEU . . . . . . . . . . . . . 6.2 tp -75.02 -44.74 46.29 Favored 'General case' 0 N--CA 1.492 1.669 0 O-C-N 121.357 -0.839 . . . . 0.0 110.298 179.951 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 49' ' ' GLY . . . . . . . . . . . . . . . -155.28 -76.77 0.02 OUTLIER Glycine 0 N--CA 1.495 2.613 0 N-CA-C 110.024 -1.23 . . . . 0.0 110.024 179.918 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 50' ' ' GLN . . . . . . . . . . . . . 36.9 mt-30 -137.54 171.63 14.17 Favored 'General case' 0 N--CA 1.499 1.975 0 O-C-N 121.409 -1.053 . . . . 0.0 110.584 -179.833 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 51' ' ' ASN . . . . . . . . . . . . . 1.3 t30 -106.66 105.74 55.76 Favored Pre-proline 0 N--CA 1.499 1.993 0 O-C-N 121.225 -0.922 . . . . 0.0 111.266 -179.556 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 52' ' ' PRO . . . . . 0.598 ' HG2' HD11 ' A' ' 57' ' ' LEU . 46.8 Cg_endo -77.34 166.23 26.44 Favored 'Trans proline' 0 C--N 1.315 -1.225 0 O-C-N 123.668 1.352 . . . . 0.0 110.242 178.799 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 53' ' ' THR . . . . . . . . . . . . . 65.4 p -79.16 159.23 73.38 Favored Pre-proline 0 N--CA 1.5 2.044 0 O-C-N 121.198 -0.939 . . . . 0.0 110.833 -179.527 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 54' ' ' PRO . . . . . . . . . . . . . 41.6 Cg_endo -67.18 -38.7 15.0 Favored 'Trans proline' 0 N--CA 1.49 1.287 0 O-C-N 123.818 1.43 . . . . 0.0 110.817 179.793 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 55' ' ' GLU . . . . . 0.414 ' O ' ' HB2' ' A' ' 58' ' ' GLN . 0.1 OUTLIER -58.88 -39.61 81.91 Favored 'General case' 0 N--CA 1.498 1.933 0 O-C-N 121.394 -0.816 . . . . 0.0 110.107 179.505 . . . . . . . . 3 3 . 1 . 017 nuclear build full ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 5.8 mt-10 -66.58 -37.94 86.0 Favored 'General case' 0 N--CA 1.497 1.876 0 O-C-N 121.38 -0.825 . . . . 0.0 110.302 179.307 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 57' ' ' LEU . . . . . 0.754 HD22 HD12 ' A' ' 41' ' ' LEU . 9.0 mt -81.51 -9.79 59.62 Favored 'General case' 0 N--CA 1.499 1.993 0 O-C-N 121.332 -0.855 . . . . 0.0 111.25 179.958 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 58' ' ' GLN . . . . . 0.414 ' HB2' ' O ' ' A' ' 55' ' ' GLU . 9.7 mm100 -57.36 -52.1 66.7 Favored 'General case' 0 N--CA 1.5 2.062 0 O-C-N 120.997 -1.064 . . . . 0.0 110.113 -179.892 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 59' ' ' GLU . . . . . . . . . . . . . 10.9 tp10 -53.07 -40.11 63.79 Favored 'General case' 0 N--CA 1.498 1.936 0 O-C-N 121.623 -0.673 . . . . 0.0 110.362 179.461 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 60' ' ' MET . . . . . 0.495 ' HE2' HD23 ' A' ' 57' ' ' LEU . 0.4 OUTLIER -53.37 -34.44 57.64 Favored 'General case' 0 N--CA 1.501 2.082 0 O-C-N 121.415 -0.803 . . . . 0.0 110.376 179.389 . . . . . . . . 3 3 . 1 . 017 nuclear build full ' A' A ' 61' ' ' ILE . . . . . 0.574 HG12 HG23 ' A' ' 72' ' ' VAL . 15.1 mt -91.97 -44.27 14.19 Favored 'Isoleucine or valine' 0 N--CA 1.497 1.921 0 O-C-N 121.407 -0.808 . . . . 0.0 110.124 179.196 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 62' ' ' ASP . . . . . . . . . . . . . 71.8 m-20 -57.12 -33.17 67.07 Favored 'General case' 0 N--CA 1.5 2.026 0 O-C-N 121.465 -0.772 . . . . 0.0 111.04 -179.607 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 63' ' ' GLU . . . . . . . . . . . . . 1.9 tt0 -66.91 -26.85 67.06 Favored 'General case' 0 N--CA 1.5 2.044 0 O-C-N 121.186 -0.946 . . . . 0.0 111.035 179.809 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 64' ' ' VAL . . . . . 0.537 HG21 ' SD ' ' A' ' 80' ' ' MET . 24.5 m -117.14 9.96 7.22 Favored 'Isoleucine or valine' 0 N--CA 1.503 2.178 0 O-C-N 121.148 -0.97 . . . . 0.0 111.481 -179.882 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 65' ' ' ASP . . . . . . . . . . . . . 19.0 t70 -80.3 138.23 36.72 Favored 'General case' 0 N--CA 1.498 1.935 0 O-C-N 120.897 -1.127 . . . . 0.0 110.154 179.897 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 66' ' ' GLU . . . . . . . . . . . . . 21.2 mt-10 -128.77 24.07 5.74 Favored 'General case' 0 N--CA 1.497 1.914 0 O-C-N 121.376 -0.827 . . . . 0.0 111.642 -179.132 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 67' ' ' ASP . . . . . . . . . . . . . 42.6 p-10 -141.22 -0.3 1.45 Allowed 'General case' 0 N--CA 1.501 2.109 0 O-C-N 120.767 -1.208 . . . . 0.0 112.865 -179.91 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 68' ' ' GLY . . . . . . . . . . . . . . . 86.97 -21.27 20.68 Favored Glycine 0 N--CA 1.496 2.698 0 O-C-N 120.705 -1.247 . . . . 0.0 110.687 179.653 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 69' ' ' SER . . . . . . . . . . . . . 1.7 p -59.52 -27.99 66.68 Favored 'General case' 0 N--CA 1.499 1.987 0 O-C-N 121.253 -1.145 . . . . 0.0 110.482 179.83 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 70' ' ' GLY . . . . . . . . . . . . . . . 71.44 30.21 67.12 Favored Glycine 0 N--CA 1.498 2.817 0 N-CA-C 110.195 -1.162 . . . . 0.0 110.195 -179.981 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 71' ' ' THR . . . . . 0.42 HG23 ' HB2' ' A' ' 37' ' ' SER . 5.3 m -134.54 142.93 47.14 Favored 'General case' 0 N--CA 1.499 1.999 0 O-C-N 121.407 -1.055 . . . . 0.0 108.929 179.489 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 72' ' ' VAL . . . . . 0.574 HG23 HG12 ' A' ' 61' ' ' ILE . 17.0 t -75.92 113.49 14.91 Favored 'Isoleucine or valine' 0 N--CA 1.498 1.944 0 O-C-N 121.192 -0.943 . . . . 0.0 111.198 -179.002 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 73' ' ' ASP . . . . . . . . . . . . . 17.0 m-20 -88.48 -178.69 5.91 Favored 'General case' 0 N--CA 1.494 1.772 0 N-CA-C 108.7 -0.852 . . . . 0.0 108.7 178.409 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 74' ' ' PHE . . . . . . . . . . . . . 49.1 t80 -63.91 -42.18 97.47 Favored 'General case' 0 N--CA 1.499 2.015 0 O-C-N 120.905 -1.122 . . . . 0.0 109.828 179.266 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 75' ' ' ASP . . . . . . . . . . . . . 1.0 OUTLIER -66.54 -47.13 73.83 Favored 'General case' 0 N--CA 1.496 1.862 0 O-C-N 121.511 -0.743 . . . . 0.0 110.228 179.435 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 76' ' ' GLU . . . . . . . . . . . . . 72.4 mt-10 -63.95 -38.01 89.53 Favored 'General case' 0 N--CA 1.499 1.986 0 O-C-N 121.453 -0.779 . . . . 0.0 109.755 179.238 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 77' ' ' PHE . . . . . . . . . . . . . 75.7 t80 -57.11 -40.6 77.39 Favored 'General case' 0 N--CA 1.495 1.785 0 O-C-N 121.673 -0.642 . . . . 0.0 109.628 179.118 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 78' ' ' LEU . . . . . . . . . . . . . 43.2 mt -63.15 -43.68 97.64 Favored 'General case' 0 N--CA 1.498 1.945 0 O-C-N 121.396 -0.815 . . . . 0.0 109.476 178.802 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 79' ' ' VAL . . . . . . . . . . . . . 73.2 t -61.27 -39.53 82.93 Favored 'Isoleucine or valine' 0 N--CA 1.501 2.101 0 O-C-N 121.616 -0.677 . . . . 0.0 109.473 178.948 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 80' ' ' MET . . . . . 0.537 ' SD ' HG21 ' A' ' 64' ' ' VAL . 11.8 ttp -67.16 -35.19 79.16 Favored 'General case' 0 N--CA 1.496 1.866 0 O-C-N 121.486 -0.759 . . . . 0.0 110.096 179.168 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 81' ' ' MET . . . . . . . . . . . . . 11.3 mmt -70.49 -51.78 26.64 Favored 'General case' 0 N--CA 1.497 1.892 0 O-C-N 121.486 -0.758 . . . . 0.0 110.767 -179.915 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 82' ' ' VAL . . . . . 0.63 ' HB ' ' HB1' ' A' ' 8' ' ' ALA . 34.2 m -62.61 -24.53 35.65 Favored 'Isoleucine or valine' 0 N--CA 1.501 2.1 0 O-C-N 121.141 -0.975 . . . . 0.0 110.655 -179.982 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 83' ' ' ARG . . . . . 0.568 ' HG2' ' CE1' ' A' ' 5' ' ' TYR . 11.3 mtt180 -62.45 -31.48 72.2 Favored 'General case' 0 N--CA 1.499 1.99 0 O-C-N 121.232 -0.917 . . . . 0.0 110.206 179.145 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 84' ' ' CYS . . . . . . . . . . . . . 3.3 t -86.58 -30.88 21.52 Favored 'General case' 0 N--CA 1.494 1.765 0 O-C-N 121.479 -0.763 . . . . 0.0 109.474 178.651 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 85' ' ' MET . . . . . . . . . . . . . 30.9 mtm -74.52 -32.15 62.4 Favored 'General case' 0 N--CA 1.499 2.001 0 O-C-N 121.486 -0.759 . . . . 0.0 111.247 -179.96 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 86' ' ' LYS . . . . . 0.475 ' O ' ' HB3' ' A' ' 87' ' ' ASP . 0.1 OUTLIER -62.89 -25.69 68.43 Favored 'General case' 0 N--CA 1.502 2.169 0 O-C-N 121.219 -0.925 . . . . 0.0 111.185 -179.562 . . . . . . . . 3 3 . 1 . 017 nuclear build full ' A' A ' 87' ' ' ASP . . . . . 0.475 ' HB3' ' O ' ' A' ' 86' ' ' LYS . 31.6 t70 64.53 -69.53 0.09 Allowed 'General case' 0 N--CA 1.505 2.275 0 O-C-N 121.854 -0.529 . . . . 0.0 111.623 179.657 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 88' ' ' ASP . . . . . 0.46 ' CB ' ' O ' ' A' ' 87' ' ' ASP . 1.7 t70 75.13 -63.65 0.41 Allowed 'General case' 0 N--CA 1.505 2.304 0 O-C-N 121.76 -0.588 . . . . 0.0 110.629 -179.46 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 89' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER . . . . . 0 N--CA 1.497 1.914 0 CA-C-O 117.902 -1.047 . . . . 0.0 110.447 179.929 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' B' B ' 144' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.496 1.861 0 CA-C-O 121.089 0.471 . . . . 0.0 110.472 . . . . . . . . . 1 1 . 1 . 017 nuclear build full ' B' B ' 145' ' ' ARG . . . . . . . . . . . . . 1.1 ttp180 -146.46 142.16 27.84 Favored 'General case' 0 N--CA 1.494 1.759 0 O-C-N 121.412 -0.805 . . . . 0.0 110.311 -179.867 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' B' B ' 146' ' ' VAL . . . . . . . . . . . . . 14.5 p -120.59 138.37 51.31 Favored 'Isoleucine or valine' 0 N--CA 1.496 1.828 0 O-C-N 121.481 -0.762 . . . . 0.0 110.434 -179.852 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' B' B ' 147' ' ' ARG . . . . . 0.539 ' C ' HD12 ' B' ' 148' ' ' ILE . 0.0 OUTLIER -133.57 143.12 48.49 Favored 'General case' 0 N--CA 1.495 1.787 0 O-C-N 121.42 -0.8 . . . . 0.0 110.651 -179.739 . . . . . . . . 3 3 . 1 . 017 nuclear build full ' B' B ' 148' ' ' ILE . . . . . 0.605 HG12 ' HE1' ' A' ' 45' ' ' MET . 1.2 mp -123.92 138.66 52.86 Favored 'Isoleucine or valine' 0 N--CA 1.495 1.794 0 O-C-N 121.597 -0.689 . . . . 0.0 109.774 -179.957 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' B' B ' 149' ' ' SER . . . . . . . . . . . . . 45.5 t -104.38 167.43 9.75 Favored 'General case' 0 N--CA 1.493 1.692 0 O-C-N 121.614 -0.679 . . . . 0.0 110.227 179.762 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' B' B ' 150' ' ' ALA . . . . . . . . . . . . . . . -55.67 -38.37 69.52 Favored 'General case' 0 N--CA 1.497 1.906 0 O-C-N 121.678 -0.638 . . . . 0.0 110.591 179.836 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' B' B ' 151' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -65.35 -46.28 80.83 Favored 'General case' 0 N--CA 1.497 1.908 0 O-C-N 121.329 -0.857 . . . . 0.0 110.445 179.695 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' B' B ' 152' ' ' ALA . . . . . . . . . . . . . . . -51.0 -48.32 61.42 Favored 'General case' 0 N--CA 1.501 2.081 0 O-C-N 121.486 -0.759 . . . . 0.0 110.644 179.943 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' B' B ' 153' ' ' MET . . . . . . . . . . . . . 11.6 mmt -63.17 -42.9 99.49 Favored 'General case' 0 N--CA 1.498 1.973 0 O-C-N 121.357 -0.839 . . . . 0.0 110.099 179.468 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' B' B ' 154' ' ' MET . . . . . . . . . . . . . 13.2 mtt -64.55 -37.04 86.17 Favored 'General case' 0 N--CA 1.498 1.959 0 O-C-N 121.493 -0.755 . . . . 0.0 110.499 179.586 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' B' B ' 155' ' ' GLN . . . . . . . . . . . . . 0.3 OUTLIER -58.02 -33.98 69.55 Favored 'General case' 0 N--CA 1.502 2.166 0 O-C-N 121.419 -0.801 . . . . 0.0 111.533 -179.67 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' B' B ' 156' ' ' ALA . . . . . . . . . . . . . . . -100.8 -44.23 5.85 Favored 'General case' 0 N--CA 1.501 2.094 0 O-C-N 121.159 -0.963 . . . . 0.0 111.162 -179.598 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' B' B ' 157' ' ' LEU . . . . . . . . . . . . . 10.0 mt -75.78 -37.88 58.79 Favored 'General case' 0 N--CA 1.501 2.101 0 O-C-N 121.27 -0.894 . . . . 0.0 111.018 -179.493 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' B' B ' 158' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -113.54 32.82 5.53 Favored 'General case' 0 N--CA 1.498 1.929 0 O-C-N 121.257 -0.902 . . . . 0.0 110.375 179.877 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' B' B ' 159' ' ' GLY . . . . . 0.402 ' O ' ' HB3' ' B' ' 160' ' ' ALA . . . -168.77 -175.72 38.43 Favored Glycine 0 N--CA 1.495 2.587 0 N-CA-C 110.181 -1.168 . . . . 0.0 110.181 -179.806 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' B' B ' 160' ' ' ALA . . . . . 0.402 ' HB3' ' O ' ' B' ' 159' ' ' GLY . . . 59.54 -86.22 0.02 OUTLIER 'General case' 0 N--CA 1.503 2.196 0 O-C-N 121.864 -0.786 . . . . 0.0 110.967 -179.962 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' B' B ' 161' ' ' ARG . . . . . . . . . . . . . 2.5 tpm_? -100.57 -45.22 5.59 Favored 'General case' 0 N--CA 1.497 1.907 0 O-C-N 121.134 -0.979 . . . . 0.0 110.132 179.672 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' B' B ' 162' ' ' ALA . . . . . . . . . . . . . . . -96.49 179.36 5.04 Favored 'General case' 0 N--CA 1.494 1.738 0 O-C-N 121.632 -0.667 . . . . 0.0 109.992 179.816 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' B' B ' 163' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER . . . . . 0 N--CA 1.496 1.871 0 CA-C-O 117.798 -1.096 . . . . 0.0 110.876 -179.642 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 90' ' ' ' CA' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 017 nuclear build full ' A' A ' 91' ' ' SXK . . . . . 0.434 ' HAK' HD23 ' A' ' 41' ' ' LEU . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.497 1.899 0 N-CA-C 109.913 -0.403 . . . . 0.0 109.913 . . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 2' ' ' ASP . . . . . . . . . . . . . 14.2 t70 -129.74 142.75 50.65 Favored 'General case' 0 N--CA 1.494 1.744 0 O-C-N 121.312 -0.867 . . . . 0.0 110.837 -179.786 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 3' ' ' ASP . . . . . 0.504 ' HA ' ' HD2' ' A' ' 6' ' ' LYS . 1.1 m-20 -121.86 6.18 9.89 Favored 'General case' 0 N--CA 1.495 1.807 0 O-C-N 121.65 -0.656 . . . . 0.0 110.717 179.361 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 4' ' ' ILE . . . . . . . . . . . . . 2.7 mp -90.38 -40.55 12.89 Favored 'Isoleucine or valine' 0 N--CA 1.496 1.86 0 O-C-N 121.18 -0.95 . . . . 0.0 110.02 179.769 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 5' ' ' TYR . . . . . . . . . . . . . 5.8 m-85 -57.63 -30.01 65.03 Favored 'General case' 0 N--CA 1.5 2.048 0 O-C-N 121.306 -0.872 . . . . 0.0 110.082 179.384 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 6' ' ' LYS . . . . . 0.547 ' O ' HG12 ' A' ' 9' ' ' VAL . 14.8 mttt -61.15 -43.53 98.74 Favored 'General case' 0 N--CA 1.499 1.997 0 O-C-N 121.385 -0.822 . . . . 0.0 109.716 178.986 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 7' ' ' ALA . . . . . . . . . . . . . . . -55.32 -32.67 62.66 Favored 'General case' 0 N--CA 1.499 2.007 0 O-C-N 121.342 -0.849 . . . . 0.0 110.238 179.099 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 8' ' ' ALA . . . . . . . . . . . . . . . -71.32 -37.52 71.75 Favored 'General case' 0 N--CA 1.499 1.985 0 O-C-N 121.433 -0.792 . . . . 0.0 110.424 179.39 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 9' ' ' VAL . . . . . 0.576 ' HA ' HD11 ' A' ' 12' ' ' LEU . 0.3 OUTLIER -77.4 -23.1 14.37 Favored 'Isoleucine or valine' 0 N--CA 1.499 2.008 0 O-C-N 121.503 -0.748 . . . . 0.0 111.169 -179.66 . . . . . . . . 3 3 . 1 . 018 nuclear build full ' A' A ' 10' ' ' GLU . . . . . . . . . . . . . 28.1 mt-10 -92.89 -26.26 17.7 Favored 'General case' 0 N--CA 1.495 1.811 0 O-C-N 121.238 -0.914 . . . . 0.0 111.918 -179.233 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 11' ' ' GLN . . . . . . . . . . . . . 2.8 mt-30 -119.35 64.06 0.79 Allowed 'General case' 0 N--CA 1.499 2.009 0 O-C-N 120.825 -1.172 . . . . 0.0 112.239 -178.825 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 12' ' ' LEU . . . . . 0.576 HD11 ' HA ' ' A' ' 9' ' ' VAL . 0.5 OUTLIER -90.36 164.15 14.44 Favored 'General case' 0 N--CA 1.501 2.11 0 O-C-N 120.933 -1.105 . . . . 0.0 109.796 178.422 . . . . . . . . 3 3 . 1 . 018 nuclear build full ' A' A ' 13' ' ' THR . . . . . . . . . . . . . 39.4 p -79.47 162.46 25.43 Favored 'General case' 0 N--CA 1.499 1.999 0 O-C-N 121.005 -1.06 . . . . 0.0 109.379 178.658 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 14' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER -55.92 -33.21 64.47 Favored 'General case' 0 N--CA 1.493 1.693 0 O-C-N 121.389 -0.819 . . . . 0.0 110.709 -179.349 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 1.8 mp0 -73.71 -55.81 5.79 Favored 'General case' 0 N--CA 1.498 1.961 0 O-C-N 121.29 -0.881 . . . . 0.0 109.935 179.349 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 16' ' ' GLN . . . . . . . . . . . . . 2.1 mp0 -57.03 -53.59 56.33 Favored 'General case' 0 N--CA 1.503 2.177 0 O-C-N 121.425 -0.797 . . . . 0.0 110.891 -179.827 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 17' ' ' LYS . . . . . 0.507 ' HD3' ' HB2' ' A' ' 12' ' ' LEU . 2.6 ttpm? -57.65 -42.73 84.07 Favored 'General case' 0 N--CA 1.499 2.021 0 CA-C-N 116.228 -0.442 . . . . 0.0 110.96 -179.95 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 18' ' ' ASN . . . . . . . . . . . . . 14.7 t30 -70.62 -42.51 70.81 Favored 'General case' 0 N--CA 1.497 1.921 0 O-C-N 121.288 -0.882 . . . . 0.0 110.66 -179.993 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -56.96 -47.55 80.45 Favored 'General case' 0 N--CA 1.499 2.018 0 O-C-N 121.369 -0.832 . . . . 0.0 110.608 -179.657 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 20' ' ' PHE . . . . . . . . . . . . . 23.3 m-85 -64.7 -37.82 88.88 Favored 'General case' 0 N--CA 1.501 2.095 0 O-C-N 121.051 -1.03 . . . . 0.0 109.863 179.363 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 21' ' ' LYS . . . . . . . . . . . . . 17.3 tptp -62.7 -41.74 99.28 Favored 'General case' 0 N--CA 1.499 1.993 0 O-C-N 121.525 -0.734 . . . . 0.0 109.908 179.228 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 22' ' ' ALA . . . . . . . . . . . . . . . -77.73 -42.62 33.66 Favored 'General case' 0 N--CA 1.496 1.863 0 O-C-N 121.488 -0.757 . . . . 0.0 110.084 179.506 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 23' ' ' ALA . . . . . . . . . . . . . . . -62.71 -42.86 99.86 Favored 'General case' 0 N--CA 1.497 1.903 0 O-C-N 121.463 -0.773 . . . . 0.0 110.461 179.717 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 24' ' ' PHE . . . . . 0.453 ' CE1' HG13 ' A' ' 36' ' ' ILE . 79.7 t80 -62.96 -42.82 99.93 Favored 'General case' 0 N--CA 1.496 1.865 0 O-C-N 121.393 -0.817 . . . . 0.0 110.476 179.854 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 25' ' ' ASP . . . . . . . . . . . . . 0.7 OUTLIER -58.14 -45.38 87.48 Favored 'General case' 0 N--CA 1.499 2.02 0 O-C-N 121.44 -0.787 . . . . 0.0 110.253 179.784 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 26' ' ' ILE . . . . . . . . . . . . . 21.1 mt -68.19 -28.39 40.68 Favored 'Isoleucine or valine' 0 N--CA 1.497 1.912 0 O-C-N 121.42 -0.8 . . . . 0.0 109.611 178.956 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 27' ' ' PHE . . . . . 0.424 ' CE2' HD13 ' B' ' 157' ' ' LEU . 0.1 OUTLIER -73.11 -42.56 62.81 Favored 'General case' 0 N--CA 1.498 1.95 0 O-C-N 121.405 -0.809 . . . . 0.0 111.108 179.871 . . . . . . . . 3 3 . 1 . 018 nuclear build full ' A' A ' 28' ' ' VAL . . . . . 0.429 ' CG1' HG13 ' A' ' 36' ' ' ILE . 18.7 m -92.26 38.33 0.09 OUTLIER 'Isoleucine or valine' 0 N--CA 1.506 2.337 0 O-C-N 121.238 -0.914 . . . . 0.0 111.503 -179.471 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 29' ' ' LEU . . . . . . . . . . . . . 4.7 mt -69.3 -36.75 77.34 Favored 'General case' 0 N--CA 1.498 1.932 0 O-C-N 120.954 -1.091 . . . . 0.0 109.878 179.042 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 30' ' ' GLY . . . . . . . . . . . . . . . -102.67 38.32 3.26 Favored Glycine 0 N--CA 1.494 2.514 0 N-CA-C 109.372 -1.491 . . . . 0.0 109.372 179.018 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 31' ' ' ALA . . . . . . . . . . . . . . . -129.58 -171.82 2.6 Favored 'General case' 0 N--CA 1.496 1.853 0 O-C-N 121.575 -0.956 . . . . 0.0 110.371 -179.992 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 32' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER -136.47 153.93 50.9 Favored 'General case' 0 N--CA 1.492 1.65 0 O-C-N 121.284 -0.885 . . . . 0.0 109.736 179.888 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER 62.81 14.81 7.66 Favored 'General case' 0 N--CA 1.502 2.163 0 O-C-N 121.598 -0.689 . . . . 0.0 111.772 -179.727 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 34' ' ' GLY . . . . . . . . . . . . . . . 60.81 57.17 20.2 Favored Glycine 0 N--CA 1.496 2.668 0 N-CA-C 110.308 -1.117 . . . . 0.0 110.308 179.36 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 35' ' ' CYS . . . . . . . . . . . . . 3.3 t -135.25 127.89 30.86 Favored 'General case' 0 N--CA 1.497 1.906 0 O-C-N 121.475 -1.015 . . . . 0.0 110.093 179.7 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 36' ' ' ILE . . . . . 0.453 HG13 ' CE1' ' A' ' 24' ' ' PHE . 14.8 mt -76.51 132.37 33.11 Favored 'Isoleucine or valine' 0 N--CA 1.5 2.048 0 O-C-N 121.235 -0.916 . . . . 0.0 110.367 -179.775 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 37' ' ' SER . . . . . . . . . . . . . 22.9 t -117.14 173.36 6.71 Favored 'General case' 0 N--CA 1.496 1.848 0 O-C-N 121.601 -0.687 . . . . 0.0 109.804 179.126 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 38' ' ' THR . . . . . 0.503 ' HB ' ' O ' ' A' ' 54' ' ' PRO . 23.3 p -61.04 -45.8 93.31 Favored 'General case' 0 N--CA 1.502 2.153 0 O-C-N 121.215 -0.928 . . . . 0.0 110.613 -180.0 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 39' ' ' LYS . . . . . . . . . . . . . 9.6 tmtt? -59.64 -35.18 73.89 Favored 'General case' 0 N--CA 1.499 1.976 0 O-C-N 121.596 -0.69 . . . . 0.0 110.557 179.728 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 40' ' ' GLU . . . . . 0.401 ' O ' ' HB3' ' A' ' 43' ' ' LYS . 9.3 mm-40 -69.58 -36.68 76.48 Favored 'General case' 0 N--CA 1.497 1.899 0 O-C-N 121.363 -0.836 . . . . 0.0 110.579 -179.968 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 41' ' ' LEU . . . . . 0.566 HD23 ' HB3' ' A' ' 57' ' ' LEU . 6.8 tp -67.59 -45.16 76.32 Favored 'General case' 0 N--CA 1.497 1.922 0 O-C-N 121.028 -1.045 . . . . 0.0 109.053 178.748 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 42' ' ' GLY . . . . . . . . . . . . . . . -57.73 -34.3 70.21 Favored Glycine 0 N--CA 1.491 2.316 0 N-CA-C 110.073 -1.211 . . . . 0.0 110.073 179.862 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 43' ' ' LYS . . . . . 0.401 ' HB3' ' O ' ' A' ' 40' ' ' GLU . 15.2 ttpt -54.0 -37.96 64.57 Favored 'General case' 0 N--CA 1.501 2.11 0 O-C-N 121.472 -1.017 . . . . 0.0 109.773 179.057 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 44' ' ' VAL . . . . . . . . . . . . . 98.0 t -84.55 -41.24 15.92 Favored 'Isoleucine or valine' 0 N--CA 1.499 2.017 0 O-C-N 121.395 -0.816 . . . . 0.0 109.699 179.097 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 45' ' ' MET . . . . . . . . . . . . . 2.6 mtt -64.31 -22.67 67.03 Favored 'General case' 0 N--CA 1.502 2.149 0 O-C-N 121.485 -0.759 . . . . 0.0 110.992 179.564 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 46' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -49.6 -40.96 40.75 Favored 'General case' 0 N--CA 1.501 2.079 0 O-C-N 121.364 -0.835 . . . . 0.0 111.555 -179.642 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 47' ' ' MET . . . . . . . . . . . . . 2.7 ptt? -94.39 4.23 54.13 Favored 'General case' 0 N--CA 1.5 2.037 0 O-C-N 121.26 -0.9 . . . . 0.0 111.741 -179.646 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 48' ' ' LEU . . . . . . . . . . . . . 43.0 tp -132.84 -64.07 0.76 Allowed 'General case' 0 N--CA 1.493 1.723 0 O-C-N 120.803 -1.185 . . . . 0.0 111.045 -179.466 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 49' ' ' GLY . . . . . 0.463 ' O ' ' HB2' ' A' ' 50' ' ' GLN . . . -96.96 19.24 55.58 Favored Glycine 0 N--CA 1.498 2.772 0 C-N-CA 120.405 -0.903 . . . . 0.0 111.115 -179.464 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 50' ' ' GLN . . . . . 0.463 ' HB2' ' O ' ' A' ' 49' ' ' GLY . 36.1 mt-30 65.19 -68.4 0.11 Allowed 'General case' 0 N--CA 1.507 2.407 0 CA-C-N 118.254 1.027 . . . . 0.0 111.469 179.661 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 51' ' ' ASN . . . . . . . . . . . . . 0.9 OUTLIER 63.49 94.28 0.05 OUTLIER Pre-proline 0 N--CA 1.504 2.227 0 O-C-N 121.492 -0.755 . . . . 0.0 110.956 -179.759 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 52' ' ' PRO . . . . . . . . . . . . . 49.2 Cg_endo -75.41 -42.96 0.4 Allowed 'Trans proline' 0 N--CA 1.49 1.274 0 O-C-N 123.747 1.393 . . . . 0.0 111.212 179.819 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 53' ' ' THR . . . . . 0.603 HG23 ' HB2' ' A' ' 56' ' ' GLU . 0.0 OUTLIER -143.54 153.94 59.23 Favored Pre-proline 0 N--CA 1.501 2.086 0 O-C-N 121.198 -0.939 . . . . 0.0 110.622 -179.875 . . . . . . . . 3 3 . 1 . 018 nuclear build full ' A' A ' 54' ' ' PRO . . . . . 0.503 ' O ' ' HB ' ' A' ' 38' ' ' THR . 44.2 Cg_endo -69.9 -42.08 3.56 Favored 'Trans proline' 0 C--N 1.312 -1.382 0 O-C-N 124.111 1.585 . . . . 0.0 110.774 179.431 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 55' ' ' GLU . . . . . . . . . . . . . 3.0 mp0 -55.04 -28.6 53.43 Favored 'General case' 0 N--CA 1.504 2.24 0 O-C-N 121.312 -0.867 . . . . 0.0 111.045 179.997 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 56' ' ' GLU . . . . . 0.603 ' HB2' HG23 ' A' ' 53' ' ' THR . 22.5 tt0 -65.74 -29.96 70.55 Favored 'General case' 0 N--CA 1.496 1.836 0 O-C-N 121.317 -0.865 . . . . 0.0 111.206 179.91 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 57' ' ' LEU . . . . . 0.67 HD22 ' N ' ' A' ' 57' ' ' LEU . 3.1 mm? -84.51 -12.95 53.26 Favored 'General case' 0 N--CA 1.5 2.035 0 O-C-N 120.949 -1.095 . . . . 0.0 111.58 -179.459 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 58' ' ' GLN . . . . . 0.673 ' HA ' HG22 ' A' ' 61' ' ' ILE . 0.0 OUTLIER -57.2 -30.57 64.67 Favored 'General case' 0 N--CA 1.502 2.132 0 O-C-N 121.126 -0.984 . . . . 0.0 109.525 179.545 . . . . . . . . 3 3 . 1 . 018 nuclear build full ' A' A ' 59' ' ' GLU . . . . . . . . . . . . . 0.7 OUTLIER -61.9 -37.46 84.69 Favored 'General case' 0 N--CA 1.498 1.966 0 O-C-N 121.058 -1.027 . . . . 0.0 109.013 178.214 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 60' ' ' MET . . . . . . . . . . . . . 0.7 OUTLIER -72.55 -40.54 66.63 Favored 'General case' 0 N--CA 1.495 1.786 0 O-C-N 121.798 -0.564 . . . . 0.0 110.509 179.49 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 61' ' ' ILE . . . . . 0.673 HG22 ' HA ' ' A' ' 58' ' ' GLN . 15.2 tt -76.23 -38.32 33.63 Favored 'Isoleucine or valine' 0 N--CA 1.498 1.954 0 O-C-N 121.245 -0.909 . . . . 0.0 111.019 -179.75 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 62' ' ' ASP . . . . . . . . . . . . . 0.7 OUTLIER -66.84 -35.23 79.58 Favored 'General case' 0 N--CA 1.499 2.023 0 O-C-N 121.148 -0.97 . . . . 0.0 110.433 179.928 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 63' ' ' GLU . . . . . . . . . . . . . 1.2 tt0 -56.84 -34.27 67.59 Favored 'General case' 0 N--CA 1.499 1.982 0 O-C-N 121.535 -0.728 . . . . 0.0 110.452 179.412 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 64' ' ' VAL . . . . . 0.54 HG11 ' HB2' ' A' ' 80' ' ' MET . 27.5 t -101.63 -20.64 5.47 Favored 'Isoleucine or valine' 0 N--CA 1.496 1.872 0 O-C-N 121.311 -0.868 . . . . 0.0 110.651 179.632 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 65' ' ' ASP . . . . . . . . . . . . . 30.0 t70 -58.55 -70.93 0.13 Allowed 'General case' 0 N--CA 1.5 2.071 0 O-C-N 121.359 -0.838 . . . . 0.0 110.778 -179.641 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 66' ' ' GLU . . . . . . . . . . . . . 15.8 mm-40 49.18 30.61 3.12 Favored 'General case' 0 N--CA 1.504 2.23 0 O-C-N 121.489 -0.757 . . . . 0.0 110.293 -179.209 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 67' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -105.05 -29.15 10.61 Favored 'General case' 0 N--CA 1.492 1.633 0 O-C-N 121.604 -0.685 . . . . 0.0 110.549 -179.45 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 68' ' ' GLY . . . . . . . . . . . . . . . 110.92 -11.68 29.56 Favored Glycine 0 N--CA 1.495 2.569 0 N-CA-C 109.406 -1.477 . . . . 0.0 109.406 -178.729 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 69' ' ' SER . . . . . . . . . . . . . 89.7 p -102.32 -42.89 5.85 Favored 'General case' 0 N--CA 1.495 1.818 0 O-C-N 121.468 -1.019 . . . . 0.0 111.015 -179.847 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 70' ' ' GLY . . . . . . . . . . . . . . . 95.31 38.14 4.88 Favored Glycine 0 N--CA 1.496 2.657 0 N-CA-C 108.417 -1.873 . . . . 0.0 108.417 -178.954 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 71' ' ' THR . . . . . . . . . . . . . 8.1 p -142.6 134.31 26.77 Favored 'General case' 0 N--CA 1.492 1.648 0 O-C-N 121.763 -0.845 . . . . 0.0 109.954 -179.086 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 72' ' ' VAL . . . . . . . . . . . . . 2.9 t -103.05 113.56 40.16 Favored 'Isoleucine or valine' 0 N--CA 1.494 1.733 0 O-C-N 121.386 -0.821 . . . . 0.0 110.59 -179.859 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 73' ' ' ASP . . . . . . . . . . . . . 1.6 p-10 -87.15 -159.32 0.5 Allowed 'General case' 0 N--CA 1.496 1.83 0 O-C-N 121.493 -0.754 . . . . 0.0 110.042 179.581 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 74' ' ' PHE . . . . . . . . . . . . . 46.7 t80 -61.67 -51.87 66.64 Favored 'General case' 0 N--CA 1.496 1.866 0 O-C-N 121.303 -0.873 . . . . 0.0 110.323 179.812 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 75' ' ' ASP . . . . . 0.418 ' HA ' HD23 ' A' ' 78' ' ' LEU . 0.3 OUTLIER -61.61 -47.31 86.01 Favored 'General case' 0 N--CA 1.496 1.87 0 O-C-N 121.518 -0.738 . . . . 0.0 110.675 -179.935 . . . . . . . . 3 3 . 1 . 018 nuclear build full ' A' A ' 76' ' ' GLU . . . . . . . . . . . . . 14.2 mt-10 -63.58 -33.53 75.81 Favored 'General case' 0 N--CA 1.499 2.004 0 O-C-N 121.327 -0.858 . . . . 0.0 110.433 179.586 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 77' ' ' PHE . . . . . . . . . . . . . 33.6 t80 -76.68 -46.2 26.59 Favored 'General case' 0 N--CA 1.497 1.886 0 O-C-N 121.173 -0.954 . . . . 0.0 110.033 179.358 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 78' ' ' LEU . . . . . 0.568 HD11 HD11 ' A' ' 12' ' ' LEU . 0.1 OUTLIER -66.44 -36.14 82.05 Favored 'General case' 0 N--CA 1.498 1.946 0 O-C-N 121.429 -0.794 . . . . 0.0 110.429 -179.791 . . . . . . . . 3 3 . 1 . 018 nuclear build full ' A' A ' 79' ' ' VAL . . . . . 0.488 ' N ' ' HG ' ' A' ' 78' ' ' LEU . 4.3 p -71.78 -33.91 49.97 Favored 'Isoleucine or valine' 0 N--CA 1.499 2.015 0 O-C-N 120.951 -1.093 . . . . 0.0 109.206 178.684 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 80' ' ' MET . . . . . 0.54 ' HB2' HG11 ' A' ' 64' ' ' VAL . 56.2 ttp -61.24 -33.53 73.67 Favored 'General case' 0 N--CA 1.496 1.829 0 O-C-N 121.545 -0.722 . . . . 0.0 109.198 178.415 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 81' ' ' MET . . . . . . . . . . . . . 9.1 mmt -62.96 -42.85 99.95 Favored 'General case' 0 N--CA 1.494 1.763 0 O-C-N 121.667 -0.646 . . . . 0.0 109.544 178.881 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 82' ' ' VAL . . . . . . . . . . . . . 71.9 t -60.69 -38.85 79.76 Favored 'Isoleucine or valine' 0 N--CA 1.5 2.06 0 O-C-N 121.478 -0.764 . . . . 0.0 109.363 178.832 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 83' ' ' ARG . . . . . . . . . . . . . 20.1 mtp180 -62.79 -37.06 85.18 Favored 'General case' 0 N--CA 1.498 1.965 0 O-C-N 121.372 -0.83 . . . . 0.0 109.383 178.62 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 84' ' ' CYS . . . . . 0.618 ' SG ' ' HAF' ' A' ' 91' ' ' SXK . 66.7 m -78.86 -24.88 44.04 Favored 'General case' 0 N--CA 1.496 1.863 0 O-C-N 121.577 -0.702 . . . . 0.0 110.311 179.226 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 85' ' ' MET . . . . . . . . . . . . . 2.5 mtp -80.0 51.82 1.41 Allowed 'General case' 0 N--CA 1.499 2.012 0 O-C-N 121.28 -0.888 . . . . 0.0 109.7 179.156 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 86' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -165.51 128.53 2.16 Favored 'General case' 0 N--CA 1.493 1.716 0 O-C-N 121.282 -0.886 . . . . 0.0 109.924 -179.482 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 87' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -112.93 -61.81 1.68 Allowed 'General case' 0 N--CA 1.495 1.807 0 O-C-N 121.446 -0.784 . . . . 0.0 111.022 -179.505 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 88' ' ' ASP . . . . . . . . . . . . . 21.5 t70 -94.35 -63.14 1.22 Allowed 'General case' 0 N--CA 1.499 1.978 0 O-C-N 121.195 -0.94 . . . . 0.0 110.623 -179.805 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 89' ' ' SER . . . . . . . . . . . . . 7.7 t . . . . . 0 N--CA 1.495 1.814 0 CA-C-O 117.805 -1.093 . . . . 0.0 110.251 179.948 . . . . . . . . 0 0 . 1 . 018 nuclear build full ' B' B ' 144' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER . . . . . 0 N--CA 1.499 1.997 0 CA-C-O 121.272 0.558 . . . . 0.0 110.401 . . . . . . . . . 1 1 . 1 . 018 nuclear build full ' B' B ' 145' ' ' ARG . . . . . . . . . . . . . 4.1 tpt85 -158.76 -58.52 0.07 Allowed 'General case' 0 N--CA 1.498 1.929 0 O-C-N 121.241 -0.912 . . . . 0.0 111.173 -179.901 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' B' B ' 146' ' ' VAL . . . . . 0.739 HG21 HD12 ' B' ' 148' ' ' ILE . 28.3 m -77.61 -13.79 14.16 Favored 'Isoleucine or valine' 0 N--CA 1.505 2.316 0 O-C-N 121.263 -0.898 . . . . 0.0 112.234 -178.821 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' B' B ' 147' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER 56.69 40.35 29.26 Favored 'General case' 0 N--CA 1.504 2.231 0 O-C-N 121.149 -0.969 . . . . 0.0 111.039 -179.872 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' B' B ' 148' ' ' ILE . . . . . 0.739 HD12 HG21 ' B' ' 146' ' ' VAL . 0.4 OUTLIER -77.85 135.94 25.23 Favored 'Isoleucine or valine' 0 N--CA 1.501 2.075 0 O-C-N 121.278 -0.889 . . . . 0.0 110.039 179.801 . . . . . . . . 3 3 . 1 . 018 nuclear build full ' B' B ' 149' ' ' SER . . . . . 0.404 ' HA ' ' HB3' ' A' ' 84' ' ' CYS . 40.8 t -107.1 172.57 6.75 Favored 'General case' 0 N--CA 1.5 2.042 0 O-C-N 121.204 -0.935 . . . . 0.0 111.163 -179.255 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' B' B ' 150' ' ' ALA . . . . . . . . . . . . . . . -55.75 -50.58 70.0 Favored 'General case' 0 N--CA 1.499 2.019 0 O-C-N 121.72 -0.612 . . . . 0.0 111.084 -179.792 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' B' B ' 151' ' ' ASP . . . . . . . . . . . . . 4.7 p-10 -56.97 -37.28 71.39 Favored 'General case' 0 N--CA 1.501 2.083 0 O-C-N 121.392 -0.817 . . . . 0.0 110.696 179.893 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' B' B ' 152' ' ' ALA . . . . . . . . . . . . . . . -70.44 -45.29 66.12 Favored 'General case' 0 N--CA 1.495 1.803 0 O-C-N 121.321 -0.862 . . . . 0.0 109.636 179.304 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' B' B ' 153' ' ' MET . . . . . 0.6 ' HG3' ' HAJ' ' A' ' 91' ' ' SXK . 1.1 mmt -62.74 -40.95 98.83 Favored 'General case' 0 N--CA 1.496 1.86 0 O-C-N 121.613 -0.68 . . . . 0.0 110.137 179.364 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' B' B ' 154' ' ' MET . . . . . . . . . . . . . 9.9 mmt -61.86 -47.94 82.77 Favored 'General case' 0 N--CA 1.499 1.993 0 O-C-N 121.358 -0.839 . . . . 0.0 109.956 179.458 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' B' B ' 155' ' ' GLN . . . . . . . . . . . . . 13.9 mt-30 -68.72 -29.69 68.16 Favored 'General case' 0 N--CA 1.498 1.973 0 O-C-N 121.338 -0.851 . . . . 0.0 110.505 179.334 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' B' B ' 156' ' ' ALA . . . . . 0.497 ' O ' ' HB3' ' B' ' 160' ' ' ALA . . . -80.39 -20.32 44.28 Favored 'General case' 0 N--CA 1.498 1.973 0 O-C-N 121.243 -0.911 . . . . 0.0 111.082 179.867 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' B' B ' 157' ' ' LEU . . . . . 0.424 HD13 ' CE2' ' A' ' 27' ' ' PHE . 13.6 tp -96.59 -49.18 5.22 Favored 'General case' 0 N--CA 1.497 1.907 0 O-C-N 121.041 -1.037 . . . . 0.0 111.017 -179.685 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' B' B ' 158' ' ' LEU . . . . . 0.438 ' HA ' ' HB2' ' B' ' 162' ' ' ALA . 19.0 mt -96.64 -29.56 13.76 Favored 'General case' 0 N--CA 1.5 2.069 0 O-C-N 121.15 -0.969 . . . . 0.0 111.587 -179.24 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' B' B ' 159' ' ' GLY . . . . . . . . . . . . . . . -84.91 -31.82 22.62 Favored Glycine 0 N--CA 1.498 2.829 0 O-C-N 121.153 -0.967 . . . . 0.0 110.886 -179.24 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' B' B ' 160' ' ' ALA . . . . . 0.497 ' HB3' ' O ' ' B' ' 156' ' ' ALA . . . -83.32 78.79 9.57 Favored 'General case' 0 N--CA 1.497 1.921 0 O-C-N 121.139 -1.212 . . . . 0.0 111.214 -179.167 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' B' B ' 161' ' ' ARG . . . . . . . . . . . . . 0.3 OUTLIER 46.48 74.2 0.15 Allowed 'General case' 0 N--CA 1.504 2.238 0 O-C-N 121.582 -0.699 . . . . 0.0 111.544 179.338 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' B' B ' 162' ' ' ALA . . . . . 0.438 ' HB2' ' HA ' ' B' ' 158' ' ' LEU . . . -89.66 133.45 34.64 Favored 'General case' 0 N--CA 1.496 1.83 0 O-C-N 121.139 -0.976 . . . . 0.0 109.726 179.126 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' B' B ' 163' ' ' LYS . . . . . 0.414 ' HB3' ' O ' ' B' ' 162' ' ' ALA . 0.0 OUTLIER . . . . . 0 N--CA 1.505 2.295 0 CA-C-O 118.776 -0.63 . . . . 0.0 110.598 -179.603 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 90' ' ' ' CA' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 018 nuclear build full ' A' A ' 91' ' ' SXK . . . . . 0.618 ' HAF' ' SG ' ' A' ' 84' ' ' CYS . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 1.7 tpp . . . . . 0 N--CA 1.498 1.938 0 CA-C-O 120.858 0.361 . . . . 0.0 110.244 . . . . . . . . . 0 0 . 1 . 019 nuclear build full ' A' A ' 2' ' ' ASP . . . . . . . . . . . . . 4.4 t70 -97.61 62.06 1.65 Allowed 'General case' 0 N--CA 1.495 1.805 0 O-C-N 121.333 -0.855 . . . . 0.0 109.787 179.584 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 3' ' ' ASP . . . . . . . . . . . . . 8.0 m-20 -90.0 -34.99 15.78 Favored 'General case' 0 N--CA 1.495 1.788 0 O-C-N 121.36 -0.837 . . . . 0.0 110.632 -179.453 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 4' ' ' ILE . . . . . . . . . . . . . 72.3 mt -57.88 -49.5 80.88 Favored 'Isoleucine or valine' 0 N--CA 1.502 2.17 0 O-C-N 121.347 -0.845 . . . . 0.0 110.371 179.842 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 5' ' ' TYR . . . . . . . . . . . . . 44.1 m-85 -66.26 -42.22 88.81 Favored 'General case' 0 N--CA 1.501 2.122 0 O-C-N 121.244 -0.91 . . . . 0.0 110.525 179.931 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 6' ' ' LYS . . . . . 0.483 ' HB3' ' HE3' ' A' ' 6' ' ' LYS . 15.9 mtpp -65.3 -32.18 73.7 Favored 'General case' 0 N--CA 1.493 1.683 0 O-C-N 121.332 -0.855 . . . . 0.0 110.415 179.99 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 7' ' ' ALA . . . . . . . . . . . . . . . -51.65 -42.91 62.42 Favored 'General case' 0 N--CA 1.498 1.954 0 O-C-N 121.253 -0.904 . . . . 0.0 109.306 178.803 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 8' ' ' ALA . . . . . 0.472 ' HB3' HG21 ' A' ' 82' ' ' VAL . . . -70.23 -42.24 72.5 Favored 'General case' 0 N--CA 1.495 1.812 0 O-C-N 121.503 -0.748 . . . . 0.0 109.158 178.218 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 9' ' ' VAL . . . . . 0.768 HG13 ' HB3' ' A' ' 78' ' ' LEU . 69.7 t -61.52 -40.53 86.79 Favored 'Isoleucine or valine' 0 N--CA 1.5 2.034 0 O-C-N 121.704 -0.623 . . . . 0.0 110.103 179.15 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 10' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER -69.16 -28.83 66.77 Favored 'General case' 0 N--CA 1.497 1.912 0 O-C-N 121.512 -0.743 . . . . 0.0 110.587 179.7 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 11' ' ' GLN . . . . . . . . . . . . . 0.1 OUTLIER -92.42 41.61 1.08 Allowed 'General case' 0 N--CA 1.496 1.836 0 O-C-N 121.279 -0.888 . . . . 0.0 110.946 -179.754 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 12' ' ' LEU . . . . . 0.557 HD12 ' HA ' ' A' ' 9' ' ' VAL . 10.7 mt -106.8 123.82 48.71 Favored 'General case' 0 N--CA 1.497 1.904 0 O-C-N 121.134 -0.979 . . . . 0.0 110.177 179.516 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 13' ' ' THR . . . . . . . . . . . . . 0.3 OUTLIER -79.69 164.49 23.7 Favored 'General case' 0 N--CA 1.498 1.927 0 O-C-N 121.193 -0.942 . . . . 0.0 110.07 179.621 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 14' ' ' GLU . . . . . . . . . . . . . 0.2 OUTLIER -52.54 -30.75 32.2 Favored 'General case' 0 N--CA 1.497 1.879 0 O-C-N 121.625 -0.672 . . . . 0.0 111.196 -179.281 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 1.5 mp0 -59.65 -51.23 70.71 Favored 'General case' 0 N--CA 1.497 1.892 0 O-C-N 121.449 -0.782 . . . . 0.0 109.838 179.483 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 16' ' ' GLN . . . . . . . . . . . . . 3.0 mp0 -79.99 -26.79 39.77 Favored 'General case' 0 N--CA 1.5 2.03 0 O-C-N 121.452 -0.78 . . . . 0.0 110.12 179.148 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 17' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -69.15 -42.57 75.76 Favored 'General case' 0 N--CA 1.496 1.867 0 O-C-N 121.628 -0.67 . . . . 0.0 110.097 179.707 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 18' ' ' ASN . . . . . 0.508 ' HA ' ' HG2' ' A' ' 21' ' ' LYS . 12.2 t30 -56.9 -39.69 74.89 Favored 'General case' 0 N--CA 1.499 2.002 0 O-C-N 121.6 -0.688 . . . . 0.0 110.761 179.923 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 4.4 mt-10 -54.88 -48.51 72.9 Favored 'General case' 0 N--CA 1.499 2.011 0 O-C-N 121.33 -0.856 . . . . 0.0 109.987 179.553 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 20' ' ' PHE . . . . . . . . . . . . . 43.9 m-85 -77.65 -33.58 53.41 Favored 'General case' 0 N--CA 1.497 1.919 0 O-C-N 121.436 -0.79 . . . . 0.0 110.282 179.516 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 21' ' ' LYS . . . . . 0.514 ' HG3' ' N ' ' A' ' 22' ' ' ALA . 0.0 OUTLIER -64.21 -34.31 77.79 Favored 'General case' 0 N--CA 1.496 1.858 0 O-C-N 121.183 -0.948 . . . . 0.0 109.508 179.02 . . . . . . . . 3 3 . 1 . 019 nuclear build full ' A' A ' 22' ' ' ALA . . . . . 0.514 ' N ' ' HG3' ' A' ' 21' ' ' LYS . . . -76.02 -41.52 50.74 Favored 'General case' 0 N--CA 1.496 1.873 0 O-C-N 121.556 -0.715 . . . . 0.0 109.153 178.434 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 23' ' ' ALA . . . . . 0.492 ' O ' ' HB2' ' A' ' 27' ' ' PHE . . . -73.3 -7.27 50.83 Favored 'General case' 0 N--CA 1.494 1.732 0 O-C-N 121.679 -0.638 . . . . 0.0 110.75 178.975 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 24' ' ' PHE . . . . . . . . . . . . . 38.5 t80 -107.92 -49.32 3.23 Favored 'General case' 0 N--CA 1.495 1.793 0 O-C-N 121.181 -0.949 . . . . 0.0 110.795 -179.574 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 25' ' ' ASP . . . . . . . . . . . . . 0.1 OUTLIER -61.38 -41.84 97.75 Favored 'General case' 0 N--CA 1.5 2.065 0 O-C-N 121.307 -0.871 . . . . 0.0 110.891 -179.389 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 26' ' ' ILE . . . . . . . . . . . . . 37.4 mt -76.62 -27.05 16.83 Favored 'Isoleucine or valine' 0 N--CA 1.499 1.977 0 O-C-N 121.152 -0.968 . . . . 0.0 109.798 179.037 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 27' ' ' PHE . . . . . 0.567 ' HA ' HD21 ' B' ' 157' ' ' LEU . 1.7 t80 -59.08 -50.6 73.45 Favored 'General case' 0 N--CA 1.497 1.894 0 O-C-N 121.638 -0.664 . . . . 0.0 110.421 179.484 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 28' ' ' VAL . . . . . . . . . . . . . 18.6 m -91.04 -35.4 7.12 Favored 'Isoleucine or valine' 0 N--CA 1.497 1.906 0 O-C-N 121.555 -0.716 . . . . 0.0 111.254 -179.288 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 29' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER 46.48 43.66 12.31 Favored 'General case' 0 N--CA 1.497 1.919 0 O-C-N 121.45 -0.781 . . . . 0.0 110.218 -179.654 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 30' ' ' GLY . . . . . . . . . . . . . . . 106.06 -62.04 0.33 Allowed Glycine 0 N--CA 1.494 2.503 0 N-CA-C 108.794 -1.722 . . . . 0.0 108.794 -178.768 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 31' ' ' ALA . . . . . . . . . . . . . . . 47.88 56.64 6.95 Favored 'General case' 0 N--CA 1.501 2.121 0 O-C-N 121.81 -0.817 . . . . 0.0 111.13 179.531 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 32' ' ' GLU . . . . . . . . . . . . . 2.8 mm-40 51.33 32.47 8.44 Favored 'General case' 0 N--CA 1.502 2.13 0 O-C-N 121.644 -0.66 . . . . 0.0 110.979 179.938 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 1.2 t70 55.17 53.52 10.02 Favored 'General case' 0 N--CA 1.499 2.017 0 O-C-N 121.49 -0.756 . . . . 0.0 110.696 -179.848 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 34' ' ' GLY . . . . . 0.508 ' O ' HG21 ' A' ' 71' ' ' THR . . . -145.46 31.29 1.68 Allowed Glycine 0 N--CA 1.499 2.839 0 C-N-CA 119.883 -1.151 . . . . 0.0 111.146 -179.762 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 35' ' ' CYS . . . . . . . . . . . . . 96.7 m 48.62 -151.59 0.13 Allowed 'General case' 0 N--CA 1.508 2.456 0 O-C-N 121.373 -1.075 . . . . 0.0 111.302 179.353 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 36' ' ' ILE . . . . . . . . . . . . . 30.5 mt -80.95 105.56 11.0 Favored 'Isoleucine or valine' 0 N--CA 1.5 2.054 0 O-C-N 120.792 -1.193 . . . . 0.0 110.141 -179.893 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 37' ' ' SER . . . . . . . . . . . . . 5.7 t -100.57 175.71 5.58 Favored 'General case' 0 N--CA 1.496 1.835 0 O-C-N 121.429 -0.794 . . . . 0.0 110.098 179.595 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 38' ' ' THR . . . . . 0.407 HG21 ' HG2' ' A' ' 58' ' ' GLN . 33.6 p -61.81 -38.8 89.49 Favored 'General case' 0 N--CA 1.501 2.1 0 O-C-N 121.231 -0.918 . . . . 0.0 110.041 179.553 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 39' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -65.64 -40.29 92.36 Favored 'General case' 0 N--CA 1.499 2.005 0 O-C-N 121.674 -0.641 . . . . 0.0 110.379 179.535 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 2.3 mp0 -65.42 -48.8 71.57 Favored 'General case' 0 N--CA 1.499 2.014 0 O-C-N 121.434 -0.791 . . . . 0.0 110.399 179.896 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 41' ' ' LEU . . . . . 0.587 HD22 ' HAK' ' A' ' 91' ' ' SXK . 7.7 tp -61.69 -47.44 85.31 Favored 'General case' 0 N--CA 1.499 1.983 0 O-C-N 121.481 -0.762 . . . . 0.0 110.323 179.898 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 42' ' ' GLY . . . . . . . . . . . . . . . -58.16 -40.06 93.16 Favored Glycine 0 N--CA 1.493 2.472 0 N-CA-C 110.155 -1.178 . . . . 0.0 110.155 -179.712 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 43' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -56.42 -45.21 80.82 Favored 'General case' 0 N--CA 1.5 2.066 0 O-C-N 121.439 -1.036 . . . . 0.0 109.97 179.426 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 44' ' ' VAL . . . . . 0.447 HG21 ' CE1' ' A' ' 27' ' ' PHE . 72.1 t -67.84 -42.69 86.14 Favored 'Isoleucine or valine' 0 N--CA 1.498 1.94 0 O-C-N 121.42 -0.8 . . . . 0.0 109.557 179.154 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 45' ' ' MET . . . . . 0.53 ' HE1' HD11 ' A' ' 41' ' ' LEU . 0.9 OUTLIER -60.04 -39.27 85.35 Favored 'General case' 0 N--CA 1.499 2.012 0 O-C-N 121.431 -0.793 . . . . 0.0 109.59 178.805 . . . . . . . . 3 3 . 1 . 019 nuclear build full ' A' A ' 46' ' ' ARG . . . . . . . . . . . . . 0.3 OUTLIER -61.49 -37.49 83.87 Favored 'General case' 0 N--CA 1.496 1.832 0 O-C-N 121.65 -0.656 . . . . 0.0 109.706 178.859 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 47' ' ' MET . . . . . . . . . . . . . 18.1 ttp -67.02 -38.65 86.33 Favored 'General case' 0 N--CA 1.496 1.863 0 O-C-N 121.711 -0.618 . . . . 0.0 110.032 179.153 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 48' ' ' LEU . . . . . . . . . . . . . 5.9 tp -68.9 -36.79 78.45 Favored 'General case' 0 N--CA 1.493 1.677 0 O-C-N 121.4 -0.812 . . . . 0.0 110.307 179.691 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 49' ' ' GLY . . . . . . . . . . . . . . . 131.98 -39.61 1.74 Allowed Glycine 0 N--CA 1.494 2.561 0 N-CA-C 110.023 -1.231 . . . . 0.0 110.023 179.925 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 50' ' ' GLN . . . . . . . . . . . . . 7.8 mt-30 -88.16 107.51 18.81 Favored 'General case' 0 N--CA 1.497 1.922 0 O-C-N 121.274 -1.133 . . . . 0.0 110.626 -179.741 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 51' ' ' ASN . . . . . . . . . . . . . 24.4 t-20 -156.79 100.76 1.99 Allowed Pre-proline 0 N--CA 1.499 1.999 0 O-C-N 121.412 -0.805 . . . . 0.0 110.196 179.81 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 52' ' ' PRO . . . . . . . . . . . . . 49.0 Cg_endo -79.53 -89.2 0.0 OUTLIER 'Trans proline' 0 C--N 1.317 -1.131 0 O-C-N 123.839 1.441 . . . . 0.0 111.178 -179.999 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 53' ' ' THR . . . . . . . . . . . . . 4.6 p -127.95 165.83 27.77 Favored Pre-proline 0 N--CA 1.496 1.846 0 O-C-N 120.945 -1.097 . . . . 0.0 110.791 -179.233 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 54' ' ' PRO . . . . . . . . . . . . . 42.7 Cg_endo -68.79 -31.76 24.64 Favored 'Trans proline' 0 N--CA 1.491 1.335 0 O-C-N 123.704 1.371 . . . . 0.0 110.939 179.495 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 55' ' ' GLU . . . . . . . . . . . . . 1.9 mp0 -67.4 -29.45 68.97 Favored 'General case' 0 N--CA 1.499 1.994 0 O-C-N 121.22 -0.925 . . . . 0.0 110.075 179.271 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 4.6 tm-20 -56.82 -35.99 69.44 Favored 'General case' 0 N--CA 1.499 1.979 0 O-C-N 121.53 -0.732 . . . . 0.0 110.663 179.587 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 57' ' ' LEU . . . . . 0.593 ' H ' HD22 ' A' ' 57' ' ' LEU . 0.7 OUTLIER -69.58 -29.26 66.77 Favored 'General case' 0 N--CA 1.499 1.98 0 O-C-N 121.33 -0.856 . . . . 0.0 110.87 179.983 . . . . . . . . 3 3 . 1 . 019 nuclear build full ' A' A ' 58' ' ' GLN . . . . . 0.748 ' O ' HG22 ' A' ' 61' ' ' ILE . 0.0 OUTLIER -56.86 -49.74 74.57 Favored 'General case' 0 N--CA 1.498 1.941 0 O-C-N 121.051 -1.031 . . . . 0.0 109.451 179.642 . . . . . . . . 3 3 . 1 . 019 nuclear build full ' A' A ' 59' ' ' GLU . . . . . . . . . . . . . 0.7 OUTLIER -64.65 -38.1 89.85 Favored 'General case' 0 N--CA 1.495 1.805 0 N-CA-C 108.418 -0.956 . . . . 0.0 108.418 177.971 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 60' ' ' MET . . . . . 0.442 ' HB2' ' HA ' ' A' ' 57' ' ' LEU . 7.5 mmm -58.8 -39.1 80.15 Favored 'General case' 0 N--CA 1.496 1.838 0 O-C-N 121.795 -0.566 . . . . 0.0 110.096 178.772 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 61' ' ' ILE . . . . . 0.748 HG22 ' O ' ' A' ' 58' ' ' GLN . 5.1 tt -76.72 -26.9 16.59 Favored 'Isoleucine or valine' 0 N--CA 1.498 1.943 0 O-C-N 121.435 -0.791 . . . . 0.0 110.575 179.729 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 62' ' ' ASP . . . . . . . . . . . . . 1.8 t70 -62.32 -25.22 67.76 Favored 'General case' 0 N--CA 1.498 1.948 0 O-C-N 121.417 -0.802 . . . . 0.0 110.487 179.683 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 63' ' ' GLU . . . . . . . . . . . . . 16.2 tt0 -47.28 -42.39 20.79 Favored 'General case' 0 N--CA 1.501 2.097 0 O-C-N 121.613 -0.68 . . . . 0.0 110.961 179.459 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 64' ' ' VAL . . . . . 0.563 HG11 ' HB2' ' A' ' 80' ' ' MET . 27.5 m -127.45 30.14 1.81 Allowed 'Isoleucine or valine' 0 N--CA 1.498 1.96 0 O-C-N 121.342 -0.849 . . . . 0.0 110.85 179.929 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 65' ' ' ASP . . . . . . . . . . . . . 19.3 t70 -119.9 -97.82 0.46 Allowed 'General case' 0 N--CA 1.495 1.78 0 O-C-N 121.173 -0.955 . . . . 0.0 110.062 179.589 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 66' ' ' GLU . . . . . . . . . . . . . 1.4 mm-40 47.24 35.34 3.66 Favored 'General case' 0 N--CA 1.502 2.126 0 O-C-N 121.354 -0.841 . . . . 0.0 110.967 -179.903 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 67' ' ' ASP . . . . . . . . . . . . . 4.4 p-10 -114.09 7.45 16.71 Favored 'General case' 0 N--CA 1.497 1.884 0 O-C-N 121.213 -0.93 . . . . 0.0 111.367 -179.691 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 68' ' ' GLY . . . . . . . . . . . . . . . 98.34 -27.1 21.0 Favored Glycine 0 N--CA 1.497 2.759 0 N-CA-C 110.45 -1.06 . . . . 0.0 110.45 179.888 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 69' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -80.34 -42.36 23.08 Favored 'General case' 0 N--CA 1.498 1.951 0 O-C-N 121.22 -1.165 . . . . 0.0 111.01 -179.612 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 70' ' ' GLY . . . . . . . . . . . . . . . 81.13 6.77 89.16 Favored Glycine 0 N--CA 1.499 2.854 0 C-N-CA 120.205 -0.997 . . . . 0.0 110.871 179.959 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 71' ' ' THR . . . . . 0.508 HG21 ' O ' ' A' ' 34' ' ' GLY . 2.7 m -124.33 140.53 52.87 Favored 'General case' 0 N--CA 1.498 1.955 0 O-C-N 121.09 -1.241 . . . . 0.0 109.842 179.697 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 72' ' ' VAL . . . . . 0.658 HG23 HG12 ' A' ' 61' ' ' ILE . 3.0 t -92.35 123.63 44.52 Favored 'Isoleucine or valine' 0 N--CA 1.495 1.791 0 O-C-N 121.426 -0.796 . . . . 0.0 110.723 -179.633 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 73' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER -97.28 -163.5 1.05 Allowed 'General case' 0 N--CA 1.494 1.736 0 O-C-N 121.525 -0.735 . . . . 0.0 109.671 179.28 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 74' ' ' PHE . . . . . 0.412 ' CE2' HD11 ' A' ' 78' ' ' LEU . 11.1 t80 -64.97 -45.49 85.47 Favored 'General case' 0 N--CA 1.499 2.023 0 O-C-N 121.067 -1.02 . . . . 0.0 110.475 179.771 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 75' ' ' ASP . . . . . . . . . . . . . 16.3 t70 -59.85 -50.76 72.54 Favored 'General case' 0 N--CA 1.498 1.974 0 O-C-N 121.358 -0.839 . . . . 0.0 109.978 179.389 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 76' ' ' GLU . . . . . . . . . . . . . 43.5 mt-10 -62.18 -40.7 96.91 Favored 'General case' 0 N--CA 1.498 1.943 0 O-C-N 121.515 -0.741 . . . . 0.0 109.553 179.167 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 77' ' ' PHE . . . . . . . . . . . . . 71.8 t80 -60.83 -44.19 97.27 Favored 'General case' 0 N--CA 1.496 1.872 0 O-C-N 121.617 -0.677 . . . . 0.0 109.703 178.712 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 78' ' ' LEU . . . . . 0.768 ' HB3' HG13 ' A' ' 9' ' ' VAL . 52.6 mt -65.98 -43.62 87.29 Favored 'General case' 0 N--CA 1.5 2.046 0 O-C-N 121.567 -0.708 . . . . 0.0 110.087 179.389 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 79' ' ' VAL . . . . . 0.642 ' O ' HG12 ' A' ' 82' ' ' VAL . 45.2 t -60.2 -44.68 95.94 Favored 'Isoleucine or valine' 0 N--CA 1.497 1.891 0 O-C-N 121.61 -0.681 . . . . 0.0 109.393 179.374 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 80' ' ' MET . . . . . 0.563 ' HB2' HG11 ' A' ' 64' ' ' VAL . 2.3 ttp -62.78 -39.77 95.26 Favored 'General case' 0 N--CA 1.495 1.812 0 O-C-N 121.517 -0.74 . . . . 0.0 110.013 178.923 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 81' ' ' MET . . . . . . . . . . . . . 11.2 mmt -62.33 -44.29 96.84 Favored 'General case' 0 N--CA 1.498 1.948 0 O-C-N 121.57 -0.706 . . . . 0.0 110.743 179.946 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 82' ' ' VAL . . . . . 0.642 HG12 ' O ' ' A' ' 79' ' ' VAL . 2.4 p -70.21 -26.57 29.69 Favored 'Isoleucine or valine' 0 N--CA 1.5 2.05 0 O-C-N 121.169 -0.957 . . . . 0.0 110.292 179.514 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 83' ' ' ARG . . . . . 0.618 ' HD2' HG12 ' A' ' 79' ' ' VAL . 4.0 mtp180 -74.6 -33.68 62.68 Favored 'General case' 0 N--CA 1.495 1.795 0 O-C-N 121.222 -0.924 . . . . 0.0 109.444 178.742 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 84' ' ' CYS . . . . . 0.768 ' HA ' ' HB2' ' A' ' 88' ' ' ASP . 0.1 OUTLIER -71.59 -11.52 60.89 Favored 'General case' 0 N--CA 1.496 1.869 0 O-C-N 121.703 -0.623 . . . . 0.0 110.921 179.323 . . . . . . . . 3 3 . 1 . 019 nuclear build full ' A' A ' 85' ' ' MET . . . . . . . . . . . . . 12.2 tpp -58.19 -22.02 49.96 Favored 'General case' 0 N--CA 1.5 2.029 0 O-C-N 121.315 -0.865 . . . . 0.0 111.563 -179.953 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 86' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -90.95 43.53 1.15 Allowed 'General case' 0 N--CA 1.5 2.039 0 O-C-N 120.994 -1.066 . . . . 0.0 110.7 179.962 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 87' ' ' ASP . . . . . . . . . . . . . 1.1 t70 55.35 30.8 15.5 Favored 'General case' 0 N--CA 1.501 2.096 0 O-C-N 121.407 -0.808 . . . . 0.0 111.652 179.607 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 88' ' ' ASP . . . . . 0.768 ' HB2' ' HA ' ' A' ' 84' ' ' CYS . 0.9 OUTLIER -67.63 -39.06 84.69 Favored 'General case' 0 N--CA 1.498 1.949 0 O-C-N 120.911 -1.118 . . . . 0.0 109.923 179.339 . . . . . . . . 3 3 . 1 . 019 nuclear build full ' A' A ' 89' ' ' SER . . . . . 0.483 ' HA ' ' HD3' ' B' ' 147' ' ' ARG . 0.2 OUTLIER . . . . . 0 N--CA 1.496 1.834 0 CA-C-O 118.363 -0.827 . . . . 0.0 110.538 179.434 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' B' B ' 144' ' ' ARG . . . . . . . . . . . . . 6.2 mpt_? . . . . . 0 N--CA 1.497 1.878 0 CA-C-O 120.867 0.365 . . . . 0.0 110.151 . . . . . . . . . 0 0 . 1 . 019 nuclear build full ' B' B ' 145' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER 60.64 -158.89 0.32 Allowed 'General case' 0 N--CA 1.502 2.151 0 O-C-N 121.67 -0.644 . . . . 0.0 110.683 -179.848 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' B' B ' 146' ' ' VAL . . . . . 0.732 HG12 HG12 ' B' ' 148' ' ' ILE . 91.6 t -114.94 -77.08 0.45 Allowed 'Isoleucine or valine' 0 N--CA 1.498 1.965 0 O-C-N 121.088 -1.008 . . . . 0.0 110.472 -179.571 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' B' B ' 147' ' ' ARG . . . . . 0.483 ' HD3' ' HA ' ' A' ' 89' ' ' SER . 0.0 OUTLIER 54.57 83.07 0.08 Allowed 'General case' 0 N--CA 1.505 2.278 0 O-C-N 121.519 -0.738 . . . . 0.0 110.824 -179.927 . . . . . . . . 3 3 . 1 . 019 nuclear build full ' B' B ' 148' ' ' ILE . . . . . 0.732 HG12 HG12 ' B' ' 146' ' ' VAL . 36.7 mm -111.91 110.21 31.38 Favored 'Isoleucine or valine' 0 N--CA 1.495 1.823 0 O-C-N 121.294 -0.879 . . . . 0.0 110.426 -179.879 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' B' B ' 149' ' ' SER . . . . . . . . . . . . . 89.0 p -96.99 158.9 15.2 Favored 'General case' 0 N--CA 1.496 1.839 0 O-C-N 121.383 -0.823 . . . . 0.0 110.391 179.696 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' B' B ' 150' ' ' ALA . . . . . . . . . . . . . . . -58.85 -50.09 75.28 Favored 'General case' 0 N--CA 1.498 1.974 0 O-C-N 121.482 -0.761 . . . . 0.0 111.104 -179.652 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' B' B ' 151' ' ' ASP . . . . . . . . . . . . . 7.2 p-10 -60.62 -35.75 76.92 Favored 'General case' 0 N--CA 1.502 2.137 0 O-C-N 121.371 -0.83 . . . . 0.0 111.252 -179.804 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' B' B ' 152' ' ' ALA . . . . . . . . . . . . . . . -74.36 -38.82 63.1 Favored 'General case' 0 N--CA 1.496 1.825 0 O-C-N 121.131 -0.981 . . . . 0.0 110.252 179.645 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' B' B ' 153' ' ' MET . . . . . . . . . . . . . 0.4 OUTLIER -64.66 -47.97 76.49 Favored 'General case' 0 N--CA 1.498 1.962 0 O-C-N 121.41 -0.806 . . . . 0.0 110.608 179.973 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' B' B ' 154' ' ' MET . . . . . 0.427 ' HG3' ' N ' ' B' ' 155' ' ' GLN . 17.2 ptp -63.84 -30.25 71.36 Favored 'General case' 0 N--CA 1.5 2.04 0 O-C-N 121.167 -0.958 . . . . 0.0 110.298 179.57 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' B' B ' 155' ' ' GLN . . . . . 0.427 ' N ' ' HG3' ' B' ' 154' ' ' MET . 0.2 OUTLIER -65.54 -35.79 81.88 Favored 'General case' 0 N--CA 1.498 1.961 0 O-C-N 121.327 -0.858 . . . . 0.0 110.201 179.074 . . . . . . . . 3 3 . 1 . 019 nuclear build full ' B' B ' 156' ' ' ALA . . . . . . . . . . . . . . . -87.28 -43.77 11.92 Favored 'General case' 0 N--CA 1.495 1.799 0 O-C-N 121.431 -0.793 . . . . 0.0 110.143 179.719 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' B' B ' 157' ' ' LEU . . . . . 0.567 HD21 ' HA ' ' A' ' 27' ' ' PHE . 0.9 OUTLIER -64.67 -48.65 73.96 Favored 'General case' 0 N--CA 1.498 1.972 0 O-C-N 121.614 -0.679 . . . . 0.0 110.481 179.969 . . . . . . . . 3 3 . 1 . 019 nuclear build full ' B' B ' 158' ' ' LEU . . . . . . . . . . . . . 6.3 mt -101.28 27.16 6.4 Favored 'General case' 0 N--CA 1.498 1.947 0 O-C-N 121.161 -0.962 . . . . 0.0 110.856 -179.988 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' B' B ' 159' ' ' GLY . . . . . . . . . . . . . . . -122.75 -49.14 0.24 Allowed Glycine 0 N--CA 1.497 2.748 0 N-CA-C 109.205 -1.558 . . . . 0.0 109.205 179.293 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' B' B ' 160' ' ' ALA . . . . . . . . . . . . . . . -85.18 -43.23 14.01 Favored 'General case' 0 N--CA 1.497 1.88 0 O-C-N 121.418 -1.048 . . . . 0.0 109.808 179.258 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' B' B ' 161' ' ' ARG . . . . . . . . . . . . . 0.9 OUTLIER -78.31 -54.12 6.55 Favored 'General case' 0 N--CA 1.497 1.889 0 O-C-N 121.289 -0.882 . . . . 0.0 109.631 179.349 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' B' B ' 162' ' ' ALA . . . . . . . . . . . . . . . -97.87 133.29 42.56 Favored 'General case' 0 N--CA 1.494 1.762 0 O-C-N 121.402 -0.811 . . . . 0.0 109.62 179.242 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' B' B ' 163' ' ' LYS . . . . . 0.4 ' HA ' ' HE2' ' B' ' 163' ' ' LYS . 0.0 OUTLIER . . . . . 0 N--CA 1.495 1.812 0 CA-C-O 117.763 -1.113 . . . . 0.0 110.725 -179.921 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 90' ' ' ' CA' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 019 nuclear build full ' A' A ' 91' ' ' SXK . . . . . 0.587 ' HAK' HD22 ' A' ' 41' ' ' LEU . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 9.9 tpt . . . . . 0 N--CA 1.496 1.849 0 CA-C-O 120.987 0.422 . . . . 0.0 110.279 . . . . . . . . . 0 0 . 1 . 020 nuclear build full ' A' A ' 2' ' ' ASP . . . . . . . . . . . . . 1.6 p30 -157.71 168.31 27.59 Favored 'General case' 0 N--CA 1.498 1.969 0 O-C-N 121.463 -0.773 . . . . 0.0 110.574 -179.743 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 3' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER -111.52 95.61 5.61 Favored 'General case' 0 N--CA 1.498 1.946 0 O-C-N 121.315 -0.866 . . . . 0.0 110.798 -179.823 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 4' ' ' ILE . . . . . . . . . . . . . 1.8 pp -82.27 -28.75 9.17 Favored 'Isoleucine or valine' 0 N--CA 1.499 2.009 0 O-C-N 121.272 -0.892 . . . . 0.0 110.626 179.674 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 5' ' ' TYR . . . . . 0.423 ' CE1' ' HG2' ' A' ' 83' ' ' ARG . 16.5 m-85 -72.07 -42.55 66.08 Favored 'General case' 0 N--CA 1.496 1.872 0 O-C-N 121.252 -0.905 . . . . 0.0 109.767 179.407 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -66.5 -44.13 83.44 Favored 'General case' 0 N--CA 1.495 1.791 0 O-C-N 121.541 -0.724 . . . . 0.0 109.771 179.121 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 7' ' ' ALA . . . . . . . . . . . . . . . -52.42 -41.26 63.06 Favored 'General case' 0 N--CA 1.498 1.973 0 O-C-N 121.464 -0.773 . . . . 0.0 109.936 179.12 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 8' ' ' ALA . . . . . . . . . . . . . . . -60.12 -33.07 71.63 Favored 'General case' 0 N--CA 1.498 1.948 0 O-C-N 121.515 -0.741 . . . . 0.0 110.633 179.203 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 9' ' ' VAL . . . . . 0.503 ' HA ' HD23 ' A' ' 12' ' ' LEU . 84.5 t -84.61 -37.46 12.64 Favored 'Isoleucine or valine' 0 N--CA 1.498 1.958 0 O-C-N 121.459 -0.776 . . . . 0.0 110.566 179.996 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 10' ' ' GLU . . . . . . . . . . . . . 0.5 OUTLIER -67.98 -26.31 65.86 Favored 'General case' 0 N--CA 1.499 2.022 0 O-C-N 121.431 -0.793 . . . . 0.0 112.447 -178.73 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 11' ' ' GLN . . . . . . . . . . . . . 0.8 OUTLIER -134.13 65.82 1.56 Allowed 'General case' 0 N--CA 1.498 1.974 0 O-C-N 120.638 -1.289 . . . . 0.0 112.18 -179.346 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 12' ' ' LEU . . . . . 0.566 ' C ' HD12 ' A' ' 12' ' ' LEU . 4.4 pp -110.41 160.17 16.82 Favored 'General case' 0 N--CA 1.499 2.01 0 O-C-N 121.236 -0.915 . . . . 0.0 109.317 177.854 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 13' ' ' THR . . . . . . . . . . . . . 60.5 p -73.91 157.05 36.97 Favored 'General case' 0 N--CA 1.505 2.276 0 O-C-N 121.084 -1.01 . . . . 0.0 111.456 -178.627 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 14' ' ' GLU . . . . . . . . . . . . . 3.0 tp10 -53.18 -34.82 58.59 Favored 'General case' 0 N--CA 1.495 1.801 0 O-C-N 121.828 -0.545 . . . . 0.0 110.338 179.848 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 1.2 mp0 -63.29 -43.88 96.64 Favored 'General case' 0 N--CA 1.496 1.829 0 O-C-N 121.601 -0.687 . . . . 0.0 109.59 179.389 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 16' ' ' GLN . . . . . 0.505 ' HB3' HD13 ' A' ' 12' ' ' LEU . 0.1 OUTLIER -58.52 -37.88 76.56 Favored 'General case' 0 N--CA 1.498 1.931 0 CA-C-O 121.587 0.708 . . . . 0.0 110.144 179.269 . . . . . . . . 3 3 . 1 . 020 nuclear build full ' A' A ' 17' ' ' LYS . . . . . 0.527 ' HB2' HD11 ' A' ' 12' ' ' LEU . 1.3 ttpt -77.8 -33.72 52.41 Favored 'General case' 0 N--CA 1.493 1.709 0 O-C-N 121.5 -0.75 . . . . 0.0 109.986 179.173 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 18' ' ' ASN . . . . . . . . . . . . . 52.5 m-20 -68.42 -46.31 70.25 Favored 'General case' 0 N--CA 1.498 1.973 0 O-C-N 121.417 -0.802 . . . . 0.0 110.847 179.92 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 12.6 pt-20 -60.61 -35.84 77.12 Favored 'General case' 0 N--CA 1.502 2.131 0 O-C-N 121.173 -0.954 . . . . 0.0 110.121 179.856 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 20' ' ' PHE . . . . . . . . . . . . . 18.4 m-30 -77.12 -32.18 56.28 Favored 'General case' 0 N--CA 1.496 1.847 0 O-C-N 121.317 -0.864 . . . . 0.0 109.927 178.923 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 21' ' ' LYS . . . . . . . . . . . . . 2.9 tptp -60.97 -46.95 88.67 Favored 'General case' 0 N--CA 1.498 1.956 0 O-C-N 121.484 -0.76 . . . . 0.0 109.649 178.961 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 22' ' ' ALA . . . . . 0.497 ' O ' HD12 ' A' ' 26' ' ' ILE . . . -61.73 -50.23 73.24 Favored 'General case' 0 N--CA 1.499 1.989 0 O-C-N 121.395 -0.816 . . . . 0.0 109.869 179.324 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 23' ' ' ALA . . . . . . . . . . . . . . . -59.04 -40.44 85.05 Favored 'General case' 0 N--CA 1.498 1.929 0 O-C-N 121.557 -0.715 . . . . 0.0 109.647 178.94 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 24' ' ' PHE . . . . . 0.53 ' O ' HG13 ' A' ' 28' ' ' VAL . 73.9 t80 -64.55 -43.8 92.78 Favored 'General case' 0 N--CA 1.498 1.946 0 O-C-N 121.788 -0.57 . . . . 0.0 109.89 179.212 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 25' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER -56.6 -45.47 81.42 Favored 'General case' 0 N--CA 1.499 2.013 0 O-C-N 121.475 -0.766 . . . . 0.0 110.496 179.573 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 26' ' ' ILE . . . . . 0.543 ' HB ' HD12 ' B' ' 157' ' ' LEU . 6.6 mt -70.56 -31.75 47.41 Favored 'Isoleucine or valine' 0 N--CA 1.498 1.966 0 O-C-N 121.168 -0.957 . . . . 0.0 109.518 179.143 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 27' ' ' PHE . . . . . 0.585 ' CZ ' HG11 ' A' ' 44' ' ' VAL . 0.2 OUTLIER -74.46 -22.5 59.08 Favored 'General case' 0 N--CA 1.496 1.845 0 O-C-N 121.102 -0.999 . . . . 0.0 110.774 179.186 . . . . . . . . 3 3 . 1 . 020 nuclear build full ' A' A ' 28' ' ' VAL . . . . . 0.692 HG12 HG13 ' A' ' 36' ' ' ILE . 10.6 m -107.36 10.6 9.13 Favored 'Isoleucine or valine' 0 N--CA 1.501 2.076 0 O-C-N 121.153 -0.967 . . . . 0.0 111.902 -179.354 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 29' ' ' LEU . . . . . 0.622 ' O ' HD12 ' A' ' 29' ' ' LEU . 4.6 pp -57.13 136.85 56.4 Favored 'General case' 0 N--CA 1.504 2.242 0 O-C-N 120.77 -1.206 . . . . 0.0 109.398 179.379 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 30' ' ' GLY . . . . . . . . . . . . . . . 90.39 -49.6 3.22 Favored Glycine 0 N--CA 1.495 2.628 0 N-CA-C 108.093 -2.003 . . . . 0.0 108.093 -177.838 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 31' ' ' ALA . . . . . . . . . . . . . . . -88.42 67.48 8.61 Favored 'General case' 0 N--CA 1.491 1.616 0 O-C-N 121.617 -0.931 . . . . 0.0 108.727 178.481 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 32' ' ' GLU . . . . . . . . . . . . . 1.3 mp0 -61.71 -10.87 9.69 Favored 'General case' 0 N--CA 1.501 2.122 0 O-C-N 121.565 -0.71 . . . . 0.0 112.146 -178.898 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 15.7 t70 -52.8 -35.39 56.76 Favored 'General case' 0 N--CA 1.501 2.09 0 O-C-N 121.148 -0.97 . . . . 0.0 110.516 179.484 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 34' ' ' GLY . . . . . . . . . . . . . . . 107.53 34.16 2.94 Favored Glycine 0 N--CA 1.497 2.746 0 N-CA-C 110.267 -1.133 . . . . 0.0 110.267 179.521 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 35' ' ' CYS . . . . . . . . . . . . . 28.3 p -144.36 156.8 44.4 Favored 'General case' 0 N--CA 1.495 1.79 0 O-C-N 121.275 -1.132 . . . . 0.0 110.203 179.697 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 36' ' ' ILE . . . . . 0.692 HG13 HG12 ' A' ' 28' ' ' VAL . 17.9 mt -121.42 118.59 56.46 Favored 'Isoleucine or valine' 0 N--CA 1.494 1.752 0 O-C-N 121.383 -0.823 . . . . 0.0 109.987 -179.965 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 37' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -101.07 163.19 12.4 Favored 'General case' 0 N--CA 1.493 1.72 0 O-C-N 121.558 -0.714 . . . . 0.0 109.637 179.167 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 38' ' ' THR . . . . . 0.832 HG21 ' HA ' ' A' ' 58' ' ' GLN . 77.7 p -64.27 -32.76 74.47 Favored 'General case' 0 N--CA 1.5 2.045 0 O-C-N 121.31 -0.869 . . . . 0.0 110.595 -179.829 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 39' ' ' LYS . . . . . 0.473 ' HA ' ' HB3' ' A' ' 54' ' ' PRO . 11.6 mttp -60.88 -34.33 74.46 Favored 'General case' 0 N--CA 1.496 1.864 0 O-C-N 121.518 -0.739 . . . . 0.0 109.465 178.777 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 1.2 mp0 -83.42 -30.55 27.23 Favored 'General case' 0 N--CA 1.497 1.921 0 O-C-N 121.485 -0.76 . . . . 0.0 109.604 178.471 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 41' ' ' LEU . . . . . 0.487 HD13 ' CAK' ' A' ' 91' ' ' SXK . 6.4 tp -62.46 -39.83 94.67 Favored 'General case' 0 N--CA 1.497 1.877 0 O-C-N 121.412 -0.805 . . . . 0.0 110.412 179.574 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 42' ' ' GLY . . . . . 0.507 ' HA2' ' HB2' ' A' ' 45' ' ' MET . . . -53.92 -36.18 55.17 Favored Glycine 0 N--CA 1.495 2.616 0 N-CA-C 110.831 -0.908 . . . . 0.0 110.831 -179.049 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 43' ' ' LYS . . . . . . . . . . . . . 1.6 mtmt -55.21 -34.13 63.65 Favored 'General case' 0 N--CA 1.502 2.145 0 O-C-N 121.381 -1.07 . . . . 0.0 110.561 179.711 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 44' ' ' VAL . . . . . 0.585 HG11 ' CZ ' ' A' ' 27' ' ' PHE . 42.1 t -93.07 -36.72 7.74 Favored 'Isoleucine or valine' 0 N--CA 1.498 1.936 0 O-C-N 121.334 -0.854 . . . . 0.0 109.6 178.921 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 45' ' ' MET . . . . . 0.507 ' HB2' ' HA2' ' A' ' 42' ' ' GLY . 0.3 OUTLIER -58.29 -38.08 76.3 Favored 'General case' 0 N--CA 1.5 2.036 0 O-C-N 121.47 -0.769 . . . . 0.0 110.777 179.646 . . . . . . . . 3 3 . 1 . 020 nuclear build full ' A' A ' 46' ' ' ARG . . . . . 0.47 ' HA ' ' C ' ' A' ' 50' ' ' GLN . 16.6 ptt180 -63.44 -23.68 67.5 Favored 'General case' 0 N--CA 1.499 2.012 0 O-C-N 121.304 -0.872 . . . . 0.0 110.911 179.97 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 47' ' ' MET . . . . . . . . . . . . . 7.1 ttp -82.14 1.18 37.41 Favored 'General case' 0 N--CA 1.495 1.798 0 O-C-N 121.397 -0.815 . . . . 0.0 110.731 179.389 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 48' ' ' LEU . . . . . . . . . . . . . 45.1 mt -131.16 -50.7 1.02 Allowed 'General case' 0 N--CA 1.496 1.83 0 O-C-N 121.078 -1.014 . . . . 0.0 111.052 -179.82 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 49' ' ' GLY . . . . . 0.508 ' O ' ' HB2' ' A' ' 50' ' ' GLN . . . -125.52 38.04 2.37 Favored Glycine 0 N--CA 1.498 2.772 0 C-N-CA 119.866 -1.159 . . . . 0.0 110.987 -179.14 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 50' ' ' GLN . . . . . 0.508 ' HB2' ' O ' ' A' ' 49' ' ' GLY . 10.9 mt-30 67.12 -50.06 0.48 Allowed 'General case' 0 N--CA 1.512 2.636 0 CA-C-N 117.913 0.857 . . . . 0.0 112.498 179.122 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 51' ' ' ASN . . . . . 0.555 ' OD1' HD11 ' A' ' 57' ' ' LEU . 8.3 t30 64.94 101.24 0.04 OUTLIER Pre-proline 0 N--CA 1.504 2.258 0 O-C-N 121.414 -0.804 . . . . 0.0 110.542 -179.185 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 52' ' ' PRO . . . . . . . . . . . . . 44.3 Cg_endo -74.64 -52.87 0.11 Allowed 'Trans proline' 0 C--N 1.312 -1.352 0 O-C-N 123.938 1.494 . . . . 0.0 111.464 -179.642 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 53' ' ' THR . . . . . 0.703 HG23 ' HB2' ' A' ' 56' ' ' GLU . 0.0 OUTLIER -149.31 153.04 36.96 Favored Pre-proline 0 N--CA 1.5 2.048 0 O-C-N 121.131 -0.981 . . . . 0.0 111.073 -179.63 . . . . . . . . 3 3 . 1 . 020 nuclear build full ' A' A ' 54' ' ' PRO . . . . . 0.473 ' HB3' ' HA ' ' A' ' 39' ' ' LYS . 46.4 Cg_endo -71.75 -36.28 6.55 Favored 'Trans proline' 0 C--N 1.313 -1.331 0 O-C-N 124.205 1.634 . . . . 0.0 110.69 179.563 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 55' ' ' GLU . . . . . 0.458 ' O ' ' HB3' ' A' ' 58' ' ' GLN . 0.7 OUTLIER -65.11 -27.78 68.98 Favored 'General case' 0 N--CA 1.5 2.063 0 O-C-N 121.338 -0.851 . . . . 0.0 110.959 179.931 . . . . . . . . 3 3 . 1 . 020 nuclear build full ' A' A ' 56' ' ' GLU . . . . . 0.703 ' HB2' HG23 ' A' ' 53' ' ' THR . 24.0 tt0 -66.8 -30.12 70.24 Favored 'General case' 0 N--CA 1.498 1.93 0 O-C-N 121.119 -0.988 . . . . 0.0 110.275 179.28 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 57' ' ' LEU . . . . . 0.555 HD11 ' OD1' ' A' ' 51' ' ' ASN . 29.7 mt -80.31 -9.54 59.74 Favored 'General case' 0 N--CA 1.496 1.843 0 O-C-N 121.253 -0.904 . . . . 0.0 111.414 -179.889 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 58' ' ' GLN . . . . . 0.832 ' HA ' HG21 ' A' ' 38' ' ' THR . 0.0 OUTLIER -56.74 -42.11 78.69 Favored 'General case' 0 N--CA 1.5 2.052 0 O-C-N 121.032 -1.042 . . . . 0.0 110.142 -179.819 . . . . . . . . 3 3 . 1 . 020 nuclear build full ' A' A ' 59' ' ' GLU . . . . . . . . . . . . . 7.8 tt0 -59.2 -35.94 74.49 Favored 'General case' 0 N--CA 1.498 1.963 0 O-C-N 121.37 -0.831 . . . . 0.0 110.035 179.175 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 60' ' ' MET . . . . . . . . . . . . . 2.5 tpp -59.18 -46.2 89.04 Favored 'General case' 0 N--CA 1.498 1.95 0 O-C-N 121.584 -0.698 . . . . 0.0 109.989 179.304 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 61' ' ' ILE . . . . . 0.469 HG23 HG23 ' A' ' 72' ' ' VAL . 1.9 mt -72.65 -41.1 62.81 Favored 'Isoleucine or valine' 0 N--CA 1.497 1.884 0 O-C-N 121.352 -0.843 . . . . 0.0 109.716 179.276 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 62' ' ' ASP . . . . . . . . . . . . . 75.1 m-20 -53.62 -31.11 45.83 Favored 'General case' 0 N--CA 1.501 2.098 0 O-C-N 121.476 -0.765 . . . . 0.0 110.956 179.566 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 63' ' ' GLU . . . . . . . . . . . . . 0.3 OUTLIER -68.27 -25.54 65.22 Favored 'General case' 0 N--CA 1.5 2.028 0 O-C-N 121.359 -0.838 . . . . 0.0 111.254 179.958 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 64' ' ' VAL . . . . . 0.463 HG22 ' NH1' ' A' ' 83' ' ' ARG . 20.1 t -121.76 6.34 5.89 Favored 'Isoleucine or valine' 0 N--CA 1.501 2.098 0 O-C-N 121.162 -0.962 . . . . 0.0 111.436 -179.328 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 65' ' ' ASP . . . . . . . . . . . . . 5.6 t70 -98.35 73.94 2.16 Favored 'General case' 0 N--CA 1.496 1.833 0 O-C-N 120.706 -1.246 . . . . 0.0 110.459 179.87 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 66' ' ' GLU . . . . . . . . . . . . . 4.6 mp0 -88.56 55.91 3.58 Favored 'General case' 0 N--CA 1.496 1.832 0 O-C-N 121.239 -0.913 . . . . 0.0 108.978 179.23 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 67' ' ' ASP . . . . . . . . . . . . . 2.1 t70 -126.58 -59.33 1.29 Allowed 'General case' 0 N--CA 1.493 1.71 0 O-C-N 121.6 -0.688 . . . . 0.0 110.944 -178.759 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 68' ' ' GLY . . . . . . . . . . . . . . . 143.09 -40.18 1.26 Allowed Glycine 0 N--CA 1.494 2.518 0 N-CA-C 109.715 -1.354 . . . . 0.0 109.715 -179.434 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 69' ' ' SER . . . . . . . . . . . . . 59.6 p -63.89 -29.0 70.22 Favored 'General case' 0 N--CA 1.5 2.031 0 O-C-N 121.404 -1.057 . . . . 0.0 111.206 -179.9 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 70' ' ' GLY . . . . . . . . . . . . . . . 86.72 -12.91 60.14 Favored Glycine 0 N--CA 1.497 2.717 0 C-N-CA 119.875 -1.155 . . . . 0.0 110.569 -179.806 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 71' ' ' THR . . . . . . . . . . . . . 3.5 m -101.09 138.0 38.71 Favored 'General case' 0 N--CA 1.497 1.91 0 O-C-N 121.028 -1.278 . . . . 0.0 109.681 179.694 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 72' ' ' VAL . . . . . 0.469 HG23 HG23 ' A' ' 61' ' ' ILE . 8.1 t -82.36 125.63 39.88 Favored 'Isoleucine or valine' 0 N--CA 1.496 1.861 0 O-C-N 121.704 -0.622 . . . . 0.0 110.793 -179.634 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 73' ' ' ASP . . . . . . . . . . . . . 0.8 OUTLIER -99.75 -163.17 1.01 Allowed 'General case' 0 N--CA 1.494 1.757 0 O-C-N 121.41 -0.806 . . . . 0.0 109.564 179.206 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 74' ' ' PHE . . . . . 0.754 ' CE2' HD11 ' A' ' 78' ' ' LEU . 65.4 t80 -63.16 -45.78 90.23 Favored 'General case' 0 N--CA 1.5 2.039 0 O-C-N 121.161 -0.962 . . . . 0.0 110.361 179.827 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 75' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -62.22 -51.72 66.65 Favored 'General case' 0 N--CA 1.499 1.979 0 O-C-N 121.373 -0.83 . . . . 0.0 110.616 179.897 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 76' ' ' GLU . . . . . . . . . . . . . 55.5 mt-10 -64.88 -23.22 67.17 Favored 'General case' 0 N--CA 1.501 2.076 0 O-C-N 121.326 -0.859 . . . . 0.0 110.085 179.449 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 77' ' ' PHE . . . . . . . . . . . . . 88.4 t80 -79.34 -35.31 41.22 Favored 'General case' 0 N--CA 1.496 1.868 0 O-C-N 121.3 -0.875 . . . . 0.0 109.677 178.872 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 78' ' ' LEU . . . . . 0.754 HD11 ' CE2' ' A' ' 74' ' ' PHE . 65.5 mt -62.41 -50.42 71.58 Favored 'General case' 0 N--CA 1.498 1.944 0 O-C-N 121.412 -0.805 . . . . 0.0 109.984 179.454 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 79' ' ' VAL . . . . . . . . . . . . . 7.4 p -62.74 -31.91 53.86 Favored 'Isoleucine or valine' 0 N--CA 1.5 2.065 0 O-C-N 121.369 -0.832 . . . . 0.0 109.797 179.066 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 80' ' ' MET . . . . . . . . . . . . . 5.2 ttp -65.71 -38.94 90.58 Favored 'General case' 0 N--CA 1.496 1.839 0 O-C-N 121.255 -0.903 . . . . 0.0 109.47 178.633 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 81' ' ' MET . . . . . . . . . . . . . 7.6 mmt -62.08 -41.62 98.36 Favored 'General case' 0 N--CA 1.497 1.881 0 O-C-N 121.501 -0.749 . . . . 0.0 110.036 179.261 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 82' ' ' VAL . . . . . . . . . . . . . 30.6 t -61.41 -35.85 69.21 Favored 'Isoleucine or valine' 0 N--CA 1.5 2.04 0 O-C-N 121.245 -0.909 . . . . 0.0 109.21 178.79 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 83' ' ' ARG . . . . . 0.463 ' NH1' HG22 ' A' ' 64' ' ' VAL . 8.5 mtt180 -68.18 -26.1 65.57 Favored 'General case' 0 N--CA 1.498 1.938 0 O-C-N 121.422 -0.799 . . . . 0.0 109.761 178.496 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 84' ' ' CYS . . . . . 0.515 ' HB3' ' HA ' ' B' ' 149' ' ' SER . 73.2 m -85.25 11.6 9.69 Favored 'General case' 0 N--CA 1.499 2.009 0 O-C-N 121.364 -0.835 . . . . 0.0 111.097 179.468 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 85' ' ' MET . . . . . . . . . . . . . 2.6 tpp -88.82 8.08 30.86 Favored 'General case' 0 N--CA 1.499 2.008 0 O-C-N 121.043 -1.036 . . . . 0.0 111.071 179.782 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 86' ' ' LYS . . . . . . . . . . . . . 1.0 OUTLIER 70.4 -65.73 0.31 Allowed 'General case' 0 N--CA 1.504 2.272 0 O-C-N 121.558 -0.714 . . . . 0.0 111.72 179.708 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 87' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER -137.6 -159.41 0.95 Allowed 'General case' 0 N--CA 1.5 2.037 0 O-C-N 121.032 -1.043 . . . . 0.0 111.031 -179.348 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 88' ' ' ASP . . . . . . . . . . . . . 8.7 t70 70.32 -69.41 0.18 Allowed 'General case' 0 N--CA 1.504 2.267 0 O-C-N 121.976 -0.453 . . . . 0.0 111.387 179.993 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 89' ' ' SER . . . . . . . . . . . . . 25.4 p . . . . . 0 N--CA 1.499 1.986 0 O-C-N 121.196 -0.94 . . . . 0.0 111.154 -179.75 . . . . . . . . 0 0 . 1 . 020 nuclear build full ' B' B ' 144' ' ' ARG . . . . . 0.474 ' O ' ' HB3' ' B' ' 145' ' ' ARG . 2.3 tpt85 . . . . . 0 N--CA 1.499 1.991 0 CA-C-O 120.69 0.281 . . . . 0.0 110.4 . . . . . . . . . 1 1 . 1 . 020 nuclear build full ' B' B ' 145' ' ' ARG . . . . . 0.474 ' HB3' ' O ' ' B' ' 144' ' ' ARG . 3.0 ttt-85 70.09 150.26 0.09 Allowed 'General case' 0 N--CA 1.504 2.262 0 CA-C-O 121.412 0.625 . . . . 0.0 110.686 -179.688 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' B' B ' 146' ' ' VAL . . . . . 1.081 HG12 HD13 ' B' ' 148' ' ' ILE . 22.8 t -91.85 -47.94 13.93 Favored 'Isoleucine or valine' 0 N--CA 1.499 1.996 0 O-C-N 121.448 -0.782 . . . . 0.0 109.951 -179.667 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' B' B ' 147' ' ' ARG . . . . . 0.496 ' HB2' ' O ' ' B' ' 146' ' ' VAL . 33.5 mtm-85 64.85 -82.34 0.03 OUTLIER 'General case' 0 N--CA 1.503 2.216 0 O-C-N 121.995 -0.44 . . . . 0.0 112.088 179.249 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' B' B ' 148' ' ' ILE . . . . . 1.081 HD13 HG12 ' B' ' 146' ' ' VAL . 0.9 OUTLIER 56.62 90.71 0.04 OUTLIER 'Isoleucine or valine' 0 N--CA 1.505 2.28 0 CA-C-O 122.23 1.014 . . . . 0.0 109.158 -178.61 . . . . . . . . 3 3 . 1 . 020 nuclear build full ' B' B ' 149' ' ' SER . . . . . 0.515 ' HA ' ' HB3' ' A' ' 84' ' ' CYS . 74.0 p -93.69 164.11 13.27 Favored 'General case' 0 N--CA 1.495 1.789 0 O-C-N 121.1 -1.0 . . . . 0.0 111.068 -178.743 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' B' B ' 150' ' ' ALA . . . . . . . . . . . . . . . -65.49 -49.4 69.18 Favored 'General case' 0 N--CA 1.494 1.772 0 O-C-N 121.704 -0.623 . . . . 0.0 110.766 -179.831 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' B' B ' 151' ' ' ASP . . . . . . . . . . . . . 5.7 p-10 -54.95 -38.84 68.24 Favored 'General case' 0 N--CA 1.502 2.17 0 O-C-N 121.539 -0.726 . . . . 0.0 110.885 179.932 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' B' B ' 152' ' ' ALA . . . . . . . . . . . . . . . -74.64 -44.21 51.56 Favored 'General case' 0 N--CA 1.496 1.851 0 O-C-N 121.296 -0.878 . . . . 0.0 110.43 179.678 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' B' B ' 153' ' ' MET . . . . . . . . . . . . . 2.1 mmt -67.67 -31.73 71.91 Favored 'General case' 0 N--CA 1.498 1.962 0 O-C-N 121.267 -0.896 . . . . 0.0 110.65 179.841 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' B' B ' 154' ' ' MET . . . . . . . . . . . . . 4.4 ttm -57.61 -44.0 85.13 Favored 'General case' 0 N--CA 1.5 2.049 0 O-C-N 121.361 -0.837 . . . . 0.0 110.501 179.876 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' B' B ' 155' ' ' GLN . . . . . . . . . . . . . 1.3 tm0? -66.11 -37.19 85.12 Favored 'General case' 0 N--CA 1.5 2.06 0 O-C-N 121.384 -0.822 . . . . 0.0 110.354 179.631 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' B' B ' 156' ' ' ALA . . . . . . . . . . . . . . . -76.74 -34.29 58.09 Favored 'General case' 0 N--CA 1.499 2.022 0 O-C-N 121.478 -0.764 . . . . 0.0 111.178 -179.753 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' B' B ' 157' ' ' LEU . . . . . 0.543 HD12 ' HB ' ' A' ' 26' ' ' ILE . 3.1 mm? -85.22 -49.68 8.0 Favored 'General case' 0 N--CA 1.5 2.044 0 O-C-N 121.186 -0.946 . . . . 0.0 110.522 -179.565 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' B' B ' 158' ' ' LEU . . . . . . . . . . . . . 3.7 mp -95.88 62.68 2.28 Favored 'General case' 0 N--CA 1.496 1.865 0 O-C-N 121.275 -0.89 . . . . 0.0 110.01 179.967 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' B' B ' 159' ' ' GLY . . . . . . . . . . . . . . . -171.9 -159.79 19.0 Favored Glycine 0 N--CA 1.495 2.589 0 N-CA-C 109.71 -1.356 . . . . 0.0 109.71 -179.988 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' B' B ' 160' ' ' ALA . . . . . . . . . . . . . . . 54.25 -91.35 0.03 OUTLIER 'General case' 0 N--CA 1.503 2.221 0 O-C-N 121.782 -0.834 . . . . 0.0 110.984 -179.903 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' B' B ' 161' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -137.21 31.71 2.64 Favored 'General case' 0 N--CA 1.497 1.89 0 O-C-N 121.052 -1.03 . . . . 0.0 110.553 179.741 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' B' B ' 162' ' ' ALA . . . . . . . . . . . . . . . -155.94 159.35 39.18 Favored 'General case' 0 N--CA 1.497 1.917 0 O-C-N 121.183 -0.948 . . . . 0.0 110.776 -179.846 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' B' B ' 163' ' ' LYS . . . . . . . . . . . . . 0.6 OUTLIER . . . . . 0 N--CA 1.497 1.89 0 CA-C-O 118.238 -0.887 . . . . 0.0 110.394 -179.972 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 90' ' ' ' CA' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 020 nuclear build full ' A' A ' 91' ' ' SXK . . . . . 0.487 ' CAK' HD13 ' A' ' 41' ' ' LEU . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 4' ' ' ILE . . . . . . . . . . . . . 2.8 mp . . . . . 0 N--CA 1.496 1.87 0 CA-C-O 121.004 0.43 . . . . 0.0 110.05 . . . . . . . . . 0 0 . 1 . 001 nuclear nobuild core ' A' A ' 5' ' ' TYR . . . . . . . . . . . . . 9.6 m-85 -71.04 -37.85 72.56 Favored 'General case' 0 N--CA 1.496 1.863 0 O-C-N 121.226 -0.921 . . . . 0.0 110.585 179.849 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -70.49 -32.09 69.46 Favored 'General case' 0 N--CA 1.498 1.963 0 O-C-N 121.16 -0.962 . . . . 0.0 110.04 179.336 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 7' ' ' ALA . . . . . . . . . . . . . . . -55.6 -41.38 73.34 Favored 'General case' 0 N--CA 1.497 1.92 0 O-C-N 121.384 -0.823 . . . . 0.0 109.254 178.54 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 8' ' ' ALA . . . . . . . . . . . . . . . -69.94 -37.04 75.75 Favored 'General case' 0 N--CA 1.495 1.78 0 O-C-N 121.705 -0.622 . . . . 0.0 109.423 178.487 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 9' ' ' VAL . . . . . 0.679 HG11 ' CG2' ' A' ' 79' ' ' VAL . 53.3 t -60.58 -45.11 97.74 Favored 'Isoleucine or valine' 0 N--CA 1.5 2.048 0 O-C-N 121.637 -0.664 . . . . 0.0 109.806 179.148 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 10' ' ' GLU . . . . . . . . . . . . . 25.3 mt-10 -66.06 -46.25 78.47 Favored 'General case' 0 N--CA 1.498 1.932 0 O-C-N 121.567 -0.708 . . . . 0.0 110.068 179.602 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 11' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -80.71 -84.76 0.1 Allowed 'General case' 0 N--CA 1.488 1.455 0 O-C-N 121.531 -0.731 . . . . 0.0 109.661 179.655 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 12' ' ' LEU . . . . . 0.623 HD12 ' HA ' ' A' ' 9' ' ' VAL . 0.8 OUTLIER 53.23 -159.59 0.14 Allowed 'General case' 0 N--CA 1.501 2.08 0 O-C-N 121.428 -0.795 . . . . 0.0 111.047 179.472 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' A' A ' 13' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -142.96 154.69 44.3 Favored 'General case' 0 N--CA 1.495 1.824 0 O-C-N 121.301 -0.874 . . . . 0.0 109.913 179.813 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 14' ' ' GLU . . . . . . . . . . . . . 0.7 OUTLIER -54.15 -39.82 66.88 Favored 'General case' 0 N--CA 1.491 1.6 0 O-C-N 121.696 -0.627 . . . . 0.0 111.015 -179.58 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 1.4 mp0 -55.56 -45.4 77.28 Favored 'General case' 0 N--CA 1.498 1.943 0 O-C-N 121.475 -0.766 . . . . 0.0 110.629 179.742 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 16' ' ' GLN . . . . . . . . . . . . . 69.0 mt-30 -86.01 -33.19 21.12 Favored 'General case' 0 N--CA 1.499 1.991 0 O-C-N 121.344 -0.848 . . . . 0.0 110.983 179.929 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 17' ' ' LYS . . . . . . . . . . . . . 0.4 OUTLIER -65.03 -52.88 53.46 Favored 'General case' 0 N--CA 1.5 2.063 0 O-C-N 121.596 -0.69 . . . . 0.0 110.035 -179.963 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 18' ' ' ASN . . . . . . . . . . . . . 1.3 t-20 -62.37 -32.22 72.99 Favored 'General case' 0 N--CA 1.497 1.902 0 O-C-N 121.545 -0.722 . . . . 0.0 109.462 178.9 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 0.7 OUTLIER -61.37 -45.07 95.91 Favored 'General case' 0 N--CA 1.495 1.817 0 O-C-N 121.558 -0.714 . . . . 0.0 109.687 178.966 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 20' ' ' PHE . . . . . . . . . . . . . 13.4 m-85 -62.77 -35.92 81.37 Favored 'General case' 0 N--CA 1.498 1.974 0 O-C-N 121.409 -0.807 . . . . 0.0 109.438 178.873 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 21' ' ' LYS . . . . . . . . . . . . . 9.5 tptp -64.76 -46.22 83.08 Favored 'General case' 0 N--CA 1.498 1.938 0 O-C-N 121.516 -0.74 . . . . 0.0 109.389 178.602 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 22' ' ' ALA . . . . . . . . . . . . . . . -66.8 -31.15 71.59 Favored 'General case' 0 N--CA 1.498 1.949 0 O-C-N 121.599 -0.688 . . . . 0.0 110.202 179.085 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 23' ' ' ALA . . . . . . . . . . . . . . . -87.17 -7.97 57.41 Favored 'General case' 0 N--CA 1.497 1.899 0 O-C-N 121.231 -0.918 . . . . 0.0 110.806 179.448 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 24' ' ' PHE . . . . . 0.414 ' O ' HG12 ' A' ' 28' ' ' VAL . 93.1 t80 -87.6 -49.89 6.87 Favored 'General case' 0 N--CA 1.498 1.937 0 O-C-N 121.236 -0.915 . . . . 0.0 111.631 -179.265 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 25' ' ' ASP . . . . . . . . . . . . . 5.4 p-10 -58.05 -38.45 76.3 Favored 'General case' 0 N--CA 1.503 2.22 0 O-C-N 121.086 -1.009 . . . . 0.0 111.535 -178.817 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 26' ' ' ILE . . . . . 0.438 ' CG2' HD11 ' B' ' 157' ' ' LEU . 34.2 mt -65.84 -35.54 75.38 Favored 'Isoleucine or valine' 0 N--CA 1.5 2.055 0 O-C-N 120.854 -1.154 . . . . 0.0 109.386 178.918 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 27' ' ' PHE . . . . . 0.705 ' CE1' HG21 ' A' ' 44' ' ' VAL . 0.2 OUTLIER -66.13 -48.48 70.7 Favored 'General case' 0 N--CA 1.497 1.912 0 O-C-N 121.346 -0.846 . . . . 0.0 109.292 178.843 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' A' A ' 28' ' ' VAL . . . . . 1.033 HG23 ' HB3' ' A' ' 31' ' ' ALA . 2.2 p -112.18 95.75 4.1 Favored 'Isoleucine or valine' 0 N--CA 1.497 1.882 0 O-C-N 121.678 -0.638 . . . . 0.0 109.658 178.986 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 29' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -96.18 -39.56 9.63 Favored 'General case' 0 N--CA 1.5 2.06 0 O-C-N 121.371 -0.83 . . . . 0.0 109.879 -179.898 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 30' ' ' GLY . . . . . . . . . . . . . . . -135.32 55.86 0.72 Allowed Glycine 0 N--CA 1.494 2.559 0 N-CA-C 109.121 -1.591 . . . . 0.0 109.121 179.615 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 31' ' ' ALA . . . . . 1.033 ' HB3' HG23 ' A' ' 28' ' ' VAL . . . . . . . . 0 N--CA 1.492 1.642 0 O-C-N 121.479 -1.012 . . . . 0.0 110.43 -179.712 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 35' ' ' CYS . . . . . 0.707 ' N ' HG21 ' A' ' 28' ' ' VAL . 84.0 m . . . . . 0 N--CA 1.492 1.644 0 N-CA-C 109.612 -0.514 . . . . 0.0 109.612 . . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 36' ' ' ILE . . . . . 0.557 HG12 ' HB3' ' A' ' 27' ' ' PHE . 87.2 mt -59.2 113.89 0.8 Allowed 'Isoleucine or valine' 0 N--CA 1.498 1.974 0 O-C-N 121.369 -0.832 . . . . 0.0 110.133 -179.724 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 37' ' ' SER . . . . . . . . . . . . . 0.2 OUTLIER -107.47 -172.96 2.17 Favored 'General case' 0 N--CA 1.496 1.854 0 O-C-N 121.581 -0.699 . . . . 0.0 110.373 -179.684 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 38' ' ' THR . . . . . . . . . . . . . 17.6 p -59.23 -42.63 91.49 Favored 'General case' 0 N--CA 1.504 2.228 0 O-C-N 121.338 -0.851 . . . . 0.0 110.831 -179.861 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 39' ' ' LYS . . . . . . . . . . . . . 4.1 ttmt -64.54 -41.44 96.34 Favored 'General case' 0 N--CA 1.5 2.056 0 O-C-N 121.454 -0.779 . . . . 0.0 111.298 -179.602 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 40' ' ' GLU . . . . . 0.547 ' CG ' ' HB2' ' A' ' 31' ' ' ALA . 8.8 mm-40 -67.31 -46.0 74.82 Favored 'General case' 0 N--CA 1.499 2.025 0 O-C-N 121.257 -0.902 . . . . 0.0 109.925 -179.85 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 41' ' ' LEU . . . . . 0.569 ' O ' HD12 ' A' ' 41' ' ' LEU . 3.9 tp -63.58 -40.33 96.69 Favored 'General case' 0 N--CA 1.496 1.838 0 O-C-N 121.344 -0.848 . . . . 0.0 109.561 179.0 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 42' ' ' GLY . . . . . . . . . . . . . . . -60.5 -31.57 74.97 Favored Glycine 0 N--CA 1.494 2.524 0 N-CA-C 110.144 -1.182 . . . . 0.0 110.144 179.576 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 43' ' ' LYS . . . . . . . . . . . . . 0.5 OUTLIER -58.59 -47.97 82.51 Favored 'General case' 0 N--CA 1.5 2.038 0 O-C-N 121.272 -1.134 . . . . 0.0 109.563 179.219 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 44' ' ' VAL . . . . . 0.705 HG21 ' CE1' ' A' ' 27' ' ' PHE . 86.9 t -71.5 -29.78 36.42 Favored 'Isoleucine or valine' 0 N--CA 1.498 1.961 0 O-C-N 121.511 -0.743 . . . . 0.0 109.847 178.889 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 45' ' ' MET . . . . . . . . . . . . . 5.6 mmt -58.9 -39.04 80.31 Favored 'General case' 0 N--CA 1.501 2.079 0 O-C-N 121.344 -0.848 . . . . 0.0 109.861 179.147 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 46' ' ' ARG . . . . . . . . . . . . . 1.6 ttp180 -64.32 -32.41 74.01 Favored 'General case' 0 N--CA 1.496 1.875 0 O-C-N 121.624 -0.673 . . . . 0.0 110.434 179.408 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 47' ' ' MET . . . . . . . . . . . . . 12.0 mmm -61.24 -37.83 84.47 Favored 'General case' 0 N--CA 1.502 2.165 0 O-C-N 121.392 -0.818 . . . . 0.0 110.102 179.524 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 48' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -68.17 -37.98 81.56 Favored 'General case' 0 N--CA 1.497 1.904 0 O-C-N 121.413 -0.805 . . . . 0.0 110.186 179.537 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 49' ' ' GLY . . . . . . . . . . . . . . . 130.77 11.1 2.42 Favored Glycine 0 N--CA 1.497 2.716 0 C-N-CA 120.506 -0.854 . . . . 0.0 111.18 179.537 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 50' ' ' GLN . . . . . . . . . . . . . 0.1 OUTLIER -127.78 138.01 52.6 Favored 'General case' 0 N--CA 1.495 1.789 0 O-C-N 120.887 -1.361 . . . . 0.0 110.524 179.934 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 51' ' ' ASN . . . . . . . . . . . . . 1.4 m120 -122.18 80.32 44.07 Favored Pre-proline 0 N--CA 1.495 1.787 0 O-C-N 121.551 -0.718 . . . . 0.0 109.721 179.713 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 52' ' ' PRO . . . . . . . . . . . . . 49.8 Cg_endo -78.03 168.18 22.39 Favored 'Trans proline' 0 C--N 1.316 -1.136 0 O-C-N 123.885 1.466 . . . . 0.0 111.078 -179.292 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 53' ' ' THR . . . . . 0.561 ' HB ' ' HD2' ' A' ' 54' ' ' PRO . 41.3 p -76.56 168.81 24.8 Favored Pre-proline 0 N--CA 1.498 1.951 0 O-C-N 121.473 -0.767 . . . . 0.0 109.694 179.411 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 54' ' ' PRO . . . . . 0.561 ' HD2' ' HB ' ' A' ' 53' ' ' THR . 40.8 Cg_endo -64.83 -25.62 60.33 Favored 'Trans proline' 0 N--CA 1.491 1.338 0 O-C-N 123.45 1.237 . . . . 0.0 110.888 -179.984 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 55' ' ' GLU . . . . . . . . . . . . . 0.6 OUTLIER -64.79 -39.49 93.68 Favored 'General case' 0 N--CA 1.498 1.962 0 O-C-N 121.437 -0.789 . . . . 0.0 109.974 179.091 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 56' ' ' GLU . . . . . 0.45 ' O ' ' HE3' ' A' ' 60' ' ' MET . 0.6 OUTLIER -54.22 -46.48 72.51 Favored 'General case' 0 N--CA 1.499 1.988 0 O-C-N 121.634 -0.666 . . . . 0.0 109.985 179.526 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' A' A ' 57' ' ' LEU . . . . . 0.62 ' H ' HD22 ' A' ' 57' ' ' LEU . 0.7 OUTLIER -77.83 -28.01 50.1 Favored 'General case' 0 N--CA 1.492 1.673 0 O-C-N 121.334 -0.854 . . . . 0.0 110.245 179.545 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' A' A ' 58' ' ' GLN . . . . . 0.594 ' HG3' ' N ' ' A' ' 59' ' ' GLU . 0.0 OUTLIER -59.76 -34.2 72.68 Favored 'General case' 0 N--CA 1.497 1.884 0 O-C-N 121.08 -1.012 . . . . 0.0 109.077 179.054 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' A' A ' 59' ' ' GLU . . . . . 0.594 ' N ' ' HG3' ' A' ' 58' ' ' GLN . 0.5 OUTLIER -69.63 -37.05 76.65 Favored 'General case' 0 N--CA 1.494 1.763 0 N-CA-C 108.505 -0.924 . . . . 0.0 108.505 177.781 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' A' A ' 60' ' ' MET . . . . . 0.45 ' HE3' ' O ' ' A' ' 56' ' ' GLU . 4.1 mtm -63.1 -44.62 95.16 Favored 'General case' 0 N--CA 1.496 1.867 0 O-C-N 121.809 -0.557 . . . . 0.0 109.835 178.602 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 61' ' ' ILE . . . . . 0.59 HG13 HG23 ' A' ' 72' ' ' VAL . 0.2 OUTLIER -66.93 -33.6 64.45 Favored 'Isoleucine or valine' 0 N--CA 1.498 1.968 0 O-C-N 121.624 -0.673 . . . . 0.0 110.472 179.826 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' A' A ' 62' ' ' ASP . . . . . . . . . . . . . 0.9 OUTLIER -70.2 -35.86 74.22 Favored 'General case' 0 N--CA 1.498 1.947 0 O-C-N 121.27 -0.894 . . . . 0.0 110.276 179.607 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 63' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER -65.78 -35.73 81.54 Favored 'General case' 0 N--CA 1.497 1.912 0 O-C-N 121.355 -0.841 . . . . 0.0 111.174 -179.882 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 64' ' ' VAL . . . . . 0.652 HG11 ' SD ' ' A' ' 80' ' ' MET . 33.4 m -102.54 -15.58 7.8 Favored 'Isoleucine or valine' 0 N--CA 1.502 2.126 0 O-C-N 121.212 -0.93 . . . . 0.0 111.964 -179.359 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 65' ' ' ASP . . . . . . . . . . . . . 21.6 t0 -131.74 140.74 49.34 Favored 'General case' 0 N--CA 1.498 1.956 0 O-C-N 120.843 -1.16 . . . . 0.0 111.6 -179.774 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 66' ' ' GLU . . . . . . . . . . . . . 3.3 tp10 -155.46 40.01 0.4 Allowed 'General case' 0 N--CA 1.492 1.631 0 CA-C-O 121.477 0.656 . . . . 0.0 109.43 179.017 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 67' ' ' ASP . . . . . . . . . . . . . 12.1 p-10 -99.15 4.49 46.85 Favored 'General case' 0 N--CA 1.498 1.962 0 O-C-N 121.437 -0.789 . . . . 0.0 111.536 -179.532 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 68' ' ' GLY . . . . . . . . . . . . . . . 105.8 -32.39 7.45 Favored Glycine 0 N--CA 1.493 2.452 0 N-CA-C 109.543 -1.423 . . . . 0.0 109.543 -179.724 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 69' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER -69.07 -42.8 75.73 Favored 'General case' 0 N--CA 1.495 1.823 0 O-C-N 121.396 -1.061 . . . . 0.0 110.428 179.826 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 70' ' ' GLY . . . . . . . . . . . . . . . 72.78 29.76 64.82 Favored Glycine 0 N--CA 1.496 2.688 0 N-CA-C 109.248 -1.541 . . . . 0.0 109.248 -179.781 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 71' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -136.39 143.07 43.8 Favored 'General case' 0 N--CA 1.492 1.638 0 O-C-N 121.622 -0.928 . . . . 0.0 108.968 179.938 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 72' ' ' VAL . . . . . 0.59 HG23 HG13 ' A' ' 61' ' ' ILE . 3.9 t -75.5 110.63 10.71 Favored 'Isoleucine or valine' 0 N--CA 1.497 1.891 0 O-C-N 121.635 -0.665 . . . . 0.0 110.235 -179.585 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 73' ' ' ASP . . . . . . . . . . . . . 46.0 m-20 -83.03 -174.57 5.37 Favored 'General case' 0 N--CA 1.496 1.848 0 O-C-N 121.596 -0.69 . . . . 0.0 109.431 179.72 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 74' ' ' PHE . . . . . . . . . . . . . 52.2 t80 -60.62 -47.69 85.09 Favored 'General case' 0 N--CA 1.5 2.027 0 O-C-N 121.093 -1.004 . . . . 0.0 109.792 179.701 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 75' ' ' ASP . . . . . 0.572 ' HA ' HD23 ' A' ' 78' ' ' LEU . 23.6 t70 -62.14 -52.33 64.29 Favored 'General case' 0 N--CA 1.494 1.729 0 O-C-N 121.66 -0.65 . . . . 0.0 110.148 179.534 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 76' ' ' GLU . . . . . . . . . . . . . 18.4 mt-10 -57.65 -38.38 74.98 Favored 'General case' 0 N--CA 1.5 2.028 0 O-C-N 121.534 -0.729 . . . . 0.0 110.508 179.631 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 77' ' ' PHE . . . . . . . . . . . . . 58.0 t80 -63.48 -48.15 78.85 Favored 'General case' 0 N--CA 1.496 1.848 0 O-C-N 121.367 -0.833 . . . . 0.0 109.619 179.019 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 78' ' ' LEU . . . . . 0.572 HD23 ' HA ' ' A' ' 75' ' ' ASP . 0.1 OUTLIER -71.13 -30.93 67.11 Favored 'General case' 0 N--CA 1.496 1.867 0 O-C-N 121.45 -0.781 . . . . 0.0 109.734 179.117 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' A' A ' 79' ' ' VAL . . . . . 0.679 ' CG2' HG11 ' A' ' 9' ' ' VAL . 4.8 t -68.4 -39.71 81.23 Favored 'Isoleucine or valine' 0 N--CA 1.501 2.093 0 O-C-N 121.216 -0.927 . . . . 0.0 109.102 178.276 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 80' ' ' MET . . . . . 0.652 ' SD ' HG11 ' A' ' 64' ' ' VAL . 26.0 ttp -68.5 -27.46 66.15 Favored 'General case' 0 N--CA 1.495 1.822 0 O-C-N 121.562 -0.711 . . . . 0.0 109.936 179.057 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 81' ' ' MET . . . . . 0.414 ' O ' ' HB2' ' A' ' 85' ' ' MET . 8.1 mmt -67.01 -55.17 15.58 Favored 'General case' 0 N--CA 1.496 1.845 0 O-C-N 121.467 -0.77 . . . . 0.0 110.793 179.948 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 82' ' ' VAL . . . . . 0.408 HG22 ' O ' ' A' ' 79' ' ' VAL . 20.2 m -59.46 -30.66 44.9 Favored 'Isoleucine or valine' 0 N--CA 1.503 2.177 0 O-C-N 121.424 -0.798 . . . . 0.0 110.681 -179.829 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 83' ' ' ARG . . . . . . . . . . . . . 5.3 mtp-105 -52.6 -47.27 67.05 Favored 'General case' 0 N--CA 1.5 2.047 0 O-C-N 121.468 -0.77 . . . . 0.0 110.297 179.424 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 84' ' ' CYS . . . . . . . . . . . . . 36.1 m -94.3 -4.35 48.88 Favored 'General case' 0 N--CA 1.499 2.0 0 O-C-N 121.426 -0.796 . . . . 0.0 110.465 178.968 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 85' ' ' MET . . . . . 0.414 ' HB2' ' O ' ' A' ' 81' ' ' MET . 3.3 ttm . . . . . 0 N--CA 1.497 1.923 0 O-C-N 121.219 -0.925 . . . . 0.0 111.118 179.503 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' B' B ' 149' ' ' SER . . . . . . . . . . . . . 2.2 t . . . . . 0 N--CA 1.497 1.895 0 N-CA-C 109.563 -0.532 . . . . 0.0 109.563 . . . . . . . . . 0 0 . 1 . 001 nuclear nobuild core ' B' B ' 150' ' ' ALA . . . . . . . . . . . . . . . -57.79 -55.47 34.47 Favored 'General case' 0 N--CA 1.499 2.008 0 O-C-N 121.261 -0.899 . . . . 0.0 110.542 -179.828 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' B' B ' 151' ' ' ASP . . . . . . . . . . . . . 18.5 t70 -65.27 -41.54 94.12 Favored 'General case' 0 N--CA 1.497 1.894 0 O-C-N 121.328 -0.858 . . . . 0.0 110.58 179.752 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' B' B ' 152' ' ' ALA . . . . . . . . . . . . . . . -59.84 -52.37 65.74 Favored 'General case' 0 N--CA 1.499 2.013 0 O-C-N 121.414 -0.804 . . . . 0.0 110.649 179.981 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' B' B ' 153' ' ' MET . . . . . . . . . . . . . 1.3 tpt -63.22 -40.56 97.8 Favored 'General case' 0 N--CA 1.497 1.892 0 O-C-N 121.291 -0.881 . . . . 0.0 110.183 179.779 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' B' B ' 154' ' ' MET . . . . . . . . . . . . . 1.7 mtp -63.34 -43.85 96.53 Favored 'General case' 0 N--CA 1.501 2.118 0 O-C-N 121.346 -0.846 . . . . 0.0 110.121 179.345 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' B' B ' 155' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -60.25 -40.17 89.35 Favored 'General case' 0 N--CA 1.498 1.965 0 O-C-N 121.635 -0.666 . . . . 0.0 110.049 179.493 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' B' B ' 156' ' ' ALA . . . . . . . . . . . . . . . -78.29 -25.11 46.5 Favored 'General case' 0 N--CA 1.495 1.816 0 O-C-N 121.434 -0.791 . . . . 0.0 110.33 179.213 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' B' B ' 157' ' ' LEU . . . . . 0.438 HD11 ' CG2' ' A' ' 26' ' ' ILE . 0.5 OUTLIER -69.65 -50.36 44.84 Favored 'General case' 0 N--CA 1.497 1.921 0 O-C-N 121.349 -0.844 . . . . 0.0 110.503 179.951 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' B' B ' 158' ' ' LEU . . . . . . . . . . . . . 1.6 mt . . . . . 0 N--CA 1.496 1.874 0 O-C-N 121.224 -0.922 . . . . 0.0 110.245 179.713 . . . . . . . . 0 0 . 1 . 002 nuclear nobuild core ' A' A ' 4' ' ' ILE . . . . . 0.426 HG13 ' N ' ' A' ' 5' ' ' TYR . 35.3 pt . . . . . 0 N--CA 1.501 2.094 0 CA-C-O 120.829 0.347 . . . . 0.0 110.615 . . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 5' ' ' TYR . . . . . 0.426 ' N ' HG13 ' A' ' 4' ' ' ILE . 56.8 m-85 -71.1 -21.78 62.18 Favored 'General case' 0 N--CA 1.496 1.834 0 O-C-N 121.297 -0.877 . . . . 0.0 109.749 179.022 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -69.32 -49.64 53.88 Favored 'General case' 0 N--CA 1.494 1.762 0 O-C-N 121.492 -0.755 . . . . 0.0 109.722 178.916 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 7' ' ' ALA . . . . . . . . . . . . . . . -50.56 -38.84 47.4 Favored 'General case' 0 N--CA 1.499 2.017 0 O-C-N 121.572 -0.705 . . . . 0.0 110.345 179.422 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 8' ' ' ALA . . . . . . . . . . . . . . . -59.07 -42.31 90.05 Favored 'General case' 0 N--CA 1.497 1.889 0 O-C-N 121.561 -0.712 . . . . 0.0 109.758 178.978 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 9' ' ' VAL . . . . . 0.616 HG21 ' CG2' ' A' ' 79' ' ' VAL . 55.3 t -66.91 -42.67 89.22 Favored 'Isoleucine or valine' 0 N--CA 1.498 1.967 0 O-C-N 121.602 -0.686 . . . . 0.0 109.552 178.969 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 10' ' ' GLU . . . . . . . . . . . . . 0.9 OUTLIER -57.93 -39.83 78.96 Favored 'General case' 0 N--CA 1.499 1.989 0 O-C-N 121.484 -0.76 . . . . 0.0 110.041 178.949 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 11' ' ' GLN . . . . . . . . . . . . . 5.4 mt-30 -109.1 48.22 0.88 Allowed 'General case' 0 N--CA 1.495 1.786 0 O-C-N 121.486 -0.759 . . . . 0.0 109.926 179.501 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 12' ' ' LEU . . . . . 0.479 HD22 ' HB3' ' A' ' 16' ' ' GLN . 2.8 mt -82.8 158.73 22.66 Favored 'General case' 0 N--CA 1.5 2.027 0 O-C-N 121.309 -0.869 . . . . 0.0 110.636 -179.874 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 13' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -80.15 153.36 28.7 Favored 'General case' 0 N--CA 1.498 1.945 0 O-C-N 121.49 -0.756 . . . . 0.0 110.488 179.876 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 14' ' ' GLU . . . . . . . . . . . . . 12.4 tp10 -58.17 -47.18 84.2 Favored 'General case' 0 N--CA 1.492 1.673 0 C-N-CA 120.106 -0.637 . . . . 0.0 109.966 179.81 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 5.0 tt0 -57.68 -45.51 85.51 Favored 'General case' 0 N--CA 1.499 2.0 0 O-C-N 121.443 -0.786 . . . . 0.0 109.906 179.157 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 16' ' ' GLN . . . . . 0.479 ' HB3' HD22 ' A' ' 12' ' ' LEU . 3.0 mp0 -63.29 -48.41 78.25 Favored 'General case' 0 N--CA 1.496 1.875 0 CA-C-O 121.648 0.737 . . . . 0.0 110.158 179.381 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 17' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -60.97 -49.33 77.87 Favored 'General case' 0 N--CA 1.496 1.871 0 CA-C-N 116.245 -0.434 . . . . 0.0 110.199 179.647 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 18' ' ' ASN . . . . . . . . . . . . . 0.5 OUTLIER -62.12 -39.95 94.25 Favored 'General case' 0 N--CA 1.497 1.896 0 O-C-N 121.504 -0.748 . . . . 0.0 110.129 179.619 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 19' ' ' GLU . . . . . 0.403 ' HB3' ' CE ' ' B' ' 154' ' ' MET . 7.6 mm-40 -63.89 -49.32 73.18 Favored 'General case' 0 N--CA 1.497 1.907 0 O-C-N 121.51 -0.744 . . . . 0.0 110.001 179.529 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 20' ' ' PHE . . . . . 0.4 ' CE1' ' HB3' ' A' ' 81' ' ' MET . 15.6 m-85 -66.49 -35.04 79.28 Favored 'General case' 0 N--CA 1.499 2.0 0 O-C-N 121.365 -0.834 . . . . 0.0 110.235 179.497 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 21' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -58.58 -54.2 49.7 Favored 'General case' 0 N--CA 1.498 1.951 0 O-C-N 121.423 -0.798 . . . . 0.0 109.907 179.434 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 22' ' ' ALA . . . . . . . . . . . . . . . -66.04 -42.07 90.02 Favored 'General case' 0 N--CA 1.496 1.834 0 O-C-N 121.53 -0.732 . . . . 0.0 110.619 179.974 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 23' ' ' ALA . . . . . . . . . . . . . . . -61.99 -40.77 96.78 Favored 'General case' 0 N--CA 1.499 1.994 0 O-C-N 121.324 -0.86 . . . . 0.0 110.105 179.478 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 24' ' ' PHE . . . . . . . . . . . . . 67.9 t80 -60.82 -45.31 94.95 Favored 'General case' 0 N--CA 1.498 1.956 0 O-C-N 121.561 -0.712 . . . . 0.0 110.088 179.392 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 25' ' ' ASP . . . . . . . . . . . . . 3.2 m-20 -60.52 -38.2 83.62 Favored 'General case' 0 N--CA 1.498 1.942 0 O-C-N 121.595 -0.691 . . . . 0.0 110.246 179.694 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 26' ' ' ILE . . . . . 0.574 ' HA ' HD12 ' A' ' 29' ' ' LEU . 57.1 mt -74.68 -26.87 20.13 Favored 'Isoleucine or valine' 0 N--CA 1.5 2.043 0 O-C-N 121.311 -0.868 . . . . 0.0 109.919 179.285 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 27' ' ' PHE . . . . . 0.479 ' CE1' HG21 ' A' ' 44' ' ' VAL . 0.2 OUTLIER -71.4 -37.92 71.5 Favored 'General case' 0 N--CA 1.496 1.866 0 O-C-N 121.288 -0.883 . . . . 0.0 111.245 -179.836 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' A' A ' 28' ' ' VAL . . . . . 0.419 ' H ' HG22 ' A' ' 28' ' ' VAL . 28.1 m -79.71 9.79 0.7 Allowed 'Isoleucine or valine' 0 N--CA 1.503 2.211 0 O-C-N 121.29 -0.881 . . . . 0.0 111.726 -179.518 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 29' ' ' LEU . . . . . 0.574 HD12 ' HA ' ' A' ' 26' ' ' ILE . 2.5 mt -70.63 96.11 1.17 Allowed 'General case' 0 N--CA 1.496 1.834 0 O-C-N 121.001 -1.062 . . . . 0.0 109.737 179.449 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 30' ' ' GLY . . . . . . . . . . . . . . . 143.47 -25.21 2.16 Favored Glycine 0 N--CA 1.493 2.471 0 N-CA-C 109.264 -1.534 . . . . 0.0 109.264 -178.963 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 31' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.494 1.757 0 O-C-N 121.42 -1.047 . . . . 0.0 109.951 179.679 . . . . . . . . 0 0 . 1 . 002 nuclear nobuild core ' A' A ' 35' ' ' CYS . . . . . . . . . . . . . 0.1 OUTLIER . . . . . 0 N--CA 1.498 1.975 0 CA-C-O 121.391 0.615 . . . . 0.0 111.353 . . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 36' ' ' ILE . . . . . 0.566 ' HB ' ' HB ' ' A' ' 72' ' ' VAL . 1.2 mp -113.75 126.74 71.28 Favored 'Isoleucine or valine' 0 N--CA 1.496 1.875 0 O-C-N 121.405 -0.809 . . . . 0.0 109.81 179.253 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 37' ' ' SER . . . . . . . . . . . . . 52.1 p -103.06 -168.34 1.5 Allowed 'General case' 0 N--CA 1.497 1.887 0 O-C-N 121.482 -0.761 . . . . 0.0 110.593 -179.902 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 38' ' ' THR . . . . . . . . . . . . . 30.1 p -65.49 -46.21 80.64 Favored 'General case' 0 N--CA 1.501 2.103 0 O-C-N 121.291 -0.88 . . . . 0.0 110.255 179.675 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 39' ' ' LYS . . . . . . . . . . . . . 10.8 mttm -65.75 -38.34 88.83 Favored 'General case' 0 N--CA 1.499 1.99 0 O-C-N 121.484 -0.76 . . . . 0.0 110.031 179.459 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 40' ' ' GLU . . . . . 0.405 ' HB3' HG23 ' A' ' 36' ' ' ILE . 4.2 tp10 -64.69 -30.74 71.76 Favored 'General case' 0 N--CA 1.496 1.832 0 O-C-N 121.528 -0.732 . . . . 0.0 110.22 179.465 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 41' ' ' LEU . . . . . 0.698 ' CD2' HD22 ' A' ' 57' ' ' LEU . 6.0 tp -85.96 -45.84 11.11 Favored 'General case' 0 N--CA 1.496 1.841 0 O-C-N 121.445 -0.784 . . . . 0.0 110.602 179.615 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 42' ' ' GLY . . . . . . . . . . . . . . . -51.71 -39.12 45.95 Favored Glycine 0 N--CA 1.497 2.754 0 N-CA-C 111.141 -0.783 . . . . 0.0 111.141 -178.939 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 43' ' ' LYS . . . . . . . . . . . . . 2.7 pttm -58.9 -30.83 68.08 Favored 'General case' 0 N--CA 1.5 2.056 0 O-C-N 121.242 -1.152 . . . . 0.0 110.793 -179.975 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 44' ' ' VAL . . . . . 0.479 HG21 ' CE1' ' A' ' 27' ' ' PHE . 93.4 t -86.66 -32.49 6.59 Favored 'Isoleucine or valine' 0 N--CA 1.499 2.002 0 O-C-N 121.232 -0.917 . . . . 0.0 109.658 178.765 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 45' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -57.28 -50.67 72.16 Favored 'General case' 0 N--CA 1.5 2.04 0 O-C-N 121.443 -0.785 . . . . 0.0 110.282 179.8 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 46' ' ' ARG . . . . . 0.417 ' N ' ' HB2' ' A' ' 51' ' ' ASN . 0.0 OUTLIER -69.28 -41.04 77.38 Favored 'General case' 0 N--CA 1.499 1.987 0 O-C-N 121.394 -0.816 . . . . 0.0 109.796 179.393 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' A' A ' 47' ' ' MET . . . . . . . . . . . . . 0.2 OUTLIER -62.2 -37.44 85.3 Favored 'General case' 0 N--CA 1.499 1.988 0 O-C-N 121.574 -0.704 . . . . 0.0 110.112 179.238 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 48' ' ' LEU . . . . . 0.534 HD13 ' HG3' ' B' ' 153' ' ' MET . 0.4 OUTLIER -75.86 -46.75 28.59 Favored 'General case' 0 N--CA 1.493 1.686 0 O-C-N 121.446 -0.784 . . . . 0.0 110.229 179.592 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' A' A ' 49' ' ' GLY . . . . . . . . . . . . . . . -161.8 -82.69 0.04 OUTLIER Glycine 0 N--CA 1.494 2.508 0 N-CA-C 110.237 -1.145 . . . . 0.0 110.237 -179.832 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 50' ' ' GLN . . . . . . . . . . . . . 78.2 mt-30 -127.28 143.07 51.31 Favored 'General case' 0 N--CA 1.497 1.891 0 O-C-N 121.408 -1.054 . . . . 0.0 111.144 -179.361 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 51' ' ' ASN . . . . . 0.417 ' HB2' ' N ' ' A' ' 46' ' ' ARG . 33.1 t30 -116.4 110.97 42.35 Favored Pre-proline 0 N--CA 1.493 1.712 0 O-C-N 121.485 -0.759 . . . . 0.0 109.574 178.859 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 52' ' ' PRO . . . . . . . . . . . . . 44.0 Cg_endo -71.34 -92.62 0.01 OUTLIER 'Trans proline' 0 C--N 1.312 -1.361 0 O-C-N 124.003 1.528 . . . . 0.0 111.014 -179.541 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 53' ' ' THR . . . . . . . . . . . . . 0.6 OUTLIER -144.92 160.38 46.91 Favored Pre-proline 0 N--CA 1.495 1.801 0 O-C-N 120.841 -1.162 . . . . 0.0 110.667 -179.532 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 54' ' ' PRO . . . . . . . . . . . . . 43.5 Cg_endo -69.42 -38.14 8.97 Favored 'Trans proline' 0 N--CA 1.492 1.392 0 O-C-N 124.039 1.547 . . . . 0.0 111.307 179.993 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 55' ' ' GLU . . . . . . . . . . . . . 32.6 mt-10 -61.31 -38.44 86.86 Favored 'General case' 0 N--CA 1.499 1.996 0 O-C-N 121.381 -0.825 . . . . 0.0 110.634 -179.837 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 15.1 mm-40 -62.19 -37.99 87.39 Favored 'General case' 0 N--CA 1.498 1.961 0 O-C-N 121.417 -0.802 . . . . 0.0 110.765 179.736 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 57' ' ' LEU . . . . . 0.698 HD22 ' CD2' ' A' ' 41' ' ' LEU . 74.4 mt -68.65 -31.91 71.38 Favored 'General case' 0 N--CA 1.496 1.871 0 O-C-N 121.228 -0.92 . . . . 0.0 110.405 179.952 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 58' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -55.13 -52.56 62.89 Favored 'General case' 0 N--CA 1.498 1.946 0 O-C-N 121.287 -0.883 . . . . 0.0 109.041 179.024 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 59' ' ' GLU . . . . . . . . . . . . . 1.5 tm-20 -66.37 -35.96 81.67 Favored 'General case' 0 N--CA 1.494 1.744 0 N-CA-C 108.958 -0.756 . . . . 0.0 108.958 178.033 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 60' ' ' MET . . . . . . . . . . . . . 3.0 tpp -55.98 -40.68 73.63 Favored 'General case' 0 N--CA 1.498 1.949 0 O-C-N 121.571 -0.705 . . . . 0.0 109.775 178.715 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 61' ' ' ILE . . . . . 0.464 HG12 ' CG2' ' A' ' 72' ' ' VAL . 69.2 mt -71.19 -50.14 43.64 Favored 'Isoleucine or valine' 0 N--CA 1.498 1.959 0 O-C-N 121.446 -0.784 . . . . 0.0 109.302 178.928 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 62' ' ' ASP . . . . . 0.445 ' HA ' ' CB ' ' A' ' 65' ' ' ASP . 5.1 m-20 -58.9 -26.97 64.79 Favored 'General case' 0 N--CA 1.498 1.965 0 O-C-N 121.704 -0.623 . . . . 0.0 110.865 179.64 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 63' ' ' GLU . . . . . . . . . . . . . 3.0 tt0 -50.94 -39.08 53.98 Favored 'General case' 0 N--CA 1.501 2.076 0 O-C-N 121.347 -0.846 . . . . 0.0 109.981 179.179 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 64' ' ' VAL . . . . . . . . . . . . . 9.8 p -125.83 25.78 2.87 Favored 'Isoleucine or valine' 0 N--CA 1.495 1.824 0 O-C-N 121.587 -0.696 . . . . 0.0 110.393 179.259 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 65' ' ' ASP . . . . . 0.445 ' CB ' ' HA ' ' A' ' 62' ' ' ASP . 9.3 t70 -86.74 116.36 24.79 Favored 'General case' 0 N--CA 1.498 1.934 0 O-C-N 121.099 -1.001 . . . . 0.0 110.397 179.886 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 66' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER -80.07 -20.98 43.91 Favored 'General case' 0 N--CA 1.497 1.895 0 O-C-N 121.505 -0.747 . . . . 0.0 110.627 179.457 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 67' ' ' ASP . . . . . . . . . . . . . 70.0 m-20 -80.52 -15.75 55.93 Favored 'General case' 0 N--CA 1.497 1.918 0 O-C-N 121.18 -0.95 . . . . 0.0 111.729 -179.7 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 68' ' ' GLY . . . . . . . . . . . . . . . 66.66 16.68 66.0 Favored Glycine 0 N--CA 1.494 2.56 0 N-CA-C 108.731 -1.747 . . . . 0.0 108.731 -178.17 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 69' ' ' SER . . . . . . . . . . . . . 88.7 p -94.22 -34.53 12.85 Favored 'General case' 0 N--CA 1.492 1.66 0 O-C-N 121.674 -0.898 . . . . 0.0 109.984 -179.86 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 70' ' ' GLY . . . . . . . . . . . . . . . 94.87 30.34 8.48 Favored Glycine 0 N--CA 1.499 2.877 0 N-CA-C 110.137 -1.185 . . . . 0.0 110.137 179.962 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 71' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -128.75 134.34 48.39 Favored 'General case' 0 N--CA 1.499 2.025 0 O-C-N 121.516 -0.991 . . . . 0.0 108.64 179.346 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 72' ' ' VAL . . . . . 0.566 ' HB ' ' HB ' ' A' ' 36' ' ' ILE . 74.0 t -75.61 113.66 14.75 Favored 'Isoleucine or valine' 0 N--CA 1.5 2.043 0 O-C-N 121.199 -0.938 . . . . 0.0 111.375 -178.87 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 73' ' ' ASP . . . . . . . . . . . . . 3.5 m-20 -96.9 -174.61 3.03 Favored 'General case' 0 N--CA 1.493 1.721 0 O-C-N 121.724 -0.61 . . . . 0.0 109.423 178.788 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 74' ' ' PHE . . . . . . . . . . . . . 27.6 t80 -72.37 -40.51 67.25 Favored 'General case' 0 N--CA 1.498 1.943 0 O-C-N 120.928 -1.107 . . . . 0.0 109.747 179.729 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 75' ' ' ASP . . . . . . . . . . . . . 3.0 p-10 -67.69 -36.37 80.53 Favored 'General case' 0 N--CA 1.494 1.734 0 O-C-N 121.705 -0.622 . . . . 0.0 109.977 179.251 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 76' ' ' GLU . . . . . . . . . . . . . 7.6 mt-10 -73.12 -41.46 63.99 Favored 'General case' 0 N--CA 1.494 1.763 0 O-C-N 121.485 -0.76 . . . . 0.0 109.826 179.247 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 77' ' ' PHE . . . . . 0.446 ' O ' ' HG2' ' A' ' 81' ' ' MET . 61.3 t80 -57.76 -49.92 74.98 Favored 'General case' 0 N--CA 1.498 1.963 0 O-C-N 121.669 -0.644 . . . . 0.0 110.653 179.803 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 78' ' ' LEU . . . . . . . . . . . . . 46.6 mt -54.42 -45.98 73.1 Favored 'General case' 0 N--CA 1.501 2.079 0 O-C-N 121.363 -0.836 . . . . 0.0 110.372 179.928 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 79' ' ' VAL . . . . . 0.616 ' CG2' HG21 ' A' ' 9' ' ' VAL . 75.5 t -66.33 -37.99 80.87 Favored 'Isoleucine or valine' 0 N--CA 1.5 2.035 0 O-C-N 121.51 -0.744 . . . . 0.0 109.773 179.196 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 80' ' ' MET . . . . . 0.527 ' HA ' ' HG2' ' A' ' 83' ' ' ARG . 25.8 ttp -65.74 -41.84 91.67 Favored 'General case' 0 N--CA 1.495 1.786 0 O-C-N 121.53 -0.731 . . . . 0.0 110.837 179.93 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 81' ' ' MET . . . . . 0.446 ' HG2' ' O ' ' A' ' 77' ' ' PHE . 22.8 mmm -66.06 -49.87 66.13 Favored 'General case' 0 N--CA 1.497 1.923 0 O-C-N 121.286 -0.884 . . . . 0.0 111.121 -179.351 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 82' ' ' VAL . . . . . 0.45 ' HA ' ' HE2' ' A' ' 85' ' ' MET . 34.9 m -64.4 -35.19 73.59 Favored 'Isoleucine or valine' 0 N--CA 1.503 2.215 0 O-C-N 121.135 -0.978 . . . . 0.0 111.197 -179.418 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 83' ' ' ARG . . . . . 0.527 ' HG2' ' HA ' ' A' ' 80' ' ' MET . 0.0 OUTLIER -79.33 -21.11 46.32 Favored 'General case' 0 N--CA 1.499 1.996 0 O-C-N 121.094 -1.004 . . . . 0.0 110.642 179.564 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' A' A ' 84' ' ' CYS . . . . . 0.485 ' N ' ' HG3' ' A' ' 83' ' ' ARG . 41.3 t -78.72 -25.17 44.58 Favored 'General case' 0 N--CA 1.498 1.967 0 O-C-N 121.103 -0.998 . . . . 0.0 110.614 179.74 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 85' ' ' MET . . . . . 0.45 ' HE2' ' HA ' ' A' ' 82' ' ' VAL . 7.6 mtm . . . . . 0 N--CA 1.501 2.111 0 O-C-N 121.449 -0.782 . . . . 0.0 110.988 -179.882 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' B' B ' 149' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER . . . . . 0 N--CA 1.504 2.257 0 CA-C-O 121.474 0.654 . . . . 0.0 111.132 . . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' B' B ' 150' ' ' ALA . . . . . . . . . . . . . . . -56.89 -41.76 78.64 Favored 'General case' 0 N--CA 1.5 2.045 0 O-C-N 121.298 -0.876 . . . . 0.0 110.283 179.632 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' B' B ' 151' ' ' ASP . . . . . . . . . . . . . 7.9 p-10 -61.56 -38.72 88.51 Favored 'General case' 0 N--CA 1.498 1.944 0 O-C-N 121.505 -0.747 . . . . 0.0 110.444 179.438 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' B' B ' 152' ' ' ALA . . . . . . . . . . . . . . . -67.02 -48.32 68.76 Favored 'General case' 0 N--CA 1.497 1.886 0 O-C-N 121.312 -0.868 . . . . 0.0 109.703 179.392 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' B' B ' 153' ' ' MET . . . . . 0.534 ' HG3' HD13 ' A' ' 48' ' ' LEU . 1.6 ttt -64.23 -36.85 85.42 Favored 'General case' 0 N--CA 1.498 1.927 0 O-C-N 121.545 -0.722 . . . . 0.0 110.155 179.221 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' B' B ' 154' ' ' MET . . . . . 0.403 ' CE ' ' HB3' ' A' ' 19' ' ' GLU . 15.8 mtp -58.82 -48.3 81.79 Favored 'General case' 0 N--CA 1.499 1.977 0 O-C-N 121.571 -0.706 . . . . 0.0 110.092 179.449 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' B' B ' 155' ' ' GLN . . . . . . . . . . . . . 19.1 mt-30 -71.97 -33.33 68.07 Favored 'General case' 0 N--CA 1.498 1.95 0 O-C-N 121.479 -0.763 . . . . 0.0 110.387 179.46 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' B' B ' 156' ' ' ALA . . . . . . . . . . . . . . . -62.98 -42.72 99.91 Favored 'General case' 0 N--CA 1.496 1.848 0 O-C-N 121.42 -0.8 . . . . 0.0 110.497 -179.889 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' B' B ' 157' ' ' LEU . . . . . . . . . . . . . 0.8 OUTLIER -86.4 -54.03 4.66 Favored 'General case' 0 N--CA 1.497 1.9 0 O-C-N 121.356 -0.84 . . . . 0.0 110.298 179.803 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' B' B ' 158' ' ' LEU . . . . . . . . . . . . . 4.8 mt . . . . . 0 N--CA 1.495 1.803 0 O-C-N 121.368 -0.833 . . . . 0.0 109.907 179.751 . . . . . . . . 0 0 . 1 . 003 nuclear nobuild core ' A' A ' 4' ' ' ILE . . . . . . . . . . . . . 49.4 mt . . . . . 0 N--CA 1.504 2.252 0 N-CA-C 111.899 0.333 . . . . 0.0 111.899 . . . . . . . . . 0 0 . 1 . 003 nuclear nobuild core ' A' A ' 5' ' ' TYR . . . . . 0.489 ' CE1' ' HA ' ' A' ' 83' ' ' ARG . 31.7 m-85 -60.53 -32.66 71.68 Favored 'General case' 0 N--CA 1.502 2.147 0 O-C-N 121.053 -1.03 . . . . 0.0 111.246 -179.501 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -62.68 -38.93 92.3 Favored 'General case' 0 N--CA 1.498 1.941 0 O-C-N 121.117 -0.989 . . . . 0.0 109.741 178.811 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 7' ' ' ALA . . . . . . . . . . . . . . . -59.73 -38.49 81.86 Favored 'General case' 0 N--CA 1.497 1.909 0 O-C-N 121.544 -0.722 . . . . 0.0 110.251 179.13 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 8' ' ' ALA . . . . . 0.702 ' HB1' HG21 ' A' ' 82' ' ' VAL . . . -60.34 -33.93 73.11 Favored 'General case' 0 N--CA 1.498 1.928 0 O-C-N 121.364 -0.835 . . . . 0.0 110.308 179.232 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 9' ' ' VAL . . . . . 0.44 HG21 ' HB ' ' A' ' 79' ' ' VAL . 93.3 t -65.96 -34.88 73.22 Favored 'Isoleucine or valine' 0 N--CA 1.5 2.046 0 O-C-N 121.403 -0.81 . . . . 0.0 109.745 179.3 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 10' ' ' GLU . . . . . . . . . . . . . 22.7 mt-10 -62.98 -31.68 72.85 Favored 'General case' 0 N--CA 1.498 1.93 0 O-C-N 121.376 -0.828 . . . . 0.0 109.951 178.951 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 11' ' ' GLN . . . . . . . . . . . . . 1.0 OUTLIER -67.1 -28.63 68.33 Favored 'General case' 0 N--CA 1.499 1.978 0 O-C-N 121.413 -0.804 . . . . 0.0 110.247 179.202 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 12' ' ' LEU . . . . . 0.486 HD22 ' HB3' ' A' ' 16' ' ' GLN . 81.0 mt -77.11 98.56 5.08 Favored 'General case' 0 N--CA 1.496 1.838 0 O-C-N 121.227 -0.92 . . . . 0.0 109.797 179.661 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 13' ' ' THR . . . . . . . . . . . . . 11.6 p -77.31 -176.2 4.04 Favored 'General case' 0 N--CA 1.498 1.964 0 O-C-N 121.438 -0.789 . . . . 0.0 110.874 -179.588 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 14' ' ' GLU . . . . . 0.419 ' HA ' ' HB2' ' A' ' 17' ' ' LYS . 0.5 OUTLIER -50.54 -36.32 33.72 Favored 'General case' 0 N--CA 1.496 1.828 0 O-C-N 121.734 -0.604 . . . . 0.0 111.299 -178.848 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 1.9 mp0 -60.82 -46.62 89.83 Favored 'General case' 0 N--CA 1.5 2.033 0 O-C-N 121.422 -0.799 . . . . 0.0 109.972 179.516 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 16' ' ' GLN . . . . . 0.486 ' HB3' HD22 ' A' ' 12' ' ' LEU . 1.1 mp0 -75.96 -35.73 59.55 Favored 'General case' 0 N--CA 1.497 1.913 0 O-C-N 121.567 -0.708 . . . . 0.0 109.986 179.208 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 17' ' ' LYS . . . . . 0.419 ' HB2' ' HA ' ' A' ' 14' ' ' GLU . 14.0 mmtt -62.92 -41.45 99.48 Favored 'General case' 0 N--CA 1.495 1.812 0 O-C-N 121.925 -0.484 . . . . 0.0 109.811 179.271 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 18' ' ' ASN . . . . . . . . . . . . . 9.4 t30 -62.46 -40.46 96.7 Favored 'General case' 0 N--CA 1.496 1.863 0 O-C-N 121.598 -0.689 . . . . 0.0 110.399 179.587 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 19' ' ' GLU . . . . . 0.514 ' HB3' ' HE3' ' B' ' 154' ' ' MET . 4.5 mm-40 -61.0 -42.87 99.28 Favored 'General case' 0 N--CA 1.501 2.085 0 O-C-N 121.438 -0.789 . . . . 0.0 110.129 179.503 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 20' ' ' PHE . . . . . . . . . . . . . 5.7 m-85 -77.41 -36.42 53.33 Favored 'General case' 0 N--CA 1.499 2.008 0 O-C-N 121.326 -0.859 . . . . 0.0 109.978 179.221 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 21' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -57.79 -48.65 79.08 Favored 'General case' 0 N--CA 1.499 1.993 0 O-C-N 121.645 -0.659 . . . . 0.0 110.15 179.408 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 22' ' ' ALA . . . . . . . . . . . . . . . -59.98 -43.97 94.8 Favored 'General case' 0 N--CA 1.497 1.881 0 O-C-N 121.605 -0.685 . . . . 0.0 110.036 179.597 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 23' ' ' ALA . . . . . . . . . . . . . . . -66.67 -35.44 80.17 Favored 'General case' 0 N--CA 1.497 1.902 0 O-C-N 121.334 -0.854 . . . . 0.0 109.142 178.597 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 24' ' ' PHE . . . . . 0.568 ' CE1' HD12 ' A' ' 36' ' ' ILE . 56.5 t80 -62.4 -34.51 76.87 Favored 'General case' 0 N--CA 1.497 1.876 0 O-C-N 121.737 -0.602 . . . . 0.0 110.173 179.029 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 25' ' ' ASP . . . . . . . . . . . . . 16.5 m-20 -58.45 -52.62 64.85 Favored 'General case' 0 N--CA 1.5 2.026 0 O-C-N 121.523 -0.736 . . . . 0.0 110.503 179.675 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 26' ' ' ILE . . . . . 0.502 HD13 ' O ' ' B' ' 157' ' ' LEU . 3.2 mt -63.38 -37.75 80.36 Favored 'Isoleucine or valine' 0 N--CA 1.498 1.966 0 O-C-N 121.393 -0.817 . . . . 0.0 109.678 179.527 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 27' ' ' PHE . . . . . 0.696 ' HB3' HD11 ' A' ' 36' ' ' ILE . 0.1 OUTLIER -61.62 -34.43 75.65 Favored 'General case' 0 N--CA 1.498 1.932 0 O-C-N 121.603 -0.685 . . . . 0.0 110.672 179.632 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' A' A ' 28' ' ' VAL . . . . . 0.704 HG12 HG13 ' A' ' 36' ' ' ILE . 16.0 m -101.93 -6.39 9.2 Favored 'Isoleucine or valine' 0 N--CA 1.502 2.169 0 O-C-N 121.166 -0.959 . . . . 0.0 111.527 -179.879 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 29' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -52.73 -56.97 11.76 Favored 'General case' 0 N--CA 1.501 2.112 0 O-C-N 121.129 -0.982 . . . . 0.0 110.886 -179.671 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 30' ' ' GLY . . . . . . . . . . . . . . . -105.28 51.4 0.77 Allowed Glycine 0 N--CA 1.494 2.525 0 N-CA-C 108.851 -1.7 . . . . 0.0 108.851 179.381 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 31' ' ' ALA . . . . . 0.546 ' HA ' ' HG2' ' A' ' 40' ' ' GLU . . . . . . . . 0 N--CA 1.495 1.775 0 O-C-N 121.37 -1.076 . . . . 0.0 111.562 -179.235 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 35' ' ' CYS . . . . . . . . . . . . . 94.9 m . . . . . 0 N--CA 1.499 1.998 0 CA-C-O 121.092 0.472 . . . . 0.0 110.652 . . . . . . . . . 0 0 . 1 . 003 nuclear nobuild core ' A' A ' 36' ' ' ILE . . . . . 0.704 HG13 HG12 ' A' ' 28' ' ' VAL . 4.7 mt -68.91 112.23 3.55 Favored 'Isoleucine or valine' 0 N--CA 1.499 1.999 0 O-C-N 121.339 -0.851 . . . . 0.0 110.27 -179.82 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 37' ' ' SER . . . . . . . . . . . . . 18.6 t -101.03 -174.61 2.65 Favored 'General case' 0 N--CA 1.495 1.823 0 O-C-N 121.517 -0.739 . . . . 0.0 109.825 179.558 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 38' ' ' THR . . . . . . . . . . . . . 8.3 p -60.55 -53.33 58.8 Favored 'General case' 0 N--CA 1.504 2.239 0 O-C-N 121.345 -0.847 . . . . 0.0 111.303 -179.447 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 39' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -59.14 -39.63 82.99 Favored 'General case' 0 N--CA 1.502 2.153 0 O-C-N 121.422 -0.799 . . . . 0.0 111.512 -179.22 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 40' ' ' GLU . . . . . 0.546 ' HG2' ' HA ' ' A' ' 31' ' ' ALA . 1.1 mp0 -63.09 -46.18 88.6 Favored 'General case' 0 N--CA 1.502 2.127 0 O-C-N 121.064 -1.023 . . . . 0.0 110.346 179.652 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 41' ' ' LEU . . . . . 0.475 HD12 ' HG3' ' A' ' 45' ' ' MET . 0.1 OUTLIER -58.71 -61.02 2.92 Favored 'General case' 0 N--CA 1.499 1.983 0 O-C-N 121.544 -0.723 . . . . 0.0 109.693 179.192 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' A' A ' 42' ' ' GLY . . . . . . . . . . . . . . . -48.99 -33.33 13.32 Favored Glycine 0 N--CA 1.5 2.907 0 N-CA-C 111.036 -0.826 . . . . 0.0 111.036 179.938 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 43' ' ' LYS . . . . . . . . . . . . . 2.4 tmtt? -56.7 -42.36 79.0 Favored 'General case' 0 N--CA 1.504 2.243 0 O-C-N 121.224 -1.162 . . . . 0.0 110.322 179.912 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 44' ' ' VAL . . . . . . . . . . . . . 76.8 t -76.84 -33.84 21.88 Favored 'Isoleucine or valine' 0 N--CA 1.494 1.762 0 O-C-N 121.296 -0.877 . . . . 0.0 109.265 179.191 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 45' ' ' MET . . . . . 0.519 ' SD ' ' HG3' ' A' ' 52' ' ' PRO . 1.2 mtt -57.73 -55.28 36.97 Favored 'General case' 0 N--CA 1.497 1.913 0 O-C-N 121.514 -0.741 . . . . 0.0 109.825 179.103 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 46' ' ' ARG . . . . . . . . . . . . . 15.4 ptp180 -61.45 -34.22 75.05 Favored 'General case' 0 N--CA 1.502 2.163 0 O-C-N 121.343 -0.848 . . . . 0.0 110.279 179.279 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 47' ' ' MET . . . . . . . . . . . . . 16.5 ttp -61.31 -32.9 72.76 Favored 'General case' 0 N--CA 1.499 2.007 0 O-C-N 121.281 -0.887 . . . . 0.0 109.388 178.557 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 48' ' ' LEU . . . . . . . . . . . . . 8.2 tp -85.06 -42.46 14.81 Favored 'General case' 0 N--CA 1.492 1.649 0 O-C-N 121.617 -0.677 . . . . 0.0 110.003 179.164 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 49' ' ' GLY . . . . . . . . . . . . . . . 169.9 -65.8 0.17 Allowed Glycine 0 N--CA 1.497 2.705 0 C-N-CA 119.759 -1.21 . . . . 0.0 110.896 179.882 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 50' ' ' GLN . . . . . . . . . . . . . 1.2 mt-30 -59.59 136.52 58.01 Favored 'General case' 0 N--CA 1.504 2.236 0 O-C-N 121.356 -1.085 . . . . 0.0 111.165 -179.03 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 51' ' ' ASN . . . . . . . . . . . . . 2.2 m-80 -118.74 77.98 15.22 Favored Pre-proline 0 N--CA 1.498 1.937 0 O-C-N 121.282 -0.887 . . . . 0.0 110.693 -179.97 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 52' ' ' PRO . . . . . 0.519 ' HG3' ' SD ' ' A' ' 45' ' ' MET . 54.2 Cg_endo -81.94 163.68 18.06 Favored 'Trans proline' 0 C--N 1.313 -1.294 0 O-C-N 123.814 1.428 . . . . 0.0 110.809 179.768 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 53' ' ' THR . . . . . 0.514 ' O ' HD12 ' A' ' 57' ' ' LEU . 34.2 p -95.25 161.98 26.26 Favored Pre-proline 0 N--CA 1.496 1.854 0 O-C-N 121.325 -0.859 . . . . 0.0 109.826 179.245 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 54' ' ' PRO . . . . . . . . . . . . . 38.9 Cg_endo -65.85 -32.73 45.23 Favored 'Trans proline' 0 C--N 1.312 -1.362 0 O-C-N 123.703 1.37 . . . . 0.0 110.255 179.355 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 55' ' ' GLU . . . . . . . . . . . . . 12.2 mp0 -66.73 -38.47 86.74 Favored 'General case' 0 N--CA 1.496 1.834 0 O-C-N 121.401 -0.812 . . . . 0.0 109.425 178.558 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 0.3 OUTLIER -74.14 -40.78 62.39 Favored 'General case' 0 N--CA 1.495 1.804 0 O-C-N 121.568 -0.707 . . . . 0.0 110.078 179.298 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 57' ' ' LEU . . . . . 0.552 ' HA ' ' HG3' ' A' ' 60' ' ' MET . 6.7 mt -62.39 -20.25 64.26 Favored 'General case' 0 N--CA 1.5 2.037 0 O-C-N 121.259 -0.9 . . . . 0.0 110.93 179.69 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 58' ' ' GLN . . . . . 0.576 ' HG3' ' N ' ' A' ' 59' ' ' GLU . 0.0 OUTLIER -59.81 -37.55 79.47 Favored 'General case' 0 N--CA 1.496 1.865 0 O-C-N 121.05 -1.031 . . . . 0.0 109.095 179.131 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' A' A ' 59' ' ' GLU . . . . . 0.576 ' N ' ' HG3' ' A' ' 58' ' ' GLN . 0.4 OUTLIER -73.56 -35.81 65.53 Favored 'General case' 0 N--CA 1.497 1.879 0 N-CA-C 108.9 -0.778 . . . . 0.0 108.9 178.128 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' A' A ' 60' ' ' MET . . . . . 0.552 ' HG3' ' HA ' ' A' ' 57' ' ' LEU . 1.6 mmm -58.92 -42.64 90.2 Favored 'General case' 0 N--CA 1.497 1.881 0 O-C-N 121.708 -0.62 . . . . 0.0 109.679 179.04 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 61' ' ' ILE . . . . . 0.568 HG23 HG23 ' A' ' 72' ' ' VAL . 3.2 mt -76.86 -42.29 32.87 Favored 'Isoleucine or valine' 0 N--CA 1.497 1.923 0 O-C-N 121.511 -0.743 . . . . 0.0 109.913 179.226 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 62' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -58.9 -31.5 68.67 Favored 'General case' 0 N--CA 1.502 2.141 0 O-C-N 121.438 -0.789 . . . . 0.0 110.909 179.943 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 63' ' ' GLU . . . . . . . . . . . . . 2.7 tt0 -53.54 -34.73 59.27 Favored 'General case' 0 N--CA 1.5 2.035 0 O-C-N 121.7 -0.625 . . . . 0.0 111.099 179.893 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 64' ' ' VAL . . . . . 0.512 HG21 HG13 ' A' ' 79' ' ' VAL . 9.8 p -118.46 16.87 7.04 Favored 'Isoleucine or valine' 0 N--CA 1.497 1.888 0 O-C-N 121.25 -0.906 . . . . 0.0 111.16 179.999 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 65' ' ' ASP . . . . . . . . . . . . . 25.7 t70 -92.6 -88.43 0.21 Allowed 'General case' 0 N--CA 1.498 1.934 0 O-C-N 120.902 -1.124 . . . . 0.0 110.091 179.673 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 66' ' ' GLU . . . . . . . . . . . . . 3.3 mt-10 47.84 38.67 9.26 Favored 'General case' 0 N--CA 1.504 2.24 0 O-C-N 121.374 -0.828 . . . . 0.0 111.326 179.654 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 67' ' ' ASP . . . . . . . . . . . . . 0.8 OUTLIER -114.77 -32.74 5.72 Favored 'General case' 0 N--CA 1.5 2.058 0 O-C-N 121.062 -1.024 . . . . 0.0 111.455 -179.774 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 68' ' ' GLY . . . . . . . . . . . . . . . 140.13 -30.87 2.31 Favored Glycine 0 N--CA 1.497 2.703 0 C-N-CA 120.006 -1.092 . . . . 0.0 110.658 179.923 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 69' ' ' SER . . . . . . . . . . . . . 11.4 p -93.55 -29.68 15.38 Favored 'General case' 0 N--CA 1.499 2.006 0 O-C-N 121.189 -1.183 . . . . 0.0 111.847 -179.358 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 70' ' ' GLY . . . . . . . . . . . . . . . 89.2 -42.62 3.03 Favored Glycine 0 N--CA 1.498 2.824 0 C-N-CA 119.614 -1.279 . . . . 0.0 109.919 -179.383 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 71' ' ' THR . . . . . . . . . . . . . 26.7 m -71.41 153.25 42.42 Favored 'General case' 0 N--CA 1.502 2.128 0 O-C-N 121.373 -1.075 . . . . 0.0 110.38 179.966 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 72' ' ' VAL . . . . . 0.568 HG23 HG23 ' A' ' 61' ' ' ILE . 1.7 t -77.22 138.11 21.13 Favored 'Isoleucine or valine' 0 N--CA 1.501 2.11 0 O-C-N 121.29 -0.881 . . . . 0.0 111.016 -179.579 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 73' ' ' ASP . . . . . . . . . . . . . 5.0 m-20 -104.0 -162.0 0.87 Allowed 'General case' 0 N--CA 1.5 2.042 0 O-C-N 121.597 -0.689 . . . . 0.0 109.858 179.291 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 74' ' ' PHE . . . . . . . . . . . . . 16.9 t80 -78.66 -65.21 1.02 Allowed 'General case' 0 N--CA 1.502 2.16 0 O-C-N 120.927 -1.108 . . . . 0.0 110.015 179.642 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 75' ' ' ASP . . . . . 0.754 ' HA ' HD12 ' A' ' 78' ' ' LEU . 0.6 OUTLIER -60.17 -31.43 70.1 Favored 'General case' 0 N--CA 1.498 1.933 0 O-C-N 121.327 -0.858 . . . . 0.0 109.73 179.34 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' A' A ' 76' ' ' GLU . . . . . 0.646 ' O ' HG12 ' A' ' 79' ' ' VAL . 3.8 tt0 -65.73 -36.37 83.39 Favored 'General case' 0 N--CA 1.498 1.971 0 O-C-N 121.365 -0.834 . . . . 0.0 108.793 178.07 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 77' ' ' PHE . . . . . 0.428 ' O ' ' HG2' ' A' ' 81' ' ' MET . 19.1 t80 -69.97 -37.98 75.94 Favored 'General case' 0 N--CA 1.494 1.732 0 N-CA-C 108.907 -0.775 . . . . 0.0 108.907 178.301 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 78' ' ' LEU . . . . . 0.754 HD12 ' HA ' ' A' ' 75' ' ' ASP . 17.4 mt -58.88 -44.51 91.12 Favored 'General case' 0 N--CA 1.498 1.954 0 O-C-N 121.581 -0.699 . . . . 0.0 110.292 179.308 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 79' ' ' VAL . . . . . 0.646 HG12 ' O ' ' A' ' 76' ' ' GLU . 9.0 p -72.74 -18.88 18.76 Favored 'Isoleucine or valine' 0 N--CA 1.5 2.034 0 O-C-N 121.334 -0.854 . . . . 0.0 110.211 178.803 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 80' ' ' MET . . . . . 0.411 ' SD ' HG11 ' A' ' 64' ' ' VAL . 13.6 ttt -76.58 -39.03 53.89 Favored 'General case' 0 N--CA 1.497 1.91 0 O-C-N 121.226 -0.921 . . . . 0.0 109.783 179.035 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 81' ' ' MET . . . . . 0.428 ' HG2' ' O ' ' A' ' 77' ' ' PHE . 55.3 mmm -60.69 -45.64 93.4 Favored 'General case' 0 N--CA 1.497 1.91 0 O-C-N 121.441 -0.787 . . . . 0.0 110.209 179.479 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 82' ' ' VAL . . . . . 0.702 HG21 ' HB1' ' A' ' 8' ' ' ALA . 1.8 p -69.91 -30.6 44.93 Favored 'Isoleucine or valine' 0 N--CA 1.496 1.826 0 O-C-N 121.364 -0.835 . . . . 0.0 110.111 179.558 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 83' ' ' ARG . . . . . 0.489 ' HA ' ' CE1' ' A' ' 5' ' ' TYR . 4.0 mtt-85 -65.5 -44.44 87.01 Favored 'General case' 0 N--CA 1.496 1.871 0 O-C-N 121.278 -0.888 . . . . 0.0 109.369 178.811 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 84' ' ' CYS . . . . . . . . . . . . . 23.9 t -72.63 -38.23 67.8 Favored 'General case' 0 N--CA 1.495 1.816 0 O-C-N 121.619 -0.676 . . . . 0.0 109.788 178.795 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 85' ' ' MET . . . . . . . . . . . . . 4.0 ttm . . . . . 0 N--CA 1.498 1.96 0 O-C-N 121.506 -0.746 . . . . 0.0 110.514 179.453 . . . . . . . . 0 0 . 1 . 003 nuclear nobuild core ' B' B ' 149' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER . . . . . 0 N--CA 1.496 1.826 0 CA-C-O 121.087 0.47 . . . . 0.0 110.443 . . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' B' B ' 150' ' ' ALA . . . . . . . . . . . . . . . -57.72 -45.57 85.58 Favored 'General case' 0 N--CA 1.499 1.993 0 O-C-N 121.577 -0.702 . . . . 0.0 110.742 -179.915 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' B' B ' 151' ' ' ASP . . . . . . . . . . . . . 6.9 p-10 -67.64 -37.53 82.57 Favored 'General case' 0 N--CA 1.499 2.007 0 O-C-N 121.511 -0.743 . . . . 0.0 110.414 179.703 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' B' B ' 152' ' ' ALA . . . . . . . . . . . . . . . -62.55 -47.56 83.33 Favored 'General case' 0 N--CA 1.498 1.945 0 O-C-N 121.345 -0.847 . . . . 0.0 109.875 179.367 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' B' B ' 153' ' ' MET . . . . . . . . . . . . . 5.1 mtt -66.16 -39.9 90.14 Favored 'General case' 0 N--CA 1.496 1.846 0 O-C-N 121.692 -0.63 . . . . 0.0 110.029 179.254 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' B' B ' 154' ' ' MET . . . . . 0.514 ' HE3' ' HB3' ' A' ' 19' ' ' GLU . 0.3 OUTLIER -63.01 -51.88 65.11 Favored 'General case' 0 N--CA 1.496 1.83 0 O-C-N 121.622 -0.674 . . . . 0.0 110.314 179.815 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' B' B ' 155' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -64.15 -40.95 97.24 Favored 'General case' 0 N--CA 1.497 1.909 0 O-C-N 121.367 -0.833 . . . . 0.0 110.196 179.377 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' B' B ' 156' ' ' ALA . . . . . . . . . . . . . . . -62.43 -37.76 87.08 Favored 'General case' 0 N--CA 1.499 1.993 0 O-C-N 121.349 -0.844 . . . . 0.0 110.514 179.526 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' B' B ' 157' ' ' LEU . . . . . 0.502 ' O ' HD13 ' A' ' 26' ' ' ILE . 0.3 OUTLIER -89.13 -1.71 58.21 Favored 'General case' 0 N--CA 1.5 2.03 0 O-C-N 121.205 -0.934 . . . . 0.0 111.284 179.722 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' B' B ' 158' ' ' LEU . . . . . . . . . . . . . 1.5 mt . . . . . 0 N--CA 1.5 2.037 0 O-C-N 120.943 -1.098 . . . . 0.0 110.541 179.985 . . . . . . . . 0 0 . 1 . 004 nuclear nobuild core ' A' A ' 4' ' ' ILE . . . . . . . . . . . . . 16.7 mt . . . . . 0 N--CA 1.497 1.889 0 CA-C-O 120.774 0.321 . . . . 0.0 110.595 . . . . . . . . . 0 0 . 1 . 004 nuclear nobuild core ' A' A ' 5' ' ' TYR . . . . . 0.434 ' CE1' ' HD3' ' A' ' 83' ' ' ARG . 72.2 m-85 -59.05 -42.97 91.59 Favored 'General case' 0 N--CA 1.5 2.062 0 O-C-N 121.428 -0.795 . . . . 0.0 110.148 -179.919 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -62.52 -41.22 98.71 Favored 'General case' 0 N--CA 1.497 1.921 0 O-C-N 121.363 -0.836 . . . . 0.0 108.995 178.586 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 7' ' ' ALA . . . . . . . . . . . . . . . -63.6 -38.19 90.19 Favored 'General case' 0 N--CA 1.496 1.838 0 O-C-N 121.562 -0.711 . . . . 0.0 109.94 178.752 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 8' ' ' ALA . . . . . . . . . . . . . . . -58.67 -35.08 72.02 Favored 'General case' 0 N--CA 1.499 1.993 0 O-C-N 121.405 -0.809 . . . . 0.0 109.887 179.193 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 9' ' ' VAL . . . . . 0.58 ' HA ' HD12 ' A' ' 12' ' ' LEU . 40.9 t -61.27 -41.59 90.26 Favored 'Isoleucine or valine' 0 N--CA 1.498 1.946 0 O-C-N 121.495 -0.753 . . . . 0.0 109.493 178.908 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 10' ' ' GLU . . . . . . . . . . . . . 10.1 mt-10 -69.37 -26.91 64.9 Favored 'General case' 0 N--CA 1.498 1.972 0 O-C-N 121.55 -0.719 . . . . 0.0 110.224 179.082 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 11' ' ' GLN . . . . . . . . . . . . . 8.9 mt-30 -73.55 -36.2 65.6 Favored 'General case' 0 N--CA 1.499 2.013 0 O-C-N 121.403 -0.811 . . . . 0.0 110.694 179.91 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 12' ' ' LEU . . . . . 0.58 HD12 ' HA ' ' A' ' 9' ' ' VAL . 18.9 mt -58.5 136.75 57.61 Favored 'General case' 0 N--CA 1.496 1.87 0 O-C-N 121.51 -0.744 . . . . 0.0 110.619 -179.673 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 13' ' ' THR . . . . . . . . . . . . . 82.7 p -81.65 171.98 13.97 Favored 'General case' 0 N--CA 1.499 1.977 0 O-C-N 121.348 -0.845 . . . . 0.0 110.359 179.971 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 14' ' ' GLU . . . . . . . . . . . . . 1.0 OUTLIER -57.27 -34.34 68.54 Favored 'General case' 0 N--CA 1.491 1.583 0 O-C-N 121.511 -0.743 . . . . 0.0 109.981 179.84 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 1.4 mp0 -57.7 -55.48 34.32 Favored 'General case' 0 N--CA 1.497 1.885 0 O-C-N 121.652 -0.655 . . . . 0.0 109.745 179.273 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 16' ' ' GLN . . . . . 0.471 ' HA ' ' HB2' ' A' ' 19' ' ' GLU . 1.7 mt-30 -65.6 -37.77 87.57 Favored 'General case' 0 N--CA 1.498 1.967 0 O-C-N 121.494 -0.754 . . . . 0.0 110.178 179.345 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 17' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -58.91 -49.14 78.9 Favored 'General case' 0 N--CA 1.496 1.872 0 N-CA-C 109.333 -0.618 . . . . 0.0 109.333 179.009 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 18' ' ' ASN . . . . . . . . . . . . . 2.1 t30 -71.05 -34.37 71.19 Favored 'General case' 0 N--CA 1.494 1.762 0 O-C-N 121.62 -0.675 . . . . 0.0 109.449 178.861 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 19' ' ' GLU . . . . . 0.471 ' HB2' ' HA ' ' A' ' 16' ' ' GLN . 7.7 mt-10 -56.63 -48.03 78.4 Favored 'General case' 0 N--CA 1.5 2.062 0 O-C-N 121.567 -0.708 . . . . 0.0 110.064 178.991 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 20' ' ' PHE . . . . . . . . . . . . . 18.4 m-85 -66.8 -38.24 86.11 Favored 'General case' 0 N--CA 1.498 1.937 0 O-C-N 121.537 -0.727 . . . . 0.0 110.211 179.586 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 21' ' ' LYS . . . . . . . . . . . . . 14.2 tptt -56.7 -53.04 62.32 Favored 'General case' 0 N--CA 1.5 2.074 0 O-C-N 121.455 -0.778 . . . . 0.0 109.895 179.522 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 22' ' ' ALA . . . . . . . . . . . . . . . -60.1 -45.95 91.22 Favored 'General case' 0 N--CA 1.499 1.989 0 O-C-N 121.518 -0.739 . . . . 0.0 110.046 179.513 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 23' ' ' ALA . . . . . . . . . . . . . . . -61.73 -37.56 84.67 Favored 'General case' 0 N--CA 1.496 1.871 0 O-C-N 121.583 -0.698 . . . . 0.0 109.867 179.131 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 24' ' ' PHE . . . . . 0.529 ' O ' HG12 ' A' ' 28' ' ' VAL . 25.6 t80 -62.72 -45.39 92.96 Favored 'General case' 0 N--CA 1.495 1.823 0 O-C-N 121.565 -0.709 . . . . 0.0 109.971 179.328 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 25' ' ' ASP . . . . . . . . . . . . . 18.7 m-20 -56.37 -43.75 79.47 Favored 'General case' 0 N--CA 1.498 1.962 0 O-C-N 121.562 -0.711 . . . . 0.0 109.973 179.468 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 26' ' ' ILE . . . . . . . . . . . . . 41.0 mt -71.68 -32.24 44.68 Favored 'Isoleucine or valine' 0 N--CA 1.498 1.974 0 O-C-N 121.523 -0.736 . . . . 0.0 109.825 179.14 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 27' ' ' PHE . . . . . 0.758 ' HE2' HD11 ' B' ' 157' ' ' LEU . 0.2 OUTLIER -63.11 -43.56 98.11 Favored 'General case' 0 N--CA 1.498 1.947 0 O-C-N 121.511 -0.743 . . . . 0.0 110.421 179.727 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' A' A ' 28' ' ' VAL . . . . . 0.761 HG23 ' HB2' ' A' ' 31' ' ' ALA . 5.7 p -110.02 63.6 0.17 Allowed 'Isoleucine or valine' 0 N--CA 1.498 1.951 0 O-C-N 121.283 -0.885 . . . . 0.0 110.952 -179.956 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 29' ' ' LEU . . . . . . . . . . . . . 28.0 mt -80.0 77.17 6.7 Favored 'General case' 0 N--CA 1.499 2.007 0 N-CA-C 107.618 -1.253 . . . . 0.0 107.618 177.87 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 30' ' ' GLY . . . . . . . . . . . . . . . 97.48 -55.43 1.23 Allowed Glycine 0 N--CA 1.491 2.337 0 N-CA-C 107.185 -2.366 . . . . 0.0 107.185 -176.963 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 31' ' ' ALA . . . . . 0.761 ' HB2' HG23 ' A' ' 28' ' ' VAL . . . . . . . . 0 N--CA 1.5 2.043 0 CA-C-O 121.556 0.693 . . . . 0.0 111.946 178.367 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 35' ' ' CYS . . . . . . . . . . . . . 1.2 m . . . . . 0 N--CA 1.495 1.786 0 N-CA-C 109.464 -0.569 . . . . 0.0 109.464 . . . . . . . . . 0 0 . 1 . 004 nuclear nobuild core ' A' A ' 36' ' ' ILE . . . . . 0.456 ' HB ' ' HB ' ' A' ' 72' ' ' VAL . 2.5 mp -91.84 98.87 8.87 Favored 'Isoleucine or valine' 0 N--CA 1.495 1.795 0 O-C-N 121.023 -1.048 . . . . 0.0 110.168 179.823 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 37' ' ' SER . . . . . . . . . . . . . 10.1 p -94.0 -165.75 1.38 Allowed 'General case' 0 N--CA 1.498 1.935 0 O-C-N 121.396 -0.815 . . . . 0.0 110.132 179.776 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 38' ' ' THR . . . . . . . . . . . . . 17.7 p -58.93 -39.28 81.12 Favored 'General case' 0 N--CA 1.502 2.138 0 O-C-N 121.284 -0.885 . . . . 0.0 110.527 179.727 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 39' ' ' LYS . . . . . . . . . . . . . 32.7 mttt -67.62 -45.82 74.29 Favored 'General case' 0 N--CA 1.499 1.975 0 O-C-N 121.43 -0.794 . . . . 0.0 110.071 179.567 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 2.4 mp0 -65.21 -40.35 94.04 Favored 'General case' 0 N--CA 1.502 2.129 0 O-C-N 121.383 -0.823 . . . . 0.0 109.93 179.408 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 41' ' ' LEU . . . . . 0.415 HD13 ' HA ' ' A' ' 41' ' ' LEU . 0.1 OUTLIER -67.68 -59.27 3.46 Favored 'General case' 0 N--CA 1.496 1.843 0 O-C-N 121.556 -0.715 . . . . 0.0 109.645 179.343 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' A' A ' 42' ' ' GLY . . . . . 0.56 ' HA2' ' HB2' ' A' ' 45' ' ' MET . . . -49.53 -33.48 17.79 Favored Glycine 0 N--CA 1.498 2.819 0 N-CA-C 110.527 -1.029 . . . . 0.0 110.527 179.661 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 43' ' ' LYS . . . . . . . . . . . . . 16.0 ttpt -55.12 -37.39 66.84 Favored 'General case' 0 N--CA 1.502 2.142 0 O-C-N 121.294 -1.121 . . . . 0.0 110.514 179.464 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 44' ' ' VAL . . . . . . . . . . . . . 42.6 t -90.81 -29.92 4.87 Favored 'Isoleucine or valine' 0 N--CA 1.497 1.912 0 O-C-N 121.277 -0.889 . . . . 0.0 109.815 179.165 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 45' ' ' MET . . . . . 0.56 ' HB2' ' HA2' ' A' ' 42' ' ' GLY . 5.4 mmt -57.57 -43.97 84.93 Favored 'General case' 0 N--CA 1.499 2.015 0 O-C-N 121.499 -0.75 . . . . 0.0 111.111 -179.949 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 46' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -53.3 -16.93 1.48 Allowed 'General case' 0 N--CA 1.504 2.261 0 O-C-N 121.35 -0.844 . . . . 0.0 112.298 -179.423 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 47' ' ' MET . . . . . . . . . . . . . 42.7 mtt -82.66 -30.39 29.33 Favored 'General case' 0 N--CA 1.499 2.022 0 O-C-N 120.833 -1.167 . . . . 0.0 111.072 179.717 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 48' ' ' LEU . . . . . . . . . . . . . 5.5 tp -143.43 -48.02 0.3 Allowed 'General case' 0 N--CA 1.495 1.786 0 O-C-N 121.134 -0.979 . . . . 0.0 111.453 -179.177 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 49' ' ' GLY . . . . . 0.414 ' O ' ' HB3' ' A' ' 45' ' ' MET . . . -95.11 102.48 2.86 Favored Glycine 0 N--CA 1.494 2.541 0 N-CA-C 110.09 -1.204 . . . . 0.0 110.09 -179.31 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 50' ' ' GLN . . . . . . . . . . . . . 0.9 OUTLIER -46.19 143.48 2.36 Favored 'General case' 0 N--CA 1.502 2.165 0 O-C-N 121.768 -0.842 . . . . 0.0 111.756 -179.941 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 51' ' ' ASN . . . . . . . . . . . . . 1.6 p-10 -130.59 92.69 34.14 Favored Pre-proline 0 N--CA 1.499 2.005 0 O-C-N 121.51 -0.744 . . . . 0.0 109.686 179.463 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 52' ' ' PRO . . . . . . . . . . . . . 43.6 Cg_endo -70.1 -38.67 6.75 Favored 'Trans proline' 0 N--CA 1.491 1.368 0 O-C-N 123.762 1.401 . . . . 0.0 111.4 -179.385 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 53' ' ' THR . . . . . 0.479 HG23 ' HB2' ' A' ' 56' ' ' GLU . 0.0 OUTLIER -145.16 153.54 52.99 Favored Pre-proline 0 N--CA 1.498 1.946 0 O-C-N 121.21 -0.931 . . . . 0.0 110.429 -179.862 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' A' A ' 54' ' ' PRO . . . . . . . . . . . . . 42.9 Cg_endo -68.59 -32.76 23.76 Favored 'Trans proline' 0 C--N 1.313 -1.332 0 O-C-N 124.126 1.593 . . . . 0.0 110.46 179.665 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 55' ' ' GLU . . . . . 0.449 ' HA ' ' HB2' ' A' ' 58' ' ' GLN . 33.7 mm-40 -61.26 -33.75 74.04 Favored 'General case' 0 N--CA 1.497 1.924 0 O-C-N 121.575 -0.703 . . . . 0.0 110.282 179.462 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 56' ' ' GLU . . . . . 0.479 ' HB2' HG23 ' A' ' 53' ' ' THR . 20.4 tt0 -57.06 -44.17 82.79 Favored 'General case' 0 N--CA 1.498 1.933 0 O-C-N 121.508 -0.745 . . . . 0.0 109.592 179.113 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 57' ' ' LEU . . . . . 0.546 ' H ' HD22 ' A' ' 57' ' ' LEU . 0.8 OUTLIER -77.1 -31.35 55.85 Favored 'General case' 0 N--CA 1.495 1.789 0 O-C-N 121.51 -0.744 . . . . 0.0 109.753 178.954 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' A' A ' 58' ' ' GLN . . . . . 0.449 ' HB2' ' HA ' ' A' ' 55' ' ' GLU . 0.0 OUTLIER -54.47 -49.94 68.92 Favored 'General case' 0 N--CA 1.496 1.842 0 O-C-N 121.341 -0.849 . . . . 0.0 109.014 179.076 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' A' A ' 59' ' ' GLU . . . . . . . . . . . . . 4.2 mt-10 -65.53 -34.69 78.86 Favored 'General case' 0 N--CA 1.496 1.872 0 O-C-N 121.712 -0.617 . . . . 0.0 109.432 178.16 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 60' ' ' MET . . . . . 0.456 ' HB2' ' O ' ' A' ' 57' ' ' LEU . 2.1 mmm -59.99 -47.05 87.43 Favored 'General case' 0 N--CA 1.498 1.931 0 O-C-N 121.649 -0.657 . . . . 0.0 110.071 179.449 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 61' ' ' ILE . . . . . 0.473 HG12 HG23 ' A' ' 72' ' ' VAL . 59.5 mt -72.79 -42.15 61.48 Favored 'Isoleucine or valine' 0 N--CA 1.498 1.962 0 O-C-N 121.332 -0.855 . . . . 0.0 110.046 179.437 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 62' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -57.58 -31.27 66.01 Favored 'General case' 0 N--CA 1.501 2.079 0 O-C-N 121.299 -0.876 . . . . 0.0 110.219 179.174 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 63' ' ' GLU . . . . . . . . . . . . . 1.3 tt0 -66.16 -33.03 74.85 Favored 'General case' 0 N--CA 1.496 1.841 0 O-C-N 121.183 -0.948 . . . . 0.0 109.471 178.697 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 64' ' ' VAL . . . . . 0.573 HG22 ' NH2' ' A' ' 83' ' ' ARG . 51.4 t -84.14 -37.01 12.59 Favored 'Isoleucine or valine' 0 N--CA 1.495 1.784 0 O-C-N 121.571 -0.706 . . . . 0.0 110.471 179.418 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 65' ' ' ASP . . . . . . . . . . . . . 0.0 OUTLIER -128.2 146.16 50.81 Favored 'General case' 0 N--CA 1.496 1.848 0 O-C-N 121.155 -0.966 . . . . 0.0 111.93 -179.39 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 66' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -139.79 46.29 1.88 Allowed 'General case' 0 N--CA 1.491 1.597 0 N-CA-C 108.301 -1.0 . . . . 0.0 108.301 178.331 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 67' ' ' ASP . . . . . . . . . . . . . 0.9 OUTLIER -104.59 43.8 1.07 Allowed 'General case' 0 N--CA 1.498 1.93 0 O-C-N 121.702 -0.624 . . . . 0.0 111.118 -178.844 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 68' ' ' GLY . . . . . . . . . . . . . . . 56.83 43.61 92.22 Favored Glycine 0 N--CA 1.499 2.895 0 N-CA-C 110.415 -1.074 . . . . 0.0 110.415 179.26 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 69' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -146.44 -52.2 0.23 Allowed 'General case' 0 N--CA 1.496 1.826 0 O-C-N 121.338 -1.096 . . . . 0.0 110.359 179.968 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 70' ' ' GLY . . . . . . . . . . . . . . . 69.31 23.91 76.2 Favored Glycine 0 N--CA 1.497 2.707 0 N-CA-C 109.95 -1.26 . . . . 0.0 109.95 -179.807 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 71' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -123.86 138.65 54.46 Favored 'General case' 0 N--CA 1.499 1.994 0 O-C-N 121.42 -1.047 . . . . 0.0 109.107 179.755 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 72' ' ' VAL . . . . . 0.473 HG23 HG12 ' A' ' 61' ' ' ILE . 26.1 t -76.17 126.67 37.11 Favored 'Isoleucine or valine' 0 N--CA 1.499 1.991 0 O-C-N 121.422 -0.798 . . . . 0.0 111.527 -178.985 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 73' ' ' ASP . . . . . 0.422 ' O ' ' HB2' ' A' ' 77' ' ' PHE . 0.2 OUTLIER -110.47 -168.0 1.26 Allowed 'General case' 0 N--CA 1.496 1.835 0 O-C-N 121.471 -0.768 . . . . 0.0 109.042 178.369 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' A' A ' 74' ' ' PHE . . . . . . . . . . . . . 25.8 t80 -66.66 -45.81 77.74 Favored 'General case' 0 N--CA 1.501 2.094 0 O-C-N 120.825 -1.172 . . . . 0.0 110.857 -179.83 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 75' ' ' ASP . . . . . . . . . . . . . 24.8 t70 -60.46 -53.95 51.37 Favored 'General case' 0 N--CA 1.5 2.039 0 O-C-N 121.405 -0.809 . . . . 0.0 110.482 179.867 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 76' ' ' GLU . . . . . . . . . . . . . 25.0 mt-10 -59.67 -40.66 88.51 Favored 'General case' 0 N--CA 1.499 1.99 0 O-C-N 121.484 -0.76 . . . . 0.0 110.252 179.572 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 77' ' ' PHE . . . . . 0.445 ' O ' ' HG2' ' A' ' 81' ' ' MET . 38.3 t80 -60.86 -41.37 95.75 Favored 'General case' 0 N--CA 1.496 1.853 0 O-C-N 121.472 -0.768 . . . . 0.0 110.317 179.718 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 78' ' ' LEU . . . . . 0.424 HD23 ' HA ' ' A' ' 78' ' ' LEU . 38.1 mt -60.28 -49.59 76.99 Favored 'General case' 0 N--CA 1.497 1.892 0 O-C-N 121.338 -0.851 . . . . 0.0 110.749 -179.849 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 79' ' ' VAL . . . . . 0.43 ' O ' ' HG3' ' A' ' 83' ' ' ARG . 3.5 m -73.45 -32.42 36.68 Favored 'Isoleucine or valine' 0 N--CA 1.501 2.092 0 O-C-N 121.119 -0.988 . . . . 0.0 109.782 179.626 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 80' ' ' MET . . . . . . . . . . . . . 9.6 ttt -59.03 -49.52 77.57 Favored 'General case' 0 N--CA 1.498 1.944 0 O-C-N 121.372 -0.83 . . . . 0.0 109.616 179.215 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 81' ' ' MET . . . . . 0.445 ' HG2' ' O ' ' A' ' 77' ' ' PHE . 83.8 mmm -62.64 -33.88 75.93 Favored 'General case' 0 N--CA 1.493 1.681 0 O-C-N 121.57 -0.706 . . . . 0.0 109.512 178.88 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 82' ' ' VAL . . . . . . . . . . . . . 3.2 t -66.34 -36.78 78.19 Favored 'Isoleucine or valine' 0 N--CA 1.497 1.893 0 O-C-N 121.6 -0.687 . . . . 0.0 109.985 179.13 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 83' ' ' ARG . . . . . 0.573 ' NH2' HG22 ' A' ' 64' ' ' VAL . 9.7 mtm180 -58.75 -39.5 81.12 Favored 'General case' 0 N--CA 1.502 2.136 0 O-C-N 121.431 -0.793 . . . . 0.0 110.328 179.511 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 84' ' ' CYS . . . . . . . . . . . . . 25.8 m -92.52 -15.88 26.46 Favored 'General case' 0 N--CA 1.499 1.992 0 O-C-N 121.367 -0.833 . . . . 0.0 111.118 179.71 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 85' ' ' MET . . . . . . . . . . . . . 30.7 ttp . . . . . 0 N--CA 1.498 1.957 0 O-C-N 121.196 -0.94 . . . . 0.0 110.405 -179.866 . . . . . . . . 0 0 . 1 . 004 nuclear nobuild core ' B' B ' 149' ' ' SER . . . . . 0.463 ' HB3' ' HB3' ' B' ' 152' ' ' ALA . 13.3 t . . . . . 0 N--CA 1.497 1.881 0 CA-C-O 121.06 0.457 . . . . 0.0 110.103 . . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' B' B ' 150' ' ' ALA . . . . . . . . . . . . . . . -59.03 -40.13 84.07 Favored 'General case' 0 N--CA 1.499 2.017 0 O-C-N 121.442 -0.786 . . . . 0.0 110.721 179.926 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' B' B ' 151' ' ' ASP . . . . . . . . . . . . . 16.9 t70 -75.76 -49.33 18.49 Favored 'General case' 0 N--CA 1.497 1.88 0 O-C-N 121.318 -0.864 . . . . 0.0 110.256 179.648 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' B' B ' 152' ' ' ALA . . . . . 0.463 ' HB3' ' HB3' ' B' ' 149' ' ' SER . . . -58.58 -44.91 89.95 Favored 'General case' 0 N--CA 1.498 1.966 0 O-C-N 121.502 -0.749 . . . . 0.0 110.57 179.896 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' B' B ' 153' ' ' MET . . . . . . . . . . . . . 0.2 OUTLIER -65.83 -37.95 87.59 Favored 'General case' 0 N--CA 1.498 1.97 0 O-C-N 121.299 -0.876 . . . . 0.0 109.789 179.312 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' B' B ' 154' ' ' MET . . . . . . . . . . . . . 19.9 mmm -61.86 -42.27 98.85 Favored 'General case' 0 N--CA 1.497 1.915 0 O-C-N 121.454 -0.779 . . . . 0.0 109.635 178.862 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' B' B ' 155' ' ' GLN . . . . . . . . . . . . . 18.2 tt0 -67.02 -35.72 80.52 Favored 'General case' 0 N--CA 1.497 1.91 0 O-C-N 121.546 -0.721 . . . . 0.0 109.998 178.979 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' B' B ' 156' ' ' ALA . . . . . . . . . . . . . . . -67.72 -42.41 82.0 Favored 'General case' 0 N--CA 1.496 1.835 0 O-C-N 121.496 -0.753 . . . . 0.0 110.121 179.538 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' B' B ' 157' ' ' LEU . . . . . 0.758 HD11 ' HE2' ' A' ' 27' ' ' PHE . 2.4 mt -57.43 -33.76 68.25 Favored 'General case' 0 N--CA 1.499 1.981 0 O-C-N 121.615 -0.678 . . . . 0.0 111.031 179.705 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' B' B ' 158' ' ' LEU . . . . . . . . . . . . . 0.8 OUTLIER . . . . . 0 N--CA 1.495 1.824 0 O-C-N 121.377 -0.827 . . . . 0.0 110.793 -179.592 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 4' ' ' ILE . . . . . 0.436 HG23 ' N ' ' A' ' 5' ' ' TYR . 6.1 tp . . . . . 0 N--CA 1.499 2.008 0 CA-C-O 120.813 0.34 . . . . 0.0 110.516 . . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 5' ' ' TYR . . . . . 0.536 ' O ' HG23 ' A' ' 9' ' ' VAL . 42.1 m-85 -83.82 -32.15 25.47 Favored 'General case' 0 N--CA 1.496 1.868 0 O-C-N 121.33 -0.856 . . . . 0.0 109.289 178.596 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 3.4 ttmt -59.73 -45.73 91.3 Favored 'General case' 0 N--CA 1.499 2.001 0 O-C-N 121.716 -0.615 . . . . 0.0 110.382 179.548 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 7' ' ' ALA . . . . . . . . . . . . . . . -54.25 -42.75 70.28 Favored 'General case' 0 N--CA 1.498 1.949 0 O-C-N 121.666 -0.646 . . . . 0.0 110.113 179.695 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 8' ' ' ALA . . . . . . . . . . . . . . . -66.32 -39.74 89.46 Favored 'General case' 0 N--CA 1.497 1.887 0 O-C-N 121.552 -0.717 . . . . 0.0 110.358 179.374 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 9' ' ' VAL . . . . . 0.672 HG21 HG22 ' A' ' 79' ' ' VAL . 97.7 t -60.89 -41.52 89.13 Favored 'Isoleucine or valine' 0 N--CA 1.502 2.165 0 O-C-N 121.474 -0.766 . . . . 0.0 110.447 179.834 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 10' ' ' GLU . . . . . . . . . . . . . 17.9 mt-10 -79.86 -44.13 21.04 Favored 'General case' 0 N--CA 1.495 1.808 0 O-C-N 121.495 -0.753 . . . . 0.0 111.02 -179.641 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 11' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -89.64 39.15 0.94 Allowed 'General case' 0 N--CA 1.499 1.996 0 O-C-N 121.289 -0.882 . . . . 0.0 111.49 -179.532 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 12' ' ' LEU . . . . . 0.54 ' HB3' ' HD3' ' A' ' 17' ' ' LYS . 0.8 OUTLIER -78.65 138.71 38.44 Favored 'General case' 0 N--CA 1.497 1.899 0 O-C-N 120.916 -1.115 . . . . 0.0 109.783 179.165 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' A' A ' 13' ' ' THR . . . . . 0.409 HG23 ' H ' ' A' ' 16' ' ' GLN . 14.9 t -69.66 164.15 24.02 Favored 'General case' 0 N--CA 1.501 2.079 0 O-C-N 121.264 -0.897 . . . . 0.0 111.396 -179.567 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 14' ' ' GLU . . . . . . . . . . . . . 17.7 tt0 -62.35 -35.89 80.52 Favored 'General case' 0 N--CA 1.495 1.8 0 O-C-N 121.844 -0.535 . . . . 0.0 110.897 -179.422 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 1.3 mp0 -56.89 -41.71 78.55 Favored 'General case' 0 N--CA 1.499 2.024 0 O-C-N 121.415 -0.803 . . . . 0.0 110.776 -179.838 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 16' ' ' GLN . . . . . 0.409 ' H ' HG23 ' A' ' 13' ' ' THR . 81.0 mt-30 -86.35 -44.94 11.67 Favored 'General case' 0 N--CA 1.497 1.907 0 O-C-N 121.333 -0.854 . . . . 0.0 110.796 -179.946 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 17' ' ' LYS . . . . . 0.54 ' HD3' ' HB3' ' A' ' 12' ' ' LEU . 0.2 OUTLIER -59.78 -47.21 86.58 Favored 'General case' 0 N--CA 1.5 2.031 0 O-C-N 121.81 -0.556 . . . . 0.0 110.611 -179.889 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' A' A ' 18' ' ' ASN . . . . . 0.626 ' HA ' ' HG2' ' A' ' 21' ' ' LYS . 32.5 t30 -67.72 -29.49 68.74 Favored 'General case' 0 N--CA 1.495 1.799 0 O-C-N 121.461 -0.775 . . . . 0.0 110.447 179.593 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 12.7 tt0 -73.65 -43.43 59.5 Favored 'General case' 0 N--CA 1.492 1.669 0 O-C-N 121.237 -0.915 . . . . 0.0 109.876 179.444 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 20' ' ' PHE . . . . . . . . . . . . . 16.9 m-85 -73.59 -35.74 65.44 Favored 'General case' 0 N--CA 1.498 1.925 0 O-C-N 121.354 -0.841 . . . . 0.0 110.784 179.869 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 21' ' ' LYS . . . . . 0.626 ' HG2' ' HA ' ' A' ' 18' ' ' ASN . 0.0 OUTLIER -64.13 -30.86 71.9 Favored 'General case' 0 N--CA 1.496 1.868 0 O-C-N 121.14 -0.975 . . . . 0.0 110.207 179.546 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' A' A ' 22' ' ' ALA . . . . . 0.515 ' N ' ' HG3' ' A' ' 21' ' ' LYS . . . -77.15 -31.69 55.76 Favored 'General case' 0 N--CA 1.5 2.034 0 O-C-N 121.401 -0.812 . . . . 0.0 109.603 178.701 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 23' ' ' ALA . . . . . . . . . . . . . . . -85.73 -8.69 58.01 Favored 'General case' 0 N--CA 1.494 1.773 0 O-C-N 121.416 -0.803 . . . . 0.0 110.328 178.96 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 24' ' ' PHE . . . . . . . . . . . . . 73.1 t80 -88.07 -52.05 5.46 Favored 'General case' 0 N--CA 1.494 1.773 0 O-C-N 121.179 -0.951 . . . . 0.0 110.382 -179.823 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 25' ' ' ASP . . . . . . . . . . . . . 3.1 p-10 -60.71 -36.18 78.16 Favored 'General case' 0 N--CA 1.501 2.077 0 O-C-N 121.26 -0.9 . . . . 0.0 110.348 179.85 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 26' ' ' ILE . . . . . 0.458 ' O ' HD12 ' A' ' 29' ' ' LEU . 81.9 mt -70.1 -34.55 59.77 Favored 'Isoleucine or valine' 0 N--CA 1.5 2.039 0 O-C-N 121.063 -1.023 . . . . 0.0 109.34 178.669 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 27' ' ' PHE . . . . . . . . . . . . . 0.3 OUTLIER -62.09 -43.86 97.91 Favored 'General case' 0 N--CA 1.497 1.888 0 O-C-N 121.463 -0.773 . . . . 0.0 110.248 179.244 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 28' ' ' VAL . . . . . . . . . . . . . 32.6 m -84.9 43.67 0.06 OUTLIER 'Isoleucine or valine' 0 N--CA 1.5 2.051 0 O-C-N 121.503 -0.748 . . . . 0.0 111.443 -179.675 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 29' ' ' LEU . . . . . 0.458 HD12 ' O ' ' A' ' 26' ' ' ILE . 0.1 OUTLIER -63.11 -55.12 27.98 Favored 'General case' 0 N--CA 1.499 2.02 0 O-C-N 121.019 -1.05 . . . . 0.0 109.718 179.161 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' A' A ' 30' ' ' GLY . . . . . . . . . . . . . . . -103.1 52.89 0.77 Allowed Glycine 0 N--CA 1.497 2.721 0 N-CA-C 108.601 -1.8 . . . . 0.0 108.601 178.787 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 31' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.496 1.847 0 O-C-N 121.632 -0.922 . . . . 0.0 111.172 -179.269 . . . . . . . . 0 0 . 1 . 005 nuclear nobuild core ' A' A ' 35' ' ' CYS . . . . . 0.413 ' HB3' ' HB ' ' A' ' 71' ' ' THR . 99.6 m . . . . . 0 N--CA 1.499 2.001 0 CA-C-O 121.02 0.438 . . . . 0.0 110.524 . . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 36' ' ' ILE . . . . . 0.423 ' HB ' ' HB ' ' A' ' 72' ' ' VAL . 66.8 mt -67.07 128.57 30.52 Favored 'Isoleucine or valine' 0 N--CA 1.502 2.152 0 O-C-N 121.323 -0.861 . . . . 0.0 110.462 -179.841 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 37' ' ' SER . . . . . . . . . . . . . 9.1 t -103.81 171.25 7.46 Favored 'General case' 0 N--CA 1.498 1.932 0 O-C-N 121.665 -0.647 . . . . 0.0 110.535 179.812 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 38' ' ' THR . . . . . 0.686 HG21 ' HG2' ' A' ' 58' ' ' GLN . 68.9 p -67.94 -48.75 65.06 Favored 'General case' 0 N--CA 1.502 2.143 0 O-C-N 121.278 -0.889 . . . . 0.0 110.4 -179.983 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 39' ' ' LYS . . . . . . . . . . . . . 0.7 OUTLIER -61.2 -37.97 84.89 Favored 'General case' 0 N--CA 1.5 2.063 0 O-C-N 121.295 -0.878 . . . . 0.0 109.316 178.98 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 12.9 tt0 -63.97 -46.52 84.26 Favored 'General case' 0 N--CA 1.495 1.802 0 CA-C-O 121.305 0.574 . . . . 0.0 109.479 178.874 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 41' ' ' LEU . . . . . 0.414 ' C ' ' CD1' ' A' ' 41' ' ' LEU . 0.1 OUTLIER -65.56 -58.02 6.79 Favored 'General case' 0 N--CA 1.494 1.763 0 O-C-N 121.634 -0.666 . . . . 0.0 109.275 178.798 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' A' A ' 42' ' ' GLY . . . . . 0.404 ' O ' ' HB2' ' A' ' 45' ' ' MET . . . -47.27 -33.08 7.42 Favored Glycine 0 N--CA 1.502 3.057 0 N-CA-C 111.259 -0.737 . . . . 0.0 111.259 179.985 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 43' ' ' LYS . . . . . . . . . . . . . 1.8 tmtm? -58.98 -36.6 75.15 Favored 'General case' 0 N--CA 1.502 2.129 0 O-C-N 121.063 -1.257 . . . . 0.0 110.232 179.573 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 44' ' ' VAL . . . . . . . . . . . . . 93.9 t -85.05 -22.06 7.71 Favored 'Isoleucine or valine' 0 N--CA 1.498 1.961 0 O-C-N 121.499 -0.751 . . . . 0.0 109.911 179.335 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 45' ' ' MET . . . . . 0.404 ' HB2' ' O ' ' A' ' 42' ' ' GLY . 6.4 mmt -56.52 -36.9 69.73 Favored 'General case' 0 N--CA 1.499 2.02 0 O-C-N 121.262 -0.899 . . . . 0.0 110.326 179.35 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 46' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -62.21 -33.34 74.37 Favored 'General case' 0 N--CA 1.5 2.036 0 O-C-N 121.326 -0.858 . . . . 0.0 110.298 179.207 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 47' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -63.22 -32.28 73.64 Favored 'General case' 0 N--CA 1.501 2.102 0 O-C-N 121.342 -0.849 . . . . 0.0 110.141 179.332 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 48' ' ' LEU . . . . . . . . . . . . . 8.0 mt -93.2 -43.51 8.8 Favored 'General case' 0 N--CA 1.496 1.855 0 O-C-N 121.405 -0.81 . . . . 0.0 109.631 179.347 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 49' ' ' GLY . . . . . . . . . . . . . . . -143.73 -101.6 0.37 Allowed Glycine 0 N--CA 1.493 2.456 0 N-CA-C 109.082 -1.607 . . . . 0.0 109.082 179.557 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 50' ' ' GLN . . . . . . . . . . . . . 12.8 mt-30 -147.21 170.17 17.81 Favored 'General case' 0 N--CA 1.496 1.872 0 O-C-N 121.403 -1.057 . . . . 0.0 110.54 179.83 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 51' ' ' ASN . . . . . . . . . . . . . 44.7 t30 -138.79 104.76 7.49 Favored Pre-proline 0 N--CA 1.495 1.817 0 O-C-N 121.489 -0.757 . . . . 0.0 109.876 179.894 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 52' ' ' PRO . . . . . . . . . . . . . 48.9 Cg_endo -77.94 -50.74 0.08 OUTLIER 'Trans proline' 0 C--N 1.314 -1.267 0 O-C-N 123.771 1.406 . . . . 0.0 111.108 -179.614 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 53' ' ' THR . . . . . 0.478 ' OG1' ' HD2' ' A' ' 54' ' ' PRO . 0.1 OUTLIER -156.89 159.16 31.45 Favored Pre-proline 0 N--CA 1.498 1.931 0 O-C-N 121.142 -0.974 . . . . 0.0 110.739 -179.448 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' A' A ' 54' ' ' PRO . . . . . 0.478 ' HD2' ' OG1' ' A' ' 53' ' ' THR . 42.5 Cg_endo -67.12 -24.57 44.56 Favored 'Trans proline' 0 N--CA 1.49 1.296 0 O-C-N 123.932 1.49 . . . . 0.0 110.69 179.246 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 55' ' ' GLU . . . . . . . . . . . . . 0.9 OUTLIER -59.31 -36.5 75.74 Favored 'General case' 0 N--CA 1.498 1.958 0 O-C-N 121.319 -0.863 . . . . 0.0 109.971 179.178 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 1.2 mm-40 -59.85 -42.93 94.69 Favored 'General case' 0 N--CA 1.497 1.882 0 O-C-N 121.502 -0.749 . . . . 0.0 109.808 179.103 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 57' ' ' LEU . . . . . 0.562 HD22 ' N ' ' A' ' 57' ' ' LEU . 2.6 mm? -74.05 -28.89 61.63 Favored 'General case' 0 N--CA 1.494 1.761 0 O-C-N 121.367 -0.833 . . . . 0.0 109.769 178.988 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 58' ' ' GLN . . . . . 0.686 ' HG2' HG21 ' A' ' 38' ' ' THR . 0.0 OUTLIER -54.83 -53.36 56.24 Favored 'General case' 0 N--CA 1.5 2.027 0 O-C-N 121.28 -0.887 . . . . 0.0 109.056 179.127 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' A' A ' 59' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER -61.17 -33.71 73.87 Favored 'General case' 0 N--CA 1.495 1.804 0 N-CA-C 108.848 -0.797 . . . . 0.0 108.848 177.966 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 60' ' ' MET . . . . . 0.524 ' HB2' ' HA ' ' A' ' 57' ' ' LEU . 0.0 OUTLIER -64.65 -37.91 89.2 Favored 'General case' 0 N--CA 1.496 1.838 0 O-C-N 121.753 -0.592 . . . . 0.0 110.052 178.752 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' A' A ' 61' ' ' ILE . . . . . 0.673 HG12 HG23 ' A' ' 72' ' ' VAL . 1.0 OUTLIER -74.57 -43.84 47.79 Favored 'Isoleucine or valine' 0 N--CA 1.496 1.835 0 O-C-N 121.308 -0.87 . . . . 0.0 109.573 179.375 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' A' A ' 62' ' ' ASP . . . . . 0.411 ' N ' ' CG2' ' A' ' 61' ' ' ILE . 2.6 m-20 -55.6 -31.67 62.44 Favored 'General case' 0 N--CA 1.5 2.06 0 O-C-N 121.262 -0.899 . . . . 0.0 109.902 178.874 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 63' ' ' GLU . . . . . . . . . . . . . 7.4 tt0 -59.74 -35.07 73.82 Favored 'General case' 0 N--CA 1.497 1.92 0 O-C-N 121.737 -0.602 . . . . 0.0 110.672 179.226 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 64' ' ' VAL . . . . . 0.634 HG11 ' SD ' ' A' ' 80' ' ' MET . 9.9 p -124.11 23.38 3.87 Favored 'Isoleucine or valine' 0 N--CA 1.497 1.885 0 O-C-N 121.216 -0.927 . . . . 0.0 110.842 -179.75 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 65' ' ' ASP . . . . . . . . . . . . . 8.5 t70 -131.36 -82.44 0.52 Allowed 'General case' 0 N--CA 1.497 1.909 0 O-C-N 121.172 -0.955 . . . . 0.0 109.654 -179.918 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 66' ' ' GLU . . . . . . . . . . . . . 0.3 OUTLIER 40.81 48.46 2.71 Favored 'General case' 0 N--CA 1.505 2.315 0 O-C-N 121.42 -0.8 . . . . 0.0 112.366 178.734 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 67' ' ' ASP . . . . . . . . . . . . . 4.3 p-10 -117.46 7.39 12.73 Favored 'General case' 0 N--CA 1.501 2.08 0 O-C-N 120.982 -1.074 . . . . 0.0 111.079 179.532 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 68' ' ' GLY . . . . . . . . . . . . . . . 96.3 -5.46 65.35 Favored Glycine 0 N--CA 1.497 2.764 0 N-CA-C 110.521 -1.032 . . . . 0.0 110.521 -179.856 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 69' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -106.07 -43.82 4.74 Favored 'General case' 0 N--CA 1.496 1.838 0 O-C-N 121.049 -1.265 . . . . 0.0 110.496 -179.825 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 70' ' ' GLY . . . . . . . . . . . . . . . 78.78 19.84 72.25 Favored Glycine 0 N--CA 1.497 2.758 0 N-CA-C 109.527 -1.429 . . . . 0.0 109.527 -179.472 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 71' ' ' THR . . . . . 0.413 ' HB ' ' HB3' ' A' ' 35' ' ' CYS . 0.1 OUTLIER -132.22 124.01 28.11 Favored 'General case' 0 N--CA 1.492 1.643 0 O-C-N 121.601 -0.941 . . . . 0.0 108.652 -179.761 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' A' A ' 72' ' ' VAL . . . . . 0.673 HG23 HG12 ' A' ' 61' ' ' ILE . 4.9 t -75.59 124.54 33.79 Favored 'Isoleucine or valine' 0 N--CA 1.496 1.844 0 O-C-N 121.448 -0.783 . . . . 0.0 111.008 -178.68 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 73' ' ' ASP . . . . . . . . . . . . . 18.0 t70 -95.6 -176.84 3.87 Favored 'General case' 0 N--CA 1.495 1.791 0 O-C-N 121.673 -0.642 . . . . 0.0 109.399 179.145 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 74' ' ' PHE . . . . . . . . . . . . . 28.6 t80 -60.07 -44.62 94.63 Favored 'General case' 0 N--CA 1.498 1.945 0 O-C-N 120.957 -1.09 . . . . 0.0 109.784 179.61 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 75' ' ' ASP . . . . . . . . . . . . . 31.4 t70 -62.71 -48.03 81.02 Favored 'General case' 0 N--CA 1.496 1.864 0 O-C-N 121.543 -0.723 . . . . 0.0 110.287 179.32 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 76' ' ' GLU . . . . . . . . . . . . . 54.0 mt-10 -66.92 -32.67 74.07 Favored 'General case' 0 N--CA 1.498 1.933 0 O-C-N 121.444 -0.785 . . . . 0.0 109.656 179.342 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 77' ' ' PHE . . . . . . . . . . . . . 68.3 t80 -60.74 -39.16 87.64 Favored 'General case' 0 N--CA 1.493 1.708 0 O-C-N 121.513 -0.742 . . . . 0.0 109.44 178.642 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 78' ' ' LEU . . . . . . . . . . . . . 88.9 mt -63.77 -37.94 89.26 Favored 'General case' 0 N--CA 1.498 1.942 0 O-C-N 121.432 -0.792 . . . . 0.0 109.46 178.736 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 79' ' ' VAL . . . . . 0.672 HG22 HG21 ' A' ' 9' ' ' VAL . 85.0 t -64.17 -34.74 70.81 Favored 'Isoleucine or valine' 0 N--CA 1.499 2.014 0 O-C-N 121.36 -0.838 . . . . 0.0 109.13 178.405 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 80' ' ' MET . . . . . 0.634 ' SD ' HG11 ' A' ' 64' ' ' VAL . 1.5 ttt -67.88 -39.48 83.69 Favored 'General case' 0 N--CA 1.496 1.842 0 O-C-N 121.552 -0.718 . . . . 0.0 109.53 178.835 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 81' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -65.95 -50.23 65.12 Favored 'General case' 0 N--CA 1.497 1.913 0 O-C-N 121.562 -0.711 . . . . 0.0 110.684 179.702 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 82' ' ' VAL . . . . . 0.472 HG12 ' O ' ' A' ' 79' ' ' VAL . 9.4 p -62.19 -30.02 47.9 Favored 'Isoleucine or valine' 0 N--CA 1.5 2.035 0 O-C-N 121.25 -0.906 . . . . 0.0 110.189 179.774 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 83' ' ' ARG . . . . . . . . . . . . . 3.2 mtp-105 -69.24 -46.48 67.21 Favored 'General case' 0 N--CA 1.495 1.78 0 O-C-N 121.354 -0.842 . . . . 0.0 109.392 178.724 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 84' ' ' CYS . . . . . . . . . . . . . 88.6 m -66.92 -32.78 74.27 Favored 'General case' 0 N--CA 1.497 1.906 0 O-C-N 121.61 -0.681 . . . . 0.0 110.155 179.254 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 85' ' ' MET . . . . . . . . . . . . . 32.2 mtm . . . . . 0 N--CA 1.5 2.033 0 O-C-N 121.453 -0.779 . . . . 0.0 110.249 179.216 . . . . . . . . 0 0 . 1 . 005 nuclear nobuild core ' B' B ' 149' ' ' SER . . . . . . . . . . . . . 27.5 m . . . . . 0 N--CA 1.498 1.965 0 CA-C-O 121.252 0.548 . . . . 0.0 110.772 . . . . . . . . . 0 0 . 1 . 005 nuclear nobuild core ' B' B ' 150' ' ' ALA . . . . . . . . . . . . . . . -60.47 -50.76 72.29 Favored 'General case' 0 N--CA 1.498 1.958 0 O-C-N 121.573 -0.704 . . . . 0.0 110.549 179.909 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' B' B ' 151' ' ' ASP . . . . . . . . . . . . . 7.5 p-10 -61.54 -34.79 76.16 Favored 'General case' 0 N--CA 1.5 2.029 0 O-C-N 121.453 -0.779 . . . . 0.0 110.68 179.771 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' B' B ' 152' ' ' ALA . . . . . . . . . . . . . . . -68.06 -54.4 18.55 Favored 'General case' 0 N--CA 1.497 1.878 0 O-C-N 121.316 -0.865 . . . . 0.0 110.44 179.995 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' B' B ' 153' ' ' MET . . . . . . . . . . . . . 1.1 tpt -66.16 -31.04 71.65 Favored 'General case' 0 N--CA 1.499 1.991 0 O-C-N 121.317 -0.865 . . . . 0.0 110.346 179.597 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' B' B ' 154' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -64.12 -41.21 97.31 Favored 'General case' 0 N--CA 1.499 2.009 0 O-C-N 121.348 -0.845 . . . . 0.0 110.326 179.486 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' B' B ' 155' ' ' GLN . . . . . . . . . . . . . 33.6 mt-30 -77.94 -31.75 51.16 Favored 'General case' 0 N--CA 1.499 1.98 0 O-C-N 121.346 -0.846 . . . . 0.0 110.83 179.878 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' B' B ' 156' ' ' ALA . . . . . . . . . . . . . . . -54.93 -45.85 74.87 Favored 'General case' 0 N--CA 1.501 2.11 0 O-C-N 121.386 -0.821 . . . . 0.0 110.959 -179.683 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' B' B ' 157' ' ' LEU . . . . . . . . . . . . . 1.2 tp -80.35 -46.35 16.22 Favored 'General case' 0 N--CA 1.496 1.83 0 O-C-N 121.173 -0.955 . . . . 0.0 110.208 179.71 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' B' B ' 158' ' ' LEU . . . . . . . . . . . . . 1.1 mp . . . . . 0 N--CA 1.495 1.816 0 O-C-N 121.34 -0.85 . . . . 0.0 109.308 179.207 . . . . . . . . 0 0 . 1 . 006 nuclear nobuild core ' A' A ' 4' ' ' ILE . . . . . 0.438 HG23 ' N ' ' A' ' 5' ' ' TYR . 1.1 tp . . . . . 0 N--CA 1.499 2.023 0 CA-C-O 120.595 0.236 . . . . 0.0 111.107 . . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 5' ' ' TYR . . . . . 0.552 ' CD2' ' HG2' ' A' ' 83' ' ' ARG . 27.2 m-85 -78.84 -34.03 45.47 Favored 'General case' 0 N--CA 1.497 1.885 0 O-C-N 121.037 -1.039 . . . . 0.0 109.781 179.615 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 11.7 ttpp -61.03 -43.54 98.73 Favored 'General case' 0 N--CA 1.493 1.722 0 O-C-N 121.564 -0.71 . . . . 0.0 109.929 179.159 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 7' ' ' ALA . . . . . . . . . . . . . . . -55.31 -38.94 69.33 Favored 'General case' 0 N--CA 1.5 2.075 0 O-C-N 121.47 -0.769 . . . . 0.0 110.083 179.325 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 8' ' ' ALA . . . . . . . . . . . . . . . -61.0 -39.1 88.42 Favored 'General case' 0 N--CA 1.497 1.915 0 O-C-N 121.481 -0.762 . . . . 0.0 109.614 178.91 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 9' ' ' VAL . . . . . 0.94 ' HA ' HD12 ' A' ' 12' ' ' LEU . 59.1 t -64.27 -39.11 84.35 Favored 'Isoleucine or valine' 0 N--CA 1.499 2.0 0 O-C-N 121.532 -0.73 . . . . 0.0 109.288 178.784 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 10' ' ' GLU . . . . . . . . . . . . . 3.4 mt-10 -64.98 -29.07 69.97 Favored 'General case' 0 N--CA 1.5 2.041 0 O-C-N 121.459 -0.776 . . . . 0.0 109.769 178.675 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 11' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -82.62 -19.05 39.09 Favored 'General case' 0 N--CA 1.498 1.972 0 O-C-N 121.445 -0.784 . . . . 0.0 110.69 179.417 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 12' ' ' LEU . . . . . 0.94 HD12 ' HA ' ' A' ' 9' ' ' VAL . 18.3 mt -62.99 116.14 5.05 Favored 'General case' 0 N--CA 1.497 1.887 0 O-C-N 121.255 -0.903 . . . . 0.0 110.057 179.857 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 13' ' ' THR . . . . . . . . . . . . . 71.3 p -74.62 167.49 21.66 Favored 'General case' 0 N--CA 1.497 1.902 0 O-C-N 121.297 -0.877 . . . . 0.0 109.888 179.75 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 14' ' ' GLU . . . . . . . . . . . . . 9.7 tp10 -58.23 -34.71 70.73 Favored 'General case' 0 N--CA 1.492 1.671 0 O-C-N 121.588 -0.695 . . . . 0.0 110.643 -179.421 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 17.9 tt0 -59.32 -46.39 88.7 Favored 'General case' 0 N--CA 1.498 1.968 0 O-C-N 121.338 -0.851 . . . . 0.0 109.44 178.981 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 16' ' ' GLN . . . . . . . . . . . . . 3.2 mt-30 -65.15 -37.58 87.87 Favored 'General case' 0 N--CA 1.498 1.949 0 O-C-N 121.531 -0.73 . . . . 0.0 109.871 178.826 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 17' ' ' LYS . . . . . 0.474 ' HD2' HD11 ' A' ' 78' ' ' LEU . 15.8 mtmt -60.58 -40.3 91.22 Favored 'General case' 0 N--CA 1.497 1.882 0 N-CA-C 109.163 -0.68 . . . . 0.0 109.163 178.795 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 18' ' ' ASN . . . . . 0.481 ' HA ' ' HB3' ' A' ' 21' ' ' LYS . 8.2 t30 -64.9 -39.32 93.34 Favored 'General case' 0 N--CA 1.497 1.884 0 O-C-N 121.588 -0.695 . . . . 0.0 109.894 179.107 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 14.9 mt-10 -57.49 -42.49 82.8 Favored 'General case' 0 N--CA 1.499 1.988 0 O-C-N 121.46 -0.775 . . . . 0.0 109.224 178.862 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 20' ' ' PHE . . . . . . . . . . . . . 3.8 m-85 -75.5 -30.11 59.74 Favored 'General case' 0 N--CA 1.494 1.76 0 O-C-N 121.581 -0.699 . . . . 0.0 109.49 178.543 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 21' ' ' LYS . . . . . 0.481 ' HB3' ' HA ' ' A' ' 18' ' ' ASN . 0.0 OUTLIER -57.43 -32.55 67.01 Favored 'General case' 0 N--CA 1.498 1.965 0 O-C-N 121.58 -0.7 . . . . 0.0 109.638 179.042 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' A' A ' 22' ' ' ALA . . . . . 0.433 ' N ' ' HG3' ' A' ' 21' ' ' LYS . . . -58.3 -52.98 63.3 Favored 'General case' 0 N--CA 1.497 1.876 0 O-C-N 121.394 -0.816 . . . . 0.0 109.408 178.787 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 23' ' ' ALA . . . . . . . . . . . . . . . -68.89 -35.88 77.38 Favored 'General case' 0 N--CA 1.496 1.865 0 O-C-N 121.602 -0.687 . . . . 0.0 109.548 178.622 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 24' ' ' PHE . . . . . 0.476 ' HB3' ' HA ' ' A' ' 21' ' ' LYS . 70.8 t80 -61.58 -51.06 70.09 Favored 'General case' 0 N--CA 1.497 1.911 0 O-C-N 121.721 -0.612 . . . . 0.0 110.404 179.446 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 25' ' ' ASP . . . . . . . . . . . . . 0.7 OUTLIER -62.33 -44.91 95.4 Favored 'General case' 0 N--CA 1.498 1.964 0 O-C-N 121.562 -0.711 . . . . 0.0 110.241 179.812 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 26' ' ' ILE . . . . . . . . . . . . . 22.1 mt -65.84 -29.53 47.22 Favored 'Isoleucine or valine' 0 N--CA 1.498 1.947 0 O-C-N 121.268 -0.895 . . . . 0.0 109.68 179.009 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 27' ' ' PHE . . . . . 0.406 ' HZ ' ' SD ' ' B' ' 153' ' ' MET . 0.1 OUTLIER -62.14 -42.58 99.39 Favored 'General case' 0 N--CA 1.498 1.945 0 O-C-N 121.372 -0.83 . . . . 0.0 110.13 179.033 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' A' A ' 28' ' ' VAL . . . . . 0.414 ' H ' HG22 ' A' ' 28' ' ' VAL . 34.0 m -88.24 37.01 0.07 OUTLIER 'Isoleucine or valine' 0 N--CA 1.5 2.046 0 O-C-N 121.29 -0.881 . . . . 0.0 111.137 -179.846 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 29' ' ' LEU . . . . . . . . . . . . . 2.7 mt -74.17 -44.89 51.77 Favored 'General case' 0 N--CA 1.498 1.957 0 O-C-N 120.954 -1.091 . . . . 0.0 109.58 178.944 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 30' ' ' GLY . . . . . . . . . . . . . . . -110.46 30.3 8.32 Favored Glycine 0 N--CA 1.494 2.533 0 N-CA-C 109.381 -1.488 . . . . 0.0 109.381 179.071 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 31' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.497 1.901 0 O-C-N 121.363 -1.081 . . . . 0.0 110.585 -179.884 . . . . . . . . 0 0 . 1 . 006 nuclear nobuild core ' A' A ' 35' ' ' CYS . . . . . 0.413 ' SG ' ' HB ' ' A' ' 71' ' ' THR . 30.3 p . . . . . 0 N--CA 1.499 1.989 0 N-CA-C 109.807 -0.442 . . . . 0.0 109.807 . . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 36' ' ' ILE . . . . . 0.67 ' HA ' ' HG2' ' A' ' 40' ' ' GLU . 4.2 mt -81.15 104.07 9.13 Favored 'Isoleucine or valine' 0 N--CA 1.497 1.916 0 O-C-N 120.94 -1.1 . . . . 0.0 110.207 179.833 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 37' ' ' SER . . . . . . . . . . . . . 0.9 OUTLIER -107.95 -170.54 1.7 Allowed 'General case' 0 N--CA 1.494 1.752 0 O-C-N 121.644 -0.66 . . . . 0.0 110.014 179.758 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 38' ' ' THR . . . . . . . . . . . . . 23.9 p -63.45 -37.7 88.3 Favored 'General case' 0 N--CA 1.502 2.175 0 O-C-N 121.23 -0.919 . . . . 0.0 110.54 179.726 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 39' ' ' LYS . . . . . . . . . . . . . 9.8 mtmt -63.47 -47.39 82.01 Favored 'General case' 0 N--CA 1.5 2.032 0 O-C-N 121.557 -0.714 . . . . 0.0 111.173 -179.77 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 40' ' ' GLU . . . . . 0.67 ' HG2' ' HA ' ' A' ' 36' ' ' ILE . 0.0 OUTLIER -60.49 -33.66 72.93 Favored 'General case' 0 N--CA 1.502 2.133 0 O-C-N 121.391 -0.818 . . . . 0.0 111.529 -179.074 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' A' A ' 41' ' ' LEU . . . . . 0.765 HD12 ' HG ' ' A' ' 57' ' ' LEU . 3.1 tm? -69.36 -66.73 0.55 Allowed 'General case' 0 N--CA 1.495 1.782 0 O-C-N 121.32 -0.863 . . . . 0.0 110.18 -179.771 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 42' ' ' GLY . . . . . . . . . . . . . . . -44.84 -42.42 7.77 Favored Glycine 0 N--CA 1.5 2.934 0 N-CA-C 110.61 -0.996 . . . . 0.0 110.61 -179.729 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 43' ' ' LYS . . . . . . . . . . . . . 5.1 mttm -56.96 -49.9 74.28 Favored 'General case' 0 N--CA 1.501 2.077 0 O-C-N 121.476 -1.014 . . . . 0.0 110.348 179.617 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 44' ' ' VAL . . . . . . . . . . . . . 21.3 t -67.42 -36.32 76.11 Favored 'Isoleucine or valine' 0 N--CA 1.5 2.07 0 O-C-N 121.334 -0.854 . . . . 0.0 110.179 179.221 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 45' ' ' MET . . . . . . . . . . . . . 1.2 mtt -63.11 -32.34 73.7 Favored 'General case' 0 N--CA 1.499 2.006 0 O-C-N 121.472 -0.767 . . . . 0.0 111.21 -179.89 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 46' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -47.92 -41.64 25.14 Favored 'General case' 0 N--CA 1.503 2.179 0 O-C-N 121.212 -0.93 . . . . 0.0 111.365 -179.786 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 47' ' ' MET . . . . . . . . . . . . . 13.3 ptt? -90.66 -27.69 18.86 Favored 'General case' 0 N--CA 1.5 2.041 0 O-C-N 121.162 -0.961 . . . . 0.0 110.395 179.384 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 48' ' ' LEU . . . . . . . . . . . . . 14.6 tp -128.86 87.45 2.57 Favored 'General case' 0 N--CA 1.492 1.654 0 O-C-N 121.367 -0.833 . . . . 0.0 109.236 179.423 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 49' ' ' GLY . . . . . . . . . . . . . . . 93.53 70.34 1.12 Allowed Glycine 0 N--CA 1.497 2.758 0 N-CA-C 108.504 -1.838 . . . . 0.0 108.504 -178.767 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 50' ' ' GLN . . . . . . . . . . . . . 3.2 mm-40 -36.93 136.41 0.39 Allowed 'General case' 0 N--CA 1.504 2.272 0 CA-C-O 121.574 0.702 . . . . 0.0 112.865 -178.518 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 51' ' ' ASN . . . . . 0.819 ' OD1' HD21 ' A' ' 57' ' ' LEU . 37.2 t30 -100.75 116.28 64.34 Favored Pre-proline 0 N--CA 1.493 1.725 0 O-C-N 121.843 -0.536 . . . . 0.0 110.048 179.353 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 52' ' ' PRO . . . . . . . . . . . . . 42.8 Cg_endo -73.26 -64.31 0.03 OUTLIER 'Trans proline' 0 C--N 1.311 -1.407 0 O-C-N 123.928 1.488 . . . . 0.0 111.705 -179.829 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 53' ' ' THR . . . . . . . . . . . . . 1.0 OUTLIER -118.25 152.64 50.92 Favored Pre-proline 0 N--CA 1.498 1.964 0 O-C-N 121.111 -0.993 . . . . 0.0 110.942 -179.252 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 54' ' ' PRO . . . . . . . . . . . . . 45.0 Cg_endo -71.69 -37.2 5.51 Favored 'Trans proline' 0 N--CA 1.492 1.401 0 O-C-N 123.941 1.495 . . . . 0.0 111.267 179.983 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 55' ' ' GLU . . . . . . . . . . . . . 2.5 mp0 -62.8 -32.3 73.45 Favored 'General case' 0 N--CA 1.5 2.03 0 O-C-N 121.374 -0.829 . . . . 0.0 110.732 -179.895 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 2.5 tt0 -51.9 -40.25 60.38 Favored 'General case' 0 N--CA 1.499 2.023 0 O-C-N 121.604 -0.685 . . . . 0.0 111.117 -179.997 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 57' ' ' LEU . . . . . 0.819 HD21 ' OD1' ' A' ' 51' ' ' ASN . 0.4 OUTLIER -73.62 -31.51 63.58 Favored 'General case' 0 N--CA 1.499 2.016 0 O-C-N 121.082 -1.012 . . . . 0.0 110.153 179.778 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' A' A ' 58' ' ' GLN . . . . . 0.46 ' O ' HG22 ' A' ' 61' ' ' ILE . 0.0 OUTLIER -58.08 -44.19 87.43 Favored 'General case' 0 N--CA 1.496 1.842 0 O-C-N 121.191 -0.943 . . . . 0.0 108.465 178.951 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' A' A ' 59' ' ' GLU . . . . . . . . . . . . . 2.0 mp0 -61.12 -36.09 78.79 Favored 'General case' 0 N--CA 1.496 1.874 0 O-C-N 121.282 -0.887 . . . . 0.0 108.68 177.831 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 60' ' ' MET . . . . . 0.409 ' HB2' ' O ' ' A' ' 57' ' ' LEU . 0.4 OUTLIER -62.61 -36.89 84.2 Favored 'General case' 0 N--CA 1.497 1.907 0 O-C-N 121.725 -0.609 . . . . 0.0 109.867 178.618 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' A' A ' 61' ' ' ILE . . . . . 0.478 HG13 HG23 ' A' ' 72' ' ' VAL . 0.8 OUTLIER -83.77 -31.78 8.37 Favored 'Isoleucine or valine' 0 N--CA 1.498 1.946 0 O-C-N 121.41 -0.806 . . . . 0.0 111.039 -179.916 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' A' A ' 62' ' ' ASP . . . . . . . . . . . . . 2.7 m-20 -58.04 -47.57 82.72 Favored 'General case' 0 N--CA 1.5 2.065 0 O-C-N 121.289 -0.882 . . . . 0.0 111.233 -179.37 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 63' ' ' GLU . . . . . . . . . . . . . 0.9 OUTLIER -63.5 -36.21 83.02 Favored 'General case' 0 N--CA 1.5 2.028 0 O-C-N 121.274 -0.891 . . . . 0.0 110.799 -179.875 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 64' ' ' VAL . . . . . . . . . . . . . 84.4 t -84.36 -30.44 7.28 Favored 'Isoleucine or valine' 0 N--CA 1.498 1.944 0 O-C-N 121.33 -0.856 . . . . 0.0 111.465 -179.49 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 65' ' ' ASP . . . . . . . . . . . . . 16.9 t70 -133.72 137.78 45.44 Favored 'General case' 0 N--CA 1.497 1.885 0 O-C-N 121.006 -1.058 . . . . 0.0 111.76 -179.368 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 66' ' ' GLU . . . . . . . . . . . . . 0.3 OUTLIER -148.17 45.39 1.07 Allowed 'General case' 0 N--CA 1.495 1.796 0 CA-C-O 121.573 0.701 . . . . 0.0 109.245 178.694 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 67' ' ' ASP . . . . . . . . . . . . . 12.7 p-10 -102.78 13.18 35.03 Favored 'General case' 0 N--CA 1.499 1.992 0 O-C-N 121.448 -0.783 . . . . 0.0 111.567 -179.359 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 68' ' ' GLY . . . . . . . . . . . . . . . 107.79 -51.55 0.71 Allowed Glycine 0 N--CA 1.496 2.657 0 C-N-CA 120.039 -1.077 . . . . 0.0 110.497 179.422 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 69' ' ' SER . . . . . . . . . . . . . 82.3 p -64.07 -55.78 19.68 Favored 'General case' 0 N--CA 1.501 2.11 0 O-C-N 121.241 -1.152 . . . . 0.0 110.876 -179.418 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 70' ' ' GLY . . . . . . . . . . . . . . . 89.75 34.74 8.2 Favored Glycine 0 N--CA 1.495 2.595 0 N-CA-C 108.326 -1.91 . . . . 0.0 108.326 -179.283 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 71' ' ' THR . . . . . 0.413 ' HB ' ' SG ' ' A' ' 35' ' ' CYS . 3.1 p -131.0 143.03 50.41 Favored 'General case' 0 N--CA 1.489 1.49 0 O-C-N 122.029 -0.689 . . . . 0.0 109.694 -179.29 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 72' ' ' VAL . . . . . 0.534 HG11 ' HD1' ' A' ' 77' ' ' PHE . 93.3 t -75.59 107.37 6.32 Favored 'Isoleucine or valine' 0 N--CA 1.496 1.87 0 O-C-N 121.545 -0.722 . . . . 0.0 110.598 -179.724 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 73' ' ' ASP . . . . . 0.405 ' HB2' ' HB2' ' A' ' 76' ' ' GLU . 1.1 m-20 -75.25 -175.34 2.66 Favored 'General case' 0 N--CA 1.497 1.913 0 O-C-N 121.415 -0.803 . . . . 0.0 110.244 179.601 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 74' ' ' PHE . . . . . . . . . . . . . 39.0 t80 -65.16 -58.09 6.88 Favored 'General case' 0 N--CA 1.499 2.002 0 O-C-N 121.194 -0.941 . . . . 0.0 109.779 179.951 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 75' ' ' ASP . . . . . 0.694 ' HA ' HD12 ' A' ' 78' ' ' LEU . 0.5 OUTLIER -65.79 -34.64 78.65 Favored 'General case' 0 N--CA 1.495 1.783 0 O-C-N 121.553 -0.717 . . . . 0.0 109.86 179.174 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' A' A ' 76' ' ' GLU . . . . . 0.405 ' HB2' ' HB2' ' A' ' 73' ' ' ASP . 19.3 mt-10 -63.67 -40.42 96.78 Favored 'General case' 0 N--CA 1.497 1.903 0 O-C-N 121.451 -0.78 . . . . 0.0 109.502 178.715 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 77' ' ' PHE . . . . . 0.534 ' HD1' HG11 ' A' ' 72' ' ' VAL . 57.6 t80 -56.86 -40.46 76.17 Favored 'General case' 0 N--CA 1.498 1.972 0 O-C-N 121.621 -0.674 . . . . 0.0 110.541 179.48 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 78' ' ' LEU . . . . . 0.721 HD22 HD13 ' A' ' 12' ' ' LEU . 27.2 mt -55.45 -40.5 71.65 Favored 'General case' 0 N--CA 1.502 2.16 0 O-C-N 121.463 -0.773 . . . . 0.0 110.63 179.831 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 79' ' ' VAL . . . . . 0.75 HG22 HG21 ' A' ' 9' ' ' VAL . 77.8 t -62.5 -34.85 67.0 Favored 'Isoleucine or valine' 0 N--CA 1.502 2.125 0 O-C-N 121.497 -0.752 . . . . 0.0 110.033 179.496 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 80' ' ' MET . . . . . . . . . . . . . 18.9 ttp -73.58 -35.27 65.4 Favored 'General case' 0 N--CA 1.494 1.732 0 O-C-N 121.342 -0.849 . . . . 0.0 110.305 179.539 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 81' ' ' MET . . . . . 0.46 ' CE ' ' HB2' ' B' ' 150' ' ' ALA . 12.0 mmm -66.62 -46.76 74.8 Favored 'General case' 0 N--CA 1.499 1.979 0 O-C-N 121.424 -0.798 . . . . 0.0 110.715 -179.719 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 82' ' ' VAL . . . . . . . . . . . . . 33.2 m -62.81 -32.64 56.5 Favored 'Isoleucine or valine' 0 N--CA 1.504 2.243 0 O-C-N 121.128 -0.983 . . . . 0.0 110.441 179.88 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 83' ' ' ARG . . . . . 0.552 ' HG2' ' CD2' ' A' ' 5' ' ' TYR . 69.8 mtt180 -66.84 -34.52 77.99 Favored 'General case' 0 N--CA 1.497 1.908 0 O-C-N 121.38 -0.825 . . . . 0.0 109.835 179.132 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 84' ' ' CYS . . . . . . . . . . . . . 79.5 m -77.41 -28.93 52.81 Favored 'General case' 0 N--CA 1.496 1.856 0 O-C-N 121.502 -0.749 . . . . 0.0 109.983 178.914 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 85' ' ' MET . . . . . . . . . . . . . 42.0 mtm . . . . . 0 N--CA 1.497 1.903 0 O-C-N 121.582 -0.699 . . . . 0.0 110.76 179.838 . . . . . . . . 0 0 . 1 . 006 nuclear nobuild core ' B' B ' 149' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER . . . . . 0 N--CA 1.505 2.315 0 CA-C-O 121.41 0.624 . . . . 0.0 111.154 . . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' B' B ' 150' ' ' ALA . . . . . 0.46 ' HB2' ' CE ' ' A' ' 81' ' ' MET . . . -55.29 -42.76 74.08 Favored 'General case' 0 N--CA 1.501 2.118 0 O-C-N 121.412 -0.805 . . . . 0.0 110.824 179.955 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' B' B ' 151' ' ' ASP . . . . . . . . . . . . . 4.2 p-10 -53.92 -39.33 65.74 Favored 'General case' 0 N--CA 1.502 2.135 0 O-C-N 121.613 -0.679 . . . . 0.0 110.741 179.743 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' B' B ' 152' ' ' ALA . . . . . . . . . . . . . . . -87.14 -40.1 14.93 Favored 'General case' 0 N--CA 1.496 1.833 0 O-C-N 121.365 -0.834 . . . . 0.0 110.318 179.555 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' B' B ' 153' ' ' MET . . . . . 0.406 ' SD ' ' HZ ' ' A' ' 27' ' ' PHE . 5.7 ttt -60.09 -44.9 94.46 Favored 'General case' 0 N--CA 1.498 1.971 0 O-C-N 121.484 -0.76 . . . . 0.0 110.627 179.875 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' B' B ' 154' ' ' MET . . . . . . . . . . . . . 19.7 ttt -62.46 -43.63 98.34 Favored 'General case' 0 N--CA 1.497 1.917 0 O-C-N 121.474 -0.766 . . . . 0.0 110.428 179.773 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' B' B ' 155' ' ' GLN . . . . . . . . . . . . . 0.6 OUTLIER -65.42 -43.07 91.7 Favored 'General case' 0 N--CA 1.499 2.005 0 O-C-N 121.522 -0.737 . . . . 0.0 110.587 179.771 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' B' B ' 156' ' ' ALA . . . . . . . . . . . . . . . -63.43 -34.86 78.68 Favored 'General case' 0 N--CA 1.499 1.983 0 O-C-N 121.336 -0.853 . . . . 0.0 110.587 179.817 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' B' B ' 157' ' ' LEU . . . . . . . . . . . . . 24.8 tp -80.83 -49.46 11.05 Favored 'General case' 0 N--CA 1.495 1.809 0 O-C-N 121.301 -0.875 . . . . 0.0 110.611 179.849 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' B' B ' 158' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER . . . . . 0 N--CA 1.499 2.009 0 O-C-N 121.287 -0.883 . . . . 0.0 110.069 179.825 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 4' ' ' ILE . . . . . . . . . . . . . 5.3 mt . . . . . 0 N--CA 1.493 1.682 0 N-CA-C 109.294 -0.632 . . . . 0.0 109.294 . . . . . . . . . 0 0 . 1 . 007 nuclear nobuild core ' A' A ' 5' ' ' TYR . . . . . . . . . . . . . 39.7 m-85 -68.77 -36.53 78.44 Favored 'General case' 0 N--CA 1.494 1.758 0 O-C-N 121.605 -0.684 . . . . 0.0 109.454 178.896 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 6' ' ' LYS . . . . . 0.457 ' O ' ' HB ' ' A' ' 9' ' ' VAL . 0.3 OUTLIER -64.99 -42.7 94.28 Favored 'General case' 0 N--CA 1.496 1.846 0 O-C-N 121.451 -0.78 . . . . 0.0 109.031 178.483 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' A' A ' 7' ' ' ALA . . . . . . . . . . . . . . . -61.46 -35.99 79.18 Favored 'General case' 0 N--CA 1.496 1.868 0 O-C-N 121.464 -0.772 . . . . 0.0 109.338 178.306 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 8' ' ' ALA . . . . . . . . . . . . . . . -66.57 -26.39 67.1 Favored 'General case' 0 N--CA 1.498 1.938 0 O-C-N 121.497 -0.752 . . . . 0.0 110.232 179.03 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 9' ' ' VAL . . . . . 0.681 ' HA ' HD12 ' A' ' 12' ' ' LEU . 57.1 t -59.51 -40.27 81.46 Favored 'Isoleucine or valine' 0 N--CA 1.498 1.963 0 O-C-N 121.301 -0.874 . . . . 0.0 109.416 179.036 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 10' ' ' GLU . . . . . . . . . . . . . 0.9 OUTLIER -61.69 -30.28 70.64 Favored 'General case' 0 N--CA 1.496 1.848 0 O-C-N 121.417 -0.802 . . . . 0.0 110.01 178.828 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 11' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -60.04 -33.81 72.55 Favored 'General case' 0 N--CA 1.5 2.035 0 O-C-N 121.407 -0.808 . . . . 0.0 109.388 178.406 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 12' ' ' LEU . . . . . 0.688 ' HB3' ' CB ' ' A' ' 16' ' ' GLN . 19.4 mt -67.62 -23.76 65.39 Favored 'General case' 0 N--CA 1.498 1.959 0 O-C-N 121.687 -0.633 . . . . 0.0 109.703 178.494 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 13' ' ' THR . . . . . 0.646 HG23 ' C ' ' A' ' 12' ' ' LEU . 1.3 p 74.2 165.78 0.29 Allowed 'General case' 0 N--CA 1.51 2.555 0 C-N-CA 123.47 0.708 . . . . 0.0 110.86 -179.594 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 14' ' ' GLU . . . . . . . . . . . . . 1.1 tp10 -57.33 -30.63 64.96 Favored 'General case' 0 N--CA 1.494 1.751 0 O-C-N 121.645 -0.659 . . . . 0.0 110.779 -178.958 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER -57.53 -47.4 82.1 Favored 'General case' 0 N--CA 1.495 1.782 0 O-C-N 121.436 -0.79 . . . . 0.0 109.395 178.803 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 16' ' ' GLN . . . . . 0.688 ' CB ' ' HB3' ' A' ' 12' ' ' LEU . 27.3 mt-30 -72.79 -38.55 67.2 Favored 'General case' 0 N--CA 1.495 1.815 0 O-C-N 121.459 -0.776 . . . . 0.0 110.076 178.951 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 17' ' ' LYS . . . . . 0.407 ' HD2' HG12 ' A' ' 9' ' ' VAL . 0.0 OUTLIER -56.68 -45.99 81.39 Favored 'General case' 0 N--CA 1.498 1.943 0 N-CA-C 109.259 -0.645 . . . . 0.0 109.259 179.132 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' A' A ' 18' ' ' ASN . . . . . . . . . . . . . 21.2 m-80 -71.21 -36.48 71.91 Favored 'General case' 0 N--CA 1.494 1.766 0 O-C-N 121.603 -0.686 . . . . 0.0 109.249 178.281 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 19' ' ' GLU . . . . . 0.471 ' HB2' ' HA ' ' A' ' 16' ' ' GLN . 15.2 mt-10 -62.24 -52.13 64.98 Favored 'General case' 0 N--CA 1.498 1.96 0 O-C-N 121.568 -0.707 . . . . 0.0 109.95 179.108 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 20' ' ' PHE . . . . . 0.482 ' CE1' ' HG2' ' A' ' 81' ' ' MET . 17.7 m-85 -62.51 -40.03 95.42 Favored 'General case' 0 N--CA 1.497 1.921 0 O-C-N 121.497 -0.752 . . . . 0.0 109.841 179.467 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 21' ' ' LYS . . . . . . . . . . . . . 13.8 tptt -59.1 -46.16 89.01 Favored 'General case' 0 N--CA 1.499 1.993 0 O-C-N 121.433 -0.792 . . . . 0.0 109.534 178.93 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 22' ' ' ALA . . . . . . . . . . . . . . . -68.74 -46.42 68.93 Favored 'General case' 0 N--CA 1.496 1.829 0 O-C-N 121.626 -0.671 . . . . 0.0 109.918 179.436 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 23' ' ' ALA . . . . . . . . . . . . . . . -62.53 -34.72 77.47 Favored 'General case' 0 N--CA 1.498 1.963 0 O-C-N 121.432 -0.792 . . . . 0.0 109.538 178.808 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 24' ' ' PHE . . . . . 0.602 ' CE1' HD12 ' A' ' 36' ' ' ILE . 65.5 t80 -60.39 -48.25 82.55 Favored 'General case' 0 N--CA 1.496 1.829 0 N-CA-C 109.138 -0.69 . . . . 0.0 109.138 178.839 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 25' ' ' ASP . . . . . . . . . . . . . 0.9 OUTLIER -64.36 -34.42 78.12 Favored 'General case' 0 N--CA 1.496 1.852 0 O-C-N 121.54 -0.725 . . . . 0.0 109.361 178.663 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 26' ' ' ILE . . . . . 0.921 ' HA ' HD12 ' A' ' 29' ' ' LEU . 15.9 mm -67.06 -34.69 71.4 Favored 'Isoleucine or valine' 0 N--CA 1.498 1.926 0 O-C-N 121.328 -0.857 . . . . 0.0 109.112 178.372 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 27' ' ' PHE . . . . . . . . . . . . . 0.2 OUTLIER -65.4 -34.52 78.5 Favored 'General case' 0 N--CA 1.498 1.966 0 O-C-N 121.569 -0.707 . . . . 0.0 110.587 179.366 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 28' ' ' VAL . . . . . 0.551 ' HA ' ' HB2' ' A' ' 31' ' ' ALA . 32.9 m -93.4 1.5 9.47 Favored 'Isoleucine or valine' 0 N--CA 1.502 2.142 0 O-C-N 121.283 -0.886 . . . . 0.0 112.064 -179.39 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 29' ' ' LEU . . . . . 0.921 HD12 ' HA ' ' A' ' 26' ' ' ILE . 2.3 mt -63.28 -45.92 89.19 Favored 'General case' 0 N--CA 1.501 2.089 0 O-C-N 120.821 -1.174 . . . . 0.0 109.688 179.33 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 30' ' ' GLY . . . . . . . . . . . . . . . -103.66 43.66 1.63 Allowed Glycine 0 N--CA 1.492 2.414 0 N-CA-C 108.561 -1.815 . . . . 0.0 108.561 178.643 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 31' ' ' ALA . . . . . 0.551 ' HB2' ' HA ' ' A' ' 28' ' ' VAL . . . . . . . . 0 N--CA 1.496 1.838 0 O-C-N 121.528 -0.984 . . . . 0.0 111.197 -179.18 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 35' ' ' CYS . . . . . . . . . . . . . 1.3 m . . . . . 0 N--CA 1.497 1.881 0 N-CA-C 109.965 -0.383 . . . . 0.0 109.965 . . . . . . . . . 0 0 . 1 . 007 nuclear nobuild core ' A' A ' 36' ' ' ILE . . . . . 0.602 HD12 ' CE1' ' A' ' 24' ' ' PHE . 96.6 mt -90.27 101.64 12.49 Favored 'Isoleucine or valine' 0 N--CA 1.496 1.829 0 O-C-N 121.117 -0.99 . . . . 0.0 110.57 -179.781 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 37' ' ' SER . . . . . . . . . . . . . 83.8 p -113.55 -179.36 3.62 Favored 'General case' 0 N--CA 1.494 1.733 0 N-CA-C 108.983 -0.747 . . . . 0.0 108.983 178.854 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 38' ' ' THR . . . . . 0.65 HG21 ' HG2' ' A' ' 58' ' ' GLN . 8.6 p -62.6 -41.18 98.82 Favored 'General case' 0 N--CA 1.5 2.041 0 O-C-N 120.963 -1.086 . . . . 0.0 110.056 179.515 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 39' ' ' LYS . . . . . 0.528 ' HA ' ' HB3' ' A' ' 54' ' ' PRO . 1.0 OUTLIER -60.94 -35.16 76.01 Favored 'General case' 0 N--CA 1.501 2.079 0 O-C-N 121.485 -0.759 . . . . 0.0 110.018 179.263 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 1.1 tp10 -83.41 -39.2 20.93 Favored 'General case' 0 N--CA 1.493 1.709 0 O-C-N 121.507 -0.746 . . . . 0.0 109.636 179.041 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 41' ' ' LEU . . . . . 0.485 HD11 ' CG ' ' A' ' 45' ' ' MET . 9.1 tp -62.63 -49.0 76.91 Favored 'General case' 0 N--CA 1.498 1.957 0 O-C-N 121.623 -0.673 . . . . 0.0 110.588 179.72 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 42' ' ' GLY . . . . . . . . . . . . . . . -54.36 -38.41 62.23 Favored Glycine 0 N--CA 1.494 2.549 0 N-CA-C 110.84 -0.904 . . . . 0.0 110.84 -179.038 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 43' ' ' LYS . . . . . . . . . . . . . 0.4 OUTLIER -54.49 -41.48 69.62 Favored 'General case' 0 N--CA 1.503 2.199 0 O-C-N 121.309 -1.112 . . . . 0.0 110.298 179.686 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 44' ' ' VAL . . . . . . . . . . . . . 44.0 t -83.08 -36.65 13.09 Favored 'Isoleucine or valine' 0 N--CA 1.499 2.014 0 O-C-N 121.349 -0.844 . . . . 0.0 109.876 179.21 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 45' ' ' MET . . . . . 0.704 ' HB3' ' HB2' ' A' ' 51' ' ' ASN . 69.4 mmm -61.91 -41.22 97.67 Favored 'General case' 0 N--CA 1.501 2.098 0 O-C-N 121.527 -0.733 . . . . 0.0 110.47 179.815 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 46' ' ' ARG . . . . . . . . . . . . . 8.9 tpt180 -67.34 -36.98 82.52 Favored 'General case' 0 N--CA 1.497 1.885 0 O-C-N 121.304 -0.872 . . . . 0.0 109.592 179.153 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 47' ' ' MET . . . . . . . . . . . . . 43.2 ttp -75.59 -1.97 26.99 Favored 'General case' 0 N--CA 1.499 1.977 0 O-C-N 121.559 -0.713 . . . . 0.0 110.46 178.704 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 48' ' ' LEU . . . . . . . . . . . . . 4.2 tp -119.66 -54.74 2.15 Favored 'General case' 0 N--CA 1.493 1.702 0 O-C-N 121.024 -1.048 . . . . 0.0 109.728 179.95 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 49' ' ' GLY . . . . . . . . . . . . . . . -114.04 -116.62 3.25 Favored Glycine 0 N--CA 1.494 2.515 0 N-CA-C 109.221 -1.552 . . . . 0.0 109.221 179.426 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 50' ' ' GLN . . . . . 0.482 ' O ' ' HD3' ' A' ' 52' ' ' PRO . 0.8 OUTLIER -139.11 13.68 2.63 Favored 'General case' 0 N--CA 1.5 2.067 0 O-C-N 121.375 -1.074 . . . . 0.0 111.933 -179.866 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' A' A ' 51' ' ' ASN . . . . . 0.704 ' HB2' ' HB3' ' A' ' 45' ' ' MET . 8.2 m120 -78.0 108.88 8.35 Favored Pre-proline 0 N--CA 1.505 2.291 0 O-C-N 121.02 -1.05 . . . . 0.0 109.633 179.897 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 52' ' ' PRO . . . . . 0.482 ' HD3' ' O ' ' A' ' 50' ' ' GLN . 45.2 Cg_endo -93.15 -73.6 0.0 OUTLIER 'Trans proline' 0 C--N 1.313 -1.292 0 C-N-CA 121.728 1.619 . . . . 0.0 112.627 -177.983 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 53' ' ' THR . . . . . . . . . . . . . 11.7 p -67.9 142.55 95.61 Favored Pre-proline 0 N--CA 1.499 1.986 0 O-C-N 121.311 -0.868 . . . . 0.0 111.599 -178.298 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 54' ' ' PRO . . . . . 0.528 ' HB3' ' HA ' ' A' ' 39' ' ' LYS . 43.4 Cg_endo -67.41 -32.81 31.38 Favored 'Trans proline' 0 N--CA 1.491 1.359 0 O-C-N 124.285 1.676 . . . . 0.0 110.893 179.577 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 55' ' ' GLU . . . . . . . . . . . . . 1.6 mp0 -57.92 -31.95 67.29 Favored 'General case' 0 N--CA 1.502 2.144 0 O-C-N 121.4 -0.813 . . . . 0.0 109.988 179.508 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 1.0 OUTLIER -62.8 -38.48 90.86 Favored 'General case' 0 N--CA 1.496 1.874 0 O-C-N 121.543 -0.723 . . . . 0.0 110.13 179.408 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 57' ' ' LEU . . . . . 0.523 ' H ' HD22 ' A' ' 57' ' ' LEU . 0.5 OUTLIER -87.5 -12.55 45.6 Favored 'General case' 0 N--CA 1.495 1.801 0 O-C-N 121.291 -0.88 . . . . 0.0 110.66 179.624 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' A' A ' 58' ' ' GLN . . . . . 0.65 ' HG2' HG21 ' A' ' 38' ' ' THR . 0.0 OUTLIER -56.27 -38.09 70.68 Favored 'General case' 0 N--CA 1.502 2.154 0 O-C-N 121.218 -0.926 . . . . 0.0 110.55 179.838 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' A' A ' 59' ' ' GLU . . . . . . . . . . . . . 0.9 OUTLIER -58.95 -32.16 69.36 Favored 'General case' 0 N--CA 1.498 1.951 0 O-C-N 121.018 -1.052 . . . . 0.0 109.439 178.82 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 60' ' ' MET . . . . . 0.439 ' CE ' HD12 ' A' ' 57' ' ' LEU . 40.7 mtm -78.41 -47.47 17.51 Favored 'General case' 0 N--CA 1.495 1.786 0 O-C-N 121.586 -0.696 . . . . 0.0 110.244 179.03 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 61' ' ' ILE . . . . . 0.717 HG13 HG23 ' A' ' 72' ' ' VAL . 11.0 tt -62.36 -41.57 92.21 Favored 'Isoleucine or valine' 0 N--CA 1.501 2.108 0 O-C-N 121.219 -0.926 . . . . 0.0 110.39 179.812 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 62' ' ' ASP . . . . . . . . . . . . . 0.8 OUTLIER -64.77 -36.3 83.88 Favored 'General case' 0 N--CA 1.499 2.015 0 O-C-N 121.249 -0.907 . . . . 0.0 110.159 179.286 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 63' ' ' GLU . . . . . . . . . . . . . 3.1 tt0 -63.0 -28.56 70.18 Favored 'General case' 0 N--CA 1.498 1.954 0 O-C-N 121.48 -0.762 . . . . 0.0 110.435 179.196 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 64' ' ' VAL . . . . . . . . . . . . . 4.0 t -114.95 25.85 4.03 Favored 'Isoleucine or valine' 0 N--CA 1.498 1.971 0 O-C-N 121.203 -0.936 . . . . 0.0 110.567 179.838 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 65' ' ' ASP . . . . . 0.498 ' HB2' ' O ' ' A' ' 61' ' ' ILE . 16.9 t70 -110.64 -73.9 0.67 Allowed 'General case' 0 N--CA 1.5 2.03 0 O-C-N 120.966 -1.084 . . . . 0.0 110.551 179.973 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 66' ' ' GLU . . . . . . . . . . . . . 7.7 tt0 57.92 23.31 9.67 Favored 'General case' 0 N--CA 1.501 2.109 0 O-C-N 121.607 -0.683 . . . . 0.0 110.86 -179.396 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 67' ' ' ASP . . . . . . . . . . . . . 64.9 m-20 -111.85 5.29 18.9 Favored 'General case' 0 N--CA 1.496 1.853 0 O-C-N 121.257 -0.902 . . . . 0.0 110.948 179.669 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 68' ' ' GLY . . . . . . . . . . . . . . . 63.49 38.06 95.74 Favored Glycine 0 N--CA 1.495 2.599 0 N-CA-C 108.703 -1.759 . . . . 0.0 108.703 -178.931 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 69' ' ' SER . . . . . . . . . . . . . 71.0 p -139.11 -53.53 0.57 Allowed 'General case' 0 N--CA 1.495 1.8 0 O-C-N 121.626 -0.926 . . . . 0.0 110.73 -179.1 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 70' ' ' GLY . . . . . . . . . . . . . . . 90.25 45.35 4.43 Favored Glycine 0 N--CA 1.497 2.738 0 N-CA-C 108.639 -1.785 . . . . 0.0 108.639 -179.308 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 71' ' ' THR . . . . . . . . . . . . . 0.9 OUTLIER -140.44 126.1 19.17 Favored 'General case' 0 N--CA 1.493 1.72 0 O-C-N 121.861 -0.788 . . . . 0.0 109.993 -179.154 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 72' ' ' VAL . . . . . 0.717 HG23 HG13 ' A' ' 61' ' ' ILE . 53.9 t -80.66 105.88 11.06 Favored 'Isoleucine or valine' 0 N--CA 1.497 1.879 0 O-C-N 121.535 -0.728 . . . . 0.0 110.567 -179.98 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 73' ' ' ASP . . . . . 0.4 ' O ' ' HB2' ' A' ' 77' ' ' PHE . 1.1 t70 -85.29 -162.9 0.76 Allowed 'General case' 0 N--CA 1.495 1.799 0 O-C-N 121.366 -0.834 . . . . 0.0 109.854 179.287 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 74' ' ' PHE . . . . . . . . . . . . . 25.7 t80 -64.91 -50.86 64.84 Favored 'General case' 0 N--CA 1.499 1.988 0 O-C-N 121.085 -1.009 . . . . 0.0 110.278 -179.917 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 75' ' ' ASP . . . . . . . . . . . . . 25.0 t70 -60.19 -49.61 76.93 Favored 'General case' 0 N--CA 1.497 1.902 0 O-C-N 121.543 -0.723 . . . . 0.0 109.947 179.31 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 76' ' ' GLU . . . . . . . . . . . . . 30.5 mt-10 -60.73 -37.93 83.42 Favored 'General case' 0 N--CA 1.498 1.929 0 O-C-N 121.473 -0.767 . . . . 0.0 110.468 179.633 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 77' ' ' PHE . . . . . 0.4 ' HB2' ' O ' ' A' ' 73' ' ' ASP . 42.6 t80 -59.63 -48.29 82.24 Favored 'General case' 0 N--CA 1.498 1.973 0 O-C-N 121.317 -0.864 . . . . 0.0 110.142 179.445 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 78' ' ' LEU . . . . . . . . . . . . . 16.2 mt -66.84 -37.88 85.32 Favored 'General case' 0 N--CA 1.501 2.09 0 O-C-N 121.41 -0.806 . . . . 0.0 110.023 179.579 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 79' ' ' VAL . . . . . . . . . . . . . 39.2 t -59.71 -36.7 67.27 Favored 'Isoleucine or valine' 0 N--CA 1.499 2.025 0 O-C-N 121.49 -0.756 . . . . 0.0 110.012 179.192 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 80' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -69.99 -40.34 75.35 Favored 'General case' 0 N--CA 1.496 1.849 0 O-C-N 121.359 -0.838 . . . . 0.0 109.868 179.332 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 81' ' ' MET . . . . . 0.482 ' HG2' ' CE1' ' A' ' 20' ' ' PHE . 0.0 OUTLIER -62.53 -48.4 79.71 Favored 'General case' 0 N--CA 1.496 1.848 0 O-C-N 121.557 -0.714 . . . . 0.0 109.976 179.515 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' A' A ' 82' ' ' VAL . . . . . . . . . . . . . 34.3 m -67.44 -28.18 41.27 Favored 'Isoleucine or valine' 0 N--CA 1.499 2.018 0 O-C-N 121.251 -0.905 . . . . 0.0 109.805 179.016 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 83' ' ' ARG . . . . . . . . . . . . . 7.2 mtt85 -61.58 -39.97 93.08 Favored 'General case' 0 N--CA 1.497 1.91 0 O-C-N 121.348 -0.845 . . . . 0.0 109.518 178.779 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 84' ' ' CYS . . . . . . . . . . . . . 5.2 t -62.49 -35.57 79.77 Favored 'General case' 0 N--CA 1.498 1.95 0 O-C-N 121.542 -0.724 . . . . 0.0 110.002 178.882 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 85' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.499 1.982 0 O-C-N 121.408 -0.807 . . . . 0.0 110.353 179.341 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' B' B ' 149' ' ' SER . . . . . . . . . . . . . 34.8 p . . . . . 0 N--CA 1.497 1.91 0 CA-C-O 121.383 0.611 . . . . 0.0 110.957 . . . . . . . . . 0 0 . 1 . 007 nuclear nobuild core ' B' B ' 150' ' ' ALA . . . . . . . . . . . . . . . -67.94 -28.5 67.53 Favored 'General case' 0 N--CA 1.494 1.761 0 O-C-N 121.568 -0.707 . . . . 0.0 110.438 179.482 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' B' B ' 151' ' ' ASP . . . . . . . . . . . . . 22.9 t70 -75.27 -39.43 59.75 Favored 'General case' 0 N--CA 1.499 2.005 0 O-C-N 121.32 -0.863 . . . . 0.0 110.563 179.561 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' B' B ' 152' ' ' ALA . . . . . . . . . . . . . . . -52.47 -36.71 55.48 Favored 'General case' 0 N--CA 1.501 2.117 0 O-C-N 121.508 -0.745 . . . . 0.0 110.992 -179.871 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' B' B ' 153' ' ' MET . . . . . 0.477 ' O ' HD12 ' B' ' 157' ' ' LEU . 0.0 OUTLIER -77.47 -35.77 53.45 Favored 'General case' 0 N--CA 1.495 1.815 0 O-C-N 121.17 -0.956 . . . . 0.0 110.477 179.712 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' B' B ' 154' ' ' MET . . . . . . . . . . . . . 0.7 OUTLIER -62.91 -53.4 54.65 Favored 'General case' 0 N--CA 1.5 2.034 0 O-C-N 121.264 -0.898 . . . . 0.0 110.095 179.685 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' B' B ' 155' ' ' GLN . . . . . . . . . . . . . 2.1 pp0? -62.81 -22.15 66.43 Favored 'General case' 0 N--CA 1.5 2.075 0 O-C-N 121.187 -0.945 . . . . 0.0 110.379 179.101 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' B' B ' 156' ' ' ALA . . . . . . . . . . . . . . . -82.58 -40.96 20.17 Favored 'General case' 0 N--CA 1.495 1.79 0 O-C-N 121.235 -0.916 . . . . 0.0 110.448 179.266 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' B' B ' 157' ' ' LEU . . . . . 0.477 HD12 ' O ' ' B' ' 153' ' ' MET . 2.0 mt -91.69 -59.11 2.21 Favored 'General case' 0 N--CA 1.499 2.008 0 O-C-N 121.29 -0.882 . . . . 0.0 110.408 179.996 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' B' B ' 158' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER . . . . . 0 N--CA 1.499 2.014 0 O-C-N 121.305 -0.872 . . . . 0.0 110.46 179.745 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 4' ' ' ILE . . . . . 0.428 HG23 ' N ' ' A' ' 5' ' ' TYR . 1.7 tt . . . . . 0 N--CA 1.501 2.108 0 N-CA-C 111.615 0.228 . . . . 0.0 111.615 . . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 5' ' ' TYR . . . . . 0.51 ' CG ' ' HG2' ' A' ' 83' ' ' ARG . 57.5 m-85 -76.75 -38.8 53.52 Favored 'General case' 0 N--CA 1.5 2.026 0 O-C-N 121.098 -1.001 . . . . 0.0 110.156 179.989 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 6' ' ' LYS . . . . . 0.445 ' HG2' ' CD ' ' A' ' 10' ' ' GLU . 12.3 ttpp -66.37 -37.81 86.14 Favored 'General case' 0 N--CA 1.494 1.771 0 O-C-N 121.411 -0.806 . . . . 0.0 109.456 178.9 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 7' ' ' ALA . . . . . . . . . . . . . . . -56.17 -43.64 78.56 Favored 'General case' 0 N--CA 1.498 1.971 0 O-C-N 121.534 -0.729 . . . . 0.0 110.209 179.313 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 8' ' ' ALA . . . . . . . . . . . . . . . -61.09 -39.85 91.48 Favored 'General case' 0 N--CA 1.499 2.018 0 O-C-N 121.437 -0.789 . . . . 0.0 109.977 179.149 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 9' ' ' VAL . . . . . 0.807 HG21 ' HA ' ' A' ' 79' ' ' VAL . 53.0 t -75.36 -43.65 42.8 Favored 'Isoleucine or valine' 0 N--CA 1.496 1.864 0 O-C-N 121.483 -0.761 . . . . 0.0 110.32 179.587 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 10' ' ' GLU . . . . . 0.445 ' CD ' ' HG2' ' A' ' 6' ' ' LYS . 58.6 mt-10 -57.8 -36.73 72.6 Favored 'General case' 0 N--CA 1.498 1.935 0 O-C-N 121.437 -0.789 . . . . 0.0 109.701 179.383 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 11' ' ' GLN . . . . . . . . . . . . . 0.2 OUTLIER -108.19 47.83 0.88 Allowed 'General case' 0 N--CA 1.482 1.152 0 O-C-N 121.417 -0.802 . . . . 0.0 109.704 179.363 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 12' ' ' LEU . . . . . . . . . . . . . 1.5 mt -82.03 150.68 27.47 Favored 'General case' 0 N--CA 1.497 1.911 0 O-C-N 121.304 -0.873 . . . . 0.0 110.714 -179.748 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 13' ' ' THR . . . . . . . . . . . . . 45.4 p -83.12 152.69 25.19 Favored 'General case' 0 N--CA 1.498 1.956 0 O-C-N 121.462 -0.774 . . . . 0.0 109.922 179.396 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 14' ' ' GLU . . . . . 0.622 ' HA ' ' HD3' ' A' ' 17' ' ' LYS . 5.0 tp10 -56.71 -32.2 65.26 Favored 'General case' 0 N--CA 1.492 1.666 0 O-C-N 121.554 -0.716 . . . . 0.0 110.767 -179.415 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 1.5 mp0 -60.58 -47.85 84.38 Favored 'General case' 0 N--CA 1.497 1.889 0 O-C-N 121.355 -0.84 . . . . 0.0 109.805 179.351 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 16' ' ' GLN . . . . . 0.446 ' HA ' ' HB3' ' A' ' 19' ' ' GLU . 5.4 mt-30 -77.45 -27.89 52.28 Favored 'General case' 0 N--CA 1.496 1.832 0 O-C-N 121.259 -0.9 . . . . 0.0 110.607 179.347 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 17' ' ' LYS . . . . . 0.622 ' HD3' ' HA ' ' A' ' 14' ' ' GLU . 0.2 OUTLIER -60.53 -46.67 89.31 Favored 'General case' 0 N--CA 1.498 1.965 0 O-C-N 121.513 -0.742 . . . . 0.0 109.547 179.138 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' A' A ' 18' ' ' ASN . . . . . . . . . . . . . 50.5 t30 -72.77 -34.26 66.84 Favored 'General case' 0 N--CA 1.496 1.863 0 O-C-N 121.581 -0.699 . . . . 0.0 109.926 179.061 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 19' ' ' GLU . . . . . 0.446 ' HB3' ' HA ' ' A' ' 16' ' ' GLN . 3.6 tt0 -60.47 -49.15 78.72 Favored 'General case' 0 N--CA 1.497 1.903 0 O-C-N 121.477 -0.764 . . . . 0.0 109.578 179.265 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 20' ' ' PHE . . . . . . . . . . . . . 16.9 m-85 -68.1 -32.36 72.61 Favored 'General case' 0 N--CA 1.499 2.0 0 O-C-N 121.316 -0.865 . . . . 0.0 110.092 179.123 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 21' ' ' LYS . . . . . . . . . . . . . 13.9 tptp -58.42 -45.44 88.46 Favored 'General case' 0 N--CA 1.495 1.822 0 O-C-N 121.604 -0.685 . . . . 0.0 109.611 179.43 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 22' ' ' ALA . . . . . . . . . . . . . . . -59.43 -44.23 92.95 Favored 'General case' 0 N--CA 1.496 1.847 0 O-C-N 121.514 -0.742 . . . . 0.0 110.271 179.373 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 23' ' ' ALA . . . . . . . . . . . . . . . -64.87 -44.48 89.54 Favored 'General case' 0 N--CA 1.501 2.088 0 O-C-N 121.283 -0.886 . . . . 0.0 109.926 179.209 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 24' ' ' PHE . . . . . . . . . . . . . 40.8 t80 -66.75 -38.73 87.22 Favored 'General case' 0 N--CA 1.496 1.835 0 O-C-N 121.609 -0.682 . . . . 0.0 110.303 179.505 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 25' ' ' ASP . . . . . 0.414 ' O ' HG22 ' A' ' 28' ' ' VAL . 9.1 t70 -54.73 -52.36 62.73 Favored 'General case' 0 N--CA 1.501 2.115 0 O-C-N 121.606 -0.684 . . . . 0.0 111.012 -179.805 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 26' ' ' ILE . . . . . 0.424 ' HB ' HD12 ' B' ' 157' ' ' LEU . 19.7 mt -69.8 -27.8 34.61 Favored 'Isoleucine or valine' 0 N--CA 1.498 1.959 0 O-C-N 121.145 -0.972 . . . . 0.0 110.266 179.856 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 27' ' ' PHE . . . . . 0.469 ' CD2' HD21 ' B' ' 157' ' ' LEU . 0.3 OUTLIER -65.23 -32.75 74.58 Favored 'General case' 0 N--CA 1.498 1.956 0 O-C-N 121.244 -0.91 . . . . 0.0 111.05 179.81 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' A' A ' 28' ' ' VAL . . . . . 0.414 HG22 ' O ' ' A' ' 25' ' ' ASP . 33.0 m -91.75 34.02 0.11 Allowed 'Isoleucine or valine' 0 N--CA 1.501 2.12 0 O-C-N 121.121 -0.987 . . . . 0.0 110.816 179.945 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 29' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -67.02 -42.18 85.37 Favored 'General case' 0 N--CA 1.498 1.945 0 O-C-N 121.111 -0.993 . . . . 0.0 110.176 179.459 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 30' ' ' GLY . . . . . . . . . . . . . . . -105.92 40.2 2.58 Favored Glycine 0 N--CA 1.495 2.578 0 N-CA-C 109.488 -1.445 . . . . 0.0 109.488 179.475 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 31' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.496 1.849 0 O-C-N 121.364 -1.08 . . . . 0.0 110.203 -179.982 . . . . . . . . 0 0 . 1 . 008 nuclear nobuild core ' A' A ' 35' ' ' CYS . . . . . . . . . . . . . 58.2 m . . . . . 0 N--CA 1.497 1.889 0 CA-C-O 121.096 0.474 . . . . 0.0 110.339 . . . . . . . . . 0 0 . 1 . 008 nuclear nobuild core ' A' A ' 36' ' ' ILE . . . . . . . . . . . . . 25.9 mt -102.13 129.26 53.79 Favored 'Isoleucine or valine' 0 N--CA 1.496 1.863 0 O-C-N 121.168 -0.957 . . . . 0.0 110.425 -179.685 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 37' ' ' SER . . . . . . . . . . . . . 3.4 t -107.17 163.68 12.8 Favored 'General case' 0 N--CA 1.495 1.795 0 O-C-N 121.484 -0.76 . . . . 0.0 109.722 179.133 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 38' ' ' THR . . . . . 0.725 HG21 ' HA ' ' A' ' 58' ' ' GLN . 77.1 p -63.05 -30.38 71.55 Favored 'General case' 0 N--CA 1.501 2.105 0 O-C-N 121.294 -0.879 . . . . 0.0 110.27 179.64 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 39' ' ' LYS . . . . . . . . . . . . . 1.6 mptp? -58.93 -42.96 91.02 Favored 'General case' 0 N--CA 1.497 1.912 0 O-C-N 121.535 -0.728 . . . . 0.0 109.837 179.343 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 40' ' ' GLU . . . . . 0.402 ' HA ' ' HD2' ' A' ' 43' ' ' LYS . 1.6 mp0 -74.25 -37.22 63.84 Favored 'General case' 0 N--CA 1.498 1.942 0 O-C-N 121.463 -0.773 . . . . 0.0 109.942 179.442 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 41' ' ' LEU . . . . . 0.451 ' HG ' HD13 ' A' ' 57' ' ' LEU . 6.2 tp -60.69 -47.56 85.7 Favored 'General case' 0 N--CA 1.495 1.789 0 O-C-N 121.499 -0.751 . . . . 0.0 109.807 179.499 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 42' ' ' GLY . . . . . . . . . . . . . . . -54.62 -39.84 68.22 Favored Glycine 0 N--CA 1.494 2.536 0 N-CA-C 109.887 -1.285 . . . . 0.0 109.887 179.688 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 43' ' ' LYS . . . . . 0.402 ' HD2' ' HA ' ' A' ' 40' ' ' GLU . 16.0 mttp -58.34 -40.19 81.49 Favored 'General case' 0 N--CA 1.501 2.084 0 O-C-N 121.34 -1.094 . . . . 0.0 110.033 179.171 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 44' ' ' VAL . . . . . . . . . . . . . 45.0 t -75.25 -38.45 41.11 Favored 'Isoleucine or valine' 0 N--CA 1.497 1.901 0 O-C-N 121.36 -0.838 . . . . 0.0 109.39 179.108 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 45' ' ' MET . . . . . 0.401 ' CE ' HD11 ' A' ' 41' ' ' LEU . 1.6 mmt -57.14 -43.29 82.28 Favored 'General case' 0 N--CA 1.498 1.936 0 O-C-N 121.713 -0.617 . . . . 0.0 110.031 179.343 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 46' ' ' ARG . . . . . . . . . . . . . 0.4 OUTLIER -63.12 -39.9 96.04 Favored 'General case' 0 N--CA 1.496 1.853 0 O-C-N 121.571 -0.706 . . . . 0.0 109.783 179.234 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 47' ' ' MET . . . . . . . . . . . . . 6.0 ttp -63.54 -29.35 70.63 Favored 'General case' 0 N--CA 1.497 1.875 0 O-C-N 121.569 -0.707 . . . . 0.0 110.188 179.036 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 48' ' ' LEU . . . . . . . . . . . . . 1.9 tt -72.13 -39.64 68.66 Favored 'General case' 0 N--CA 1.495 1.823 0 O-C-N 121.391 -0.818 . . . . 0.0 110.65 179.618 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 49' ' ' GLY . . . . . . . . . . . . . . . 144.29 -29.85 1.9 Allowed Glycine 0 N--CA 1.499 2.859 0 C-N-CA 120.113 -1.041 . . . . 0.0 110.627 179.982 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 50' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -127.07 129.8 48.69 Favored 'General case' 0 N--CA 1.501 2.082 0 O-C-N 121.21 -1.171 . . . . 0.0 111.166 -179.628 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 51' ' ' ASN . . . . . . . . . . . . . 43.3 t30 -172.15 104.87 0.35 Allowed Pre-proline 0 N--CA 1.496 1.845 0 O-C-N 121.549 -0.719 . . . . 0.0 110.363 179.319 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 52' ' ' PRO . . . . . . . . . . . . . 43.3 Cg_endo -76.95 -71.8 0.01 OUTLIER 'Trans proline' 0 C--N 1.311 -1.396 0 O-C-N 123.859 1.452 . . . . 0.0 110.565 179.562 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 53' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -139.96 150.77 63.47 Favored Pre-proline 0 N--CA 1.501 2.079 0 O-C-N 121.172 -0.955 . . . . 0.0 109.812 179.641 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 54' ' ' PRO . . . . . 0.465 ' O ' ' HB ' ' A' ' 38' ' ' THR . 45.3 Cg_endo -70.4 -48.17 0.63 Allowed 'Trans proline' 0 N--CA 1.491 1.368 0 O-C-N 123.837 1.44 . . . . 0.0 111.208 -179.483 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 55' ' ' GLU . . . . . 0.487 ' O ' ' HB2' ' A' ' 58' ' ' GLN . 11.3 mm-40 -66.63 -20.01 65.9 Favored 'General case' 0 N--CA 1.499 2.013 0 O-C-N 121.19 -0.944 . . . . 0.0 110.855 -179.983 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 7.6 tt0 -61.3 -25.41 67.1 Favored 'General case' 0 N--CA 1.499 1.976 0 O-C-N 121.149 -0.97 . . . . 0.0 110.321 178.981 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 57' ' ' LEU . . . . . 0.451 HD13 ' HG ' ' A' ' 41' ' ' LEU . 4.6 mt -85.78 -9.21 57.44 Favored 'General case' 0 N--CA 1.498 1.939 0 O-C-N 121.39 -0.819 . . . . 0.0 111.672 -179.875 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 58' ' ' GLN . . . . . 0.742 ' O ' HG22 ' A' ' 61' ' ' ILE . 1.7 mm100 -48.69 -53.86 17.1 Favored 'General case' 0 N--CA 1.505 2.302 0 O-C-N 121.136 -0.978 . . . . 0.0 111.38 -179.362 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 59' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -51.27 -33.91 30.55 Favored 'General case' 0 N--CA 1.502 2.153 0 O-C-N 121.299 -0.876 . . . . 0.0 110.881 179.868 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 60' ' ' MET . . . . . . . . . . . . . 1.5 ttp -75.31 -35.36 61.26 Favored 'General case' 0 N--CA 1.496 1.871 0 O-C-N 121.294 -0.879 . . . . 0.0 110.646 179.406 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 61' ' ' ILE . . . . . 0.742 HG22 ' O ' ' A' ' 58' ' ' GLN . 8.6 tt -65.22 -31.75 55.26 Favored 'Isoleucine or valine' 0 N--CA 1.501 2.083 0 O-C-N 121.021 -1.049 . . . . 0.0 110.276 179.62 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 62' ' ' ASP . . . . . . . . . . . . . 22.6 m-20 -76.99 -28.86 55.23 Favored 'General case' 0 N--CA 1.496 1.873 0 O-C-N 121.268 -0.895 . . . . 0.0 109.955 179.066 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 63' ' ' GLU . . . . . . . . . . . . . 6.6 mt-10 -59.11 -49.58 77.33 Favored 'General case' 0 N--CA 1.5 2.063 0 O-C-N 121.518 -0.739 . . . . 0.0 110.411 179.37 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 64' ' ' VAL . . . . . . . . . . . . . 14.6 p -84.33 -10.79 11.67 Favored 'Isoleucine or valine' 0 N--CA 1.497 1.9 0 O-C-N 121.661 -0.65 . . . . 0.0 111.122 -179.679 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 65' ' ' ASP . . . . . . . . . . . . . 24.9 t70 -69.13 133.72 48.39 Favored 'General case' 0 N--CA 1.497 1.887 0 O-C-N 120.945 -1.097 . . . . 0.0 110.032 179.553 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 66' ' ' GLU . . . . . . . . . . . . . 25.4 mt-10 -128.73 25.89 5.63 Favored 'General case' 0 N--CA 1.495 1.823 0 O-C-N 121.322 -0.861 . . . . 0.0 111.219 -179.493 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 67' ' ' ASP . . . . . . . . . . . . . 1.6 p-10 -124.97 -21.2 4.75 Favored 'General case' 0 N--CA 1.498 1.967 0 O-C-N 120.822 -1.174 . . . . 0.0 112.162 -179.878 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 68' ' ' GLY . . . . . . . . . . . . . . . 114.91 -37.13 3.62 Favored Glycine 0 N--CA 1.497 2.762 0 O-C-N 120.825 -1.172 . . . . 0.0 110.466 179.665 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 69' ' ' SER . . . . . . . . . . . . . 38.9 p -58.87 -32.0 69.08 Favored 'General case' 0 N--CA 1.502 2.162 0 O-C-N 121.361 -1.082 . . . . 0.0 110.996 -179.883 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 70' ' ' GLY . . . . . . . . . . . . . . . 93.27 -40.1 2.86 Favored Glycine 0 N--CA 1.499 2.845 0 N-CA-C 110.185 -1.166 . . . . 0.0 110.185 -179.824 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 71' ' ' THR . . . . . . . . . . . . . 14.0 m -64.34 144.69 56.97 Favored 'General case' 0 N--CA 1.501 2.113 0 O-C-N 121.262 -1.14 . . . . 0.0 110.273 -179.841 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 72' ' ' VAL . . . . . 0.666 HG23 ' CG1' ' A' ' 61' ' ' ILE . 2.1 t -77.62 119.36 26.16 Favored 'Isoleucine or valine' 0 N--CA 1.497 1.901 0 O-C-N 121.377 -0.827 . . . . 0.0 110.105 179.867 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 73' ' ' ASP . . . . . . . . . . . . . 45.6 m-20 -92.78 -173.31 3.28 Favored 'General case' 0 N--CA 1.496 1.831 0 O-C-N 121.616 -0.678 . . . . 0.0 109.887 179.839 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 74' ' ' PHE . . . . . . . . . . . . . 26.0 t80 -64.97 -48.45 73.99 Favored 'General case' 0 N--CA 1.495 1.821 0 O-C-N 121.195 -0.94 . . . . 0.0 110.052 179.602 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 75' ' ' ASP . . . . . 0.462 ' HA ' HD12 ' A' ' 78' ' ' LEU . 29.0 t70 -60.45 -49.82 76.02 Favored 'General case' 0 N--CA 1.498 1.927 0 O-C-N 121.579 -0.701 . . . . 0.0 109.97 179.323 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 76' ' ' GLU . . . . . . . . . . . . . 43.8 mt-10 -60.77 -41.6 95.82 Favored 'General case' 0 N--CA 1.498 1.973 0 O-C-N 121.592 -0.693 . . . . 0.0 109.8 179.135 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 77' ' ' PHE . . . . . 0.404 ' O ' ' HG2' ' A' ' 81' ' ' MET . 43.9 t80 -58.99 -45.57 90.31 Favored 'General case' 0 N--CA 1.498 1.945 0 O-C-N 121.575 -0.703 . . . . 0.0 109.528 178.888 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 78' ' ' LEU . . . . . 0.463 ' HB3' HG13 ' A' ' 9' ' ' VAL . 14.2 mt -56.92 -46.47 82.0 Favored 'General case' 0 N--CA 1.498 1.945 0 O-C-N 121.678 -0.639 . . . . 0.0 110.083 179.438 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 79' ' ' VAL . . . . . 0.807 ' HA ' HG21 ' A' ' 9' ' ' VAL . 86.3 t -61.7 -35.16 65.77 Favored 'Isoleucine or valine' 0 N--CA 1.501 2.119 0 O-C-N 121.463 -0.773 . . . . 0.0 109.835 179.453 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 80' ' ' MET . . . . . . . . . . . . . 12.4 ttp -70.66 -37.61 73.7 Favored 'General case' 0 N--CA 1.494 1.738 0 O-C-N 121.507 -0.745 . . . . 0.0 110.532 179.566 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 81' ' ' MET . . . . . 0.404 ' HG2' ' O ' ' A' ' 77' ' ' PHE . 68.4 mmm -62.77 -53.03 60.63 Favored 'General case' 0 N--CA 1.499 1.982 0 O-C-N 121.253 -0.904 . . . . 0.0 110.336 179.929 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 82' ' ' VAL . . . . . 0.426 HG11 HG23 ' A' ' 9' ' ' VAL . 13.4 p -63.26 -29.78 48.1 Favored 'Isoleucine or valine' 0 N--CA 1.501 2.113 0 O-C-N 121.302 -0.874 . . . . 0.0 110.132 179.333 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 83' ' ' ARG . . . . . 0.51 ' HG2' ' CG ' ' A' ' 5' ' ' TYR . 0.0 OUTLIER -62.24 -52.13 64.98 Favored 'General case' 0 N--CA 1.498 1.937 0 O-C-N 121.299 -0.876 . . . . 0.0 110.293 179.32 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' A' A ' 84' ' ' CYS . . . . . . . . . . . . . 0.1 OUTLIER -77.33 -22.79 51.33 Favored 'General case' 0 N--CA 1.498 1.956 0 O-C-N 121.495 -0.753 . . . . 0.0 110.88 179.928 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 85' ' ' MET . . . . . 0.43 ' HB2' ' HB2' ' B' ' 150' ' ' ALA . 22.9 ttp . . . . . 0 N--CA 1.496 1.861 0 O-C-N 121.35 -0.844 . . . . 0.0 110.138 179.665 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' B' B ' 149' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER . . . . . 0 N--CA 1.501 2.112 0 CA-C-O 121.322 0.582 . . . . 0.0 111.188 . . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' B' B ' 150' ' ' ALA . . . . . 0.43 ' HB2' ' HB2' ' A' ' 85' ' ' MET . . . -108.68 -59.73 1.84 Allowed 'General case' 0 N--CA 1.495 1.809 0 O-C-N 121.299 -0.876 . . . . 0.0 110.162 179.898 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' B' B ' 151' ' ' ASP . . . . . . . . . . . . . 6.4 p-10 -58.34 -30.9 67.08 Favored 'General case' 0 N--CA 1.5 2.059 0 O-C-N 121.491 -0.755 . . . . 0.0 110.805 179.59 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' B' B ' 152' ' ' ALA . . . . . . . . . . . . . . . -71.81 -47.5 52.84 Favored 'General case' 0 N--CA 1.496 1.845 0 O-C-N 121.343 -0.848 . . . . 0.0 110.169 179.708 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' B' B ' 153' ' ' MET . . . . . . . . . . . . . 7.1 mmt -68.31 -37.43 80.6 Favored 'General case' 0 N--CA 1.499 1.988 0 O-C-N 121.333 -0.854 . . . . 0.0 110.482 179.679 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' B' B ' 154' ' ' MET . . . . . . . . . . . . . 39.7 mtp -58.68 -45.02 90.33 Favored 'General case' 0 N--CA 1.499 2.009 0 O-C-N 121.401 -0.812 . . . . 0.0 110.513 179.836 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' B' B ' 155' ' ' GLN . . . . . . . . . . . . . 6.7 tp-100 -60.37 -42.22 95.34 Favored 'General case' 0 N--CA 1.5 2.068 0 O-C-N 121.422 -0.799 . . . . 0.0 110.503 179.895 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' B' B ' 156' ' ' ALA . . . . . . . . . . . . . . . -66.68 -39.3 88.06 Favored 'General case' 0 N--CA 1.499 1.997 0 O-C-N 121.428 -0.795 . . . . 0.0 110.34 179.608 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' B' B ' 157' ' ' LEU . . . . . 0.469 HD21 ' CD2' ' A' ' 27' ' ' PHE . 0.2 OUTLIER -67.86 -35.93 79.41 Favored 'General case' 0 N--CA 1.499 2.013 0 O-C-N 121.449 -0.782 . . . . 0.0 110.782 179.872 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' B' B ' 158' ' ' LEU . . . . . . . . . . . . . 12.0 mt . . . . . 0 N--CA 1.498 1.97 0 O-C-N 121.326 -0.859 . . . . 0.0 110.777 -179.862 . . . . . . . . 0 0 . 1 . 009 nuclear nobuild core ' A' A ' 4' ' ' ILE . . . . . . . . . . . . . 11.7 mt . . . . . 0 N--CA 1.5 2.035 0 CA-C-O 120.939 0.399 . . . . 0.0 110.147 . . . . . . . . . 0 0 . 1 . 009 nuclear nobuild core ' A' A ' 5' ' ' TYR . . . . . 0.415 ' HE1' ' HG3' ' A' ' 83' ' ' ARG . 13.0 m-85 -60.21 -36.4 77.58 Favored 'General case' 0 N--CA 1.499 2.007 0 O-C-N 121.248 -0.907 . . . . 0.0 110.668 179.778 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 6' ' ' LYS . . . . . 0.453 ' HB3' ' HE3' ' A' ' 6' ' ' LYS . 26.1 ttpp -79.77 -46.46 16.95 Favored 'General case' 0 N--CA 1.494 1.774 0 O-C-N 121.201 -0.937 . . . . 0.0 110.415 179.718 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 7' ' ' ALA . . . . . . . . . . . . . . . -56.55 -46.67 80.58 Favored 'General case' 0 N--CA 1.498 1.937 0 O-C-N 121.45 -0.781 . . . . 0.0 110.309 179.858 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 8' ' ' ALA . . . . . 0.482 ' O ' ' HG ' ' A' ' 12' ' ' LEU . . . -58.33 -44.27 88.59 Favored 'General case' 0 N--CA 1.498 1.959 0 O-C-N 121.286 -0.884 . . . . 0.0 109.532 179.1 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 9' ' ' VAL . . . . . . . . . . . . . 10.9 t -67.19 -40.91 86.12 Favored 'Isoleucine or valine' 0 N--CA 1.497 1.891 0 O-C-N 121.657 -0.652 . . . . 0.0 110.512 179.446 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 10' ' ' GLU . . . . . . . . . . . . . 55.2 mt-10 -67.85 -43.51 79.32 Favored 'General case' 0 N--CA 1.5 2.056 0 O-C-N 121.416 -0.802 . . . . 0.0 111.588 -179.348 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 11' ' ' GLN . . . . . . . . . . . . . 3.1 mp0 -86.24 -80.16 0.24 Allowed 'General case' 0 N--CA 1.496 1.844 0 O-C-N 121.308 -0.87 . . . . 0.0 111.091 -178.786 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 12' ' ' LEU . . . . . 0.482 ' HG ' ' O ' ' A' ' 8' ' ' ALA . 4.8 mt 57.33 -168.45 0.12 Allowed 'General case' 0 N--CA 1.504 2.271 0 O-C-N 121.476 -0.765 . . . . 0.0 109.981 -179.076 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 13' ' ' THR . . . . . 0.442 ' OG1' ' HB2' ' A' ' 16' ' ' GLN . 76.0 p -120.49 159.58 24.89 Favored 'General case' 0 N--CA 1.499 1.995 0 O-C-N 120.867 -1.146 . . . . 0.0 110.078 179.406 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 14' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -53.15 -43.08 66.71 Favored 'General case' 0 N--CA 1.493 1.703 0 C-N-CA 120.278 -0.569 . . . . 0.0 110.441 -179.632 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 1.2 mp0 -65.38 -59.23 4.24 Favored 'General case' 0 N--CA 1.496 1.83 0 O-C-N 121.56 -0.713 . . . . 0.0 110.31 -179.956 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 16' ' ' GLN . . . . . 0.476 ' HB3' HD22 ' A' ' 12' ' ' LEU . 0.9 OUTLIER -50.65 -52.73 36.95 Favored 'General case' 0 N--CA 1.501 2.098 0 O-C-N 121.352 -0.843 . . . . 0.0 111.257 -179.728 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' A' A ' 17' ' ' LYS . . . . . 0.438 ' O ' ' HB3' ' A' ' 21' ' ' LYS . 3.2 tttp -57.92 -41.25 82.3 Favored 'General case' 0 N--CA 1.501 2.09 0 O-C-N 121.827 -0.546 . . . . 0.0 110.7 179.847 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 18' ' ' ASN . . . . . . . . . . . . . 12.8 m-20 -70.95 -48.45 53.36 Favored 'General case' 0 N--CA 1.501 2.079 0 O-C-N 121.259 -0.9 . . . . 0.0 110.207 179.592 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 0.5 OUTLIER -59.12 -46.14 89.09 Favored 'General case' 0 N--CA 1.495 1.8 0 O-C-N 121.611 -0.68 . . . . 0.0 110.436 179.933 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 20' ' ' PHE . . . . . 0.499 ' CE1' ' HG2' ' A' ' 81' ' ' MET . 19.6 m-30 -64.54 -38.0 89.49 Favored 'General case' 0 N--CA 1.498 1.965 0 O-C-N 121.29 -0.881 . . . . 0.0 110.004 179.562 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 21' ' ' LYS . . . . . 0.516 ' HG3' ' N ' ' A' ' 22' ' ' ALA . 0.0 OUTLIER -62.9 -36.68 84.14 Favored 'General case' 0 N--CA 1.5 2.05 0 O-C-N 121.38 -0.825 . . . . 0.0 109.242 178.725 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' A' A ' 22' ' ' ALA . . . . . 0.516 ' N ' ' HG3' ' A' ' 21' ' ' LYS . . . -70.03 -49.39 51.77 Favored 'General case' 0 N--CA 1.494 1.736 0 O-C-N 121.47 -0.769 . . . . 0.0 109.382 178.841 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 23' ' ' ALA . . . . . 0.492 ' HA ' HD11 ' B' ' 157' ' ' LEU . . . -61.74 -41.59 97.86 Favored 'General case' 0 N--CA 1.496 1.835 0 O-C-N 121.685 -0.635 . . . . 0.0 109.848 179.087 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 24' ' ' PHE . . . . . 0.695 ' CE1' HD11 ' A' ' 36' ' ' ILE . 82.7 t80 -61.33 -45.65 93.53 Favored 'General case' 0 N--CA 1.498 1.941 0 O-C-N 121.69 -0.631 . . . . 0.0 110.257 179.582 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 25' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -53.73 -51.47 63.21 Favored 'General case' 0 N--CA 1.498 1.973 0 O-C-N 121.661 -0.649 . . . . 0.0 110.504 179.87 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 26' ' ' ILE . . . . . 0.724 HG21 ' HB2' ' B' ' 157' ' ' LEU . 2.8 mt -69.07 -31.63 51.03 Favored 'Isoleucine or valine' 0 N--CA 1.498 1.975 0 O-C-N 121.221 -0.924 . . . . 0.0 110.148 179.532 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 27' ' ' PHE . . . . . 0.531 ' CZ ' HG21 ' A' ' 44' ' ' VAL . 0.2 OUTLIER -67.15 -43.2 82.92 Favored 'General case' 0 N--CA 1.497 1.898 0 O-C-N 121.126 -0.984 . . . . 0.0 110.259 179.505 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' A' A ' 28' ' ' VAL . . . . . 0.439 HG11 ' CZ ' ' A' ' 24' ' ' PHE . 12.8 m -81.72 -16.69 11.99 Favored 'Isoleucine or valine' 0 N--CA 1.502 2.14 0 O-C-N 121.182 -0.948 . . . . 0.0 110.397 179.322 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 29' ' ' LEU . . . . . . . . . . . . . 1.5 tp -61.13 118.52 6.91 Favored 'General case' 0 N--CA 1.49 1.528 0 N-CA-C 108.354 -0.98 . . . . 0.0 108.354 178.979 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 30' ' ' GLY . . . . . . . . . . . . . . . 99.68 22.97 11.38 Favored Glycine 0 N--CA 1.496 2.683 0 N-CA-C 109.678 -1.369 . . . . 0.0 109.678 -178.206 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 31' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.496 1.857 0 O-C-N 121.349 -1.089 . . . . 0.0 109.516 179.596 . . . . . . . . 0 0 . 1 . 009 nuclear nobuild core ' A' A ' 35' ' ' CYS . . . . . . . . . . . . . 59.1 m . . . . . 0 N--CA 1.504 2.274 0 CA-C-O 120.546 0.212 . . . . 0.0 111.131 . . . . . . . . . 0 0 . 1 . 009 nuclear nobuild core ' A' A ' 36' ' ' ILE . . . . . 0.695 HD11 ' CE1' ' A' ' 24' ' ' PHE . 69.1 mt -129.31 92.52 1.82 Allowed 'Isoleucine or valine' 0 N--CA 1.495 1.804 0 O-C-N 120.99 -1.069 . . . . 0.0 109.987 179.478 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 37' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -95.08 -173.77 3.05 Favored 'General case' 0 N--CA 1.495 1.794 0 O-C-N 121.277 -0.889 . . . . 0.0 109.345 179.283 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 38' ' ' THR . . . . . 0.8 HG21 ' HG2' ' A' ' 58' ' ' GLN . 1.6 p -59.72 -33.52 71.73 Favored 'General case' 0 N--CA 1.499 2.001 0 O-C-N 121.062 -1.024 . . . . 0.0 109.792 179.376 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 39' ' ' LYS . . . . . . . . . . . . . 23.5 ttpp -62.69 -38.6 91.02 Favored 'General case' 0 N--CA 1.499 1.981 0 O-C-N 121.526 -0.734 . . . . 0.0 109.708 178.755 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 0.6 OUTLIER -66.7 -33.6 75.99 Favored 'General case' 0 N--CA 1.498 1.929 0 O-C-N 121.661 -0.65 . . . . 0.0 109.839 179.355 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 41' ' ' LEU . . . . . 0.691 ' C ' HD13 ' A' ' 41' ' ' LEU . 2.8 tm? -66.21 -63.73 1.01 Allowed 'General case' 0 N--CA 1.497 1.875 0 O-C-N 121.385 -0.822 . . . . 0.0 108.946 178.464 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 42' ' ' GLY . . . . . 0.596 ' N ' HD13 ' A' ' 41' ' ' LEU . . . -46.96 -28.03 3.73 Favored Glycine 0 N--CA 1.499 2.876 0 N-CA-C 111.08 -0.808 . . . . 0.0 111.08 179.911 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 43' ' ' LYS . . . . . 0.485 ' HA ' ' HD2' ' A' ' 46' ' ' ARG . 0.0 OUTLIER -49.96 -50.93 45.06 Favored 'General case' 0 N--CA 1.501 2.115 0 O-C-N 121.364 -1.08 . . . . 0.0 110.389 179.733 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' A' A ' 44' ' ' VAL . . . . . 0.649 HG23 ' SD ' ' A' ' 45' ' ' MET . 13.6 m -75.68 -35.89 32.39 Favored 'Isoleucine or valine' 0 N--CA 1.502 2.129 0 O-C-N 121.376 -0.828 . . . . 0.0 109.732 179.106 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 45' ' ' MET . . . . . 0.649 ' SD ' HG23 ' A' ' 44' ' ' VAL . 0.0 OUTLIER -57.27 -30.23 64.51 Favored 'General case' 0 N--CA 1.498 1.927 0 O-C-N 121.215 -0.928 . . . . 0.0 110.757 178.679 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' A' A ' 46' ' ' ARG . . . . . 0.485 ' HD2' ' HA ' ' A' ' 43' ' ' LYS . 43.5 mtt85 -58.46 -47.56 83.61 Favored 'General case' 0 N--CA 1.501 2.107 0 O-C-N 121.276 -0.89 . . . . 0.0 109.547 179.135 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 47' ' ' MET . . . . . . . . . . . . . 45.7 mtm -66.05 -30.42 70.94 Favored 'General case' 0 N--CA 1.499 2.014 0 O-C-N 121.59 -0.694 . . . . 0.0 109.687 178.866 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 48' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -71.63 -46.63 58.52 Favored 'General case' 0 N--CA 1.497 1.887 0 O-C-N 121.538 -0.726 . . . . 0.0 110.186 179.334 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 49' ' ' GLY . . . . . . . . . . . . . . . 117.05 -17.14 12.91 Favored Glycine 0 N--CA 1.497 2.765 0 C-N-CA 120.51 -0.852 . . . . 0.0 111.176 179.543 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 50' ' ' GLN . . . . . . . . . . . . . 2.3 mt-30 -109.83 104.38 13.32 Favored 'General case' 0 N--CA 1.499 2.016 0 O-C-N 120.886 -1.361 . . . . 0.0 111.122 -179.427 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 51' ' ' ASN . . . . . . . . . . . . . 31.7 t30 -154.92 101.58 2.32 Favored Pre-proline 0 N--CA 1.496 1.873 0 O-C-N 121.465 -0.772 . . . . 0.0 110.003 179.283 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 52' ' ' PRO . . . . . . . . . . . . . 50.5 Cg_endo -77.1 -91.46 0.0 OUTLIER 'Trans proline' 0 C--N 1.315 -1.207 0 O-C-N 123.787 1.414 . . . . 0.0 111.268 -179.411 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 53' ' ' THR . . . . . . . . . . . . . 3.1 p -130.91 163.67 47.31 Favored Pre-proline 0 N--CA 1.493 1.691 0 O-C-N 120.93 -1.106 . . . . 0.0 110.774 -179.228 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 54' ' ' PRO . . . . . . . . . . . . . 43.0 Cg_endo -72.48 -33.76 8.31 Favored 'Trans proline' 0 C--N 1.314 -1.28 0 O-C-N 123.955 1.503 . . . . 0.0 110.266 179.487 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 55' ' ' GLU . . . . . . . . . . . . . 3.5 mp0 -61.68 -30.46 70.76 Favored 'General case' 0 N--CA 1.497 1.886 0 O-C-N 121.564 -0.71 . . . . 0.0 110.653 179.751 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 3.0 tt0 -61.17 -39.52 90.45 Favored 'General case' 0 N--CA 1.498 1.941 0 O-C-N 121.384 -0.823 . . . . 0.0 110.639 179.559 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 57' ' ' LEU . . . . . 0.536 HD23 ' CE ' ' A' ' 60' ' ' MET . 1.1 mt -90.25 -9.68 47.1 Favored 'General case' 0 N--CA 1.497 1.911 0 O-C-N 121.249 -0.907 . . . . 0.0 111.379 -179.878 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 58' ' ' GLN . . . . . 0.848 ' O ' HG22 ' A' ' 61' ' ' ILE . 9.8 mm-40 -59.43 -47.06 86.91 Favored 'General case' 0 N--CA 1.501 2.107 0 O-C-N 120.999 -1.063 . . . . 0.0 110.056 179.665 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 59' ' ' GLU . . . . . . . . . . . . . 0.5 OUTLIER -63.95 -32.84 74.52 Favored 'General case' 0 N--CA 1.502 2.157 0 O-C-N 121.07 -1.019 . . . . 0.0 109.89 178.912 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 60' ' ' MET . . . . . 0.536 ' CE ' HD23 ' A' ' 57' ' ' LEU . 4.2 tmm? -65.92 -35.96 82.05 Favored 'General case' 0 N--CA 1.496 1.862 0 O-C-N 121.424 -0.798 . . . . 0.0 110.32 179.428 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 61' ' ' ILE . . . . . 0.848 HG22 ' O ' ' A' ' 58' ' ' GLN . 1.1 tt -63.26 -29.12 46.44 Favored 'Isoleucine or valine' 0 N--CA 1.499 1.992 0 O-C-N 121.326 -0.859 . . . . 0.0 110.708 179.645 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 62' ' ' ASP . . . . . . . . . . . . . 3.7 m-20 -62.21 -45.25 94.18 Favored 'General case' 0 N--CA 1.498 1.933 0 O-C-N 121.185 -0.947 . . . . 0.0 110.145 179.644 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 63' ' ' GLU . . . . . . . . . . . . . 4.0 tm-20 -69.51 -42.61 74.48 Favored 'General case' 0 N--CA 1.498 1.956 0 O-C-N 121.537 -0.727 . . . . 0.0 110.247 179.431 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 64' ' ' VAL . . . . . . . . . . . . . 77.0 t -72.19 -23.96 22.02 Favored 'Isoleucine or valine' 0 N--CA 1.498 1.952 0 O-C-N 121.383 -0.823 . . . . 0.0 110.901 -179.947 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 65' ' ' ASP . . . . . 0.464 ' O ' ' HG2' ' A' ' 66' ' ' GLU . 17.1 t70 -86.93 -68.17 0.77 Allowed 'General case' 0 N--CA 1.497 1.882 0 O-C-N 121.079 -1.013 . . . . 0.0 110.298 -179.878 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 66' ' ' GLU . . . . . 0.464 ' HG2' ' O ' ' A' ' 65' ' ' ASP . 0.4 OUTLIER 44.02 28.76 0.28 Allowed 'General case' 0 N--CA 1.507 2.414 0 N-CA-C 112.615 0.598 . . . . 0.0 112.615 179.903 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' A' A ' 67' ' ' ASP . . . . . . . . . . . . . 0.0 OUTLIER -110.57 -23.53 11.06 Favored 'General case' 0 N--CA 1.498 1.932 0 O-C-N 120.723 -1.236 . . . . 0.0 111.236 179.623 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 68' ' ' GLY . . . . . . . . . . . . . . . 131.22 -50.19 0.9 Allowed Glycine 0 N--CA 1.495 2.59 0 N-CA-C 110.255 -1.138 . . . . 0.0 110.255 -179.981 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 69' ' ' SER . . . . . . . . . . . . . 5.4 p -66.84 -37.2 84.02 Favored 'General case' 0 N--CA 1.499 1.979 0 O-C-N 121.392 -1.063 . . . . 0.0 111.192 -179.491 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 70' ' ' GLY . . . . . . . . . . . . . . . 99.42 -43.73 1.78 Allowed Glycine 0 N--CA 1.496 2.691 0 N-CA-C 110.365 -1.094 . . . . 0.0 110.365 179.781 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 71' ' ' THR . . . . . . . . . . . . . 0.6 OUTLIER -71.82 139.3 48.88 Favored 'General case' 0 N--CA 1.503 2.205 0 O-C-N 121.197 -1.178 . . . . 0.0 110.443 -179.63 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 72' ' ' VAL . . . . . 0.824 HG23 HG13 ' A' ' 61' ' ' ILE . 6.6 t -75.88 131.34 35.11 Favored 'Isoleucine or valine' 0 N--CA 1.498 1.964 0 O-C-N 121.543 -0.723 . . . . 0.0 110.395 179.844 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 73' ' ' ASP . . . . . . . . . . . . . 29.5 m-20 -117.29 -164.11 0.97 Allowed 'General case' 0 N--CA 1.5 2.03 0 O-C-N 121.373 -0.83 . . . . 0.0 110.55 -179.935 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 74' ' ' PHE . . . . . 0.459 ' HA ' ' CE1' ' A' ' 24' ' ' PHE . 87.9 t80 -66.2 -45.83 79.41 Favored 'General case' 0 N--CA 1.502 2.156 0 O-C-N 121.38 -0.825 . . . . 0.0 110.305 179.849 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 75' ' ' ASP . . . . . . . . . . . . . 1.1 m-20 -58.56 -47.8 83.01 Favored 'General case' 0 N--CA 1.497 1.887 0 O-C-N 121.58 -0.7 . . . . 0.0 109.886 179.441 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 76' ' ' GLU . . . . . . . . . . . . . 2.1 mt-10 -67.65 -33.96 76.0 Favored 'General case' 0 N--CA 1.496 1.844 0 O-C-N 121.501 -0.749 . . . . 0.0 109.821 179.044 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 77' ' ' PHE . . . . . . . . . . . . . 47.9 t80 -56.82 -40.27 75.71 Favored 'General case' 0 N--CA 1.5 2.071 0 O-C-N 121.409 -0.807 . . . . 0.0 108.915 178.324 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 78' ' ' LEU . . . . . . . . . . . . . 66.6 mt -69.36 -42.88 74.65 Favored 'General case' 0 N--CA 1.495 1.779 0 N-CA-C 109.041 -0.725 . . . . 0.0 109.041 178.21 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 79' ' ' VAL . . . . . 0.539 HG12 ' HD2' ' A' ' 83' ' ' ARG . 71.9 t -63.71 -34.97 71.18 Favored 'Isoleucine or valine' 0 N--CA 1.501 2.085 0 O-C-N 121.588 -0.695 . . . . 0.0 109.924 178.984 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 80' ' ' MET . . . . . . . . . . . . . 0.5 OUTLIER -69.07 -43.07 75.33 Favored 'General case' 0 N--CA 1.495 1.807 0 O-C-N 121.344 -0.848 . . . . 0.0 109.685 179.223 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 81' ' ' MET . . . . . 0.499 ' HG2' ' CE1' ' A' ' 20' ' ' PHE . 12.9 tpp -65.09 -49.39 70.17 Favored 'General case' 0 N--CA 1.497 1.919 0 O-C-N 121.556 -0.715 . . . . 0.0 109.949 179.556 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 82' ' ' VAL . . . . . 0.44 HG12 ' O ' ' A' ' 79' ' ' VAL . 7.2 p -61.57 -27.95 43.08 Favored 'Isoleucine or valine' 0 N--CA 1.501 2.115 0 O-C-N 121.256 -0.902 . . . . 0.0 109.492 178.549 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 83' ' ' ARG . . . . . 0.539 ' HD2' HG12 ' A' ' 79' ' ' VAL . 1.6 mtt180 -71.65 -39.63 70.2 Favored 'General case' 0 N--CA 1.499 1.989 0 O-C-N 121.427 -0.796 . . . . 0.0 109.54 178.466 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 84' ' ' CYS . . . . . . . . . . . . . 0.0 OUTLIER -69.08 -50.69 46.06 Favored 'General case' 0 N--CA 1.5 2.053 0 O-C-N 121.499 -0.751 . . . . 0.0 110.47 179.872 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 85' ' ' MET . . . . . . . . . . . . . 2.5 ptt? . . . . . 0 N--CA 1.499 2.025 0 O-C-N 121.259 -0.901 . . . . 0.0 111.202 179.85 . . . . . . . . 0 0 . 1 . 009 nuclear nobuild core ' B' B ' 149' ' ' SER . . . . . 0.519 ' HB3' ' HB3' ' B' ' 152' ' ' ALA . 0.1 OUTLIER . . . . . 0 N--CA 1.496 1.867 0 CA-C-O 121.112 0.482 . . . . 0.0 109.994 . . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' B' B ' 150' ' ' ALA . . . . . . . . . . . . . . . -58.58 -41.01 84.76 Favored 'General case' 0 N--CA 1.499 1.977 0 O-C-N 121.603 -0.686 . . . . 0.0 110.749 -179.644 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' B' B ' 151' ' ' ASP . . . . . . . . . . . . . 7.2 p-10 -64.3 -38.1 89.84 Favored 'General case' 0 N--CA 1.5 2.03 0 O-C-N 121.46 -0.775 . . . . 0.0 110.599 179.574 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' B' B ' 152' ' ' ALA . . . . . 0.519 ' HB3' ' HB3' ' B' ' 149' ' ' SER . . . -78.06 -46.78 19.93 Favored 'General case' 0 N--CA 1.496 1.852 0 O-C-N 121.368 -0.833 . . . . 0.0 110.295 179.742 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' B' B ' 153' ' ' MET . . . . . . . . . . . . . 8.5 tpp -56.69 -43.7 80.75 Favored 'General case' 0 N--CA 1.499 1.992 0 O-C-N 121.494 -0.754 . . . . 0.0 110.332 179.728 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' B' B ' 154' ' ' MET . . . . . 0.526 ' O ' ' HB2' ' B' ' 158' ' ' LEU . 9.0 mmm -58.01 -52.75 64.21 Favored 'General case' 0 N--CA 1.498 1.946 0 O-C-N 121.442 -0.786 . . . . 0.0 110.448 179.88 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' B' B ' 155' ' ' GLN . . . . . . . . . . . . . 0.9 OUTLIER -62.44 -32.64 73.53 Favored 'General case' 0 N--CA 1.499 1.993 0 O-C-N 121.434 -0.791 . . . . 0.0 111.001 -179.959 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' B' B ' 156' ' ' ALA . . . . . . . . . . . . . . . -55.52 -34.92 65.08 Favored 'General case' 0 N--CA 1.501 2.094 0 O-C-N 121.38 -0.825 . . . . 0.0 111.095 179.954 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' B' B ' 157' ' ' LEU . . . . . 0.724 ' HB2' HG21 ' A' ' 26' ' ' ILE . 1.6 pp -112.43 8.22 19.37 Favored 'General case' 0 N--CA 1.5 2.054 0 O-C-N 121.17 -0.956 . . . . 0.0 111.796 -179.709 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' B' B ' 158' ' ' LEU . . . . . 0.526 ' HB2' ' O ' ' B' ' 154' ' ' MET . 0.0 OUTLIER . . . . . 0 N--CA 1.498 1.968 0 O-C-N 120.922 -1.111 . . . . 0.0 110.682 179.682 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 4' ' ' ILE . . . . . 0.417 HG22 ' HD1' ' A' ' 5' ' ' TYR . 23.6 mm . . . . . 0 N--CA 1.497 1.882 0 N-CA-C 109.661 -0.496 . . . . 0.0 109.661 . . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 5' ' ' TYR . . . . . 0.417 ' HD1' HG22 ' A' ' 4' ' ' ILE . 1.2 m-85 -96.14 -36.85 10.82 Favored 'General case' 0 N--CA 1.494 1.773 0 O-C-N 121.473 -0.767 . . . . 0.0 109.471 179.124 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 2.0 tmmt? -63.22 -28.36 69.98 Favored 'General case' 0 N--CA 1.497 1.893 0 O-C-N 121.433 -0.792 . . . . 0.0 109.819 178.664 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 7' ' ' ALA . . . . . . . . . . . . . . . -53.58 -44.83 69.66 Favored 'General case' 0 N--CA 1.497 1.923 0 O-C-N 121.609 -0.682 . . . . 0.0 109.287 178.948 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 8' ' ' ALA . . . . . . . . . . . . . . . -67.29 -43.65 81.23 Favored 'General case' 0 N--CA 1.495 1.802 0 O-C-N 121.533 -0.729 . . . . 0.0 109.256 178.331 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 9' ' ' VAL . . . . . 0.533 HG13 ' CB ' ' A' ' 78' ' ' LEU . 53.0 t -56.62 -40.42 69.07 Favored 'Isoleucine or valine' 0 N--CA 1.5 2.075 0 O-C-N 121.8 -0.563 . . . . 0.0 110.404 179.585 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 10' ' ' GLU . . . . . . . . . . . . . 0.7 OUTLIER -63.77 -44.41 93.47 Favored 'General case' 0 N--CA 1.496 1.853 0 O-C-N 121.437 -0.789 . . . . 0.0 111.333 -179.604 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 11' ' ' GLN . . . . . . . . . . . . . 4.3 mt-30 -139.69 82.84 1.9 Allowed 'General case' 0 N--CA 1.496 1.839 0 O-C-N 121.138 -0.976 . . . . 0.0 111.184 -179.704 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 12' ' ' LEU . . . . . . . . . . . . . 36.1 mt -70.79 -74.23 0.15 Allowed 'General case' 0 N--CA 1.498 1.956 0 O-C-N 121.197 -0.94 . . . . 0.0 108.792 178.703 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 13' ' ' THR . . . . . 0.507 ' HB ' ' HB2' ' A' ' 16' ' ' GLN . 2.1 m -157.21 156.55 32.75 Favored 'General case' 0 N--CA 1.494 1.731 0 N-CA-C 108.657 -0.868 . . . . 0.0 108.657 178.55 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 14' ' ' GLU . . . . . . . . . . . . . 2.7 tp10 -53.97 -33.06 55.92 Favored 'General case' 0 N--CA 1.494 1.741 0 O-C-N 121.531 -0.73 . . . . 0.0 110.825 -179.394 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 1.7 mp0 -90.72 -44.37 9.52 Favored 'General case' 0 N--CA 1.495 1.78 0 O-C-N 121.316 -0.865 . . . . 0.0 110.649 179.973 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 16' ' ' GLN . . . . . 0.507 ' HB2' ' HB ' ' A' ' 13' ' ' THR . 0.8 OUTLIER -48.24 -59.89 3.07 Favored 'General case' 0 N--CA 1.503 2.194 0 O-C-N 121.503 -0.748 . . . . 0.0 111.123 -179.408 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' A' A ' 17' ' ' LYS . . . . . . . . . . . . . 1.0 OUTLIER -56.91 -39.73 74.99 Favored 'General case' 0 N--CA 1.498 1.962 0 O-C-N 121.891 -0.506 . . . . 0.0 110.375 179.898 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 18' ' ' ASN . . . . . . . . . . . . . 2.1 t-20 -66.56 -39.63 88.6 Favored 'General case' 0 N--CA 1.499 2.022 0 O-C-N 121.302 -0.874 . . . . 0.0 110.129 179.26 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 17.0 mt-10 -62.23 -40.41 96.04 Favored 'General case' 0 N--CA 1.497 1.916 0 O-C-N 121.327 -0.858 . . . . 0.0 109.673 179.078 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 20' ' ' PHE . . . . . . . . . . . . . 33.9 m-85 -66.35 -31.53 72.37 Favored 'General case' 0 N--CA 1.498 1.936 0 O-C-N 121.482 -0.761 . . . . 0.0 109.559 178.728 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 21' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -60.22 -43.69 95.79 Favored 'General case' 0 N--CA 1.497 1.92 0 O-C-N 121.438 -0.789 . . . . 0.0 109.05 178.836 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 22' ' ' ALA . . . . . . . . . . . . . . . -72.18 -39.91 68.31 Favored 'General case' 0 N--CA 1.495 1.804 0 O-C-N 121.637 -0.664 . . . . 0.0 109.394 178.681 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 23' ' ' ALA . . . . . 0.839 ' HB1' HD23 ' B' ' 157' ' ' LEU . . . -65.7 -28.67 69.24 Favored 'General case' 0 N--CA 1.498 1.971 0 O-C-N 121.345 -0.847 . . . . 0.0 109.778 178.821 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 24' ' ' PHE . . . . . 0.651 ' O ' HG22 ' A' ' 28' ' ' VAL . 23.7 t80 -69.53 -34.03 73.65 Favored 'General case' 0 N--CA 1.495 1.787 0 O-C-N 121.581 -0.7 . . . . 0.0 110.188 179.514 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 25' ' ' ASP . . . . . . . . . . . . . 21.5 m-20 -52.26 -53.11 47.99 Favored 'General case' 0 N--CA 1.501 2.12 0 O-C-N 121.367 -0.833 . . . . 0.0 111.024 179.875 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 26' ' ' ILE . . . . . 0.527 ' HA ' HD23 ' A' ' 29' ' ' LEU . 1.1 pt -75.01 -20.46 16.48 Favored 'Isoleucine or valine' 0 N--CA 1.503 2.179 0 O-C-N 121.256 -0.902 . . . . 0.0 111.077 -179.866 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 27' ' ' PHE . . . . . 0.639 ' CZ ' HG21 ' A' ' 44' ' ' VAL . 0.1 OUTLIER -75.83 -17.5 59.81 Favored 'General case' 0 N--CA 1.496 1.848 0 O-C-N 120.933 -1.104 . . . . 0.0 110.196 179.169 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' A' A ' 28' ' ' VAL . . . . . 0.651 HG22 ' O ' ' A' ' 24' ' ' PHE . 20.6 m -129.25 26.27 1.92 Allowed 'Isoleucine or valine' 0 N--CA 1.499 1.997 0 O-C-N 121.305 -0.872 . . . . 0.0 110.74 179.93 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 29' ' ' LEU . . . . . 0.527 HD23 ' HA ' ' A' ' 26' ' ' ILE . 3.5 pp -74.29 -27.32 60.67 Favored 'General case' 0 N--CA 1.501 2.094 0 O-C-N 120.996 -1.065 . . . . 0.0 111.068 -179.854 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 30' ' ' GLY . . . . . . . . . . . . . . . -105.72 42.27 1.95 Allowed Glycine 0 N--CA 1.495 2.607 0 N-CA-C 109.784 -1.326 . . . . 0.0 109.784 179.866 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 31' ' ' ALA . . . . . 0.47 ' HB2' ' HG3' ' A' ' 40' ' ' GLU . . . . . . . . 0 N--CA 1.494 1.756 0 O-C-N 121.395 -1.062 . . . . 0.0 110.426 -179.847 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 35' ' ' CYS . . . . . . . . . . . . . 64.2 m . . . . . 0 N--CA 1.495 1.818 0 CA-C-O 121.135 0.493 . . . . 0.0 110.116 . . . . . . . . . 0 0 . 1 . 010 nuclear nobuild core ' A' A ' 36' ' ' ILE . . . . . . . . . . . . . 78.7 mt -81.34 105.07 10.81 Favored 'Isoleucine or valine' 0 N--CA 1.498 1.946 0 O-C-N 121.142 -0.974 . . . . 0.0 110.21 -179.907 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 37' ' ' SER . . . . . . . . . . . . . 89.2 p -96.14 -177.24 3.92 Favored 'General case' 0 N--CA 1.495 1.809 0 O-C-N 121.502 -0.749 . . . . 0.0 110.237 179.773 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 38' ' ' THR . . . . . 0.448 ' HB ' ' O ' ' A' ' 54' ' ' PRO . 1.8 p -59.38 -43.94 92.83 Favored 'General case' 0 N--CA 1.502 2.129 0 O-C-N 121.438 -0.789 . . . . 0.0 110.459 179.789 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 39' ' ' LYS . . . . . 0.558 ' HA ' ' HB3' ' A' ' 54' ' ' PRO . 0.0 OUTLIER -62.98 -45.52 92.02 Favored 'General case' 0 N--CA 1.496 1.85 0 O-C-N 121.57 -0.706 . . . . 0.0 110.092 179.527 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' A' A ' 40' ' ' GLU . . . . . 0.47 ' HG3' ' HB2' ' A' ' 31' ' ' ALA . 19.0 mm-40 -69.42 -29.03 66.66 Favored 'General case' 0 N--CA 1.498 1.947 0 O-C-N 121.414 -0.804 . . . . 0.0 110.39 179.647 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 41' ' ' LEU . . . . . 0.572 ' O ' HG22 ' A' ' 44' ' ' VAL . 0.1 OUTLIER -73.32 -61.29 1.88 Allowed 'General case' 0 N--CA 1.497 1.904 0 O-C-N 121.253 -0.904 . . . . 0.0 108.833 178.603 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' A' A ' 42' ' ' GLY . . . . . 0.552 ' HA2' ' HB2' ' A' ' 45' ' ' MET . . . -49.53 -30.96 13.75 Favored Glycine 0 N--CA 1.499 2.856 0 N-CA-C 109.933 -1.267 . . . . 0.0 109.933 179.112 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 43' ' ' LYS . . . . . 0.45 ' HB3' ' O ' ' A' ' 40' ' ' GLU . 0.9 OUTLIER -48.98 -48.87 42.9 Favored 'General case' 0 N--CA 1.502 2.145 0 O-C-N 121.623 -0.928 . . . . 0.0 110.653 179.344 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' A' A ' 44' ' ' VAL . . . . . 0.639 HG21 ' CZ ' ' A' ' 27' ' ' PHE . 28.5 m -82.87 -23.86 8.54 Favored 'Isoleucine or valine' 0 N--CA 1.501 2.092 0 O-C-N 121.373 -0.83 . . . . 0.0 110.461 179.563 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 45' ' ' MET . . . . . 0.552 ' HB2' ' HA2' ' A' ' 42' ' ' GLY . 0.0 OUTLIER -65.43 -38.27 89.4 Favored 'General case' 0 N--CA 1.499 1.997 0 O-C-N 121.337 -0.852 . . . . 0.0 110.321 179.404 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' A' A ' 46' ' ' ARG . . . . . 0.456 ' CB ' ' HB3' ' A' ' 51' ' ' ASN . 13.2 ttt180 -62.19 -51.58 67.23 Favored 'General case' 0 N--CA 1.5 2.039 0 O-C-N 121.626 -0.671 . . . . 0.0 110.962 -179.746 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 47' ' ' MET . . . . . 0.413 ' CE ' ' HB1' ' B' ' 156' ' ' ALA . 4.9 ptm -67.25 -28.23 67.88 Favored 'General case' 0 N--CA 1.498 1.971 0 O-C-N 121.296 -0.877 . . . . 0.0 111.186 -179.661 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 48' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -79.83 -46.01 17.69 Favored 'General case' 0 N--CA 1.497 1.879 0 O-C-N 121.051 -1.031 . . . . 0.0 110.708 179.932 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 49' ' ' GLY . . . . . . . . . . . . . . . -147.21 -77.83 0.02 OUTLIER Glycine 0 N--CA 1.496 2.679 0 N-CA-C 110.107 -1.197 . . . . 0.0 110.107 -179.875 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 50' ' ' GLN . . . . . . . . . . . . . 2.4 pp0? -147.98 160.72 42.53 Favored 'General case' 0 N--CA 1.498 1.946 0 O-C-N 121.306 -1.114 . . . . 0.0 111.083 -179.822 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 51' ' ' ASN . . . . . 0.456 ' HB3' ' CB ' ' A' ' 46' ' ' ARG . 24.7 t30 -175.0 93.44 0.29 Allowed Pre-proline 0 N--CA 1.494 1.764 0 O-C-N 121.779 -0.576 . . . . 0.0 109.641 179.467 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 52' ' ' PRO . . . . . . . . . . . . . 42.1 Cg_endo -73.17 -65.95 0.03 OUTLIER 'Trans proline' 0 C--N 1.312 -1.387 0 O-C-N 123.658 1.346 . . . . 0.0 110.187 -179.943 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 53' ' ' THR . . . . . . . . . . . . . 1.8 p -129.94 155.76 80.1 Favored Pre-proline 0 N--CA 1.489 1.512 0 O-C-N 121.4 -0.813 . . . . 0.0 109.579 179.29 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 54' ' ' PRO . . . . . 0.565 ' HA ' HD23 ' A' ' 57' ' ' LEU . 40.4 Cg_endo -66.29 -28.3 47.43 Favored 'Trans proline' 0 C--N 1.31 -1.475 0 O-C-N 123.742 1.39 . . . . 0.0 111.071 -179.982 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 55' ' ' GLU . . . . . . . . . . . . . 1.1 mp0 -60.03 -34.85 73.94 Favored 'General case' 0 N--CA 1.501 2.117 0 O-C-N 121.218 -0.926 . . . . 0.0 110.684 179.559 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 27.1 tt0 -62.52 -21.75 65.77 Favored 'General case' 0 N--CA 1.5 2.059 0 O-C-N 121.404 -0.81 . . . . 0.0 111.529 -179.886 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 57' ' ' LEU . . . . . 0.646 HD22 ' N ' ' A' ' 57' ' ' LEU . 3.4 mm? -79.44 -12.51 59.89 Favored 'General case' 0 N--CA 1.499 2.018 0 O-C-N 121.022 -1.049 . . . . 0.0 111.115 -179.916 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 58' ' ' GLN . . . . . 0.681 ' HA ' HG22 ' A' ' 61' ' ' ILE . 5.0 pt20 -52.65 -35.36 54.75 Favored 'General case' 0 N--CA 1.5 2.041 0 O-C-N 121.072 -1.018 . . . . 0.0 110.445 -179.712 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 59' ' ' GLU . . . . . . . . . . . . . 6.8 mm-40 -56.22 -34.4 66.27 Favored 'General case' 0 N--CA 1.5 2.038 0 O-C-N 121.02 -1.05 . . . . 0.0 109.891 178.834 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 60' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -82.22 -33.17 29.44 Favored 'General case' 0 N--CA 1.495 1.813 0 O-C-N 121.68 -0.637 . . . . 0.0 110.625 179.522 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 61' ' ' ILE . . . . . 0.907 HG13 HG23 ' A' ' 72' ' ' VAL . 3.4 tt -81.4 -31.69 11.57 Favored 'Isoleucine or valine' 0 N--CA 1.498 1.955 0 O-C-N 121.17 -0.956 . . . . 0.0 111.044 -179.505 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 62' ' ' ASP . . . . . . . . . . . . . 6.7 m-20 -69.44 -44.85 70.45 Favored 'General case' 0 N--CA 1.496 1.849 0 O-C-N 121.125 -0.984 . . . . 0.0 111.032 -179.679 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 63' ' ' GLU . . . . . 0.739 ' HG3' HG23 ' A' ' 64' ' ' VAL . 0.6 OUTLIER -62.47 -23.49 66.94 Favored 'General case' 0 N--CA 1.501 2.076 0 O-C-N 121.333 -0.854 . . . . 0.0 111.714 -179.43 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' A' A ' 64' ' ' VAL . . . . . 0.739 HG23 ' HG3' ' A' ' 63' ' ' GLU . 44.2 t -107.85 -24.9 3.83 Favored 'Isoleucine or valine' 0 N--CA 1.501 2.096 0 O-C-N 121.014 -1.054 . . . . 0.0 111.648 -179.235 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 65' ' ' ASP . . . . . . . . . . . . . 22.4 t70 -75.91 -91.39 0.03 OUTLIER 'General case' 0 N--CA 1.5 2.028 0 O-C-N 120.949 -1.094 . . . . 0.0 110.456 -179.627 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 66' ' ' GLU . . . . . . . . . . . . . 3.6 mm-40 49.28 33.37 5.14 Favored 'General case' 0 N--CA 1.502 2.174 0 O-C-N 121.333 -0.854 . . . . 0.0 111.544 179.958 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 67' ' ' ASP . . . . . . . . . . . . . 1.9 p-10 -115.24 -22.7 9.3 Favored 'General case' 0 N--CA 1.499 2.018 0 O-C-N 120.968 -1.082 . . . . 0.0 111.475 -179.932 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 68' ' ' GLY . . . . . . . . . . . . . . . 127.68 -30.78 3.91 Favored Glycine 0 N--CA 1.495 2.592 0 N-CA-C 110.074 -1.21 . . . . 0.0 110.074 -179.849 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 69' ' ' SER . . . . . . . . . . . . . 0.9 OUTLIER -78.24 -35.36 48.38 Favored 'General case' 0 N--CA 1.497 1.916 0 O-C-N 121.289 -1.124 . . . . 0.0 111.033 -179.786 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 70' ' ' GLY . . . . . . . . . . . . . . . 91.26 -50.49 3.04 Favored Glycine 0 N--CA 1.499 2.883 0 N-CA-C 110.197 -1.161 . . . . 0.0 110.197 179.89 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 71' ' ' THR . . . . . . . . . . . . . 54.9 m -79.13 154.58 29.23 Favored 'General case' 0 N--CA 1.502 2.13 0 O-C-N 121.298 -1.119 . . . . 0.0 110.977 -179.417 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 72' ' ' VAL . . . . . 0.907 HG23 HG13 ' A' ' 61' ' ' ILE . 2.4 t -81.57 128.82 38.39 Favored 'Isoleucine or valine' 0 N--CA 1.498 1.974 0 O-C-N 121.727 -0.608 . . . . 0.0 110.453 179.728 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 73' ' ' ASP . . . . . . . . . . . . . 1.4 p30 -102.44 -161.07 0.82 Allowed 'General case' 0 N--CA 1.498 1.927 0 O-C-N 121.574 -0.704 . . . . 0.0 109.881 179.263 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 74' ' ' PHE . . . . . . . . . . . . . 45.5 t80 -67.99 -53.06 28.84 Favored 'General case' 0 N--CA 1.499 1.983 0 O-C-N 121.129 -0.982 . . . . 0.0 110.69 -179.577 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 75' ' ' ASP . . . . . . . . . . . . . 1.0 OUTLIER -59.5 -43.01 93.44 Favored 'General case' 0 N--CA 1.498 1.927 0 O-C-N 121.498 -0.751 . . . . 0.0 110.473 179.91 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 76' ' ' GLU . . . . . 0.455 ' HG2' HG12 ' A' ' 64' ' ' VAL . 1.5 mt-10 -65.13 -42.2 94.08 Favored 'General case' 0 N--CA 1.497 1.917 0 O-C-N 121.498 -0.751 . . . . 0.0 109.961 179.335 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 77' ' ' PHE . . . . . . . . . . . . . 25.4 t80 -59.26 -37.34 77.38 Favored 'General case' 0 N--CA 1.497 1.886 0 O-C-N 121.483 -0.761 . . . . 0.0 109.658 179.155 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 78' ' ' LEU . . . . . 0.533 ' CB ' HG13 ' A' ' 9' ' ' VAL . 41.4 mt -66.36 -34.18 77.39 Favored 'General case' 0 N--CA 1.497 1.893 0 O-C-N 121.411 -0.806 . . . . 0.0 109.914 178.987 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 79' ' ' VAL . . . . . 0.509 HG23 HG11 ' A' ' 9' ' ' VAL . 55.3 t -64.25 -42.93 96.96 Favored 'Isoleucine or valine' 0 N--CA 1.498 1.955 0 O-C-N 121.359 -0.838 . . . . 0.0 109.699 179.056 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 80' ' ' MET . . . . . 0.522 ' HG3' HG21 ' A' ' 64' ' ' VAL . 0.0 OUTLIER -60.48 -34.14 73.62 Favored 'General case' 0 N--CA 1.498 1.937 0 O-C-N 121.4 -0.813 . . . . 0.0 110.034 179.318 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' A' A ' 81' ' ' MET . . . . . . . . . . . . . 8.9 mmt -62.92 -53.44 53.98 Favored 'General case' 0 N--CA 1.498 1.955 0 O-C-N 121.459 -0.776 . . . . 0.0 110.34 179.732 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 82' ' ' VAL . . . . . . . . . . . . . 0.6 OUTLIER -66.7 -24.55 33.01 Favored 'Isoleucine or valine' 0 N--CA 1.503 2.189 0 O-C-N 121.165 -0.959 . . . . 0.0 110.035 179.236 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 83' ' ' ARG . . . . . . . . . . . . . 0.6 OUTLIER -78.38 -35.18 47.64 Favored 'General case' 0 N--CA 1.497 1.921 0 O-C-N 121.248 -0.907 . . . . 0.0 109.613 178.829 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 84' ' ' CYS . . . . . . . . . . . . . 1.0 OUTLIER -70.03 -28.91 65.87 Favored 'General case' 0 N--CA 1.498 1.942 0 O-C-N 121.504 -0.747 . . . . 0.0 110.645 179.531 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 85' ' ' MET . . . . . . . . . . . . . 34.0 mtt . . . . . 0 N--CA 1.502 2.158 0 O-C-N 121.68 -0.637 . . . . 0.0 110.759 179.867 . . . . . . . . 0 0 . 1 . 010 nuclear nobuild core ' B' B ' 149' ' ' SER . . . . . . . . . . . . . 6.5 t . . . . . 0 N--CA 1.498 1.97 0 CA-C-O 121.132 0.491 . . . . 0.0 110.728 . . . . . . . . . 0 0 . 1 . 010 nuclear nobuild core ' B' B ' 150' ' ' ALA . . . . . . . . . . . . . . . -56.35 -43.15 78.82 Favored 'General case' 0 N--CA 1.498 1.944 0 O-C-N 121.494 -0.754 . . . . 0.0 110.543 179.767 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' B' B ' 151' ' ' ASP . . . . . . . . . . . . . 4.8 m-20 -71.11 -48.11 54.15 Favored 'General case' 0 N--CA 1.498 1.95 0 O-C-N 121.406 -0.809 . . . . 0.0 110.28 179.786 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' B' B ' 152' ' ' ALA . . . . . . . . . . . . . . . -60.53 -48.3 82.38 Favored 'General case' 0 N--CA 1.498 1.949 0 O-C-N 121.544 -0.723 . . . . 0.0 110.648 179.88 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' B' B ' 153' ' ' MET . . . . . . . . . . . . . 0.5 OUTLIER -63.25 -37.72 88.35 Favored 'General case' 0 N--CA 1.499 1.985 0 O-C-N 121.364 -0.835 . . . . 0.0 110.195 179.693 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' B' B ' 154' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -65.47 -42.76 91.89 Favored 'General case' 0 N--CA 1.497 1.922 0 O-C-N 121.285 -0.884 . . . . 0.0 110.144 179.461 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' B' B ' 155' ' ' GLN . . . . . . . . . . . . . 14.3 mt-30 -62.92 -42.0 99.65 Favored 'General case' 0 N--CA 1.5 2.053 0 O-C-N 121.54 -0.725 . . . . 0.0 110.32 179.424 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' B' B ' 156' ' ' ALA . . . . . 0.413 ' HB1' ' CE ' ' A' ' 47' ' ' MET . . . -70.0 -36.26 75.0 Favored 'General case' 0 N--CA 1.496 1.858 0 O-C-N 121.438 -0.789 . . . . 0.0 110.171 179.73 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' B' B ' 157' ' ' LEU . . . . . 0.839 HD23 ' HB1' ' A' ' 23' ' ' ALA . 4.1 mp -71.05 -61.74 1.65 Allowed 'General case' 0 N--CA 1.496 1.841 0 O-C-N 121.645 -0.659 . . . . 0.0 110.351 -179.967 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' B' B ' 158' ' ' LEU . . . . . 0.588 HD11 ' HB2' ' A' ' 23' ' ' ALA . 17.5 mt . . . . . 0 N--CA 1.497 1.918 0 O-C-N 121.261 -0.899 . . . . 0.0 109.971 179.821 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 4' ' ' ILE . . . . . . . . . . . . . 11.6 mt . . . . . 0 N--CA 1.503 2.219 0 CA-C-O 120.798 0.333 . . . . 0.0 110.267 . . . . . . . . . 0 0 . 1 . 011 nuclear nobuild core ' A' A ' 5' ' ' TYR . . . . . 0.413 ' CE1' ' HG2' ' A' ' 83' ' ' ARG . 6.8 m-85 -73.52 -34.31 65.18 Favored 'General case' 0 N--CA 1.5 2.051 0 O-C-N 121.288 -0.883 . . . . 0.0 109.967 179.155 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 6' ' ' LYS . . . . . 0.52 ' O ' HG12 ' A' ' 9' ' ' VAL . 0.0 OUTLIER -59.78 -32.34 70.51 Favored 'General case' 0 N--CA 1.497 1.924 0 O-C-N 121.44 -0.787 . . . . 0.0 110.214 179.576 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild core ' A' A ' 7' ' ' ALA . . . . . . . . . . . . . . . -55.88 -34.32 65.39 Favored 'General case' 0 N--CA 1.497 1.912 0 O-C-N 121.282 -0.886 . . . . 0.0 109.693 178.865 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 8' ' ' ALA . . . . . 0.563 ' CB ' HG11 ' A' ' 82' ' ' VAL . . . -71.72 -45.42 61.84 Favored 'General case' 0 N--CA 1.497 1.892 0 O-C-N 121.523 -0.736 . . . . 0.0 110.331 179.375 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 9' ' ' VAL . . . . . 0.633 ' HA ' HD12 ' A' ' 12' ' ' LEU . 0.3 OUTLIER -63.66 -28.98 46.1 Favored 'Isoleucine or valine' 0 N--CA 1.5 2.064 0 O-C-N 121.152 -0.967 . . . . 0.0 109.999 179.398 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild core ' A' A ' 10' ' ' GLU . . . . . . . . . . . . . 1.1 tt0 -73.26 -31.98 64.41 Favored 'General case' 0 N--CA 1.493 1.677 0 O-C-N 121.606 -0.684 . . . . 0.0 110.366 179.299 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 11' ' ' GLN . . . . . . . . . . . . . 27.4 mt-30 -85.22 2.81 42.2 Favored 'General case' 0 N--CA 1.499 2.008 0 O-C-N 121.331 -0.856 . . . . 0.0 111.577 -179.84 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 12' ' ' LEU . . . . . 0.633 HD12 ' HA ' ' A' ' 9' ' ' VAL . 4.5 mt -73.2 136.83 44.75 Favored 'General case' 0 N--CA 1.5 2.033 0 O-C-N 120.877 -1.14 . . . . 0.0 110.197 179.823 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 13' ' ' THR . . . . . . . . . . . . . 3.2 m -92.26 157.6 16.58 Favored 'General case' 0 N--CA 1.503 2.196 0 O-C-N 121.323 -0.861 . . . . 0.0 111.008 -179.602 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 14' ' ' GLU . . . . . . . . . . . . . 8.5 tp10 -51.96 -41.75 62.35 Favored 'General case' 0 N--CA 1.496 1.847 0 O-C-N 121.809 -0.557 . . . . 0.0 110.607 -179.918 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 23.5 mt-10 -58.5 -43.78 89.22 Favored 'General case' 0 N--CA 1.498 1.967 0 O-C-N 121.544 -0.723 . . . . 0.0 110.512 179.56 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 16' ' ' GLN . . . . . . . . . . . . . 0.8 OUTLIER -70.5 -37.07 74.11 Favored 'General case' 0 N--CA 1.498 1.931 0 O-C-N 121.491 -0.755 . . . . 0.0 110.284 179.745 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 17' ' ' LYS . . . . . . . . . . . . . 2.6 tptt -62.98 -45.68 91.28 Favored 'General case' 0 N--CA 1.496 1.873 0 N-CA-C 109.083 -0.71 . . . . 0.0 109.083 178.756 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 18' ' ' ASN . . . . . . . . . . . . . 15.7 m-80 -70.07 -27.98 65.06 Favored 'General case' 0 N--CA 1.497 1.901 0 O-C-N 121.439 -0.788 . . . . 0.0 109.757 178.642 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 7.3 tt0 -67.33 -51.42 52.56 Favored 'General case' 0 N--CA 1.495 1.776 0 O-C-N 121.445 -0.784 . . . . 0.0 109.247 178.967 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 20' ' ' PHE . . . . . . . . . . . . . 30.6 m-85 -67.19 -27.4 67.23 Favored 'General case' 0 N--CA 1.497 1.877 0 O-C-N 121.328 -0.858 . . . . 0.0 109.798 178.936 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 21' ' ' LYS . . . . . . . . . . . . . 3.1 tptt -58.04 -46.82 84.73 Favored 'General case' 0 N--CA 1.499 1.995 0 O-C-N 121.377 -0.827 . . . . 0.0 109.62 178.885 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 22' ' ' ALA . . . . . . . . . . . . . . . -63.27 -46.67 85.71 Favored 'General case' 0 N--CA 1.496 1.832 0 O-C-N 121.541 -0.725 . . . . 0.0 109.745 179.235 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 23' ' ' ALA . . . . . . . . . . . . . . . -60.65 -42.88 97.87 Favored 'General case' 0 N--CA 1.498 1.962 0 O-C-N 121.516 -0.74 . . . . 0.0 109.625 178.946 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 24' ' ' PHE . . . . . 0.518 ' O ' HG22 ' A' ' 28' ' ' VAL . 59.4 t80 -59.38 -47.92 83.6 Favored 'General case' 0 N--CA 1.494 1.766 0 O-C-N 121.567 -0.708 . . . . 0.0 109.666 179.139 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 25' ' ' ASP . . . . . . . . . . . . . 1.1 m-20 -56.39 -41.41 76.21 Favored 'General case' 0 N--CA 1.498 1.955 0 O-C-N 121.692 -0.63 . . . . 0.0 110.393 179.475 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 26' ' ' ILE . . . . . . . . . . . . . 38.1 mm -64.87 -30.12 49.39 Favored 'Isoleucine or valine' 0 N--CA 1.501 2.109 0 O-C-N 121.389 -0.819 . . . . 0.0 110.047 179.262 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 27' ' ' PHE . . . . . 0.455 ' CE1' ' HB ' ' A' ' 44' ' ' VAL . 0.1 OUTLIER -75.38 -28.98 59.71 Favored 'General case' 0 N--CA 1.496 1.833 0 O-C-N 121.435 -0.791 . . . . 0.0 111.115 -179.954 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild core ' A' A ' 28' ' ' VAL . . . . . 0.518 HG22 ' O ' ' A' ' 24' ' ' PHE . 0.0 OUTLIER -113.75 -79.17 0.38 Allowed 'Isoleucine or valine' 0 N--CA 1.498 1.95 0 O-C-N 121.138 -0.976 . . . . 0.0 110.748 179.859 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild core ' A' A ' 29' ' ' LEU . . . . . 0.42 ' H ' HG23 ' A' ' 28' ' ' VAL . 0.2 OUTLIER 67.19 -68.89 0.14 Allowed 'General case' 0 N--CA 1.504 2.262 0 O-C-N 121.644 -0.66 . . . . 0.0 110.407 -179.615 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild core ' A' A ' 30' ' ' GLY . . . . . . . . . . . . . . . -98.36 40.84 2.37 Favored Glycine 0 N--CA 1.494 2.545 0 N-CA-C 109.538 -1.425 . . . . 0.0 109.538 179.138 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 31' ' ' ALA . . . . . 0.433 ' HB2' ' HB ' ' A' ' 28' ' ' VAL . . . . . . . . 0 N--CA 1.499 2.017 0 O-C-N 121.306 -1.114 . . . . 0.0 110.681 -179.892 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 35' ' ' CYS . . . . . . . . . . . . . 12.9 p . . . . . 0 N--CA 1.496 1.835 0 CA-C-O 121.111 0.481 . . . . 0.0 110.4 . . . . . . . . . 0 0 . 1 . 011 nuclear nobuild core ' A' A ' 36' ' ' ILE . . . . . 0.424 HG12 HG13 ' A' ' 28' ' ' VAL . 69.5 mt -78.05 96.42 1.85 Allowed 'Isoleucine or valine' 0 N--CA 1.496 1.86 0 O-C-N 121.416 -0.802 . . . . 0.0 110.059 -179.988 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 37' ' ' SER . . . . . . . . . . . . . 91.5 p -87.92 -176.79 5.6 Favored 'General case' 0 N--CA 1.496 1.833 0 O-C-N 121.407 -0.808 . . . . 0.0 109.766 179.452 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 38' ' ' THR . . . . . 0.547 HG21 ' HG2' ' A' ' 58' ' ' GLN . 7.3 p -55.45 -36.98 67.14 Favored 'General case' 0 N--CA 1.5 2.032 0 O-C-N 121.361 -0.837 . . . . 0.0 110.487 179.819 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 39' ' ' LYS . . . . . . . . . . . . . 4.2 mtmp? -71.23 -44.92 64.41 Favored 'General case' 0 N--CA 1.499 1.983 0 O-C-N 121.416 -0.802 . . . . 0.0 110.583 179.818 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 40' ' ' GLU . . . . . 0.422 ' HG3' HG12 ' A' ' 28' ' ' VAL . 9.9 mm-40 -63.61 -38.61 91.76 Favored 'General case' 0 N--CA 1.501 2.094 0 O-C-N 121.393 -0.817 . . . . 0.0 110.647 -179.811 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 41' ' ' LEU . . . . . 0.861 HD12 HD13 ' A' ' 57' ' ' LEU . 1.8 tm? -66.14 -66.39 0.56 Allowed 'General case' 0 N--CA 1.499 2.0 0 O-C-N 121.297 -0.877 . . . . 0.0 109.346 179.124 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 42' ' ' GLY . . . . . 0.605 ' HA2' ' HB2' ' A' ' 45' ' ' MET . . . -48.03 -33.28 10.08 Favored Glycine 0 N--CA 1.501 3.011 0 N-CA-C 110.873 -0.891 . . . . 0.0 110.873 179.881 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 43' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -52.52 -46.24 66.61 Favored 'General case' 0 N--CA 1.503 2.178 0 O-C-N 121.383 -1.069 . . . . 0.0 110.566 179.54 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 44' ' ' VAL . . . . . 0.462 HG11 HD11 ' B' ' 157' ' ' LEU . 60.4 t -87.99 -21.61 7.02 Favored 'Isoleucine or valine' 0 N--CA 1.499 1.992 0 O-C-N 121.446 -0.784 . . . . 0.0 110.673 179.828 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 45' ' ' MET . . . . . 0.605 ' HB2' ' HA2' ' A' ' 42' ' ' GLY . 0.2 OUTLIER -57.44 -24.91 58.41 Favored 'General case' 0 N--CA 1.502 2.165 0 O-C-N 121.214 -0.929 . . . . 0.0 111.55 -179.957 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild core ' A' A ' 46' ' ' ARG . . . . . 0.527 ' HA ' ' HG3' ' A' ' 50' ' ' GLN . 4.9 mtm180 -50.33 -36.06 30.39 Favored 'General case' 0 N--CA 1.502 2.13 0 O-C-N 121.321 -0.862 . . . . 0.0 111.119 179.989 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 47' ' ' MET . . . . . . . . . . . . . 20.3 mtm -80.15 -30.86 38.99 Favored 'General case' 0 N--CA 1.497 1.899 0 O-C-N 121.359 -0.838 . . . . 0.0 110.889 -179.96 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 48' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -134.47 84.43 2.11 Favored 'General case' 0 N--CA 1.485 1.287 0 O-C-N 121.211 -0.93 . . . . 0.0 110.872 -179.457 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 49' ' ' GLY . . . . . . . . . . . . . . . 81.02 89.95 0.55 Allowed Glycine 0 N--CA 1.495 2.614 0 N-CA-C 109.828 -1.309 . . . . 0.0 109.828 179.722 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 50' ' ' GLN . . . . . 0.527 ' HG3' ' HA ' ' A' ' 46' ' ' ARG . 7.9 mp0 -65.83 152.49 44.29 Favored 'General case' 0 N--CA 1.498 1.953 0 O-C-N 121.525 -0.985 . . . . 0.0 110.661 -179.943 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 51' ' ' ASN . . . . . 0.432 ' HA ' ' HD2' ' A' ' 52' ' ' PRO . 16.3 p-10 -97.41 110.84 56.47 Favored Pre-proline 0 N--CA 1.494 1.76 0 O-C-N 121.535 -0.728 . . . . 0.0 110.125 179.551 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 52' ' ' PRO . . . . . 0.432 ' HD2' ' HA ' ' A' ' 51' ' ' ASN . 41.7 Cg_endo -69.21 -43.33 3.19 Favored 'Trans proline' 0 C--N 1.312 -1.343 0 O-C-N 123.676 1.356 . . . . 0.0 110.832 -179.885 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 53' ' ' THR . . . . . . . . . . . . . 0.6 OUTLIER -126.93 146.78 58.78 Favored Pre-proline 0 N--CA 1.495 1.824 0 O-C-N 121.336 -0.853 . . . . 0.0 110.282 -179.991 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 54' ' ' PRO . . . . . . . . . . . . . 40.9 Cg_endo -67.37 -36.96 18.91 Favored 'Trans proline' 0 N--CA 1.491 1.371 0 O-C-N 123.729 1.384 . . . . 0.0 110.781 179.811 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 55' ' ' GLU . . . . . 0.478 ' HG2' ' N ' ' A' ' 56' ' ' GLU . 3.1 pm0 -64.29 -24.6 67.72 Favored 'General case' 0 N--CA 1.498 1.965 0 O-C-N 121.365 -0.834 . . . . 0.0 110.748 179.432 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 56' ' ' GLU . . . . . 0.478 ' N ' ' HG2' ' A' ' 55' ' ' GLU . 27.0 tt0 -65.35 -25.41 67.57 Favored 'General case' 0 N--CA 1.498 1.951 0 O-C-N 121.174 -0.954 . . . . 0.0 110.401 179.399 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 57' ' ' LEU . . . . . 0.861 HD13 HD12 ' A' ' 41' ' ' LEU . 4.7 mt -94.13 -18.79 21.41 Favored 'General case' 0 N--CA 1.496 1.85 0 O-C-N 121.155 -0.966 . . . . 0.0 110.189 179.362 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 58' ' ' GLN . . . . . 0.547 ' HG2' HG21 ' A' ' 38' ' ' THR . 4.0 mm100 -59.78 -39.84 86.27 Favored 'General case' 0 N--CA 1.499 2.016 0 O-C-N 121.059 -1.026 . . . . 0.0 109.966 179.638 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 59' ' ' GLU . . . . . 0.529 ' O ' ' HB2' ' A' ' 63' ' ' GLU . 0.0 OUTLIER -59.82 -29.39 68.21 Favored 'General case' 0 N--CA 1.5 2.052 0 O-C-N 121.359 -0.838 . . . . 0.0 109.392 178.576 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild core ' A' A ' 60' ' ' MET . . . . . 0.435 ' HB2' ' O ' ' A' ' 57' ' ' LEU . 0.0 OUTLIER -72.87 -20.69 61.05 Favored 'General case' 0 N--CA 1.493 1.716 0 O-C-N 121.586 -0.696 . . . . 0.0 109.596 178.207 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild core ' A' A ' 61' ' ' ILE . . . . . 0.539 HG23 HG23 ' A' ' 72' ' ' VAL . 28.9 mm -85.14 -59.21 2.89 Favored 'Isoleucine or valine' 0 N--CA 1.496 1.874 0 O-C-N 121.514 -0.741 . . . . 0.0 110.468 179.941 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 62' ' ' ASP . . . . . 0.446 ' HA ' ' HB3' ' A' ' 65' ' ' ASP . 25.2 m-20 -60.16 -33.44 72.19 Favored 'General case' 0 N--CA 1.501 2.11 0 O-C-N 121.736 -0.602 . . . . 0.0 112.115 -178.58 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 63' ' ' GLU . . . . . 0.529 ' HB2' ' O ' ' A' ' 59' ' ' GLU . 0.6 OUTLIER -56.35 -42.36 77.63 Favored 'General case' 0 N--CA 1.504 2.266 0 O-C-N 121.169 -0.957 . . . . 0.0 110.939 -179.492 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild core ' A' A ' 64' ' ' VAL . . . . . 0.736 HG11 ' HB3' ' A' ' 80' ' ' MET . 34.5 m -99.79 -18.0 6.49 Favored 'Isoleucine or valine' 0 N--CA 1.501 2.094 0 O-C-N 121.308 -0.87 . . . . 0.0 111.224 179.872 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 65' ' ' ASP . . . . . 0.476 ' HA ' ' CD ' ' A' ' 76' ' ' GLU . 23.6 t70 -68.37 -87.12 0.02 OUTLIER 'General case' 0 N--CA 1.496 1.831 0 O-C-N 121.371 -0.831 . . . . 0.0 110.521 -179.596 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 66' ' ' GLU . . . . . . . . . . . . . 7.6 mm-40 48.51 33.28 3.91 Favored 'General case' 0 N--CA 1.502 2.135 0 O-C-N 121.35 -0.843 . . . . 0.0 111.171 -179.971 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 67' ' ' ASP . . . . . . . . . . . . . 0.7 OUTLIER -116.88 -18.29 10.21 Favored 'General case' 0 N--CA 1.499 1.995 0 O-C-N 121.104 -0.998 . . . . 0.0 111.601 -179.633 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 68' ' ' GLY . . . . . . . . . . . . . . . 123.05 -30.07 5.14 Favored Glycine 0 N--CA 1.498 2.804 0 N-CA-C 110.42 -1.072 . . . . 0.0 110.42 179.782 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 69' ' ' SER . . . . . . . . . . . . . 1.0 OUTLIER -78.93 -35.58 43.08 Favored 'General case' 0 N--CA 1.499 2.001 0 O-C-N 121.23 -1.159 . . . . 0.0 110.891 -179.635 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 70' ' ' GLY . . . . . . . . . . . . . . . 76.39 28.02 60.57 Favored Glycine 0 N--CA 1.498 2.8 0 N-CA-C 110.391 -1.084 . . . . 0.0 110.391 179.951 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 71' ' ' THR . . . . . . . . . . . . . 2.3 m -144.18 140.67 29.48 Favored 'General case' 0 N--CA 1.499 2.008 0 O-C-N 121.24 -1.153 . . . . 0.0 109.45 179.448 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 72' ' ' VAL . . . . . 0.539 HG23 HG23 ' A' ' 61' ' ' ILE . 24.7 t -75.69 124.49 33.82 Favored 'Isoleucine or valine' 0 N--CA 1.497 1.909 0 O-C-N 121.58 -0.7 . . . . 0.0 110.734 -179.586 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 73' ' ' ASP . . . . . . . . . . . . . 1.1 p30 -111.45 -161.38 0.75 Allowed 'General case' 0 N--CA 1.498 1.949 0 O-C-N 121.539 -0.726 . . . . 0.0 110.037 179.258 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 74' ' ' PHE . . . . . . . . . . . . . 16.9 t80 -66.72 -47.99 70.6 Favored 'General case' 0 N--CA 1.5 2.063 0 O-C-N 121.063 -1.023 . . . . 0.0 111.328 -178.91 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 75' ' ' ASP . . . . . 0.469 ' HA ' HD12 ' A' ' 78' ' ' LEU . 0.4 OUTLIER -68.25 -42.65 79.34 Favored 'General case' 0 N--CA 1.496 1.828 0 O-C-N 121.136 -0.978 . . . . 0.0 110.632 -179.621 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild core ' A' A ' 76' ' ' GLU . . . . . 0.476 ' CD ' ' HA ' ' A' ' 65' ' ' ASP . 2.6 mt-10 -64.86 -30.45 71.45 Favored 'General case' 0 N--CA 1.498 1.935 0 O-C-N 121.207 -0.933 . . . . 0.0 109.742 178.767 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 77' ' ' PHE . . . . . 0.537 ' HA ' ' SD ' ' A' ' 80' ' ' MET . 67.4 t80 -58.96 -28.1 65.98 Favored 'General case' 0 N--CA 1.5 2.056 0 O-C-N 121.539 -0.725 . . . . 0.0 109.835 178.575 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 78' ' ' LEU . . . . . 0.469 HD12 ' HA ' ' A' ' 75' ' ' ASP . 20.0 mt -77.31 -35.36 54.98 Favored 'General case' 0 N--CA 1.495 1.797 0 O-C-N 121.352 -0.843 . . . . 0.0 110.257 179.297 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 79' ' ' VAL . . . . . . . . . . . . . 61.8 t -56.67 -57.21 10.21 Favored 'Isoleucine or valine' 0 N--CA 1.502 2.151 0 O-C-N 121.395 -0.816 . . . . 0.0 110.253 179.795 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 80' ' ' MET . . . . . 0.736 ' HB3' HG11 ' A' ' 64' ' ' VAL . 0.0 OUTLIER -57.17 -34.92 68.96 Favored 'General case' 0 N--CA 1.502 2.135 0 O-C-N 121.425 -0.797 . . . . 0.0 110.402 179.626 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild core ' A' A ' 81' ' ' MET . . . . . . . . . . . . . 12.3 mmt -65.58 -43.87 88.44 Favored 'General case' 0 N--CA 1.498 1.967 0 O-C-N 121.365 -0.834 . . . . 0.0 110.063 179.129 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 82' ' ' VAL . . . . . 0.563 HG11 ' CB ' ' A' ' 8' ' ' ALA . 55.0 t -63.96 -34.62 69.58 Favored 'Isoleucine or valine' 0 N--CA 1.503 2.184 0 O-C-N 121.425 -0.797 . . . . 0.0 110.146 179.317 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 83' ' ' ARG . . . . . 0.413 ' HG2' ' CE1' ' A' ' 5' ' ' TYR . 31.7 mtt180 -66.5 -44.39 82.72 Favored 'General case' 0 N--CA 1.497 1.915 0 O-C-N 121.548 -0.72 . . . . 0.0 110.381 179.864 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 84' ' ' CYS . . . . . . . . . . . . . 84.1 m -71.95 -39.31 69.47 Favored 'General case' 0 N--CA 1.498 1.953 0 O-C-N 121.434 -0.791 . . . . 0.0 110.003 179.439 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 85' ' ' MET . . . . . . . . . . . . . 38.1 ttp . . . . . 0 N--CA 1.497 1.925 0 O-C-N 121.502 -0.749 . . . . 0.0 110.797 179.527 . . . . . . . . 0 0 . 1 . 011 nuclear nobuild core ' B' B ' 149' ' ' SER . . . . . . . . . . . . . 78.9 p . . . . . 0 N--CA 1.497 1.9 0 CA-C-O 121.208 0.528 . . . . 0.0 110.449 . . . . . . . . . 0 0 . 1 . 011 nuclear nobuild core ' B' B ' 150' ' ' ALA . . . . . . . . . . . . . . . -88.75 -45.46 9.77 Favored 'General case' 0 N--CA 1.498 1.944 0 O-C-N 121.258 -0.901 . . . . 0.0 110.523 -179.955 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' B' B ' 151' ' ' ASP . . . . . . . . . . . . . 8.0 p-10 -56.8 -41.64 78.1 Favored 'General case' 0 N--CA 1.503 2.188 0 O-C-N 121.537 -0.727 . . . . 0.0 111.076 -179.977 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' B' B ' 152' ' ' ALA . . . . . . . . . . . . . . . -66.35 -43.09 87.05 Favored 'General case' 0 N--CA 1.498 1.94 0 O-C-N 121.293 -0.879 . . . . 0.0 110.286 179.78 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' B' B ' 153' ' ' MET . . . . . . . . . . . . . 7.3 mmt -63.17 -48.32 78.9 Favored 'General case' 0 N--CA 1.496 1.867 0 O-C-N 121.553 -0.717 . . . . 0.0 109.968 179.516 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' B' B ' 154' ' ' MET . . . . . . . . . . . . . 22.9 mmm -59.99 -37.57 80.05 Favored 'General case' 0 N--CA 1.498 1.957 0 O-C-N 121.566 -0.709 . . . . 0.0 110.092 179.309 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' B' B ' 155' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -69.47 -38.91 77.94 Favored 'General case' 0 N--CA 1.499 2.021 0 O-C-N 121.537 -0.727 . . . . 0.0 110.938 179.696 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' B' B ' 156' ' ' ALA . . . . . . . . . . . . . . . -75.91 -45.34 35.81 Favored 'General case' 0 N--CA 1.498 1.945 0 O-C-N 121.249 -0.907 . . . . 0.0 110.777 -179.507 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' B' B ' 157' ' ' LEU . . . . . 0.462 HD11 HG11 ' A' ' 44' ' ' VAL . 1.4 mp -60.08 -37.08 78.84 Favored 'General case' 0 N--CA 1.499 2.024 0 O-C-N 121.469 -0.77 . . . . 0.0 111.142 -179.737 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' B' B ' 158' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER . . . . . 0 N--CA 1.496 1.829 0 O-C-N 121.254 -0.904 . . . . 0.0 110.297 -179.886 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 4' ' ' ILE . . . . . . . . . . . . . 2.0 mp . . . . . 0 N--CA 1.501 2.099 0 CA-C-O 120.666 0.269 . . . . 0.0 110.316 . . . . . . . . . 0 0 . 1 . 012 nuclear nobuild core ' A' A ' 5' ' ' TYR . . . . . . . . . . . . . 0.4 OUTLIER -55.88 -31.5 62.87 Favored 'General case' 0 N--CA 1.502 2.135 0 O-C-N 121.333 -0.854 . . . . 0.0 110.181 179.448 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -58.02 -38.35 76.02 Favored 'General case' 0 N--CA 1.497 1.886 0 O-C-N 121.602 -0.686 . . . . 0.0 110.589 179.408 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 7' ' ' ALA . . . . . . . . . . . . . . . -61.42 -44.16 97.62 Favored 'General case' 0 N--CA 1.499 2.024 0 O-C-N 121.396 -0.815 . . . . 0.0 110.643 179.644 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 8' ' ' ALA . . . . . . . . . . . . . . . -74.73 -12.26 60.37 Favored 'General case' 0 N--CA 1.499 2.018 0 O-C-N 121.302 -0.874 . . . . 0.0 111.371 179.988 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 9' ' ' VAL . . . . . 0.774 HG13 ' HB3' ' A' ' 78' ' ' LEU . 48.1 t -101.58 -52.68 8.23 Favored 'Isoleucine or valine' 0 N--CA 1.498 1.961 0 O-C-N 121.142 -0.974 . . . . 0.0 110.601 -179.684 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 10' ' ' GLU . . . . . . . . . . . . . 21.9 mm-40 -86.77 -18.62 30.65 Favored 'General case' 0 N--CA 1.494 1.765 0 O-C-N 121.303 -0.873 . . . . 0.0 111.163 -179.544 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 11' ' ' GLN . . . . . . . . . . . . . 0.6 OUTLIER -120.27 59.29 0.9 Allowed 'General case' 0 N--CA 1.496 1.86 0 O-C-N 120.974 -1.078 . . . . 0.0 111.088 -179.933 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 12' ' ' LEU . . . . . 0.571 HD13 ' HB3' ' A' ' 16' ' ' GLN . 0.0 OUTLIER -92.99 -73.14 0.57 Allowed 'General case' 0 N--CA 1.501 2.121 0 O-C-N 120.988 -1.07 . . . . 0.0 108.721 178.33 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild core ' A' A ' 13' ' ' THR . . . . . 0.476 ' HB ' ' HB2' ' A' ' 16' ' ' GLN . 1.6 m -152.23 147.53 26.49 Favored 'General case' 0 N--CA 1.498 1.945 0 O-C-N 121.528 -0.732 . . . . 0.0 109.346 179.034 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 14' ' ' GLU . . . . . . . . . . . . . 0.3 OUTLIER -54.07 -46.24 71.95 Favored 'General case' 0 N--CA 1.494 1.728 0 O-C-N 121.714 -0.616 . . . . 0.0 111.013 -179.238 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 7.0 tp10 -76.87 -26.72 54.54 Favored 'General case' 0 N--CA 1.496 1.839 0 O-C-N 121.297 -0.877 . . . . 0.0 111.048 179.96 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 16' ' ' GLN . . . . . 0.571 ' HB3' HD13 ' A' ' 12' ' ' LEU . 2.5 mt-30 -56.23 -42.44 77.3 Favored 'General case' 0 N--CA 1.503 2.191 0 O-C-N 121.156 -0.965 . . . . 0.0 110.711 -179.897 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 17' ' ' LYS . . . . . 0.46 ' NZ ' HD13 ' A' ' 78' ' ' LEU . 6.7 mttm -65.95 -45.7 80.83 Favored 'General case' 0 N--CA 1.496 1.863 0 N-CA-C 109.245 -0.65 . . . . 0.0 109.245 179.145 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 18' ' ' ASN . . . . . . . . . . . . . 61.9 t30 -64.07 -37.28 86.88 Favored 'General case' 0 N--CA 1.497 1.906 0 O-C-N 121.779 -0.576 . . . . 0.0 109.628 178.736 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 5.6 tt0 -67.07 -52.62 39.87 Favored 'General case' 0 N--CA 1.495 1.799 0 O-C-N 121.543 -0.723 . . . . 0.0 109.363 179.108 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 20' ' ' PHE . . . . . . . . . . . . . 4.0 m-85 -58.58 -34.16 70.78 Favored 'General case' 0 N--CA 1.499 2.012 0 O-C-N 121.419 -0.801 . . . . 0.0 109.699 179.121 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 21' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -61.43 -46.51 89.8 Favored 'General case' 0 N--CA 1.498 1.925 0 O-C-N 121.439 -0.788 . . . . 0.0 109.19 178.852 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 22' ' ' ALA . . . . . . . . . . . . . . . -59.77 -47.9 83.82 Favored 'General case' 0 N--CA 1.499 1.978 0 O-C-N 121.387 -0.82 . . . . 0.0 109.532 179.107 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 23' ' ' ALA . . . . . . . . . . . . . . . -61.02 -41.02 95.75 Favored 'General case' 0 N--CA 1.497 1.919 0 O-C-N 121.455 -0.778 . . . . 0.0 109.412 178.563 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 24' ' ' PHE . . . . . 0.413 ' CE2' HD12 ' A' ' 36' ' ' ILE . 37.7 t80 -67.12 -45.98 75.53 Favored 'General case' 0 N--CA 1.497 1.891 0 O-C-N 121.767 -0.583 . . . . 0.0 110.112 179.339 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 25' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER -53.38 -46.38 69.6 Favored 'General case' 0 N--CA 1.5 2.071 0 O-C-N 121.606 -0.684 . . . . 0.0 110.26 179.72 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 26' ' ' ILE . . . . . 0.542 ' HB ' HD21 ' B' ' 157' ' ' LEU . 51.0 mt -72.45 -30.27 34.05 Favored 'Isoleucine or valine' 0 N--CA 1.497 1.909 0 O-C-N 121.465 -0.772 . . . . 0.0 109.68 179.171 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 27' ' ' PHE . . . . . . . . . . . . . 0.8 OUTLIER -63.52 -38.82 92.59 Favored 'General case' 0 N--CA 1.498 1.932 0 O-C-N 121.434 -0.791 . . . . 0.0 110.299 179.363 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 28' ' ' VAL . . . . . . . . . . . . . 34.9 m -93.78 36.68 0.1 Allowed 'Isoleucine or valine' 0 N--CA 1.501 2.11 0 O-C-N 121.265 -0.897 . . . . 0.0 110.811 179.838 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 29' ' ' LEU . . . . . . . . . . . . . 0.9 OUTLIER -70.22 106.45 3.32 Favored 'General case' 0 N--CA 1.499 1.996 0 O-C-N 121.012 -1.055 . . . . 0.0 109.816 179.476 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 30' ' ' GLY . . . . . . . . . . . . . . . 109.9 -30.87 7.97 Favored Glycine 0 N--CA 1.494 2.556 0 N-CA-C 109.352 -1.499 . . . . 0.0 109.352 -179.228 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 31' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.495 1.779 0 O-C-N 121.411 -1.052 . . . . 0.0 109.642 179.549 . . . . . . . . 0 0 . 1 . 012 nuclear nobuild core ' A' A ' 35' ' ' CYS . . . . . . . . . . . . . 56.3 m . . . . . 0 N--CA 1.496 1.848 0 CA-C-O 121.41 0.624 . . . . 0.0 110.656 . . . . . . . . . 0 0 . 1 . 012 nuclear nobuild core ' A' A ' 36' ' ' ILE . . . . . 0.49 ' O ' HG22 ' A' ' 36' ' ' ILE . 0.5 OUTLIER -102.28 112.58 36.02 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.613 0 CA-C-O 121.44 0.638 . . . . 0.0 109.361 179.596 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild core ' A' A ' 37' ' ' SER . . . . . . . . . . . . . 0.2 OUTLIER -108.57 -173.18 2.21 Favored 'General case' 0 N--CA 1.494 1.728 0 O-C-N 121.413 -0.805 . . . . 0.0 110.628 -179.417 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 38' ' ' THR . . . . . . . . . . . . . 57.2 p -66.21 -42.17 89.12 Favored 'General case' 0 N--CA 1.499 1.99 0 O-C-N 121.486 -0.759 . . . . 0.0 110.911 -179.73 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 39' ' ' LYS . . . . . . . . . . . . . 47.9 mtmt -58.43 -45.57 88.21 Favored 'General case' 0 N--CA 1.502 2.13 0 O-C-N 121.45 -0.781 . . . . 0.0 110.731 -179.87 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 1.1 mp0 -71.86 -27.94 63.21 Favored 'General case' 0 N--CA 1.499 2.005 0 O-C-N 121.551 -0.718 . . . . 0.0 110.522 -179.855 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 41' ' ' LEU . . . . . 0.594 ' HG ' HD13 ' A' ' 57' ' ' LEU . 6.9 tp -72.58 -53.48 11.82 Favored 'General case' 0 N--CA 1.497 1.894 0 O-C-N 121.208 -0.932 . . . . 0.0 110.452 179.72 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 42' ' ' GLY . . . . . . . . . . . . . . . -56.44 -35.89 67.98 Favored Glycine 0 N--CA 1.496 2.666 0 N-CA-C 110.4 -1.08 . . . . 0.0 110.4 -179.406 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 43' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -56.56 -37.16 70.17 Favored 'General case' 0 N--CA 1.5 2.052 0 O-C-N 121.345 -1.091 . . . . 0.0 109.907 179.218 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 44' ' ' VAL . . . . . . . . . . . . . 88.6 t -85.18 -31.8 7.06 Favored 'Isoleucine or valine' 0 N--CA 1.497 1.917 0 O-C-N 121.483 -0.76 . . . . 0.0 109.761 178.837 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 45' ' ' MET . . . . . 0.489 ' CE ' HD11 ' A' ' 41' ' ' LEU . 0.0 OUTLIER -58.52 -53.33 59.5 Favored 'General case' 0 N--CA 1.5 2.034 0 O-C-N 121.398 -0.814 . . . . 0.0 109.96 179.496 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild core ' A' A ' 46' ' ' ARG . . . . . 0.492 ' HA ' ' HB2' ' A' ' 51' ' ' ASN . 1.9 ppt_? -64.25 -28.72 69.93 Favored 'General case' 0 N--CA 1.499 2.011 0 O-C-N 121.377 -0.827 . . . . 0.0 109.938 179.125 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 47' ' ' MET . . . . . . . . . . . . . 13.9 ttp -66.95 -36.22 81.72 Favored 'General case' 0 N--CA 1.495 1.824 0 O-C-N 121.455 -0.778 . . . . 0.0 109.501 178.856 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 48' ' ' LEU . . . . . . . . . . . . . 28.5 mt -75.28 -40.35 58.77 Favored 'General case' 0 N--CA 1.498 1.959 0 O-C-N 121.516 -0.74 . . . . 0.0 110.0 179.151 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 49' ' ' GLY . . . . . . . . . . . . . . . 139.02 -50.81 0.78 Allowed Glycine 0 N--CA 1.495 2.575 0 N-CA-C 109.96 -1.256 . . . . 0.0 109.96 -179.773 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 50' ' ' GLN . . . . . . . . . . . . . 0.6 OUTLIER -84.89 99.69 11.11 Favored 'General case' 0 N--CA 1.498 1.939 0 O-C-N 121.331 -1.1 . . . . 0.0 110.739 -179.662 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 51' ' ' ASN . . . . . 0.492 ' HB2' ' HA ' ' A' ' 46' ' ' ARG . 14.2 t30 -129.69 101.08 18.84 Favored Pre-proline 0 N--CA 1.496 1.856 0 O-C-N 121.473 -0.767 . . . . 0.0 109.992 179.723 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 52' ' ' PRO . . . . . . . . . . . . . 46.1 Cg_endo -73.56 -92.3 0.01 OUTLIER 'Trans proline' 0 C--N 1.314 -1.252 0 O-C-N 123.821 1.432 . . . . 0.0 111.23 -179.569 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 53' ' ' THR . . . . . 0.665 HG22 ' HD2' ' A' ' 54' ' ' PRO . 0.1 OUTLIER -139.54 151.1 65.77 Favored Pre-proline 0 N--CA 1.502 2.164 0 O-C-N 120.918 -1.114 . . . . 0.0 110.432 -179.375 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild core ' A' A ' 54' ' ' PRO . . . . . 0.665 ' HD2' HG22 ' A' ' 53' ' ' THR . 41.8 Cg_endo -69.21 -40.31 6.37 Favored 'Trans proline' 0 N--CA 1.489 1.247 0 O-C-N 123.841 1.443 . . . . 0.0 110.667 179.807 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 55' ' ' GLU . . . . . . . . . . . . . 3.6 mp0 -66.48 -31.14 71.69 Favored 'General case' 0 N--CA 1.496 1.832 0 O-C-N 121.449 -0.782 . . . . 0.0 109.869 179.375 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 16.0 tt0 -63.7 -34.62 78.28 Favored 'General case' 0 N--CA 1.496 1.838 0 O-C-N 121.528 -0.733 . . . . 0.0 110.231 179.291 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 57' ' ' LEU . . . . . 0.594 HD13 ' HG ' ' A' ' 41' ' ' LEU . 56.7 mt -67.25 -25.63 66.17 Favored 'General case' 0 N--CA 1.496 1.853 0 O-C-N 121.186 -0.946 . . . . 0.0 110.273 179.491 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 58' ' ' GLN . . . . . 0.566 ' O ' HG22 ' A' ' 61' ' ' ILE . 0.0 OUTLIER -64.31 -29.77 70.84 Favored 'General case' 0 N--CA 1.498 1.958 0 O-C-N 121.064 -1.022 . . . . 0.0 108.969 178.793 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild core ' A' A ' 59' ' ' GLU . . . . . 0.504 ' N ' ' HG3' ' A' ' 58' ' ' GLN . 17.8 mm-40 -81.28 -32.22 33.29 Favored 'General case' 0 N--CA 1.492 1.632 0 N-CA-C 107.89 -1.152 . . . . 0.0 107.89 177.415 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 60' ' ' MET . . . . . 0.4 ' HB2' ' HA ' ' A' ' 57' ' ' LEU . 0.3 OUTLIER -68.86 -44.4 73.41 Favored 'General case' 0 N--CA 1.495 1.793 0 O-C-N 121.91 -0.494 . . . . 0.0 109.953 178.799 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild core ' A' A ' 61' ' ' ILE . . . . . 0.566 HG22 ' O ' ' A' ' 58' ' ' GLN . 12.6 tt -62.71 -31.34 51.84 Favored 'Isoleucine or valine' 0 N--CA 1.497 1.915 0 O-C-N 121.493 -0.754 . . . . 0.0 110.201 179.631 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 62' ' ' ASP . . . . . 0.573 ' HA ' ' HB3' ' A' ' 65' ' ' ASP . 17.6 t70 -64.41 -35.47 81.01 Favored 'General case' 0 N--CA 1.499 1.987 0 O-C-N 121.459 -0.776 . . . . 0.0 110.838 179.675 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 63' ' ' GLU . . . . . . . . . . . . . 5.1 tt0 -51.31 -38.51 53.34 Favored 'General case' 0 N--CA 1.503 2.225 0 O-C-N 121.399 -0.813 . . . . 0.0 110.291 179.571 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 64' ' ' VAL . . . . . . . . . . . . . 65.0 t -100.3 -24.67 4.06 Favored 'Isoleucine or valine' 0 N--CA 1.497 1.883 0 O-C-N 121.516 -0.74 . . . . 0.0 109.966 179.015 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 65' ' ' ASP . . . . . 0.573 ' HB3' ' HA ' ' A' ' 62' ' ' ASP . 18.4 t70 -79.57 -93.03 0.04 OUTLIER 'General case' 0 N--CA 1.494 1.728 0 O-C-N 121.529 -0.732 . . . . 0.0 110.58 -179.595 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 66' ' ' GLU . . . . . . . . . . . . . 0.5 OUTLIER 47.05 32.31 1.89 Allowed 'General case' 0 N--CA 1.501 2.12 0 O-C-N 121.389 -0.819 . . . . 0.0 111.073 -179.592 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 67' ' ' ASP . . . . . . . . . . . . . 4.9 p-10 -118.31 1.63 11.85 Favored 'General case' 0 N--CA 1.498 1.926 0 O-C-N 121.135 -0.978 . . . . 0.0 111.695 -179.559 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 68' ' ' GLY . . . . . . . . . . . . . . . 106.13 -41.33 2.2 Favored Glycine 0 N--CA 1.495 2.605 0 N-CA-C 109.908 -1.277 . . . . 0.0 109.908 179.949 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 69' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -60.9 -51.24 70.11 Favored 'General case' 0 N--CA 1.501 2.095 0 O-C-N 121.482 -1.01 . . . . 0.0 110.778 -179.732 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 70' ' ' GLY . . . . . . . . . . . . . . . 100.06 -28.04 17.54 Favored Glycine 0 N--CA 1.498 2.783 0 C-N-CA 120.152 -1.023 . . . . 0.0 110.959 179.535 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 71' ' ' THR . . . . . . . . . . . . . 11.7 t -104.89 159.89 15.44 Favored 'General case' 0 N--CA 1.5 2.025 0 O-C-N 120.997 -1.296 . . . . 0.0 111.389 -179.533 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 72' ' ' VAL . . . . . 0.541 HG23 HG13 ' A' ' 61' ' ' ILE . 2.5 t -94.35 118.44 40.35 Favored 'Isoleucine or valine' 0 N--CA 1.497 1.884 0 O-C-N 121.751 -0.593 . . . . 0.0 110.239 179.922 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 73' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -91.8 -166.76 1.63 Allowed 'General case' 0 N--CA 1.495 1.809 0 O-C-N 121.165 -0.96 . . . . 0.0 110.012 179.519 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 74' ' ' PHE . . . . . . . . . . . . . 77.3 t80 -61.57 -45.23 95.03 Favored 'General case' 0 N--CA 1.499 2.02 0 O-C-N 121.17 -0.956 . . . . 0.0 110.558 179.827 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 75' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -62.88 -46.2 88.96 Favored 'General case' 0 N--CA 1.499 1.989 0 O-C-N 121.432 -0.793 . . . . 0.0 110.536 179.819 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 76' ' ' GLU . . . . . . . . . . . . . 27.3 mt-10 -63.98 -36.97 85.72 Favored 'General case' 0 N--CA 1.501 2.084 0 O-C-N 121.441 -0.787 . . . . 0.0 109.807 179.35 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 77' ' ' PHE . . . . . . . . . . . . . 5.9 t80 -55.67 -43.43 76.35 Favored 'General case' 0 N--CA 1.494 1.772 0 O-C-N 121.759 -0.588 . . . . 0.0 109.818 179.266 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 78' ' ' LEU . . . . . 0.774 ' HB3' HG13 ' A' ' 9' ' ' VAL . 35.0 mt -70.41 -45.05 66.71 Favored 'General case' 0 N--CA 1.497 1.881 0 O-C-N 121.467 -0.771 . . . . 0.0 110.491 179.553 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 79' ' ' VAL . . . . . . . . . . . . . 24.1 t -58.59 -34.13 50.45 Favored 'Isoleucine or valine' 0 N--CA 1.502 2.138 0 O-C-N 121.335 -0.853 . . . . 0.0 109.202 178.968 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 80' ' ' MET . . . . . . . . . . . . . 0.8 OUTLIER -73.77 -42.27 61.28 Favored 'General case' 0 N--CA 1.493 1.693 0 O-C-N 121.526 -0.734 . . . . 0.0 109.238 178.489 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 81' ' ' MET . . . . . 0.516 ' HG3' ' CB ' ' B' ' 150' ' ' ALA . 0.0 OUTLIER -55.11 -51.25 67.0 Favored 'General case' 0 N--CA 1.499 2.014 0 O-C-N 121.76 -0.588 . . . . 0.0 110.559 179.576 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild core ' A' A ' 82' ' ' VAL . . . . . 0.439 HG21 ' CG2' ' A' ' 9' ' ' VAL . 33.7 m -65.99 -29.07 45.68 Favored 'Isoleucine or valine' 0 N--CA 1.502 2.156 0 O-C-N 121.453 -0.779 . . . . 0.0 110.671 179.931 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 83' ' ' ARG . . . . . . . . . . . . . 2.1 mtt180 -64.95 -43.0 94.15 Favored 'General case' 0 N--CA 1.496 1.827 0 O-C-N 121.255 -0.903 . . . . 0.0 109.395 179.237 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 84' ' ' CYS . . . . . . . . . . . . . 0.0 OUTLIER -72.05 -42.63 66.05 Favored 'General case' 0 N--CA 1.495 1.777 0 O-C-N 121.549 -0.719 . . . . 0.0 110.123 179.17 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 85' ' ' MET . . . . . . . . . . . . . 70.7 mtm . . . . . 0 N--CA 1.499 2.019 0 O-C-N 121.473 -0.767 . . . . 0.0 111.225 179.834 . . . . . . . . 0 0 . 1 . 012 nuclear nobuild core ' B' B ' 149' ' ' SER . . . . . . . . . . . . . 6.8 t . . . . . 0 N--CA 1.496 1.874 0 CA-C-O 121.608 0.718 . . . . 0.0 111.246 . . . . . . . . . 0 0 . 1 . 012 nuclear nobuild core ' B' B ' 150' ' ' ALA . . . . . 0.516 ' CB ' ' HG3' ' A' ' 81' ' ' MET . . . -61.54 -51.67 67.64 Favored 'General case' 0 N--CA 1.497 1.901 0 O-C-N 121.73 -0.606 . . . . 0.0 110.509 179.732 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' B' B ' 151' ' ' ASP . . . . . . . . . . . . . 6.8 p-10 -61.57 -31.92 71.98 Favored 'General case' 0 N--CA 1.499 2.018 0 O-C-N 121.627 -0.671 . . . . 0.0 110.717 179.685 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' B' B ' 152' ' ' ALA . . . . . . . . . . . . . . . -70.16 -46.52 64.5 Favored 'General case' 0 N--CA 1.497 1.902 0 O-C-N 121.21 -0.931 . . . . 0.0 110.545 179.987 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' B' B ' 153' ' ' MET . . . . . . . . . . . . . 1.5 tpt -75.2 -37.65 61.08 Favored 'General case' 0 N--CA 1.498 1.947 0 O-C-N 121.287 -0.883 . . . . 0.0 110.848 -179.99 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' B' B ' 154' ' ' MET . . . . . . . . . . . . . 2.7 ttp -70.6 -50.54 36.05 Favored 'General case' 0 N--CA 1.498 1.938 0 O-C-N 121.302 -0.874 . . . . 0.0 110.918 -179.652 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' B' B ' 155' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -64.39 -35.77 81.98 Favored 'General case' 0 N--CA 1.5 2.052 0 O-C-N 121.273 -0.892 . . . . 0.0 110.801 -179.752 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' B' B ' 156' ' ' ALA . . . . . . . . . . . . . . . -59.31 -46.91 87.3 Favored 'General case' 0 N--CA 1.498 1.933 0 O-C-N 121.303 -0.873 . . . . 0.0 110.112 179.604 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' B' B ' 157' ' ' LEU . . . . . 0.542 HD21 ' HB ' ' A' ' 26' ' ' ILE . 14.8 tp -61.22 -53.79 52.38 Favored 'General case' 0 N--CA 1.496 1.859 0 O-C-N 121.586 -0.696 . . . . 0.0 110.4 179.653 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' B' B ' 158' ' ' LEU . . . . . . . . . . . . . 1.6 mt . . . . . 0 N--CA 1.495 1.79 0 O-C-N 121.451 -0.781 . . . . 0.0 109.792 179.624 . . . . . . . . 0 0 . 1 . 013 nuclear nobuild core ' A' A ' 4' ' ' ILE . . . . . . . . . . . . . 7.8 mt . . . . . 0 N--CA 1.493 1.72 0 N-CA-C 108.975 -0.75 . . . . 0.0 108.975 . . . . . . . . . 0 0 . 1 . 013 nuclear nobuild core ' A' A ' 5' ' ' TYR . . . . . 0.411 ' HB3' HG13 ' A' ' 82' ' ' VAL . 47.8 m-85 -73.56 -30.61 63.16 Favored 'General case' 0 N--CA 1.496 1.853 0 O-C-N 121.644 -0.66 . . . . 0.0 109.92 179.124 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 6' ' ' LYS . . . . . 0.404 ' HA ' HG22 ' A' ' 79' ' ' VAL . 0.3 OUTLIER -56.67 -34.24 67.18 Favored 'General case' 0 N--CA 1.498 1.939 0 O-C-N 121.613 -0.679 . . . . 0.0 109.855 179.041 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild core ' A' A ' 7' ' ' ALA . . . . . . . . . . . . . . . -61.76 -43.05 99.61 Favored 'General case' 0 N--CA 1.496 1.859 0 O-C-N 121.519 -0.738 . . . . 0.0 109.965 179.187 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 8' ' ' ALA . . . . . . . . . . . . . . . -60.66 -34.01 73.67 Favored 'General case' 0 N--CA 1.501 2.081 0 O-C-N 121.438 -0.789 . . . . 0.0 110.829 179.521 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 9' ' ' VAL . . . . . 0.641 HG13 ' HB3' ' A' ' 78' ' ' LEU . 72.9 t -58.73 -43.84 88.73 Favored 'Isoleucine or valine' 0 N--CA 1.501 2.09 0 O-C-N 121.437 -0.79 . . . . 0.0 111.064 -179.92 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 10' ' ' GLU . . . . . . . . . . . . . 12.0 mm-40 -89.76 -1.9 58.11 Favored 'General case' 0 N--CA 1.496 1.842 0 O-C-N 121.257 -0.902 . . . . 0.0 111.166 -179.949 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 11' ' ' GLN . . . . . . . . . . . . . 4.1 mt-30 -99.63 -22.76 15.29 Favored 'General case' 0 N--CA 1.496 1.839 0 O-C-N 121.086 -1.009 . . . . 0.0 110.978 179.78 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 12' ' ' LEU . . . . . 0.556 ' C ' HD12 ' A' ' 12' ' ' LEU . 4.6 pp -67.2 171.9 5.28 Favored 'General case' 0 N--CA 1.505 2.287 0 O-C-N 121.069 -1.019 . . . . 0.0 110.998 -179.811 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 13' ' ' THR . . . . . . . . . . . . . 76.4 p -92.84 159.97 15.14 Favored 'General case' 0 N--CA 1.501 2.092 0 O-C-N 121.332 -0.855 . . . . 0.0 110.854 -179.572 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 14' ' ' GLU . . . . . . . . . . . . . 0.8 OUTLIER -56.77 -28.76 61.78 Favored 'General case' 0 N--CA 1.493 1.716 0 O-C-N 121.643 -0.661 . . . . 0.0 110.653 -179.967 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 1.3 mp0 -60.6 -41.33 94.53 Favored 'General case' 0 N--CA 1.498 1.973 0 O-C-N 121.439 -0.788 . . . . 0.0 110.167 179.419 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 16' ' ' GLN . . . . . 0.471 ' HG2' ' HB2' ' A' ' 12' ' ' LEU . 0.0 OUTLIER -80.24 -33.59 37.85 Favored 'General case' 0 N--CA 1.491 1.591 0 O-C-N 121.423 -0.798 . . . . 0.0 110.087 179.539 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild core ' A' A ' 17' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -70.78 -40.11 72.79 Favored 'General case' 0 N--CA 1.498 1.961 0 O-C-N 121.552 -0.718 . . . . 0.0 110.054 179.305 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 18' ' ' ASN . . . . . . . . . . . . . 3.9 t30 -61.24 -34.6 75.41 Favored 'General case' 0 N--CA 1.497 1.878 0 O-C-N 121.513 -0.742 . . . . 0.0 109.995 179.331 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -62.98 -49.2 75.62 Favored 'General case' 0 N--CA 1.498 1.966 0 O-C-N 121.497 -0.752 . . . . 0.0 109.809 179.295 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 20' ' ' PHE . . . . . . . . . . . . . 12.9 m-85 -64.55 -34.64 78.71 Favored 'General case' 0 N--CA 1.5 2.055 0 O-C-N 121.419 -0.8 . . . . 0.0 110.005 179.098 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 21' ' ' LYS . . . . . . . . . . . . . 1.6 tptp -55.23 -47.35 75.48 Favored 'General case' 0 N--CA 1.498 1.956 0 O-C-N 121.566 -0.709 . . . . 0.0 110.201 179.591 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 22' ' ' ALA . . . . . . . . . . . . . . . -56.07 -44.87 79.33 Favored 'General case' 0 N--CA 1.499 1.996 0 O-C-N 121.598 -0.689 . . . . 0.0 110.082 179.575 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 23' ' ' ALA . . . . . 0.449 ' HA ' HD12 ' A' ' 26' ' ' ILE . . . -66.99 -35.89 80.95 Favored 'General case' 0 N--CA 1.497 1.887 0 O-C-N 121.353 -0.842 . . . . 0.0 109.66 178.726 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 24' ' ' PHE . . . . . 0.422 ' HE1' HD12 ' A' ' 36' ' ' ILE . 76.9 t80 -65.69 -37.85 87.62 Favored 'General case' 0 N--CA 1.497 1.917 0 O-C-N 121.582 -0.699 . . . . 0.0 110.223 179.309 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 25' ' ' ASP . . . . . . . . . . . . . 51.5 m-20 -56.18 -39.72 72.82 Favored 'General case' 0 N--CA 1.501 2.083 0 O-C-N 121.549 -0.719 . . . . 0.0 110.733 179.903 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 26' ' ' ILE . . . . . 0.752 ' HA ' HD12 ' A' ' 29' ' ' LEU . 6.7 mt -71.02 -31.68 45.87 Favored 'Isoleucine or valine' 0 N--CA 1.499 1.986 0 O-C-N 121.174 -0.954 . . . . 0.0 109.846 179.379 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 27' ' ' PHE . . . . . 0.59 ' HB3' HD11 ' A' ' 36' ' ' ILE . 0.2 OUTLIER -71.09 -39.68 71.97 Favored 'General case' 0 N--CA 1.496 1.846 0 O-C-N 121.359 -0.838 . . . . 0.0 110.291 179.522 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild core ' A' A ' 28' ' ' VAL . . . . . 0.465 HG12 HG13 ' A' ' 36' ' ' ILE . 23.5 m -87.99 9.07 2.27 Favored 'Isoleucine or valine' 0 N--CA 1.501 2.086 0 O-C-N 121.365 -0.834 . . . . 0.0 111.281 179.862 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 29' ' ' LEU . . . . . 0.752 HD12 ' HA ' ' A' ' 26' ' ' ILE . 0.7 OUTLIER -61.08 105.82 0.53 Allowed 'General case' 0 N--CA 1.497 1.907 0 O-C-N 121.022 -1.049 . . . . 0.0 110.058 -179.936 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild core ' A' A ' 30' ' ' GLY . . . . . . . . . . . . . . . 96.09 16.62 37.58 Favored Glycine 0 N--CA 1.495 2.623 0 N-CA-C 110.366 -1.094 . . . . 0.0 110.366 -179.577 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 31' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.493 1.719 0 O-C-N 121.024 -1.28 . . . . 0.0 109.959 179.768 . . . . . . . . 0 0 . 1 . 013 nuclear nobuild core ' A' A ' 35' ' ' CYS . . . . . . . . . . . . . 25.8 p . . . . . 0 N--CA 1.499 1.99 0 CA-C-O 121.095 0.474 . . . . 0.0 110.359 . . . . . . . . . 0 0 . 1 . 013 nuclear nobuild core ' A' A ' 36' ' ' ILE . . . . . 0.59 HD11 ' HB3' ' A' ' 27' ' ' PHE . 31.0 mt -123.85 130.35 73.97 Favored 'Isoleucine or valine' 0 N--CA 1.497 1.888 0 O-C-N 121.369 -0.832 . . . . 0.0 110.618 -179.826 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 37' ' ' SER . . . . . . . . . . . . . 1.7 t -122.51 -176.49 3.39 Favored 'General case' 0 N--CA 1.496 1.871 0 O-C-N 121.64 -0.662 . . . . 0.0 109.877 179.307 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 38' ' ' THR . . . . . 0.557 ' HB ' ' HA ' ' A' ' 54' ' ' PRO . 54.7 p -65.12 -36.45 84.31 Favored 'General case' 0 N--CA 1.503 2.216 0 O-C-N 121.329 -0.857 . . . . 0.0 110.617 179.891 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 39' ' ' LYS . . . . . . . . . . . . . 7.1 mttm -66.73 -44.47 81.46 Favored 'General case' 0 N--CA 1.498 1.95 0 O-C-N 121.39 -0.818 . . . . 0.0 110.476 179.761 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 1.2 mp0 -71.81 -23.3 61.53 Favored 'General case' 0 N--CA 1.497 1.916 0 O-C-N 121.494 -0.754 . . . . 0.0 110.935 -179.864 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 41' ' ' LEU . . . . . 0.809 HD21 HD22 ' A' ' 57' ' ' LEU . 5.4 tp -63.2 -47.51 82.26 Favored 'General case' 0 N--CA 1.498 1.944 0 O-C-N 121.079 -1.013 . . . . 0.0 110.157 179.774 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 42' ' ' GLY . . . . . 0.495 ' HA2' ' HB2' ' A' ' 45' ' ' MET . . . -55.94 -28.81 54.06 Favored Glycine 0 N--CA 1.495 2.614 0 N-CA-C 110.478 -1.049 . . . . 0.0 110.478 -179.951 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 43' ' ' LYS . . . . . . . . . . . . . 13.5 ttmt -50.99 -47.89 61.42 Favored 'General case' 0 N--CA 1.501 2.079 0 O-C-N 121.374 -1.074 . . . . 0.0 109.984 179.039 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 44' ' ' VAL . . . . . 0.415 HG22 HD21 ' B' ' 157' ' ' LEU . 38.1 t -80.5 -29.14 11.93 Favored 'Isoleucine or valine' 0 N--CA 1.498 1.954 0 O-C-N 121.557 -0.714 . . . . 0.0 110.03 179.053 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 45' ' ' MET . . . . . 0.495 ' HB2' ' HA2' ' A' ' 42' ' ' GLY . 5.1 mmt -57.09 -40.63 77.34 Favored 'General case' 0 N--CA 1.501 2.093 0 O-C-N 121.345 -0.847 . . . . 0.0 110.268 179.654 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 46' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -59.32 -40.61 86.84 Favored 'General case' 0 N--CA 1.501 2.109 0 O-C-N 121.411 -0.805 . . . . 0.0 110.224 179.383 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 47' ' ' MET . . . . . . . . . . . . . 0.2 OUTLIER -59.76 -43.09 94.48 Favored 'General case' 0 N--CA 1.499 1.981 0 O-C-N 121.493 -0.755 . . . . 0.0 110.185 179.552 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 48' ' ' LEU . . . . . . . . . . . . . 83.9 mt -78.21 -37.49 45.33 Favored 'General case' 0 N--CA 1.498 1.931 0 O-C-N 121.443 -0.785 . . . . 0.0 109.875 179.153 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 49' ' ' GLY . . . . . . . . . . . . . . . 115.92 50.56 0.43 Allowed Glycine 0 N--CA 1.495 2.629 0 N-CA-C 109.582 -1.407 . . . . 0.0 109.582 179.792 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 50' ' ' GLN . . . . . . . . . . . . . 25.1 mt-30 -132.6 145.59 51.22 Favored 'General case' 0 N--CA 1.497 1.923 0 O-C-N 121.408 -1.054 . . . . 0.0 110.111 -179.829 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 51' ' ' ASN . . . . . . . . . . . . . 1.2 t30 -132.36 62.56 63.86 Favored Pre-proline 0 N--CA 1.497 1.919 0 O-C-N 121.273 -0.892 . . . . 0.0 110.959 -179.887 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 52' ' ' PRO . . . . . 0.714 ' HG2' HD11 ' A' ' 57' ' ' LEU . 51.3 Cg_endo -78.16 157.43 30.06 Favored 'Trans proline' 0 C--N 1.314 -1.255 0 O-C-N 123.656 1.345 . . . . 0.0 110.624 179.569 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 53' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -85.14 153.82 59.92 Favored Pre-proline 0 N--CA 1.499 1.98 0 O-C-N 121.235 -0.916 . . . . 0.0 110.191 179.728 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 54' ' ' PRO . . . . . 0.557 ' HA ' ' HB ' ' A' ' 38' ' ' THR . 39.9 Cg_endo -66.15 -47.44 3.43 Favored 'Trans proline' 0 C--N 1.313 -1.303 0 O-C-N 123.686 1.361 . . . . 0.0 110.623 -179.693 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 55' ' ' GLU . . . . . . . . . . . . . 1.3 tt0 -61.45 -30.49 70.62 Favored 'General case' 0 N--CA 1.498 1.95 0 O-C-N 121.307 -0.87 . . . . 0.0 109.834 178.917 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 1.7 tm-20 -73.6 -45.8 50.96 Favored 'General case' 0 N--CA 1.495 1.781 0 O-C-N 121.461 -0.774 . . . . 0.0 110.029 179.252 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 57' ' ' LEU . . . . . 0.809 HD22 HD21 ' A' ' 41' ' ' LEU . 15.6 mt -69.63 -18.16 63.57 Favored 'General case' 0 N--CA 1.497 1.898 0 O-C-N 121.246 -0.908 . . . . 0.0 110.813 179.736 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 58' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -52.68 -51.23 61.16 Favored 'General case' 0 N--CA 1.497 1.921 0 O-C-N 121.084 -1.01 . . . . 0.0 110.538 179.723 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 59' ' ' GLU . . . . . . . . . . . . . 6.8 mm-40 -56.86 -32.23 65.61 Favored 'General case' 0 N--CA 1.499 1.987 0 O-C-N 121.603 -0.686 . . . . 0.0 110.138 179.386 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 60' ' ' MET . . . . . . . . . . . . . 11.5 tpp -59.14 -38.56 79.97 Favored 'General case' 0 N--CA 1.497 1.894 0 O-C-N 121.386 -0.821 . . . . 0.0 109.685 178.863 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 61' ' ' ILE . . . . . 0.449 HG12 ' CG2' ' A' ' 72' ' ' VAL . 15.9 mt -70.73 -41.65 77.59 Favored 'Isoleucine or valine' 0 N--CA 1.497 1.885 0 O-C-N 121.433 -0.792 . . . . 0.0 109.353 178.862 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 62' ' ' ASP . . . . . 0.53 ' HA ' ' HB3' ' A' ' 65' ' ' ASP . 17.8 m-20 -54.84 -32.37 60.51 Favored 'General case' 0 N--CA 1.5 2.036 0 O-C-N 121.596 -0.69 . . . . 0.0 110.719 179.522 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 63' ' ' GLU . . . . . . . . . . . . . 1.4 tm-20 -50.27 -43.35 53.28 Favored 'General case' 0 N--CA 1.5 2.072 0 O-C-N 121.641 -0.662 . . . . 0.0 110.878 179.914 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 64' ' ' VAL . . . . . . . . . . . . . 27.2 m -113.08 0.2 9.08 Favored 'Isoleucine or valine' 0 N--CA 1.501 2.092 0 O-C-N 121.265 -0.897 . . . . 0.0 111.219 179.631 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 65' ' ' ASP . . . . . 0.53 ' HB3' ' HA ' ' A' ' 62' ' ' ASP . 19.7 t70 -86.32 -95.18 0.08 Allowed 'General case' 0 N--CA 1.498 1.949 0 O-C-N 121.211 -0.931 . . . . 0.0 110.37 179.927 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 66' ' ' GLU . . . . . . . . . . . . . 2.3 tp10 50.89 35.21 11.86 Favored 'General case' 0 N--CA 1.502 2.161 0 O-C-N 121.214 -0.929 . . . . 0.0 111.253 -179.759 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 67' ' ' ASP . . . . . . . . . . . . . 3.8 p-10 -117.2 -5.45 11.35 Favored 'General case' 0 N--CA 1.501 2.084 0 O-C-N 121.1 -1.0 . . . . 0.0 111.673 -179.946 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 68' ' ' GLY . . . . . . . . . . . . . . . 109.66 -26.46 14.37 Favored Glycine 0 N--CA 1.496 2.64 0 N-CA-C 110.239 -1.145 . . . . 0.0 110.239 179.822 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 69' ' ' SER . . . . . . . . . . . . . 0.5 OUTLIER -79.68 -41.22 27.29 Favored 'General case' 0 N--CA 1.498 1.955 0 O-C-N 121.227 -1.161 . . . . 0.0 110.731 -179.769 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 70' ' ' GLY . . . . . . . . . . . . . . . 74.0 26.57 68.51 Favored Glycine 0 N--CA 1.497 2.756 0 N-CA-C 109.643 -1.383 . . . . 0.0 109.643 -179.578 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 71' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -140.11 148.29 41.49 Favored 'General case' 0 N--CA 1.497 1.879 0 O-C-N 121.527 -0.984 . . . . 0.0 109.193 179.931 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 72' ' ' VAL . . . . . 0.542 ' HB ' ' HB ' ' A' ' 36' ' ' ILE . 59.4 t -75.34 114.78 15.83 Favored 'Isoleucine or valine' 0 N--CA 1.498 1.957 0 O-C-N 121.367 -0.833 . . . . 0.0 110.539 -179.553 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 73' ' ' ASP . . . . . . . . . . . . . 4.6 m-20 -86.23 -166.32 1.51 Allowed 'General case' 0 N--CA 1.498 1.973 0 O-C-N 121.331 -0.856 . . . . 0.0 109.242 179.263 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 74' ' ' PHE . . . . . . . . . . . . . 53.4 t80 -74.25 -58.38 3.33 Favored 'General case' 0 N--CA 1.498 1.964 0 O-C-N 120.841 -1.162 . . . . 0.0 109.714 179.328 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 75' ' ' ASP . . . . . 0.804 ' HA ' HD12 ' A' ' 78' ' ' LEU . 0.4 OUTLIER -63.84 -33.82 76.54 Favored 'General case' 0 N--CA 1.496 1.864 0 O-C-N 121.452 -0.78 . . . . 0.0 110.162 179.552 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild core ' A' A ' 76' ' ' GLU . . . . . . . . . . . . . 6.1 tt0 -62.16 -38.67 89.93 Favored 'General case' 0 N--CA 1.497 1.893 0 O-C-N 121.23 -0.918 . . . . 0.0 108.884 178.507 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 77' ' ' PHE . . . . . . . . . . . . . 65.2 t80 -62.72 -38.63 91.22 Favored 'General case' 0 N--CA 1.494 1.753 0 O-C-N 121.69 -0.631 . . . . 0.0 109.355 178.347 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 78' ' ' LEU . . . . . 0.804 HD12 ' HA ' ' A' ' 75' ' ' ASP . 14.3 mt -60.86 -36.59 79.54 Favored 'General case' 0 N--CA 1.498 1.967 0 O-C-N 121.475 -0.765 . . . . 0.0 110.049 178.899 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 79' ' ' VAL . . . . . 0.564 HG22 HG21 ' A' ' 9' ' ' VAL . 45.0 t -62.67 -43.56 98.7 Favored 'Isoleucine or valine' 0 N--CA 1.501 2.099 0 O-C-N 121.43 -0.794 . . . . 0.0 109.067 179.205 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 80' ' ' MET . . . . . . . . . . . . . 13.6 ttm -65.58 -36.11 82.79 Favored 'General case' 0 N--CA 1.494 1.753 0 O-C-N 121.542 -0.724 . . . . 0.0 109.355 178.593 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 81' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -58.43 -53.11 61.98 Favored 'General case' 0 N--CA 1.497 1.899 0 O-C-N 121.531 -0.731 . . . . 0.0 110.115 179.403 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 82' ' ' VAL . . . . . 0.523 HG23 ' HE3' ' A' ' 85' ' ' MET . 14.2 p -69.88 -26.51 30.37 Favored 'Isoleucine or valine' 0 N--CA 1.499 2.002 0 O-C-N 121.242 -0.911 . . . . 0.0 110.289 179.213 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 83' ' ' ARG . . . . . 0.519 ' HD2' HG12 ' A' ' 79' ' ' VAL . 27.2 mtt-85 -69.41 -45.18 69.82 Favored 'General case' 0 N--CA 1.498 1.967 0 O-C-N 121.282 -0.886 . . . . 0.0 110.111 179.387 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 84' ' ' CYS . . . . . 0.495 ' HB3' ' HA ' ' B' ' 149' ' ' SER . 86.3 m -98.69 27.08 5.09 Favored 'General case' 0 N--CA 1.498 1.928 0 O-C-N 121.392 -0.818 . . . . 0.0 110.584 179.593 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 85' ' ' MET . . . . . 0.523 ' HE3' HG23 ' A' ' 82' ' ' VAL . 0.0 OUTLIER . . . . . 0 N--CA 1.498 1.939 0 O-C-N 121.252 -0.905 . . . . 0.0 110.59 179.646 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' B' B ' 149' ' ' SER . . . . . 0.495 ' HA ' ' HB3' ' A' ' 84' ' ' CYS . 86.3 p . . . . . 0 N--CA 1.496 1.86 0 CA-C-O 121.097 0.475 . . . . 0.0 110.096 . . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' B' B ' 150' ' ' ALA . . . . . . . . . . . . . . . -74.65 -42.3 58.77 Favored 'General case' 0 N--CA 1.497 1.907 0 O-C-N 121.302 -0.874 . . . . 0.0 110.871 -179.731 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' B' B ' 151' ' ' ASP . . . . . . . . . . . . . 31.2 t70 -61.39 -52.62 63.86 Favored 'General case' 0 N--CA 1.498 1.97 0 O-C-N 121.462 -0.773 . . . . 0.0 110.882 -179.732 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' B' B ' 152' ' ' ALA . . . . . . . . . . . . . . . -52.33 -45.22 65.56 Favored 'General case' 0 N--CA 1.504 2.232 0 O-C-N 121.3 -0.875 . . . . 0.0 111.047 -179.918 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' B' B ' 153' ' ' MET . . . . . . . . . . . . . 1.3 ttt -73.16 -44.05 60.59 Favored 'General case' 0 N--CA 1.499 1.985 0 O-C-N 121.281 -0.887 . . . . 0.0 110.655 179.984 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' B' B ' 154' ' ' MET . . . . . 0.575 ' HG3' HD12 ' B' ' 158' ' ' LEU . 0.0 OUTLIER -59.4 -37.97 79.36 Favored 'General case' 0 N--CA 1.501 2.113 0 O-C-N 121.467 -0.771 . . . . 0.0 110.457 179.792 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild core ' B' B ' 155' ' ' GLN . . . . . . . . . . . . . 47.5 mt-30 -67.11 -38.4 85.57 Favored 'General case' 0 N--CA 1.499 1.998 0 O-C-N 121.539 -0.726 . . . . 0.0 110.908 179.859 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' B' B ' 156' ' ' ALA . . . . . . . . . . . . . . . -79.03 -34.39 43.94 Favored 'General case' 0 N--CA 1.498 1.951 0 O-C-N 121.321 -0.862 . . . . 0.0 110.971 -179.713 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' B' B ' 157' ' ' LEU . . . . . 0.452 HD22 ' HB ' ' A' ' 26' ' ' ILE . 17.6 mt -75.27 -42.03 55.88 Favored 'General case' 0 N--CA 1.499 1.978 0 O-C-N 121.244 -0.91 . . . . 0.0 111.211 -179.497 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' B' B ' 158' ' ' LEU . . . . . 0.575 HD12 ' HG3' ' B' ' 154' ' ' MET . 95.9 mt . . . . . 0 N--CA 1.499 2.005 0 O-C-N 121.137 -0.977 . . . . 0.0 110.941 -179.366 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 4' ' ' ILE . . . . . . . . . . . . . 4.9 mt . . . . . 0 N--CA 1.499 1.988 0 CA-C-O 120.78 0.324 . . . . 0.0 110.589 . . . . . . . . . 0 0 . 1 . 014 nuclear nobuild core ' A' A ' 5' ' ' TYR . . . . . . . . . . . . . 1.6 m-85 -63.93 -29.78 70.92 Favored 'General case' 0 N--CA 1.502 2.142 0 O-C-N 121.26 -0.9 . . . . 0.0 110.703 179.691 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 27.7 ttpt -65.11 -36.86 85.63 Favored 'General case' 0 N--CA 1.497 1.907 0 O-C-N 121.24 -0.913 . . . . 0.0 110.057 179.182 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 7' ' ' ALA . . . . . . . . . . . . . . . -58.13 -38.66 76.96 Favored 'General case' 0 N--CA 1.497 1.882 0 O-C-N 121.6 -0.688 . . . . 0.0 110.13 179.505 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 8' ' ' ALA . . . . . . . . . . . . . . . -66.42 -44.03 84.07 Favored 'General case' 0 N--CA 1.497 1.906 0 O-C-N 121.507 -0.746 . . . . 0.0 110.182 179.454 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 9' ' ' VAL . . . . . . . . . . . . . 19.6 t -64.89 -44.01 96.25 Favored 'Isoleucine or valine' 0 N--CA 1.5 2.051 0 O-C-N 121.352 -0.843 . . . . 0.0 110.015 179.362 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 10' ' ' GLU . . . . . . . . . . . . . 31.1 mm-40 -74.09 -19.66 60.52 Favored 'General case' 0 N--CA 1.496 1.849 0 O-C-N 121.346 -0.846 . . . . 0.0 110.356 179.42 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 11' ' ' GLN . . . . . . . . . . . . . 0.2 OUTLIER -58.98 -49.38 78.12 Favored 'General case' 0 N--CA 1.498 1.947 0 O-C-N 121.412 -0.805 . . . . 0.0 109.906 179.425 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 12' ' ' LEU . . . . . 0.711 HD11 ' HG3' ' A' ' 17' ' ' LYS . 0.9 OUTLIER -72.18 134.45 45.69 Favored 'General case' 0 N--CA 1.495 1.812 0 O-C-N 121.314 -0.866 . . . . 0.0 109.003 178.953 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild core ' A' A ' 13' ' ' THR . . . . . 0.477 HG23 ' HB2' ' A' ' 15' ' ' GLU . 13.3 t -60.76 166.16 3.5 Favored 'General case' 0 N--CA 1.501 2.116 0 O-C-N 121.277 -0.889 . . . . 0.0 112.12 -178.009 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 14' ' ' GLU . . . . . 0.558 ' HA ' ' HD3' ' A' ' 17' ' ' LYS . 4.5 tp10 -61.51 -26.21 67.77 Favored 'General case' 0 N--CA 1.493 1.695 0 CA-C-N 116.213 -0.449 . . . . 0.0 110.921 -179.538 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 15' ' ' GLU . . . . . 0.477 ' HB2' HG23 ' A' ' 13' ' ' THR . 1.4 mp0 -57.54 -44.06 84.86 Favored 'General case' 0 N--CA 1.498 1.973 0 O-C-N 121.279 -0.888 . . . . 0.0 109.068 179.049 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 16' ' ' GLN . . . . . 0.494 ' HB2' HD12 ' A' ' 12' ' ' LEU . 44.1 mt-30 -68.82 -38.46 79.88 Favored 'General case' 0 N--CA 1.497 1.889 0 CA-C-O 121.743 0.782 . . . . 0.0 109.033 178.168 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 17' ' ' LYS . . . . . 0.711 ' HG3' HD11 ' A' ' 12' ' ' LEU . 0.0 OUTLIER -61.84 -29.54 70.24 Favored 'General case' 0 N--CA 1.497 1.898 0 N-CA-C 109.608 -0.516 . . . . 0.0 109.608 178.734 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild core ' A' A ' 18' ' ' ASN . . . . . . . . . . . . . 4.6 t-20 -59.45 -43.34 93.19 Favored 'General case' 0 N--CA 1.499 1.976 0 O-C-N 121.592 -0.693 . . . . 0.0 110.154 179.357 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 19' ' ' GLU . . . . . 0.596 ' HB3' ' HE2' ' B' ' 154' ' ' MET . 1.2 mp0 -56.82 -41.86 78.56 Favored 'General case' 0 N--CA 1.497 1.911 0 O-C-N 121.381 -0.825 . . . . 0.0 109.499 179.138 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 20' ' ' PHE . . . . . . . . . . . . . 14.9 m-85 -70.19 -37.4 75.11 Favored 'General case' 0 N--CA 1.494 1.757 0 O-C-N 121.445 -0.784 . . . . 0.0 109.32 178.413 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 21' ' ' LYS . . . . . 0.553 ' HG3' ' N ' ' A' ' 22' ' ' ALA . 0.0 OUTLIER -63.82 -31.7 72.97 Favored 'General case' 0 N--CA 1.495 1.806 0 O-C-N 121.489 -0.757 . . . . 0.0 109.188 178.677 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild core ' A' A ' 22' ' ' ALA . . . . . 0.553 ' N ' ' HG3' ' A' ' 21' ' ' LYS . . . -69.13 -43.58 74.1 Favored 'General case' 0 N--CA 1.495 1.778 0 O-C-N 121.402 -0.811 . . . . 0.0 109.007 178.154 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 23' ' ' ALA . . . . . . . . . . . . . . . -68.84 -43.45 75.45 Favored 'General case' 0 N--CA 1.497 1.885 0 O-C-N 121.558 -0.714 . . . . 0.0 109.369 178.672 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 24' ' ' PHE . . . . . . . . . . . . . 20.1 t80 -60.53 -37.63 81.82 Favored 'General case' 0 N--CA 1.497 1.876 0 O-C-N 121.64 -0.662 . . . . 0.0 109.851 179.027 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 25' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -54.1 -45.59 71.86 Favored 'General case' 0 N--CA 1.5 2.038 0 O-C-N 121.675 -0.641 . . . . 0.0 110.769 179.547 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 26' ' ' ILE . . . . . . . . . . . . . 2.3 mt -87.07 -9.84 11.07 Favored 'Isoleucine or valine' 0 N--CA 1.499 2.01 0 O-C-N 121.304 -0.872 . . . . 0.0 110.485 179.844 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 27' ' ' PHE . . . . . 0.56 ' CE1' HD22 ' A' ' 41' ' ' LEU . 0.1 OUTLIER -73.83 -32.24 63.59 Favored 'General case' 0 N--CA 1.496 1.857 0 O-C-N 121.145 -0.972 . . . . 0.0 109.994 179.386 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild core ' A' A ' 28' ' ' VAL . . . . . . . . . . . . . 15.7 m -100.23 48.56 0.12 Allowed 'Isoleucine or valine' 0 N--CA 1.499 1.989 0 O-C-N 121.52 -0.738 . . . . 0.0 110.246 179.55 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 29' ' ' LEU . . . . . . . . . . . . . 7.0 mt -67.1 -48.51 67.94 Favored 'General case' 0 N--CA 1.5 2.069 0 O-C-N 121.287 -0.883 . . . . 0.0 109.911 179.653 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 30' ' ' GLY . . . . . . . . . . . . . . . -109.24 28.63 10.69 Favored Glycine 0 N--CA 1.495 2.578 0 N-CA-C 109.392 -1.483 . . . . 0.0 109.392 179.117 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 31' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.493 1.723 0 O-C-N 121.308 -1.113 . . . . 0.0 110.053 179.953 . . . . . . . . 0 0 . 1 . 014 nuclear nobuild core ' A' A ' 35' ' ' CYS . . . . . 0.49 ' HB3' ' HA ' ' A' ' 73' ' ' ASP . 0.1 OUTLIER . . . . . 0 N--CA 1.498 1.931 0 CA-C-O 121.081 0.467 . . . . 0.0 110.426 . . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 36' ' ' ILE . . . . . 0.573 ' O ' HG22 ' A' ' 71' ' ' THR . 38.2 mt -75.87 122.49 29.98 Favored 'Isoleucine or valine' 0 N--CA 1.497 1.922 0 O-C-N 121.115 -0.99 . . . . 0.0 110.537 -179.478 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 37' ' ' SER . . . . . . . . . . . . . 41.6 t -92.5 159.84 15.33 Favored 'General case' 0 N--CA 1.495 1.787 0 O-C-N 121.58 -0.7 . . . . 0.0 110.041 179.516 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 38' ' ' THR . . . . . 0.567 HG21 ' HA ' ' A' ' 58' ' ' GLN . 11.4 p -63.2 -37.21 86.32 Favored 'General case' 0 N--CA 1.501 2.106 0 O-C-N 121.337 -0.852 . . . . 0.0 110.556 179.954 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 39' ' ' LYS . . . . . . . . . . . . . 2.4 tttp -59.35 -42.79 92.35 Favored 'General case' 0 N--CA 1.498 1.969 0 O-C-N 121.357 -0.839 . . . . 0.0 109.903 179.322 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 1.6 mm-40 -69.1 -42.88 75.52 Favored 'General case' 0 N--CA 1.497 1.913 0 O-C-N 121.525 -0.735 . . . . 0.0 109.92 179.28 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 41' ' ' LEU . . . . . 0.56 HD22 ' CE1' ' A' ' 27' ' ' PHE . 0.1 OUTLIER -60.34 -63.94 1.13 Allowed 'General case' 0 N--CA 1.499 1.997 0 O-C-N 121.655 -0.653 . . . . 0.0 110.23 179.647 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild core ' A' A ' 42' ' ' GLY . . . . . . . . . . . . . . . -48.02 -42.11 22.72 Favored Glycine 0 N--CA 1.502 3.098 0 N-CA-C 110.098 -1.201 . . . . 0.0 110.098 179.655 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 43' ' ' LYS . . . . . . . . . . . . . 66.3 tttt -62.93 -38.05 89.49 Favored 'General case' 0 N--CA 1.501 2.103 0 O-C-N 121.301 -1.117 . . . . 0.0 110.356 179.184 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 44' ' ' VAL . . . . . . . . . . . . . 5.3 t -66.91 -26.62 37.33 Favored 'Isoleucine or valine' 0 N--CA 1.502 2.127 0 O-C-N 121.469 -0.769 . . . . 0.0 110.752 179.589 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 45' ' ' MET . . . . . . . . . . . . . 4.9 mmt -58.79 -29.52 66.9 Favored 'General case' 0 N--CA 1.503 2.222 0 O-C-N 121.192 -0.942 . . . . 0.0 111.455 -179.82 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 46' ' ' ARG . . . . . . . . . . . . . 18.0 ttp180 -56.01 -38.24 70.24 Favored 'General case' 0 N--CA 1.503 2.181 0 O-C-N 121.212 -0.93 . . . . 0.0 110.931 -179.91 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 47' ' ' MET . . . . . . . . . . . . . 14.5 ttp -89.13 4.76 47.41 Favored 'General case' 0 N--CA 1.501 2.087 0 O-C-N 121.27 -0.894 . . . . 0.0 111.148 179.716 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 48' ' ' LEU . . . . . . . . . . . . . 11.9 tp -117.14 -53.73 2.45 Favored 'General case' 0 N--CA 1.494 1.768 0 O-C-N 120.978 -1.076 . . . . 0.0 110.33 -179.824 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 49' ' ' GLY . . . . . 0.461 ' O ' ' HB2' ' A' ' 50' ' ' GLN . . . 170.51 119.4 0.5 Allowed Glycine 0 N--CA 1.493 2.466 0 N-CA-C 109.69 -1.364 . . . . 0.0 109.69 -179.976 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 50' ' ' GLN . . . . . 0.461 ' HB2' ' O ' ' A' ' 49' ' ' GLY . 64.3 mt-30 60.29 -177.7 0.1 Allowed 'General case' 0 N--CA 1.505 2.292 0 O-C-N 121.913 -0.757 . . . . 0.0 111.251 -179.97 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 51' ' ' ASN . . . . . . . . . . . . . 8.7 t-20 -159.35 105.37 1.51 Allowed Pre-proline 0 N--CA 1.496 1.858 0 O-C-N 121.231 -0.918 . . . . 0.0 110.274 -179.769 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 52' ' ' PRO . . . . . 0.71 ' HG2' HD11 ' A' ' 57' ' ' LEU . 52.6 Cg_endo -78.57 165.8 24.63 Favored 'Trans proline' 0 C--N 1.314 -1.252 0 O-C-N 123.819 1.431 . . . . 0.0 110.287 179.98 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 53' ' ' THR . . . . . 0.554 ' HB ' ' HD2' ' A' ' 54' ' ' PRO . 41.5 p -73.76 166.78 41.2 Favored Pre-proline 0 N--CA 1.5 2.042 0 O-C-N 121.103 -0.998 . . . . 0.0 110.448 179.938 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 54' ' ' PRO . . . . . 0.554 ' HD2' ' HB ' ' A' ' 53' ' ' THR . 39.6 Cg_endo -65.52 -40.87 16.8 Favored 'Trans proline' 0 N--CA 1.493 1.452 0 O-C-N 123.707 1.372 . . . . 0.0 111.051 -179.78 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 55' ' ' GLU . . . . . . . . . . . . . 27.3 mm-40 -69.43 -30.3 68.2 Favored 'General case' 0 N--CA 1.496 1.846 0 O-C-N 121.393 -0.817 . . . . 0.0 110.075 179.41 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 1.4 tt0 -54.86 -50.45 68.65 Favored 'General case' 0 N--CA 1.498 1.957 0 O-C-N 121.455 -0.778 . . . . 0.0 110.248 179.643 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 57' ' ' LEU . . . . . 0.71 HD11 ' HG2' ' A' ' 52' ' ' PRO . 1.2 mt -77.58 -22.66 50.6 Favored 'General case' 0 N--CA 1.495 1.796 0 O-C-N 121.36 -0.838 . . . . 0.0 110.825 179.754 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 58' ' ' GLN . . . . . 0.567 ' HA ' HG21 ' A' ' 38' ' ' THR . 0.0 OUTLIER -60.61 -34.62 74.5 Favored 'General case' 0 N--CA 1.499 2.008 0 O-C-N 120.978 -1.076 . . . . 0.0 109.297 179.289 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild core ' A' A ' 59' ' ' GLU . . . . . 0.552 ' N ' ' HG3' ' A' ' 58' ' ' GLN . 12.9 mm-40 -79.77 -33.76 40.36 Favored 'General case' 0 N--CA 1.493 1.695 0 O-C-N 121.289 -0.882 . . . . 0.0 108.697 177.91 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 60' ' ' MET . . . . . . . . . . . . . 16.3 ttm -67.91 -41.42 82.69 Favored 'General case' 0 N--CA 1.495 1.808 0 O-C-N 121.714 -0.616 . . . . 0.0 109.836 178.681 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 61' ' ' ILE . . . . . 0.673 HG13 HG23 ' A' ' 72' ' ' VAL . 3.2 tt -68.04 -36.96 77.39 Favored 'Isoleucine or valine' 0 N--CA 1.495 1.824 0 O-C-N 121.561 -0.712 . . . . 0.0 109.839 179.53 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 62' ' ' ASP . . . . . 0.44 ' HA ' ' HB2' ' A' ' 65' ' ' ASP . 0.4 OUTLIER -68.68 -32.34 72.1 Favored 'General case' 0 N--CA 1.498 1.934 0 O-C-N 121.374 -0.829 . . . . 0.0 110.233 179.009 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild core ' A' A ' 63' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER -59.88 -44.27 94.3 Favored 'General case' 0 N--CA 1.498 1.962 0 O-C-N 121.363 -0.836 . . . . 0.0 110.16 179.534 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 64' ' ' VAL . . . . . 0.567 HG11 ' SD ' ' A' ' 80' ' ' MET . 11.9 p -103.86 24.32 1.83 Allowed 'Isoleucine or valine' 0 N--CA 1.496 1.846 0 O-C-N 121.432 -0.793 . . . . 0.0 110.768 179.839 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 65' ' ' ASP . . . . . 0.44 ' HB2' ' HA ' ' A' ' 62' ' ' ASP . 2.7 t70 -84.41 153.62 23.3 Favored 'General case' 0 N--CA 1.495 1.803 0 O-C-N 120.971 -1.081 . . . . 0.0 110.256 179.756 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 66' ' ' GLU . . . . . . . . . . . . . 32.4 mt-10 -121.11 11.15 10.86 Favored 'General case' 0 N--CA 1.495 1.787 0 O-C-N 121.423 -0.798 . . . . 0.0 111.828 -179.263 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 67' ' ' ASP . . . . . . . . . . . . . 1.1 p30 -146.84 0.51 0.75 Allowed 'General case' 0 N--CA 1.502 2.16 0 O-C-N 120.753 -1.217 . . . . 0.0 113.205 -179.692 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 68' ' ' GLY . . . . . . . . . . . . . . . 89.02 -24.63 12.29 Favored Glycine 0 N--CA 1.497 2.702 0 O-C-N 120.576 -1.328 . . . . 0.0 111.1 179.14 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 69' ' ' SER . . . . . . . . . . . . . 4.2 p -54.45 -29.75 50.66 Favored 'General case' 0 N--CA 1.503 2.181 0 O-C-N 121.107 -1.231 . . . . 0.0 110.403 179.943 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 70' ' ' GLY . . . . . . . . . . . . . . . 71.32 41.89 58.16 Favored Glycine 0 N--CA 1.497 2.712 0 N-CA-C 109.419 -1.472 . . . . 0.0 109.419 -179.761 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 71' ' ' THR . . . . . 0.573 HG22 ' O ' ' A' ' 36' ' ' ILE . 0.2 OUTLIER -142.67 139.04 31.04 Favored 'General case' 0 N--CA 1.498 1.932 0 O-C-N 121.513 -0.992 . . . . 0.0 109.017 179.85 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild core ' A' A ' 72' ' ' VAL . . . . . 0.673 HG23 HG13 ' A' ' 61' ' ' ILE . 38.5 t -75.41 111.44 11.71 Favored 'Isoleucine or valine' 0 N--CA 1.499 1.991 0 O-C-N 121.337 -0.852 . . . . 0.0 111.178 -178.899 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 73' ' ' ASP . . . . . 0.49 ' HA ' ' HB3' ' A' ' 35' ' ' CYS . 8.6 m-20 -87.53 -173.01 4.15 Favored 'General case' 0 N--CA 1.494 1.728 0 O-C-N 121.711 -0.618 . . . . 0.0 109.405 178.941 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 74' ' ' PHE . . . . . . . . . . . . . 87.2 t80 -61.95 -48.47 80.26 Favored 'General case' 0 N--CA 1.5 2.054 0 O-C-N 121.071 -1.018 . . . . 0.0 110.237 179.804 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 75' ' ' ASP . . . . . . . . . . . . . 0.1 OUTLIER -69.36 -45.11 70.15 Favored 'General case' 0 N--CA 1.496 1.852 0 O-C-N 121.457 -0.777 . . . . 0.0 110.355 179.786 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 76' ' ' GLU . . . . . . . . . . . . . 3.2 mt-10 -59.6 -34.73 73.12 Favored 'General case' 0 N--CA 1.499 1.998 0 O-C-N 121.433 -0.792 . . . . 0.0 110.073 179.38 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 77' ' ' PHE . . . . . . . . . . . . . 48.2 t80 -62.25 -43.96 97.63 Favored 'General case' 0 N--CA 1.496 1.86 0 O-C-N 121.48 -0.763 . . . . 0.0 109.644 178.866 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 78' ' ' LEU . . . . . . . . . . . . . 67.5 mt -66.39 -40.94 89.96 Favored 'General case' 0 N--CA 1.499 1.986 0 O-C-N 121.516 -0.74 . . . . 0.0 109.742 179.11 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 79' ' ' VAL . . . . . . . . . . . . . 5.2 t -62.98 -35.0 69.58 Favored 'Isoleucine or valine' 0 N--CA 1.501 2.082 0 O-C-N 121.502 -0.749 . . . . 0.0 110.11 179.355 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 80' ' ' MET . . . . . 0.567 ' SD ' HG11 ' A' ' 64' ' ' VAL . 0.0 OUTLIER -73.58 -31.85 63.82 Favored 'General case' 0 N--CA 1.497 1.891 0 O-C-N 121.308 -0.87 . . . . 0.0 110.341 179.647 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild core ' A' A ' 81' ' ' MET . . . . . . . . . . . . . 12.0 mmt -63.54 -50.5 69.32 Favored 'General case' 0 N--CA 1.498 1.965 0 O-C-N 121.419 -0.801 . . . . 0.0 110.465 179.857 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 82' ' ' VAL . . . . . . . . . . . . . 10.9 p -66.87 -29.14 45.33 Favored 'Isoleucine or valine' 0 N--CA 1.498 1.953 0 O-C-N 121.368 -0.833 . . . . 0.0 110.29 179.606 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 83' ' ' ARG . . . . . . . . . . . . . 3.0 mtt85 -56.92 -41.16 77.68 Favored 'General case' 0 N--CA 1.501 2.103 0 O-C-N 121.307 -0.87 . . . . 0.0 109.777 178.99 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 84' ' ' CYS . . . . . . . . . . . . . 84.4 m -85.45 -33.9 21.78 Favored 'General case' 0 N--CA 1.497 1.893 0 O-C-N 121.477 -0.764 . . . . 0.0 109.584 178.857 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 85' ' ' MET . . . . . . . . . . . . . 36.2 ttp . . . . . 0 N--CA 1.496 1.864 0 O-C-N 121.46 -0.775 . . . . 0.0 109.88 179.403 . . . . . . . . 0 0 . 1 . 014 nuclear nobuild core ' B' B ' 149' ' ' SER . . . . . . . . . . . . . 8.8 t . . . . . 0 N--CA 1.502 2.159 0 CA-C-O 121.093 0.473 . . . . 0.0 110.766 . . . . . . . . . 0 0 . 1 . 014 nuclear nobuild core ' B' B ' 150' ' ' ALA . . . . . . . . . . . . . . . -111.36 -43.64 3.67 Favored 'General case' 0 N--CA 1.496 1.84 0 O-C-N 121.259 -0.9 . . . . 0.0 110.403 -179.974 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' B' B ' 151' ' ' ASP . . . . . . . . . . . . . 8.0 p-10 -58.09 -42.87 86.57 Favored 'General case' 0 N--CA 1.499 1.993 0 O-C-N 121.541 -0.725 . . . . 0.0 111.287 -179.771 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' B' B ' 152' ' ' ALA . . . . . . . . . . . . . . . -58.49 -50.02 75.25 Favored 'General case' 0 N--CA 1.499 2.009 0 O-C-N 121.149 -0.969 . . . . 0.0 110.239 179.8 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' B' B ' 153' ' ' MET . . . . . . . . . . . . . 1.5 ttt -68.33 -36.58 79.49 Favored 'General case' 0 N--CA 1.497 1.905 0 O-C-N 121.431 -0.793 . . . . 0.0 109.908 179.233 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' B' B ' 154' ' ' MET . . . . . 0.596 ' HE2' ' HB3' ' A' ' 19' ' ' GLU . 4.1 mtt -61.5 -47.83 83.83 Favored 'General case' 0 N--CA 1.497 1.912 0 O-C-N 121.501 -0.75 . . . . 0.0 110.063 179.523 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' B' B ' 155' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -63.33 -28.51 70.06 Favored 'General case' 0 N--CA 1.499 1.99 0 O-C-N 121.462 -0.774 . . . . 0.0 110.962 179.739 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' B' B ' 156' ' ' ALA . . . . . . . . . . . . . . . -89.66 -22.23 22.37 Favored 'General case' 0 N--CA 1.501 2.078 0 O-C-N 121.236 -0.915 . . . . 0.0 111.724 -179.439 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' B' B ' 157' ' ' LEU . . . . . . . . . . . . . 9.3 mt -99.12 -43.56 6.6 Favored 'General case' 0 N--CA 1.499 2.012 0 O-C-N 120.893 -1.129 . . . . 0.0 111.203 -179.486 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' B' B ' 158' ' ' LEU . . . . . . . . . . . . . 5.9 mp . . . . . 0 N--CA 1.499 1.999 0 O-C-N 121.201 -0.937 . . . . 0.0 110.49 -179.66 . . . . . . . . 0 0 . 1 . 015 nuclear nobuild core ' A' A ' 4' ' ' ILE . . . . . . . . . . . . . 2.7 mp . . . . . 0 N--CA 1.497 1.919 0 CA-C-O 120.734 0.302 . . . . 0.0 110.417 . . . . . . . . . 0 0 . 1 . 015 nuclear nobuild core ' A' A ' 5' ' ' TYR . . . . . . . . . . . . . 12.2 m-85 -62.3 -40.56 96.69 Favored 'General case' 0 N--CA 1.499 2.013 0 O-C-N 121.303 -0.873 . . . . 0.0 110.306 179.842 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 9.7 ttmt -69.95 -37.59 75.88 Favored 'General case' 0 N--CA 1.496 1.846 0 O-C-N 121.4 -0.813 . . . . 0.0 110.061 179.326 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 7' ' ' ALA . . . . . . . . . . . . . . . -51.81 -49.57 62.52 Favored 'General case' 0 N--CA 1.5 2.049 0 O-C-N 121.577 -0.702 . . . . 0.0 110.258 179.632 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 8' ' ' ALA . . . . . . . . . . . . . . . -61.0 -42.89 99.3 Favored 'General case' 0 N--CA 1.497 1.92 0 O-C-N 121.501 -0.749 . . . . 0.0 109.977 179.23 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 9' ' ' VAL . . . . . 0.408 ' HA ' HD12 ' A' ' 12' ' ' LEU . 38.3 t -60.07 -38.19 75.89 Favored 'Isoleucine or valine' 0 N--CA 1.501 2.123 0 O-C-N 121.48 -0.763 . . . . 0.0 110.135 179.414 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 10' ' ' GLU . . . . . . . . . . . . . 36.8 mt-10 -81.57 -31.66 32.51 Favored 'General case' 0 N--CA 1.497 1.877 0 O-C-N 121.51 -0.744 . . . . 0.0 110.192 179.633 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 11' ' ' GLN . . . . . . . . . . . . . 41.0 mt-30 -63.04 -32.03 73.3 Favored 'General case' 0 N--CA 1.5 2.063 0 O-C-N 121.588 -0.695 . . . . 0.0 111.027 179.923 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 12' ' ' LEU . . . . . 0.408 HD12 ' HA ' ' A' ' 9' ' ' VAL . 30.5 mt -54.54 139.49 37.8 Favored 'General case' 0 N--CA 1.501 2.112 0 O-C-N 121.292 -0.88 . . . . 0.0 110.397 179.85 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 13' ' ' THR . . . . . . . . . . . . . 72.1 p -77.55 165.01 24.86 Favored 'General case' 0 N--CA 1.499 1.979 0 O-C-N 121.216 -0.927 . . . . 0.0 110.025 179.643 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 14' ' ' GLU . . . . . 0.503 ' HA ' ' HD3' ' A' ' 17' ' ' LYS . 0.5 OUTLIER -55.22 -27.51 46.62 Favored 'General case' 0 N--CA 1.493 1.697 0 O-C-N 121.507 -0.746 . . . . 0.0 110.788 -179.6 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild core ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 1.5 mp0 -61.31 -47.49 85.69 Favored 'General case' 0 N--CA 1.496 1.848 0 O-C-N 121.351 -0.843 . . . . 0.0 109.329 178.828 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 16' ' ' GLN . . . . . . . . . . . . . 1.2 mt-30 -67.02 -41.65 86.26 Favored 'General case' 0 N--CA 1.498 1.953 0 CA-C-O 121.581 0.705 . . . . 0.0 109.614 178.784 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 17' ' ' LYS . . . . . 0.503 ' HD3' ' HA ' ' A' ' 14' ' ' GLU . 0.2 OUTLIER -59.42 -45.14 92.37 Favored 'General case' 0 N--CA 1.499 1.999 0 CA-C-O 121.119 0.485 . . . . 0.0 109.786 179.202 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild core ' A' A ' 18' ' ' ASN . . . . . . . . . . . . . 0.8 OUTLIER -69.35 -41.08 77.08 Favored 'General case' 0 N--CA 1.496 1.863 0 O-C-N 121.593 -0.692 . . . . 0.0 109.945 179.316 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 0.3 OUTLIER -60.39 -45.49 93.37 Favored 'General case' 0 N--CA 1.5 2.036 0 O-C-N 121.416 -0.802 . . . . 0.0 109.694 179.083 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 20' ' ' PHE . . . . . 0.456 ' CE1' ' HG2' ' A' ' 81' ' ' MET . 8.4 m-85 -64.73 -35.29 80.59 Favored 'General case' 0 N--CA 1.497 1.882 0 O-C-N 121.531 -0.731 . . . . 0.0 109.77 178.94 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 21' ' ' LYS . . . . . 0.467 ' HG3' ' N ' ' A' ' 22' ' ' ALA . 0.0 OUTLIER -60.82 -39.89 90.69 Favored 'General case' 0 N--CA 1.497 1.885 0 O-C-N 121.439 -0.788 . . . . 0.0 109.6 179.173 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild core ' A' A ' 22' ' ' ALA . . . . . 0.467 ' N ' ' HG3' ' A' ' 21' ' ' LYS . . . -62.99 -46.84 85.78 Favored 'General case' 0 N--CA 1.498 1.943 0 O-C-N 121.386 -0.821 . . . . 0.0 109.816 179.136 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 23' ' ' ALA . . . . . . . . . . . . . . . -66.81 -39.3 87.66 Favored 'General case' 0 N--CA 1.497 1.891 0 O-C-N 121.497 -0.752 . . . . 0.0 110.145 179.259 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 24' ' ' PHE . . . . . 0.447 ' CZ ' HG11 ' A' ' 28' ' ' VAL . 73.1 t80 -68.41 -39.83 81.49 Favored 'General case' 0 N--CA 1.498 1.941 0 O-C-N 121.516 -0.74 . . . . 0.0 110.297 179.607 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 25' ' ' ASP . . . . . . . . . . . . . 0.9 OUTLIER -54.24 -43.51 70.95 Favored 'General case' 0 N--CA 1.498 1.974 0 O-C-N 121.5 -0.75 . . . . 0.0 110.047 179.733 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 26' ' ' ILE . . . . . 0.718 ' HA ' HD23 ' A' ' 29' ' ' LEU . 12.9 mt -74.57 -28.07 21.75 Favored 'Isoleucine or valine' 0 N--CA 1.498 1.929 0 O-C-N 121.424 -0.797 . . . . 0.0 109.478 178.564 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 27' ' ' PHE . . . . . . . . . . . . . 0.2 OUTLIER -73.36 -10.54 59.85 Favored 'General case' 0 N--CA 1.498 1.953 0 O-C-N 121.285 -0.884 . . . . 0.0 111.239 179.452 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 28' ' ' VAL . . . . . 0.691 HG12 HG13 ' A' ' 36' ' ' ILE . 21.2 m -125.26 3.17 4.57 Favored 'Isoleucine or valine' 0 N--CA 1.501 2.103 0 O-C-N 121.036 -1.04 . . . . 0.0 111.25 179.841 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 29' ' ' LEU . . . . . 0.718 HD23 ' HA ' ' A' ' 26' ' ' ILE . 2.1 pp -65.64 -32.49 74.09 Favored 'General case' 0 N--CA 1.5 2.033 0 O-C-N 120.913 -1.117 . . . . 0.0 110.154 179.666 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 30' ' ' GLY . . . . . . . . . . . . . . . -114.58 28.05 8.44 Favored Glycine 0 N--CA 1.495 2.628 0 N-CA-C 109.283 -1.527 . . . . 0.0 109.283 178.939 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 31' ' ' ALA . . . . . 0.539 ' HB3' ' HA ' ' A' ' 28' ' ' VAL . . . . . . . . 0 N--CA 1.493 1.725 0 O-C-N 121.516 -0.99 . . . . 0.0 109.668 -179.994 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 35' ' ' CYS . . . . . . . . . . . . . 1.1 m . . . . . 0 N--CA 1.497 1.895 0 CA-C-O 121.163 0.506 . . . . 0.0 110.777 . . . . . . . . . 0 0 . 1 . 015 nuclear nobuild core ' A' A ' 36' ' ' ILE . . . . . 0.691 HG13 HG12 ' A' ' 28' ' ' VAL . 4.1 mt -129.12 126.12 63.72 Favored 'Isoleucine or valine' 0 N--CA 1.498 1.954 0 O-C-N 121.506 -0.746 . . . . 0.0 110.33 -179.983 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 37' ' ' SER . . . . . 0.559 ' C ' HG23 ' A' ' 38' ' ' THR . 1.1 t -125.1 66.33 1.12 Allowed 'General case' 0 N--CA 1.496 1.867 0 O-C-N 121.406 -0.809 . . . . 0.0 110.265 179.755 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 38' ' ' THR . . . . . 0.559 HG23 ' C ' ' A' ' 37' ' ' SER . 1.2 p 66.25 -43.59 0.4 Allowed 'General case' 0 N--CA 1.518 2.958 0 N-CA-C 112.866 0.691 . . . . 0.0 112.866 179.69 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 39' ' ' LYS . . . . . . . . . . . . . 3.7 ttpp -46.59 -64.84 0.66 Allowed 'General case' 0 N--CA 1.505 2.31 0 O-C-N 121.045 -1.035 . . . . 0.0 111.826 -178.941 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 40' ' ' GLU . . . . . 0.427 ' HB2' ' HB2' ' A' ' 31' ' ' ALA . 0.4 OUTLIER -71.44 -32.0 67.84 Favored 'General case' 0 N--CA 1.5 2.033 0 O-C-N 121.076 -1.015 . . . . 0.0 110.245 179.916 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild core ' A' A ' 41' ' ' LEU . . . . . 0.499 ' O ' HD12 ' A' ' 41' ' ' LEU . 4.8 tp -59.08 -50.95 72.13 Favored 'General case' 0 N--CA 1.497 1.919 0 O-C-N 121.5 -0.75 . . . . 0.0 110.377 179.737 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 42' ' ' GLY . . . . . . . . . . . . . . . -59.93 -38.06 93.56 Favored Glycine 0 N--CA 1.493 2.475 0 N-CA-C 110.033 -1.227 . . . . 0.0 110.033 -179.922 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 43' ' ' LYS . . . . . . . . . . . . . 1.9 ttpt -54.23 -44.32 71.61 Favored 'General case' 0 N--CA 1.5 2.036 0 O-C-N 121.439 -1.036 . . . . 0.0 109.832 179.251 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 44' ' ' VAL . . . . . . . . . . . . . 92.7 t -76.31 -39.46 34.58 Favored 'Isoleucine or valine' 0 N--CA 1.496 1.851 0 O-C-N 121.521 -0.737 . . . . 0.0 109.788 179.153 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 45' ' ' MET . . . . . . . . . . . . . 8.7 mmt -61.3 -36.74 80.91 Favored 'General case' 0 N--CA 1.501 2.089 0 O-C-N 121.393 -0.817 . . . . 0.0 109.944 179.222 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 46' ' ' ARG . . . . . . . . . . . . . 0.9 OUTLIER -64.02 -34.44 78.01 Favored 'General case' 0 N--CA 1.5 2.037 0 O-C-N 121.487 -0.758 . . . . 0.0 109.949 179.122 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 47' ' ' MET . . . . . . . . . . . . . 3.1 ttp -77.48 -35.16 53.95 Favored 'General case' 0 N--CA 1.496 1.852 0 O-C-N 121.484 -0.76 . . . . 0.0 109.777 179.401 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 48' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -136.04 89.89 2.53 Favored 'General case' 0 N--CA 1.495 1.794 0 O-C-N 121.407 -0.808 . . . . 0.0 109.57 179.295 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 49' ' ' GLY . . . . . 0.456 ' C ' ' HG3' ' A' ' 50' ' ' GLN . . . 147.36 -114.63 0.72 Allowed Glycine 0 N--CA 1.497 2.701 0 N-CA-C 109.617 -1.393 . . . . 0.0 109.617 -179.503 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 50' ' ' GLN . . . . . 0.456 ' HG3' ' C ' ' A' ' 49' ' ' GLY . 0.0 OUTLIER -149.21 -52.93 0.16 Allowed 'General case' 0 N--CA 1.502 2.163 0 O-C-N 121.575 -0.956 . . . . 0.0 109.818 179.914 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild core ' A' A ' 51' ' ' ASN . . . . . . . . . . . . . 45.3 t30 54.72 78.75 0.37 Allowed Pre-proline 0 N--CA 1.502 2.134 0 O-C-N 121.8 -0.562 . . . . 0.0 112.11 179.317 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 52' ' ' PRO . . . . . . . . . . . . . 44.8 Cg_endo -78.64 -61.55 0.03 OUTLIER 'Trans proline' 0 C--N 1.315 -1.224 0 O-C-N 123.601 1.316 . . . . 0.0 110.0 178.573 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 53' ' ' THR . . . . . . . . . . . . . 3.3 p -134.67 162.29 58.58 Favored Pre-proline 0 N--CA 1.492 1.639 0 O-C-N 121.297 -0.877 . . . . 0.0 109.623 179.611 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 54' ' ' PRO . . . . . . . . . . . . . 43.4 Cg_endo -68.42 -31.06 28.59 Favored 'Trans proline' 0 N--CA 1.491 1.381 0 O-C-N 123.498 1.262 . . . . 0.0 110.515 179.555 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 55' ' ' GLU . . . . . . . . . . . . . 28.9 mp0 -67.39 -29.4 68.9 Favored 'General case' 0 N--CA 1.496 1.853 0 O-C-N 121.548 -0.72 . . . . 0.0 110.227 179.381 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -60.57 -32.74 71.82 Favored 'General case' 0 N--CA 1.499 2.015 0 O-C-N 121.519 -0.738 . . . . 0.0 111.45 -179.754 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 57' ' ' LEU . . . . . 0.46 ' HB3' ' CD2' ' A' ' 41' ' ' LEU . 9.0 mt -89.17 -12.65 40.36 Favored 'General case' 0 N--CA 1.496 1.85 0 O-C-N 121.043 -1.036 . . . . 0.0 111.413 -179.408 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 58' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -66.3 -47.95 71.94 Favored 'General case' 0 N--CA 1.492 1.662 0 O-C-N 120.912 -1.118 . . . . 0.0 108.69 179.234 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 59' ' ' GLU . . . . . . . . . . . . . 8.5 pt-20 -61.15 -31.38 71.1 Favored 'General case' 0 N--CA 1.495 1.819 0 O-C-N 121.548 -0.72 . . . . 0.0 109.601 178.69 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 60' ' ' MET . . . . . 0.427 ' HB2' ' O ' ' A' ' 57' ' ' LEU . 1.9 mmm -61.08 -42.14 97.95 Favored 'General case' 0 N--CA 1.497 1.878 0 O-C-N 121.5 -0.75 . . . . 0.0 109.663 178.811 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 61' ' ' ILE . . . . . 0.848 HG23 HG23 ' A' ' 72' ' ' VAL . 10.9 mt -72.75 -45.42 57.01 Favored 'Isoleucine or valine' 0 N--CA 1.497 1.89 0 O-C-N 121.355 -0.841 . . . . 0.0 109.658 178.982 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 62' ' ' ASP . . . . . . . . . . . . . 10.4 m-20 -54.11 -35.09 61.77 Favored 'General case' 0 N--CA 1.499 1.989 0 O-C-N 121.675 -0.641 . . . . 0.0 111.064 -179.735 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 63' ' ' GLU . . . . . . . . . . . . . 3.5 tm-20 -58.47 -39.93 81.3 Favored 'General case' 0 N--CA 1.501 2.089 0 O-C-N 121.217 -0.927 . . . . 0.0 110.068 179.459 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 64' ' ' VAL . . . . . 0.512 HG12 ' NH2' ' A' ' 83' ' ' ARG . 23.1 m -107.23 23.81 3.04 Favored 'Isoleucine or valine' 0 N--CA 1.497 1.913 0 O-C-N 121.404 -0.81 . . . . 0.0 110.709 179.5 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 65' ' ' ASP . . . . . . . . . . . . . 11.3 t0 -98.2 97.15 8.6 Favored 'General case' 0 N--CA 1.495 1.806 0 O-C-N 121.104 -0.998 . . . . 0.0 110.074 179.648 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 66' ' ' GLU . . . . . . . . . . . . . 3.3 mp0 -91.88 28.67 1.75 Allowed 'General case' 0 N--CA 1.495 1.803 0 O-C-N 121.416 -0.802 . . . . 0.0 109.264 178.818 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 67' ' ' ASP . . . . . . . . . . . . . 1.0 OUTLIER -107.61 -29.58 9.09 Favored 'General case' 0 N--CA 1.492 1.65 0 O-C-N 121.593 -0.692 . . . . 0.0 110.361 -179.477 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 68' ' ' GLY . . . . . . . . . . . . . . . 80.08 19.39 69.91 Favored Glycine 0 N--CA 1.492 2.398 0 N-CA-C 108.215 -1.954 . . . . 0.0 108.215 -177.548 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 69' ' ' SER . . . . . . . . . . . . . 59.9 p -109.81 -44.9 3.73 Favored 'General case' 0 N--CA 1.493 1.704 0 O-C-N 121.609 -0.936 . . . . 0.0 110.393 -179.592 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 70' ' ' GLY . . . . . 0.417 ' O ' HG21 ' A' ' 61' ' ' ILE . . . 118.06 -40.21 2.38 Favored Glycine 0 N--CA 1.499 2.89 0 C-N-CA 119.927 -1.13 . . . . 0.0 110.881 179.518 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 71' ' ' THR . . . . . . . . . . . . . 4.7 m -76.45 144.21 40.05 Favored 'General case' 0 N--CA 1.505 2.276 0 O-C-N 121.002 -1.293 . . . . 0.0 110.342 -179.686 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 72' ' ' VAL . . . . . 0.848 HG23 HG23 ' A' ' 61' ' ' ILE . 0.7 OUTLIER -98.69 136.93 27.76 Favored 'Isoleucine or valine' 0 N--CA 1.497 1.888 0 O-C-N 121.496 -0.753 . . . . 0.0 110.373 179.919 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild core ' A' A ' 73' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER -113.81 -165.37 1.0 Allowed 'General case' 0 N--CA 1.496 1.874 0 O-C-N 121.371 -0.831 . . . . 0.0 110.05 179.814 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 74' ' ' PHE . . . . . . . . . . . . . 23.6 t80 -64.37 -44.85 90.09 Favored 'General case' 0 N--CA 1.499 1.984 0 O-C-N 121.174 -0.953 . . . . 0.0 110.475 179.893 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 75' ' ' ASP . . . . . . . . . . . . . 30.2 t70 -57.72 -51.9 67.64 Favored 'General case' 0 N--CA 1.497 1.909 0 O-C-N 121.412 -0.805 . . . . 0.0 109.881 179.447 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 76' ' ' GLU . . . . . 0.627 ' HB3' HG22 ' A' ' 72' ' ' VAL . 35.0 mt-10 -60.49 -37.09 79.95 Favored 'General case' 0 N--CA 1.499 1.989 0 O-C-N 121.576 -0.702 . . . . 0.0 109.771 178.9 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 77' ' ' PHE . . . . . 0.522 ' HA ' ' CE ' ' A' ' 80' ' ' MET . 2.4 t80 -57.63 -36.64 72.08 Favored 'General case' 0 N--CA 1.496 1.849 0 O-C-N 121.691 -0.63 . . . . 0.0 110.279 179.362 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 78' ' ' LEU . . . . . . . . . . . . . 12.5 mt -75.29 -37.12 61.04 Favored 'General case' 0 N--CA 1.496 1.84 0 O-C-N 121.512 -0.742 . . . . 0.0 110.943 -179.945 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 79' ' ' VAL . . . . . . . . . . . . . 66.1 t -62.11 -49.26 84.81 Favored 'Isoleucine or valine' 0 N--CA 1.503 2.196 0 O-C-N 121.23 -0.919 . . . . 0.0 111.21 -179.504 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 80' ' ' MET . . . . . 0.522 ' CE ' ' HA ' ' A' ' 77' ' ' PHE . 16.2 ptt? -69.67 -24.27 63.58 Favored 'General case' 0 N--CA 1.502 2.147 0 O-C-N 120.872 -1.143 . . . . 0.0 110.727 -179.806 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 81' ' ' MET . . . . . 0.456 ' HG2' ' CE1' ' A' ' 20' ' ' PHE . 24.9 tpp -73.89 -50.46 20.12 Favored 'General case' 0 N--CA 1.494 1.757 0 O-C-N 121.098 -1.002 . . . . 0.0 109.825 179.2 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 82' ' ' VAL . . . . . . . . . . . . . 30.1 m -62.25 -26.08 39.33 Favored 'Isoleucine or valine' 0 N--CA 1.503 2.19 0 O-C-N 121.174 -0.954 . . . . 0.0 109.846 178.905 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 83' ' ' ARG . . . . . 0.512 ' NH2' HG12 ' A' ' 64' ' ' VAL . 19.6 mtt180 -66.1 -52.32 49.72 Favored 'General case' 0 N--CA 1.496 1.858 0 O-C-N 121.283 -0.886 . . . . 0.0 108.936 178.601 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 84' ' ' CYS . . . . . . . . . . . . . 37.7 t -64.74 -23.36 67.22 Favored 'General case' 0 N--CA 1.499 2.009 0 O-C-N 121.648 -0.658 . . . . 0.0 110.397 178.964 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 85' ' ' MET . . . . . . . . . . . . . 9.5 mtt . . . . . 0 N--CA 1.499 1.991 0 O-C-N 121.301 -0.874 . . . . 0.0 110.647 179.257 . . . . . . . . 0 0 . 1 . 015 nuclear nobuild core ' B' B ' 149' ' ' SER . . . . . . . . . . . . . 30.1 t . . . . . 0 N--CA 1.499 1.994 0 CA-C-O 121.09 0.472 . . . . 0.0 110.477 . . . . . . . . . 0 0 . 1 . 015 nuclear nobuild core ' B' B ' 150' ' ' ALA . . . . . . . . . . . . . . . -58.24 -41.86 85.08 Favored 'General case' 0 N--CA 1.499 2.002 0 O-C-N 121.556 -0.715 . . . . 0.0 110.582 179.765 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' B' B ' 151' ' ' ASP . . . . . . . . . . . . . 20.7 t70 -67.16 -47.14 71.89 Favored 'General case' 0 N--CA 1.497 1.909 0 O-C-N 121.317 -0.864 . . . . 0.0 110.308 179.677 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' B' B ' 152' ' ' ALA . . . . . . . . . . . . . . . -60.01 -47.36 86.17 Favored 'General case' 0 N--CA 1.499 1.978 0 O-C-N 121.511 -0.743 . . . . 0.0 110.731 -179.94 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' B' B ' 153' ' ' MET . . . . . . . . . . . . . 0.1 OUTLIER -64.74 -40.05 94.65 Favored 'General case' 0 N--CA 1.498 1.932 0 O-C-N 121.328 -0.858 . . . . 0.0 110.239 179.769 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' B' B ' 154' ' ' MET . . . . . . . . . . . . . 3.1 tpp -63.18 -47.69 81.55 Favored 'General case' 0 N--CA 1.499 1.976 0 O-C-N 121.434 -0.791 . . . . 0.0 110.16 179.501 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' B' B ' 155' ' ' GLN . . . . . . . . . . . . . 0.8 OUTLIER -68.7 -36.95 79.14 Favored 'General case' 0 N--CA 1.5 2.032 0 O-C-N 121.388 -0.82 . . . . 0.0 110.494 179.573 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' B' B ' 156' ' ' ALA . . . . . . . . . . . . . . . -69.65 -29.79 67.34 Favored 'General case' 0 N--CA 1.499 2.005 0 O-C-N 121.306 -0.871 . . . . 0.0 110.934 179.881 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' B' B ' 157' ' ' LEU . . . . . 0.542 HD21 ' HB ' ' A' ' 26' ' ' ILE . 4.8 tp -84.9 -33.99 22.65 Favored 'General case' 0 N--CA 1.497 1.877 0 O-C-N 121.319 -0.863 . . . . 0.0 110.501 179.981 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' B' B ' 158' ' ' LEU . . . . . . . . . . . . . 4.2 mm? . . . . . 0 N--CA 1.496 1.862 0 O-C-N 121.297 -0.877 . . . . 0.0 110.308 -179.748 . . . . . . . . 0 0 . 1 . 016 nuclear nobuild core ' A' A ' 4' ' ' ILE . . . . . . . . . . . . . 9.5 mt . . . . . 0 N--CA 1.499 1.977 0 CA-C-O 121.033 0.444 . . . . 0.0 109.945 . . . . . . . . . 0 0 . 1 . 016 nuclear nobuild core ' A' A ' 5' ' ' TYR . . . . . 0.413 ' HB3' ' CG2' ' A' ' 79' ' ' VAL . 0.9 OUTLIER -66.92 -39.54 87.4 Favored 'General case' 0 N--CA 1.496 1.831 0 O-C-N 121.369 -0.832 . . . . 0.0 109.563 179.125 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild core ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 0.4 OUTLIER -68.07 -32.73 73.27 Favored 'General case' 0 N--CA 1.495 1.818 0 O-C-N 121.562 -0.712 . . . . 0.0 109.81 178.946 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 7' ' ' ALA . . . . . . . . . . . . . . . -63.4 -34.65 78.2 Favored 'General case' 0 N--CA 1.499 1.975 0 O-C-N 121.233 -0.917 . . . . 0.0 109.483 178.728 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 8' ' ' ALA . . . . . . . . . . . . . . . -66.02 -28.05 68.58 Favored 'General case' 0 N--CA 1.495 1.808 0 O-C-N 121.496 -0.753 . . . . 0.0 110.229 178.892 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 9' ' ' VAL . . . . . 0.434 HG13 ' HB3' ' A' ' 78' ' ' LEU . 68.6 t -64.52 -32.75 59.09 Favored 'Isoleucine or valine' 0 N--CA 1.5 2.069 0 O-C-N 121.318 -0.864 . . . . 0.0 110.338 179.475 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 10' ' ' GLU . . . . . . . . . . . . . 15.4 mt-10 -65.58 -25.45 67.41 Favored 'General case' 0 N--CA 1.499 2.01 0 O-C-N 121.301 -0.874 . . . . 0.0 110.665 179.871 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 11' ' ' GLN . . . . . . . . . . . . . 0.3 OUTLIER -65.45 -24.47 67.18 Favored 'General case' 0 N--CA 1.5 2.065 0 O-C-N 121.407 -0.808 . . . . 0.0 110.991 179.635 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 12' ' ' LEU . . . . . . . . . . . . . 10.2 mt -61.47 135.83 57.81 Favored 'General case' 0 N--CA 1.499 2.023 0 O-C-N 121.256 -0.902 . . . . 0.0 110.45 -179.935 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 13' ' ' THR . . . . . . . . . . . . . 27.9 p -77.97 165.02 24.57 Favored 'General case' 0 N--CA 1.498 1.966 0 O-C-N 121.275 -0.891 . . . . 0.0 110.357 179.623 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 14' ' ' GLU . . . . . . . . . . . . . 0.6 OUTLIER -56.52 -31.49 64.17 Favored 'General case' 0 N--CA 1.494 1.739 0 O-C-N 121.678 -0.639 . . . . 0.0 110.407 -179.879 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 1.4 mp0 -62.07 -52.79 62.47 Favored 'General case' 0 N--CA 1.498 1.933 0 O-C-N 121.467 -0.771 . . . . 0.0 109.761 179.306 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 16' ' ' GLN . . . . . 0.433 ' HA ' ' HB3' ' A' ' 19' ' ' GLU . 38.9 mt-30 -65.02 -33.18 75.44 Favored 'General case' 0 N--CA 1.497 1.888 0 O-C-N 121.627 -0.671 . . . . 0.0 110.111 179.448 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 17' ' ' LYS . . . . . . . . . . . . . 15.4 mttp -63.56 -49.0 75.15 Favored 'General case' 0 N--CA 1.497 1.904 0 N-CA-C 109.47 -0.567 . . . . 0.0 109.47 179.009 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 18' ' ' ASN . . . . . 0.554 ' HA ' ' HG2' ' A' ' 21' ' ' LYS . 41.7 t30 -71.47 -32.21 68.02 Favored 'General case' 0 N--CA 1.497 1.894 0 O-C-N 121.537 -0.727 . . . . 0.0 109.225 178.398 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 19' ' ' GLU . . . . . 0.433 ' HB3' ' HA ' ' A' ' 16' ' ' GLN . 2.4 tt0 -66.73 -41.78 87.33 Favored 'General case' 0 N--CA 1.496 1.848 0 O-C-N 121.539 -0.726 . . . . 0.0 109.425 178.925 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 20' ' ' PHE . . . . . . . . . . . . . 3.0 m-85 -70.68 -34.72 72.3 Favored 'General case' 0 N--CA 1.497 1.877 0 O-C-N 121.497 -0.752 . . . . 0.0 110.301 179.477 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 21' ' ' LYS . . . . . 0.592 ' HG3' ' N ' ' A' ' 22' ' ' ALA . 0.0 OUTLIER -64.47 -28.03 69.39 Favored 'General case' 0 N--CA 1.497 1.921 0 O-C-N 121.33 -0.856 . . . . 0.0 110.158 179.524 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild core ' A' A ' 22' ' ' ALA . . . . . 0.592 ' N ' ' HG3' ' A' ' 21' ' ' LYS . . . -65.44 -44.49 87.13 Favored 'General case' 0 N--CA 1.498 1.963 0 O-C-N 121.143 -0.973 . . . . 0.0 108.96 178.401 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 23' ' ' ALA . . . . . 0.485 ' HB2' HD11 ' B' ' 158' ' ' LEU . . . -71.71 -40.44 69.48 Favored 'General case' 0 N--CA 1.493 1.7 0 N-CA-C 109.086 -0.709 . . . . 0.0 109.086 178.33 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 24' ' ' PHE . . . . . . . . . . . . . 65.2 t80 -59.37 -43.63 92.83 Favored 'General case' 0 N--CA 1.499 1.999 0 O-C-N 121.65 -0.656 . . . . 0.0 110.511 179.448 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 25' ' ' ASP . . . . . . . . . . . . . 16.3 m-20 -61.15 -45.51 94.34 Favored 'General case' 0 N--CA 1.499 2.004 0 O-C-N 121.4 -0.813 . . . . 0.0 110.67 179.997 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 26' ' ' ILE . . . . . . . . . . . . . 54.4 mt -73.56 -21.25 18.46 Favored 'Isoleucine or valine' 0 N--CA 1.501 2.081 0 O-C-N 121.419 -0.801 . . . . 0.0 110.96 179.971 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 27' ' ' PHE . . . . . 0.65 ' CE1' HG21 ' A' ' 44' ' ' VAL . 0.2 OUTLIER -70.29 -11.24 60.77 Favored 'General case' 0 N--CA 1.502 2.15 0 O-C-N 120.991 -1.068 . . . . 0.0 111.878 -179.691 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild core ' A' A ' 28' ' ' VAL . . . . . . . . . . . . . 6.8 m -127.63 -46.83 1.2 Allowed 'Isoleucine or valine' 0 N--CA 1.499 1.984 0 O-C-N 120.949 -1.094 . . . . 0.0 111.049 179.859 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 29' ' ' LEU . . . . . . . . . . . . . 12.7 mt 47.78 39.53 10.63 Favored 'General case' 0 N--CA 1.504 2.238 0 O-C-N 121.364 -0.835 . . . . 0.0 110.629 -179.7 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 30' ' ' GLY . . . . . . . . . . . . . . . 85.13 39.96 8.24 Favored Glycine 0 N--CA 1.494 2.535 0 N-CA-C 109.588 -1.405 . . . . 0.0 109.588 -179.322 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 31' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.501 2.107 0 O-C-N 121.535 -0.979 . . . . 0.0 110.456 -179.881 . . . . . . . . 0 0 . 1 . 016 nuclear nobuild core ' A' A ' 35' ' ' CYS . . . . . . . . . . . . . 68.1 m . . . . . 0 N--CA 1.497 1.875 0 CA-C-O 121.048 0.451 . . . . 0.0 110.514 . . . . . . . . . 0 0 . 1 . 016 nuclear nobuild core ' A' A ' 36' ' ' ILE . . . . . . . . . . . . . 55.7 mt -97.16 135.31 31.8 Favored 'Isoleucine or valine' 0 N--CA 1.498 1.931 0 O-C-N 121.374 -0.829 . . . . 0.0 109.869 179.502 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 37' ' ' SER . . . . . . . . . . . . . 7.5 p -115.12 -177.77 3.21 Favored 'General case' 0 N--CA 1.496 1.857 0 O-C-N 121.288 -0.883 . . . . 0.0 110.442 179.821 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 38' ' ' THR . . . . . . . . . . . . . 42.9 p -65.38 -37.45 87.03 Favored 'General case' 0 N--CA 1.502 2.125 0 O-C-N 121.498 -0.752 . . . . 0.0 110.463 179.754 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 39' ' ' LYS . . . . . . . . . . . . . 2.6 mtmp? -63.0 -36.95 85.28 Favored 'General case' 0 N--CA 1.501 2.082 0 O-C-N 121.521 -0.737 . . . . 0.0 110.055 179.598 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 40' ' ' GLU . . . . . 0.424 ' HA ' ' HD2' ' A' ' 43' ' ' LYS . 1.1 mp0 -76.45 -26.82 55.84 Favored 'General case' 0 N--CA 1.496 1.845 0 O-C-N 121.545 -0.722 . . . . 0.0 110.664 -179.902 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 41' ' ' LEU . . . . . 0.621 HD23 ' HB3' ' A' ' 57' ' ' LEU . 4.9 tp -69.56 -49.94 49.49 Favored 'General case' 0 N--CA 1.498 1.972 0 O-C-N 121.1 -1.0 . . . . 0.0 110.135 179.591 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 42' ' ' GLY . . . . . 0.555 ' HA2' ' HB2' ' A' ' 45' ' ' MET . . . -55.02 -32.53 56.63 Favored Glycine 0 N--CA 1.497 2.734 0 N-CA-C 110.798 -0.921 . . . . 0.0 110.798 -179.423 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 43' ' ' LYS . . . . . 0.424 ' HD2' ' HA ' ' A' ' 40' ' ' GLU . 5.4 mttt -54.27 -47.96 71.73 Favored 'General case' 0 N--CA 1.501 2.081 0 O-C-N 121.419 -1.047 . . . . 0.0 110.378 179.822 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 44' ' ' VAL . . . . . 0.65 HG21 ' CE1' ' A' ' 27' ' ' PHE . 61.9 t -82.26 -28.26 9.13 Favored 'Isoleucine or valine' 0 N--CA 1.5 2.04 0 O-C-N 121.287 -0.883 . . . . 0.0 110.064 179.367 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 45' ' ' MET . . . . . 0.555 ' HB2' ' HA2' ' A' ' 42' ' ' GLY . 0.5 OUTLIER -56.95 -31.05 64.59 Favored 'General case' 0 N--CA 1.502 2.156 0 O-C-N 121.308 -0.87 . . . . 0.0 110.991 179.612 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild core ' A' A ' 46' ' ' ARG . . . . . 0.592 ' HA ' ' HG3' ' A' ' 50' ' ' GLN . 7.0 mmm180 -53.5 -27.47 25.67 Favored 'General case' 0 N--CA 1.505 2.296 0 O-C-N 121.35 -0.844 . . . . 0.0 111.729 -179.586 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 47' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -81.6 -39.73 24.07 Favored 'General case' 0 N--CA 1.496 1.871 0 O-C-N 121.101 -0.999 . . . . 0.0 110.812 -179.825 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 48' ' ' LEU . . . . . . . . . . . . . 1.1 mt -153.31 104.8 2.81 Favored 'General case' 0 N--CA 1.491 1.613 0 O-C-N 121.264 -0.897 . . . . 0.0 110.17 -179.83 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 49' ' ' GLY . . . . . 0.501 ' O ' ' HB2' ' A' ' 50' ' ' GLN . . . 124.48 -67.13 0.52 Allowed Glycine 0 N--CA 1.498 2.833 0 N-CA-C 109.677 -1.369 . . . . 0.0 109.677 -179.996 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 50' ' ' GLN . . . . . 0.592 ' HG3' ' HA ' ' A' ' 46' ' ' ARG . 0.5 OUTLIER 66.53 131.56 0.02 OUTLIER 'General case' 0 N--CA 1.504 2.244 0 CA-C-O 121.582 0.706 . . . . 0.0 111.186 179.935 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild core ' A' A ' 51' ' ' ASN . . . . . 0.613 ' CB ' HD11 ' A' ' 57' ' ' LEU . 14.6 p-10 -97.82 114.82 65.52 Favored Pre-proline 0 N--CA 1.493 1.719 0 O-C-N 121.279 -0.888 . . . . 0.0 109.653 179.367 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 52' ' ' PRO . . . . . . . . . . . . . 43.0 Cg_endo -69.29 -39.16 7.78 Favored 'Trans proline' 0 C--N 1.313 -1.334 0 O-C-N 123.613 1.323 . . . . 0.0 111.084 -179.419 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 53' ' ' THR . . . . . 0.851 HG22 ' HD2' ' A' ' 54' ' ' PRO . 0.2 OUTLIER -126.37 152.88 74.61 Favored Pre-proline 0 N--CA 1.497 1.92 0 O-C-N 121.406 -0.808 . . . . 0.0 109.956 -179.962 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild core ' A' A ' 54' ' ' PRO . . . . . 0.851 ' HD2' HG22 ' A' ' 53' ' ' THR . 42.6 Cg_endo -70.82 -44.85 1.18 Allowed 'Trans proline' 0 C--N 1.314 -1.262 0 O-C-N 123.793 1.417 . . . . 0.0 110.392 179.761 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 55' ' ' GLU . . . . . . . . . . . . . 0.9 OUTLIER -68.98 -19.85 64.16 Favored 'General case' 0 N--CA 1.497 1.881 0 O-C-N 121.441 -0.787 . . . . 0.0 110.33 179.151 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 0.6 OUTLIER -56.99 -41.61 78.73 Favored 'General case' 0 N--CA 1.498 1.939 0 O-C-N 121.361 -0.837 . . . . 0.0 110.269 179.592 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 57' ' ' LEU . . . . . 0.621 ' HB3' HD23 ' A' ' 41' ' ' LEU . 19.7 mt -78.49 -23.54 46.33 Favored 'General case' 0 N--CA 1.495 1.816 0 O-C-N 121.444 -0.785 . . . . 0.0 110.183 179.51 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 58' ' ' GLN . . . . . 0.578 ' O ' HG22 ' A' ' 61' ' ' ILE . 0.0 OUTLIER -59.41 -31.82 69.61 Favored 'General case' 0 N--CA 1.497 1.914 0 O-C-N 121.193 -0.942 . . . . 0.0 109.165 179.13 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild core ' A' A ' 59' ' ' GLU . . . . . 0.544 ' N ' ' HG3' ' A' ' 58' ' ' GLN . 0.8 OUTLIER -72.62 -41.71 65.26 Favored 'General case' 0 N--CA 1.491 1.603 0 N-CA-C 108.508 -0.923 . . . . 0.0 108.508 177.85 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild core ' A' A ' 60' ' ' MET . . . . . . . . . . . . . 2.3 mtp -60.57 -38.56 84.98 Favored 'General case' 0 N--CA 1.495 1.806 0 O-C-N 121.77 -0.581 . . . . 0.0 109.853 178.513 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 61' ' ' ILE . . . . . 0.595 HG13 HG23 ' A' ' 72' ' ' VAL . 3.5 tt -73.17 -33.13 41.01 Favored 'Isoleucine or valine' 0 N--CA 1.497 1.921 0 O-C-N 121.397 -0.814 . . . . 0.0 110.492 179.659 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 62' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -74.9 -29.86 61.11 Favored 'General case' 0 N--CA 1.498 1.941 0 O-C-N 121.334 -0.854 . . . . 0.0 110.501 179.552 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 63' ' ' GLU . . . . . . . . . . . . . 26.7 mt-10 -61.14 -26.23 67.55 Favored 'General case' 0 N--CA 1.502 2.155 0 O-C-N 121.381 -0.824 . . . . 0.0 110.939 179.72 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 64' ' ' VAL . . . . . 0.514 HG11 ' HG3' ' A' ' 80' ' ' MET . 14.0 m -112.35 -12.55 11.61 Favored 'Isoleucine or valine' 0 N--CA 1.501 2.078 0 O-C-N 121.42 -0.8 . . . . 0.0 111.195 -179.665 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 65' ' ' ASP . . . . . 0.416 ' HA ' ' CD ' ' A' ' 76' ' ' GLU . 22.3 t70 -60.17 150.69 29.09 Favored 'General case' 0 N--CA 1.498 1.946 0 O-C-N 121.362 -0.836 . . . . 0.0 110.701 -179.8 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 66' ' ' GLU . . . . . . . . . . . . . 2.1 tt0 -140.07 18.12 2.45 Favored 'General case' 0 N--CA 1.494 1.772 0 O-C-N 121.45 -0.782 . . . . 0.0 111.522 -179.482 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 67' ' ' ASP . . . . . . . . . . . . . 5.9 p30 -140.17 1.22 1.8 Allowed 'General case' 0 N--CA 1.503 2.178 0 O-C-N 120.776 -1.202 . . . . 0.0 112.546 -179.787 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 68' ' ' GLY . . . . . . . . . . . . . . . 86.04 -16.04 45.12 Favored Glycine 0 N--CA 1.496 2.644 0 O-C-N 120.649 -1.282 . . . . 0.0 110.657 179.956 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 69' ' ' SER . . . . . . . . . . . . . 1.1 p -66.96 -27.29 67.33 Favored 'General case' 0 N--CA 1.498 1.934 0 O-C-N 121.013 -1.287 . . . . 0.0 110.224 179.693 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 70' ' ' GLY . . . . . . . . . . . . . . . 87.17 -57.73 4.56 Favored Glycine 0 N--CA 1.499 2.834 0 N-CA-C 110.289 -1.124 . . . . 0.0 110.289 179.441 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 71' ' ' THR . . . . . . . . . . . . . 1.0 OUTLIER -47.99 137.94 9.63 Favored 'General case' 0 N--CA 1.506 2.339 0 O-C-N 121.585 -0.95 . . . . 0.0 110.506 -179.7 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 72' ' ' VAL . . . . . 0.595 HG23 HG13 ' A' ' 61' ' ' ILE . 0.9 OUTLIER -75.91 125.55 35.7 Favored 'Isoleucine or valine' 0 N--CA 1.499 2.0 0 CA-C-O 121.7 0.762 . . . . 0.0 111.631 -178.787 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild core ' A' A ' 73' ' ' ASP . . . . . 0.401 ' H ' ' HB2' ' A' ' 76' ' ' GLU . 1.0 OUTLIER -97.1 -170.55 2.05 Favored 'General case' 0 N--CA 1.495 1.797 0 N-CA-C 109.172 -0.677 . . . . 0.0 109.172 178.724 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild core ' A' A ' 74' ' ' PHE . . . . . . . . . . . . . 28.3 t80 -67.0 -47.72 70.64 Favored 'General case' 0 N--CA 1.499 2.024 0 O-C-N 120.826 -1.171 . . . . 0.0 110.263 179.64 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 75' ' ' ASP . . . . . . . . . . . . . 10.6 t70 -63.64 -44.5 93.68 Favored 'General case' 0 N--CA 1.498 1.967 0 O-C-N 121.412 -0.805 . . . . 0.0 110.146 179.406 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 76' ' ' GLU . . . . . 0.591 ' O ' HG12 ' A' ' 79' ' ' VAL . 95.5 mt-10 -65.77 -35.12 79.82 Favored 'General case' 0 N--CA 1.498 1.929 0 O-C-N 121.464 -0.772 . . . . 0.0 110.277 179.843 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 77' ' ' PHE . . . . . . . . . . . . . 71.2 t80 -67.19 -38.55 85.57 Favored 'General case' 0 N--CA 1.494 1.755 0 O-C-N 121.112 -0.993 . . . . 0.0 109.496 178.978 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 78' ' ' LEU . . . . . 0.434 ' HB3' HG13 ' A' ' 9' ' ' VAL . 41.3 mt -66.29 -43.82 85.27 Favored 'General case' 0 N--CA 1.498 1.955 0 O-C-N 121.542 -0.724 . . . . 0.0 110.38 179.46 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 79' ' ' VAL . . . . . 0.591 HG12 ' O ' ' A' ' 76' ' ' GLU . 7.6 p -69.34 -15.64 19.78 Favored 'Isoleucine or valine' 0 N--CA 1.502 2.165 0 O-C-N 121.185 -0.947 . . . . 0.0 110.314 179.119 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 80' ' ' MET . . . . . 0.514 ' HG3' HG11 ' A' ' 64' ' ' VAL . 15.8 ttp -76.73 -37.43 56.01 Favored 'General case' 0 N--CA 1.493 1.71 0 O-C-N 121.116 -0.99 . . . . 0.0 109.383 178.849 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 81' ' ' MET . . . . . . . . . . . . . 3.8 mmm -69.23 -45.44 69.77 Favored 'General case' 0 N--CA 1.499 2.008 0 O-C-N 121.473 -0.767 . . . . 0.0 110.343 179.696 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 82' ' ' VAL . . . . . 0.455 ' HA ' ' HB2' ' A' ' 85' ' ' MET . 35.6 m -59.51 -28.72 40.66 Favored 'Isoleucine or valine' 0 N--CA 1.505 2.316 0 O-C-N 121.388 -0.82 . . . . 0.0 110.844 -179.985 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 83' ' ' ARG . . . . . 0.493 ' HD2' HG12 ' A' ' 64' ' ' VAL . 4.0 mtp-105 -57.86 -37.07 73.24 Favored 'General case' 0 N--CA 1.502 2.132 0 O-C-N 121.131 -0.981 . . . . 0.0 109.61 178.817 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 84' ' ' CYS . . . . . . . . . . . . . 9.9 t -83.25 -28.54 29.11 Favored 'General case' 0 N--CA 1.495 1.783 0 O-C-N 121.625 -0.672 . . . . 0.0 109.833 178.868 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 85' ' ' MET . . . . . 0.455 ' HB2' ' HA ' ' A' ' 82' ' ' VAL . 66.9 mtm . . . . . 0 N--CA 1.497 1.887 0 O-C-N 121.431 -0.793 . . . . 0.0 110.876 179.887 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' B' B ' 149' ' ' SER . . . . . . . . . . . . . 20.1 t . . . . . 0 N--CA 1.505 2.324 0 CA-C-O 121.477 0.656 . . . . 0.0 110.934 . . . . . . . . . 0 0 . 1 . 016 nuclear nobuild core ' B' B ' 150' ' ' ALA . . . . . . . . . . . . . . . -57.57 -42.71 83.65 Favored 'General case' 0 N--CA 1.5 2.045 0 O-C-N 121.5 -0.75 . . . . 0.0 110.93 179.952 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' B' B ' 151' ' ' ASP . . . . . . . . . . . . . 5.4 m-20 -62.73 -49.81 73.58 Favored 'General case' 0 N--CA 1.5 2.041 0 O-C-N 121.4 -0.812 . . . . 0.0 110.644 -179.973 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' B' B ' 152' ' ' ALA . . . . . . . . . . . . . . . -63.35 -44.93 93.44 Favored 'General case' 0 N--CA 1.497 1.918 0 O-C-N 121.379 -0.826 . . . . 0.0 110.149 179.631 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' B' B ' 153' ' ' MET . . . . . . . . . . . . . 0.2 OUTLIER -63.62 -44.66 93.29 Favored 'General case' 0 N--CA 1.497 1.877 0 O-C-N 121.512 -0.743 . . . . 0.0 109.991 179.361 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' B' B ' 154' ' ' MET . . . . . 0.585 ' HG2' HD12 ' B' ' 158' ' ' LEU . 3.8 ttm -60.25 -44.26 95.42 Favored 'General case' 0 N--CA 1.497 1.916 0 O-C-N 121.419 -0.801 . . . . 0.0 110.014 179.308 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' B' B ' 155' ' ' GLN . . . . . . . . . . . . . 1.0 OUTLIER -62.5 -33.14 74.29 Favored 'General case' 0 N--CA 1.498 1.975 0 O-C-N 121.511 -0.743 . . . . 0.0 110.221 179.299 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' B' B ' 156' ' ' ALA . . . . . . . . . . . . . . . -71.78 -26.68 62.52 Favored 'General case' 0 N--CA 1.497 1.889 0 O-C-N 121.523 -0.736 . . . . 0.0 110.723 179.511 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' B' B ' 157' ' ' LEU . . . . . 0.419 HD11 HG11 ' A' ' 44' ' ' VAL . 13.9 mt -92.87 -41.97 9.77 Favored 'General case' 0 N--CA 1.495 1.82 0 O-C-N 121.273 -0.892 . . . . 0.0 111.326 -179.338 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' B' B ' 158' ' ' LEU . . . . . 0.585 HD12 ' HG2' ' B' ' 154' ' ' MET . 66.0 mt . . . . . 0 N--CA 1.5 2.06 0 O-C-N 121.198 -0.939 . . . . 0.0 111.597 -179.393 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 4' ' ' ILE . . . . . . . . . . . . . 15.4 mt . . . . . 0 N--CA 1.501 2.095 0 CA-C-O 120.965 0.412 . . . . 0.0 110.51 . . . . . . . . . 0 0 . 1 . 017 nuclear nobuild core ' A' A ' 5' ' ' TYR . . . . . 0.568 ' CE1' ' HG2' ' A' ' 83' ' ' ARG . 6.3 m-85 -70.86 -34.76 71.97 Favored 'General case' 0 N--CA 1.498 1.932 0 O-C-N 121.351 -0.843 . . . . 0.0 110.686 -179.987 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -68.57 -30.41 69.18 Favored 'General case' 0 N--CA 1.498 1.969 0 O-C-N 121.251 -0.906 . . . . 0.0 110.53 179.614 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 7' ' ' ALA . . . . . . . . . . . . . . . -55.12 -36.27 65.55 Favored 'General case' 0 N--CA 1.5 2.033 0 O-C-N 121.236 -0.915 . . . . 0.0 109.784 179.146 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 8' ' ' ALA . . . . . 0.63 ' HB1' ' HB ' ' A' ' 82' ' ' VAL . . . -65.24 -35.3 80.62 Favored 'General case' 0 N--CA 1.496 1.842 0 O-C-N 121.586 -0.697 . . . . 0.0 109.778 178.768 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 9' ' ' VAL . . . . . 0.458 ' HA ' HG11 ' A' ' 82' ' ' VAL . 43.7 t -62.62 -32.96 57.23 Favored 'Isoleucine or valine' 0 N--CA 1.502 2.128 0 O-C-N 121.456 -0.777 . . . . 0.0 109.523 178.827 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 10' ' ' GLU . . . . . . . . . . . . . 9.3 mt-10 -88.57 -5.84 57.93 Favored 'General case' 0 N--CA 1.498 1.943 0 O-C-N 121.408 -0.808 . . . . 0.0 110.732 179.273 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 11' ' ' GLN . . . . . . . . . . . . . 1.4 mt-30 -87.97 -29.6 20.66 Favored 'General case' 0 N--CA 1.496 1.865 0 O-C-N 121.105 -0.997 . . . . 0.0 111.063 -179.809 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 12' ' ' LEU . . . . . 0.408 ' HB2' ' CB ' ' A' ' 16' ' ' GLN . 3.7 pp -66.98 153.11 44.43 Favored 'General case' 0 N--CA 1.5 2.065 0 O-C-N 121.104 -0.997 . . . . 0.0 110.739 -179.71 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 13' ' ' THR . . . . . . . . . . . . . 22.2 p -99.48 -177.55 3.62 Favored 'General case' 0 N--CA 1.501 2.105 0 O-C-N 121.416 -0.803 . . . . 0.0 111.368 -179.147 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 14' ' ' GLU . . . . . 0.44 ' O ' ' HB2' ' A' ' 18' ' ' ASN . 12.8 tp10 -53.86 -39.32 65.56 Favored 'General case' 0 N--CA 1.492 1.669 0 O-C-N 121.912 -0.492 . . . . 0.0 110.697 -179.683 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 1.5 mp0 -54.53 -36.95 64.82 Favored 'General case' 0 N--CA 1.5 2.055 0 O-C-N 121.463 -0.773 . . . . 0.0 110.783 179.766 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 16' ' ' GLN . . . . . 0.408 ' CB ' ' HB2' ' A' ' 12' ' ' LEU . 0.8 OUTLIER -72.18 -63.84 1.06 Allowed 'General case' 0 N--CA 1.497 1.897 0 O-C-N 121.292 -0.88 . . . . 0.0 111.146 -179.716 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild core ' A' A ' 17' ' ' LYS . . . . . 0.427 ' HG3' ' O ' ' A' ' 14' ' ' GLU . 5.3 ptmt -54.81 -32.54 60.47 Favored 'General case' 0 N--CA 1.503 2.194 0 O-C-N 121.839 -0.538 . . . . 0.0 111.347 -179.456 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 18' ' ' ASN . . . . . 0.44 ' HB2' ' O ' ' A' ' 14' ' ' GLU . 7.6 t-20 -70.02 -49.45 51.19 Favored 'General case' 0 N--CA 1.494 1.775 0 O-C-N 121.269 -0.894 . . . . 0.0 110.308 179.999 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 0.3 OUTLIER -62.91 -43.48 98.69 Favored 'General case' 0 N--CA 1.497 1.922 0 O-C-N 121.3 -0.875 . . . . 0.0 109.545 179.187 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 20' ' ' PHE . . . . . . . . . . . . . 12.7 m-85 -59.41 -33.79 71.66 Favored 'General case' 0 N--CA 1.497 1.918 0 O-C-N 121.447 -0.783 . . . . 0.0 109.769 178.941 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 21' ' ' LYS . . . . . 0.505 ' HG3' ' N ' ' A' ' 22' ' ' ALA . 0.0 OUTLIER -65.65 -41.78 92.16 Favored 'General case' 0 N--CA 1.496 1.832 0 O-C-N 121.538 -0.726 . . . . 0.0 109.233 178.629 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild core ' A' A ' 22' ' ' ALA . . . . . 0.658 ' O ' HD12 ' A' ' 26' ' ' ILE . . . -69.69 -45.45 68.27 Favored 'General case' 0 N--CA 1.496 1.828 0 O-C-N 121.286 -0.884 . . . . 0.0 109.589 179.181 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 23' ' ' ALA . . . . . . . . . . . . . . . -63.35 -49.73 72.74 Favored 'General case' 0 N--CA 1.497 1.897 0 O-C-N 121.648 -0.658 . . . . 0.0 110.455 179.412 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 24' ' ' PHE . . . . . 0.425 ' CD2' HD12 ' A' ' 36' ' ' ILE . 27.4 t80 -55.92 -43.55 77.45 Favored 'General case' 0 N--CA 1.5 2.069 0 O-C-N 121.507 -0.746 . . . . 0.0 110.47 179.724 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 25' ' ' ASP . . . . . . . . . . . . . 20.2 t70 -62.79 -52.14 64.36 Favored 'General case' 0 N--CA 1.496 1.841 0 O-C-N 121.625 -0.672 . . . . 0.0 110.387 179.815 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 26' ' ' ILE . . . . . 0.658 HD12 ' O ' ' A' ' 22' ' ' ALA . 1.9 mt -64.55 -28.29 44.52 Favored 'Isoleucine or valine' 0 N--CA 1.498 1.963 0 O-C-N 121.334 -0.854 . . . . 0.0 110.495 179.584 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 27' ' ' PHE . . . . . 0.482 ' CZ ' HG21 ' A' ' 44' ' ' VAL . 0.1 OUTLIER -63.9 -42.86 97.32 Favored 'General case' 0 N--CA 1.498 1.947 0 O-C-N 121.194 -0.942 . . . . 0.0 110.511 179.68 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild core ' A' A ' 28' ' ' VAL . . . . . . . . . . . . . 19.5 m -91.38 -35.7 7.32 Favored 'Isoleucine or valine' 0 N--CA 1.499 2.004 0 O-C-N 121.317 -0.864 . . . . 0.0 110.772 -179.975 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 29' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER 57.24 -87.64 0.02 OUTLIER 'General case' 0 N--CA 1.501 2.082 0 O-C-N 121.672 -0.643 . . . . 0.0 110.631 -179.63 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 30' ' ' GLY . . . . . . . . . . . . . . . -89.73 -16.99 55.68 Favored Glycine 0 N--CA 1.496 2.656 0 N-CA-C 110.14 -1.184 . . . . 0.0 110.14 179.421 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 31' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.499 1.984 0 O-C-N 121.095 -1.238 . . . . 0.0 110.322 179.747 . . . . . . . . 0 0 . 1 . 017 nuclear nobuild core ' A' A ' 35' ' ' CYS . . . . . . . . . . . . . 12.7 m . . . . . 0 N--CA 1.502 2.139 0 CA-C-O 121.213 0.53 . . . . 0.0 111.08 . . . . . . . . . 0 0 . 1 . 017 nuclear nobuild core ' A' A ' 36' ' ' ILE . . . . . 0.425 HD12 ' CD2' ' A' ' 24' ' ' PHE . 65.2 mt -79.36 123.26 36.05 Favored 'Isoleucine or valine' 0 N--CA 1.499 2.009 0 O-C-N 121.191 -0.943 . . . . 0.0 111.059 -179.175 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 37' ' ' SER . . . . . 0.42 ' HB2' HG23 ' A' ' 71' ' ' THR . 18.3 t -125.08 -178.84 4.32 Favored 'General case' 0 N--CA 1.494 1.762 0 O-C-N 121.632 -0.667 . . . . 0.0 109.613 178.948 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 38' ' ' THR . . . . . . . . . . . . . 3.2 p -61.55 -36.34 80.34 Favored 'General case' 0 N--CA 1.501 2.117 0 O-C-N 121.324 -0.86 . . . . 0.0 110.597 179.709 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 39' ' ' LYS . . . . . . . . . . . . . 4.1 tptt -68.3 -34.28 75.86 Favored 'General case' 0 N--CA 1.498 1.951 0 O-C-N 121.529 -0.732 . . . . 0.0 110.804 179.843 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 40' ' ' GLU . . . . . 0.575 ' HA ' ' HD2' ' A' ' 43' ' ' LYS . 25.7 mm-40 -83.58 -24.14 31.65 Favored 'General case' 0 N--CA 1.499 1.978 0 O-C-N 121.299 -0.876 . . . . 0.0 111.083 -179.643 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 41' ' ' LEU . . . . . 0.754 HD12 HD22 ' A' ' 57' ' ' LEU . 3.4 tm? -70.22 -64.66 0.85 Allowed 'General case' 0 N--CA 1.499 1.99 0 O-C-N 121.135 -0.978 . . . . 0.0 109.711 179.519 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 42' ' ' GLY . . . . . . . . . . . . . . . -47.59 -31.85 7.44 Favored Glycine 0 N--CA 1.501 3.025 0 N-CA-C 110.621 -0.992 . . . . 0.0 110.621 179.836 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 43' ' ' LYS . . . . . 0.575 ' HD2' ' HA ' ' A' ' 40' ' ' GLU . 11.1 mttp -49.22 -49.29 43.73 Favored 'General case' 0 N--CA 1.503 2.187 0 O-C-N 121.572 -0.958 . . . . 0.0 110.91 179.602 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 44' ' ' VAL . . . . . 0.606 HG22 ' O ' ' A' ' 41' ' ' LEU . 33.6 m -81.76 -22.02 10.16 Favored 'Isoleucine or valine' 0 N--CA 1.503 2.204 0 O-C-N 121.322 -0.862 . . . . 0.0 111.204 -179.878 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 45' ' ' MET . . . . . 0.424 ' CE ' HD11 ' A' ' 41' ' ' LEU . 19.6 mmt -59.27 -38.74 80.87 Favored 'General case' 0 N--CA 1.502 2.13 0 O-C-N 121.121 -0.987 . . . . 0.0 110.258 179.672 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 46' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -57.7 -41.91 82.65 Favored 'General case' 0 N--CA 1.498 1.939 0 O-C-N 121.572 -0.705 . . . . 0.0 110.454 179.704 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 47' ' ' MET . . . . . . . . . . . . . 29.9 ttp -68.23 -36.05 78.88 Favored 'General case' 0 N--CA 1.498 1.937 0 O-C-N 121.494 -0.754 . . . . 0.0 110.562 179.693 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 48' ' ' LEU . . . . . . . . . . . . . 6.2 tp -75.02 -44.74 46.29 Favored 'General case' 0 N--CA 1.492 1.669 0 O-C-N 121.357 -0.839 . . . . 0.0 110.298 179.951 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 49' ' ' GLY . . . . . . . . . . . . . . . -155.28 -76.77 0.02 OUTLIER Glycine 0 N--CA 1.495 2.613 0 N-CA-C 110.024 -1.23 . . . . 0.0 110.024 179.918 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 50' ' ' GLN . . . . . . . . . . . . . 36.9 mt-30 -137.54 171.63 14.17 Favored 'General case' 0 N--CA 1.499 1.975 0 O-C-N 121.409 -1.053 . . . . 0.0 110.584 -179.833 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 51' ' ' ASN . . . . . . . . . . . . . 1.3 t30 -106.66 105.74 55.76 Favored Pre-proline 0 N--CA 1.499 1.993 0 O-C-N 121.225 -0.922 . . . . 0.0 111.266 -179.556 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 52' ' ' PRO . . . . . 0.598 ' HG2' HD11 ' A' ' 57' ' ' LEU . 46.8 Cg_endo -77.34 166.23 26.44 Favored 'Trans proline' 0 C--N 1.315 -1.225 0 O-C-N 123.668 1.352 . . . . 0.0 110.242 178.799 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 53' ' ' THR . . . . . . . . . . . . . 65.4 p -79.16 159.23 73.38 Favored Pre-proline 0 N--CA 1.5 2.044 0 O-C-N 121.198 -0.939 . . . . 0.0 110.833 -179.527 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 54' ' ' PRO . . . . . . . . . . . . . 41.6 Cg_endo -67.18 -38.7 15.0 Favored 'Trans proline' 0 N--CA 1.49 1.287 0 O-C-N 123.818 1.43 . . . . 0.0 110.817 179.793 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 55' ' ' GLU . . . . . 0.414 ' O ' ' HB2' ' A' ' 58' ' ' GLN . 0.1 OUTLIER -58.88 -39.61 81.91 Favored 'General case' 0 N--CA 1.498 1.933 0 O-C-N 121.394 -0.816 . . . . 0.0 110.107 179.505 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild core ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 5.8 mt-10 -66.58 -37.94 86.0 Favored 'General case' 0 N--CA 1.497 1.876 0 O-C-N 121.38 -0.825 . . . . 0.0 110.302 179.307 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 57' ' ' LEU . . . . . 0.754 HD22 HD12 ' A' ' 41' ' ' LEU . 9.0 mt -81.51 -9.79 59.62 Favored 'General case' 0 N--CA 1.499 1.993 0 O-C-N 121.332 -0.855 . . . . 0.0 111.25 179.958 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 58' ' ' GLN . . . . . 0.414 ' HB2' ' O ' ' A' ' 55' ' ' GLU . 9.7 mm100 -57.36 -52.1 66.7 Favored 'General case' 0 N--CA 1.5 2.062 0 O-C-N 120.997 -1.064 . . . . 0.0 110.113 -179.892 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 59' ' ' GLU . . . . . . . . . . . . . 10.9 tp10 -53.07 -40.11 63.79 Favored 'General case' 0 N--CA 1.498 1.936 0 O-C-N 121.623 -0.673 . . . . 0.0 110.362 179.461 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 60' ' ' MET . . . . . 0.495 ' HE2' HD23 ' A' ' 57' ' ' LEU . 0.4 OUTLIER -53.37 -34.44 57.64 Favored 'General case' 0 N--CA 1.501 2.082 0 O-C-N 121.415 -0.803 . . . . 0.0 110.376 179.389 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild core ' A' A ' 61' ' ' ILE . . . . . 0.574 HG12 HG23 ' A' ' 72' ' ' VAL . 15.1 mt -91.97 -44.27 14.19 Favored 'Isoleucine or valine' 0 N--CA 1.497 1.921 0 O-C-N 121.407 -0.808 . . . . 0.0 110.124 179.196 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 62' ' ' ASP . . . . . . . . . . . . . 71.8 m-20 -57.12 -33.17 67.07 Favored 'General case' 0 N--CA 1.5 2.026 0 O-C-N 121.465 -0.772 . . . . 0.0 111.04 -179.607 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 63' ' ' GLU . . . . . . . . . . . . . 1.9 tt0 -66.91 -26.85 67.06 Favored 'General case' 0 N--CA 1.5 2.044 0 O-C-N 121.186 -0.946 . . . . 0.0 111.035 179.809 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 64' ' ' VAL . . . . . 0.537 HG21 ' SD ' ' A' ' 80' ' ' MET . 24.5 m -117.14 9.96 7.22 Favored 'Isoleucine or valine' 0 N--CA 1.503 2.178 0 O-C-N 121.148 -0.97 . . . . 0.0 111.481 -179.882 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 65' ' ' ASP . . . . . . . . . . . . . 19.0 t70 -80.3 138.23 36.72 Favored 'General case' 0 N--CA 1.498 1.935 0 O-C-N 120.897 -1.127 . . . . 0.0 110.154 179.897 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 66' ' ' GLU . . . . . . . . . . . . . 21.2 mt-10 -128.77 24.07 5.74 Favored 'General case' 0 N--CA 1.497 1.914 0 O-C-N 121.376 -0.827 . . . . 0.0 111.642 -179.132 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 67' ' ' ASP . . . . . . . . . . . . . 42.6 p-10 -141.22 -0.3 1.45 Allowed 'General case' 0 N--CA 1.501 2.109 0 O-C-N 120.767 -1.208 . . . . 0.0 112.865 -179.91 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 68' ' ' GLY . . . . . . . . . . . . . . . 86.97 -21.27 20.68 Favored Glycine 0 N--CA 1.496 2.698 0 O-C-N 120.705 -1.247 . . . . 0.0 110.687 179.653 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 69' ' ' SER . . . . . . . . . . . . . 1.7 p -59.52 -27.99 66.68 Favored 'General case' 0 N--CA 1.499 1.987 0 O-C-N 121.253 -1.145 . . . . 0.0 110.482 179.83 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 70' ' ' GLY . . . . . . . . . . . . . . . 71.44 30.21 67.12 Favored Glycine 0 N--CA 1.498 2.817 0 N-CA-C 110.195 -1.162 . . . . 0.0 110.195 -179.981 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 71' ' ' THR . . . . . 0.42 HG23 ' HB2' ' A' ' 37' ' ' SER . 5.3 m -134.54 142.93 47.14 Favored 'General case' 0 N--CA 1.499 1.999 0 O-C-N 121.407 -1.055 . . . . 0.0 108.929 179.489 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 72' ' ' VAL . . . . . 0.574 HG23 HG12 ' A' ' 61' ' ' ILE . 17.0 t -75.92 113.49 14.91 Favored 'Isoleucine or valine' 0 N--CA 1.498 1.944 0 O-C-N 121.192 -0.943 . . . . 0.0 111.198 -179.002 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 73' ' ' ASP . . . . . . . . . . . . . 17.0 m-20 -88.48 -178.69 5.91 Favored 'General case' 0 N--CA 1.494 1.772 0 N-CA-C 108.7 -0.852 . . . . 0.0 108.7 178.409 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 74' ' ' PHE . . . . . . . . . . . . . 49.1 t80 -63.91 -42.18 97.47 Favored 'General case' 0 N--CA 1.499 2.015 0 O-C-N 120.905 -1.122 . . . . 0.0 109.828 179.266 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 75' ' ' ASP . . . . . . . . . . . . . 1.0 OUTLIER -66.54 -47.13 73.83 Favored 'General case' 0 N--CA 1.496 1.862 0 O-C-N 121.511 -0.743 . . . . 0.0 110.228 179.435 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 76' ' ' GLU . . . . . . . . . . . . . 72.4 mt-10 -63.95 -38.01 89.53 Favored 'General case' 0 N--CA 1.499 1.986 0 O-C-N 121.453 -0.779 . . . . 0.0 109.755 179.238 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 77' ' ' PHE . . . . . . . . . . . . . 75.7 t80 -57.11 -40.6 77.39 Favored 'General case' 0 N--CA 1.495 1.785 0 O-C-N 121.673 -0.642 . . . . 0.0 109.628 179.118 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 78' ' ' LEU . . . . . . . . . . . . . 43.2 mt -63.15 -43.68 97.64 Favored 'General case' 0 N--CA 1.498 1.945 0 O-C-N 121.396 -0.815 . . . . 0.0 109.476 178.802 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 79' ' ' VAL . . . . . . . . . . . . . 73.2 t -61.27 -39.53 82.93 Favored 'Isoleucine or valine' 0 N--CA 1.501 2.101 0 O-C-N 121.616 -0.677 . . . . 0.0 109.473 178.948 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 80' ' ' MET . . . . . 0.537 ' SD ' HG21 ' A' ' 64' ' ' VAL . 11.8 ttp -67.16 -35.19 79.16 Favored 'General case' 0 N--CA 1.496 1.866 0 O-C-N 121.486 -0.759 . . . . 0.0 110.096 179.168 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 81' ' ' MET . . . . . . . . . . . . . 11.3 mmt -70.49 -51.78 26.64 Favored 'General case' 0 N--CA 1.497 1.892 0 O-C-N 121.486 -0.758 . . . . 0.0 110.767 -179.915 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 82' ' ' VAL . . . . . 0.63 ' HB ' ' HB1' ' A' ' 8' ' ' ALA . 34.2 m -62.61 -24.53 35.65 Favored 'Isoleucine or valine' 0 N--CA 1.501 2.1 0 O-C-N 121.141 -0.975 . . . . 0.0 110.655 -179.982 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 83' ' ' ARG . . . . . 0.568 ' HG2' ' CE1' ' A' ' 5' ' ' TYR . 11.3 mtt180 -62.45 -31.48 72.2 Favored 'General case' 0 N--CA 1.499 1.99 0 O-C-N 121.232 -0.917 . . . . 0.0 110.206 179.145 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 84' ' ' CYS . . . . . . . . . . . . . 3.3 t -86.58 -30.88 21.52 Favored 'General case' 0 N--CA 1.494 1.765 0 O-C-N 121.479 -0.763 . . . . 0.0 109.474 178.651 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 85' ' ' MET . . . . . . . . . . . . . 30.9 mtm . . . . . 0 N--CA 1.499 2.001 0 O-C-N 121.486 -0.759 . . . . 0.0 111.247 -179.96 . . . . . . . . 0 0 . 1 . 017 nuclear nobuild core ' B' B ' 149' ' ' SER . . . . . . . . . . . . . 45.5 t . . . . . 0 N--CA 1.493 1.692 0 CA-C-O 121.191 0.519 . . . . 0.0 110.227 . . . . . . . . . 0 0 . 1 . 017 nuclear nobuild core ' B' B ' 150' ' ' ALA . . . . . . . . . . . . . . . -55.67 -38.37 69.52 Favored 'General case' 0 N--CA 1.497 1.906 0 O-C-N 121.678 -0.638 . . . . 0.0 110.591 179.836 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' B' B ' 151' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -65.35 -46.28 80.83 Favored 'General case' 0 N--CA 1.497 1.908 0 O-C-N 121.329 -0.857 . . . . 0.0 110.445 179.695 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' B' B ' 152' ' ' ALA . . . . . . . . . . . . . . . -51.0 -48.32 61.42 Favored 'General case' 0 N--CA 1.501 2.081 0 O-C-N 121.486 -0.759 . . . . 0.0 110.644 179.943 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' B' B ' 153' ' ' MET . . . . . . . . . . . . . 11.6 mmt -63.17 -42.9 99.49 Favored 'General case' 0 N--CA 1.498 1.973 0 O-C-N 121.357 -0.839 . . . . 0.0 110.099 179.468 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' B' B ' 154' ' ' MET . . . . . . . . . . . . . 13.2 mtt -64.55 -37.04 86.17 Favored 'General case' 0 N--CA 1.498 1.959 0 O-C-N 121.493 -0.755 . . . . 0.0 110.499 179.586 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' B' B ' 155' ' ' GLN . . . . . . . . . . . . . 0.3 OUTLIER -58.02 -33.98 69.55 Favored 'General case' 0 N--CA 1.502 2.166 0 O-C-N 121.419 -0.801 . . . . 0.0 111.533 -179.67 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' B' B ' 156' ' ' ALA . . . . . . . . . . . . . . . -100.8 -44.23 5.85 Favored 'General case' 0 N--CA 1.501 2.094 0 O-C-N 121.159 -0.963 . . . . 0.0 111.162 -179.598 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' B' B ' 157' ' ' LEU . . . . . . . . . . . . . 10.0 mt -75.78 -37.88 58.79 Favored 'General case' 0 N--CA 1.501 2.101 0 O-C-N 121.27 -0.894 . . . . 0.0 111.018 -179.493 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' B' B ' 158' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER . . . . . 0 N--CA 1.498 1.929 0 O-C-N 121.257 -0.902 . . . . 0.0 110.375 179.877 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 4' ' ' ILE . . . . . . . . . . . . . 2.7 mp . . . . . 0 N--CA 1.496 1.86 0 N-CA-C 110.02 -0.363 . . . . 0.0 110.02 . . . . . . . . . 0 0 . 1 . 018 nuclear nobuild core ' A' A ' 5' ' ' TYR . . . . . . . . . . . . . 5.8 m-85 -57.63 -30.01 65.03 Favored 'General case' 0 N--CA 1.5 2.048 0 O-C-N 121.306 -0.872 . . . . 0.0 110.082 179.384 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 6' ' ' LYS . . . . . 0.547 ' O ' HG12 ' A' ' 9' ' ' VAL . 14.8 mttt -61.15 -43.53 98.74 Favored 'General case' 0 N--CA 1.499 1.997 0 O-C-N 121.385 -0.822 . . . . 0.0 109.716 178.986 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 7' ' ' ALA . . . . . . . . . . . . . . . -55.32 -32.67 62.66 Favored 'General case' 0 N--CA 1.499 2.007 0 O-C-N 121.342 -0.849 . . . . 0.0 110.238 179.099 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 8' ' ' ALA . . . . . . . . . . . . . . . -71.32 -37.52 71.75 Favored 'General case' 0 N--CA 1.499 1.985 0 O-C-N 121.433 -0.792 . . . . 0.0 110.424 179.39 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 9' ' ' VAL . . . . . 0.576 ' HA ' HD11 ' A' ' 12' ' ' LEU . 0.3 OUTLIER -77.4 -23.1 14.37 Favored 'Isoleucine or valine' 0 N--CA 1.499 2.008 0 O-C-N 121.503 -0.748 . . . . 0.0 111.169 -179.66 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild core ' A' A ' 10' ' ' GLU . . . . . . . . . . . . . 28.1 mt-10 -92.89 -26.26 17.7 Favored 'General case' 0 N--CA 1.495 1.811 0 O-C-N 121.238 -0.914 . . . . 0.0 111.918 -179.233 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 11' ' ' GLN . . . . . . . . . . . . . 2.8 mt-30 -119.35 64.06 0.79 Allowed 'General case' 0 N--CA 1.499 2.009 0 O-C-N 120.825 -1.172 . . . . 0.0 112.239 -178.825 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 12' ' ' LEU . . . . . 0.576 HD11 ' HA ' ' A' ' 9' ' ' VAL . 0.5 OUTLIER -90.36 164.15 14.44 Favored 'General case' 0 N--CA 1.501 2.11 0 O-C-N 120.933 -1.105 . . . . 0.0 109.796 178.422 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild core ' A' A ' 13' ' ' THR . . . . . . . . . . . . . 39.4 p -79.47 162.46 25.43 Favored 'General case' 0 N--CA 1.499 1.999 0 O-C-N 121.005 -1.06 . . . . 0.0 109.379 178.658 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 14' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER -55.92 -33.21 64.47 Favored 'General case' 0 N--CA 1.493 1.693 0 O-C-N 121.389 -0.819 . . . . 0.0 110.709 -179.349 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 1.8 mp0 -73.71 -55.81 5.79 Favored 'General case' 0 N--CA 1.498 1.961 0 O-C-N 121.29 -0.881 . . . . 0.0 109.935 179.349 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 16' ' ' GLN . . . . . . . . . . . . . 2.1 mp0 -57.03 -53.59 56.33 Favored 'General case' 0 N--CA 1.503 2.177 0 O-C-N 121.425 -0.797 . . . . 0.0 110.891 -179.827 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 17' ' ' LYS . . . . . 0.507 ' HD3' ' HB2' ' A' ' 12' ' ' LEU . 2.6 ttpm? -57.65 -42.73 84.07 Favored 'General case' 0 N--CA 1.499 2.021 0 CA-C-N 116.228 -0.442 . . . . 0.0 110.96 -179.95 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 18' ' ' ASN . . . . . . . . . . . . . 14.7 t30 -70.62 -42.51 70.81 Favored 'General case' 0 N--CA 1.497 1.921 0 O-C-N 121.288 -0.882 . . . . 0.0 110.66 -179.993 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -56.96 -47.55 80.45 Favored 'General case' 0 N--CA 1.499 2.018 0 O-C-N 121.369 -0.832 . . . . 0.0 110.608 -179.657 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 20' ' ' PHE . . . . . . . . . . . . . 23.3 m-85 -64.7 -37.82 88.88 Favored 'General case' 0 N--CA 1.501 2.095 0 O-C-N 121.051 -1.03 . . . . 0.0 109.863 179.363 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 21' ' ' LYS . . . . . . . . . . . . . 17.3 tptp -62.7 -41.74 99.28 Favored 'General case' 0 N--CA 1.499 1.993 0 O-C-N 121.525 -0.734 . . . . 0.0 109.908 179.228 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 22' ' ' ALA . . . . . . . . . . . . . . . -77.73 -42.62 33.66 Favored 'General case' 0 N--CA 1.496 1.863 0 O-C-N 121.488 -0.757 . . . . 0.0 110.084 179.506 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 23' ' ' ALA . . . . . . . . . . . . . . . -62.71 -42.86 99.86 Favored 'General case' 0 N--CA 1.497 1.903 0 O-C-N 121.463 -0.773 . . . . 0.0 110.461 179.717 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 24' ' ' PHE . . . . . 0.453 ' CE1' HG13 ' A' ' 36' ' ' ILE . 79.7 t80 -62.96 -42.82 99.93 Favored 'General case' 0 N--CA 1.496 1.865 0 O-C-N 121.393 -0.817 . . . . 0.0 110.476 179.854 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 25' ' ' ASP . . . . . . . . . . . . . 0.7 OUTLIER -58.14 -45.38 87.48 Favored 'General case' 0 N--CA 1.499 2.02 0 O-C-N 121.44 -0.787 . . . . 0.0 110.253 179.784 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 26' ' ' ILE . . . . . . . . . . . . . 21.1 mt -68.19 -28.39 40.68 Favored 'Isoleucine or valine' 0 N--CA 1.497 1.912 0 O-C-N 121.42 -0.8 . . . . 0.0 109.611 178.956 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 27' ' ' PHE . . . . . 0.424 ' CE2' HD13 ' B' ' 157' ' ' LEU . 0.1 OUTLIER -73.11 -42.56 62.81 Favored 'General case' 0 N--CA 1.498 1.95 0 O-C-N 121.405 -0.809 . . . . 0.0 111.108 179.871 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild core ' A' A ' 28' ' ' VAL . . . . . 0.429 ' CG1' HG13 ' A' ' 36' ' ' ILE . 18.7 m -92.26 38.33 0.09 OUTLIER 'Isoleucine or valine' 0 N--CA 1.506 2.337 0 O-C-N 121.238 -0.914 . . . . 0.0 111.503 -179.471 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 29' ' ' LEU . . . . . . . . . . . . . 4.7 mt -69.3 -36.75 77.34 Favored 'General case' 0 N--CA 1.498 1.932 0 O-C-N 120.954 -1.091 . . . . 0.0 109.878 179.042 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 30' ' ' GLY . . . . . . . . . . . . . . . -102.67 38.32 3.26 Favored Glycine 0 N--CA 1.494 2.514 0 N-CA-C 109.372 -1.491 . . . . 0.0 109.372 179.018 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 31' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.496 1.853 0 O-C-N 121.575 -0.956 . . . . 0.0 110.371 -179.992 . . . . . . . . 0 0 . 1 . 018 nuclear nobuild core ' A' A ' 35' ' ' CYS . . . . . . . . . . . . . 3.3 t . . . . . 0 N--CA 1.497 1.906 0 CA-C-O 121.042 0.449 . . . . 0.0 110.093 . . . . . . . . . 0 0 . 1 . 018 nuclear nobuild core ' A' A ' 36' ' ' ILE . . . . . 0.453 HG13 ' CE1' ' A' ' 24' ' ' PHE . 14.8 mt -76.51 132.37 33.11 Favored 'Isoleucine or valine' 0 N--CA 1.5 2.048 0 O-C-N 121.235 -0.916 . . . . 0.0 110.367 -179.775 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 37' ' ' SER . . . . . . . . . . . . . 22.9 t -117.14 173.36 6.71 Favored 'General case' 0 N--CA 1.496 1.848 0 O-C-N 121.601 -0.687 . . . . 0.0 109.804 179.126 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 38' ' ' THR . . . . . 0.503 ' HB ' ' O ' ' A' ' 54' ' ' PRO . 23.3 p -61.04 -45.8 93.31 Favored 'General case' 0 N--CA 1.502 2.153 0 O-C-N 121.215 -0.928 . . . . 0.0 110.613 -180.0 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 39' ' ' LYS . . . . . . . . . . . . . 9.6 tmtt? -59.64 -35.18 73.89 Favored 'General case' 0 N--CA 1.499 1.976 0 O-C-N 121.596 -0.69 . . . . 0.0 110.557 179.728 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 40' ' ' GLU . . . . . 0.401 ' O ' ' HB3' ' A' ' 43' ' ' LYS . 9.3 mm-40 -69.58 -36.68 76.48 Favored 'General case' 0 N--CA 1.497 1.899 0 O-C-N 121.363 -0.836 . . . . 0.0 110.579 -179.968 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 41' ' ' LEU . . . . . 0.566 HD23 ' HB3' ' A' ' 57' ' ' LEU . 6.8 tp -67.59 -45.16 76.32 Favored 'General case' 0 N--CA 1.497 1.922 0 O-C-N 121.028 -1.045 . . . . 0.0 109.053 178.748 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 42' ' ' GLY . . . . . . . . . . . . . . . -57.73 -34.3 70.21 Favored Glycine 0 N--CA 1.491 2.316 0 N-CA-C 110.073 -1.211 . . . . 0.0 110.073 179.862 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 43' ' ' LYS . . . . . 0.401 ' HB3' ' O ' ' A' ' 40' ' ' GLU . 15.2 ttpt -54.0 -37.96 64.57 Favored 'General case' 0 N--CA 1.501 2.11 0 O-C-N 121.472 -1.017 . . . . 0.0 109.773 179.057 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 44' ' ' VAL . . . . . . . . . . . . . 98.0 t -84.55 -41.24 15.92 Favored 'Isoleucine or valine' 0 N--CA 1.499 2.017 0 O-C-N 121.395 -0.816 . . . . 0.0 109.699 179.097 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 45' ' ' MET . . . . . . . . . . . . . 2.6 mtt -64.31 -22.67 67.03 Favored 'General case' 0 N--CA 1.502 2.149 0 O-C-N 121.485 -0.759 . . . . 0.0 110.992 179.564 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 46' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -49.6 -40.96 40.75 Favored 'General case' 0 N--CA 1.501 2.079 0 O-C-N 121.364 -0.835 . . . . 0.0 111.555 -179.642 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 47' ' ' MET . . . . . . . . . . . . . 2.7 ptt? -94.39 4.23 54.13 Favored 'General case' 0 N--CA 1.5 2.037 0 O-C-N 121.26 -0.9 . . . . 0.0 111.741 -179.646 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 48' ' ' LEU . . . . . . . . . . . . . 43.0 tp -132.84 -64.07 0.76 Allowed 'General case' 0 N--CA 1.493 1.723 0 O-C-N 120.803 -1.185 . . . . 0.0 111.045 -179.466 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 49' ' ' GLY . . . . . 0.463 ' O ' ' HB2' ' A' ' 50' ' ' GLN . . . -96.96 19.24 55.58 Favored Glycine 0 N--CA 1.498 2.772 0 C-N-CA 120.405 -0.903 . . . . 0.0 111.115 -179.464 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 50' ' ' GLN . . . . . 0.463 ' HB2' ' O ' ' A' ' 49' ' ' GLY . 36.1 mt-30 65.19 -68.4 0.11 Allowed 'General case' 0 N--CA 1.507 2.407 0 CA-C-N 118.254 1.027 . . . . 0.0 111.469 179.661 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 51' ' ' ASN . . . . . . . . . . . . . 0.9 OUTLIER 63.49 94.28 0.05 OUTLIER Pre-proline 0 N--CA 1.504 2.227 0 O-C-N 121.492 -0.755 . . . . 0.0 110.956 -179.759 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 52' ' ' PRO . . . . . . . . . . . . . 49.2 Cg_endo -75.41 -42.96 0.4 Allowed 'Trans proline' 0 N--CA 1.49 1.274 0 O-C-N 123.747 1.393 . . . . 0.0 111.212 179.819 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 53' ' ' THR . . . . . 0.603 HG23 ' HB2' ' A' ' 56' ' ' GLU . 0.0 OUTLIER -143.54 153.94 59.23 Favored Pre-proline 0 N--CA 1.501 2.086 0 O-C-N 121.198 -0.939 . . . . 0.0 110.622 -179.875 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild core ' A' A ' 54' ' ' PRO . . . . . 0.503 ' O ' ' HB ' ' A' ' 38' ' ' THR . 44.2 Cg_endo -69.9 -42.08 3.56 Favored 'Trans proline' 0 C--N 1.312 -1.382 0 O-C-N 124.111 1.585 . . . . 0.0 110.774 179.431 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 55' ' ' GLU . . . . . . . . . . . . . 3.0 mp0 -55.04 -28.6 53.43 Favored 'General case' 0 N--CA 1.504 2.24 0 O-C-N 121.312 -0.867 . . . . 0.0 111.045 179.997 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 56' ' ' GLU . . . . . 0.603 ' HB2' HG23 ' A' ' 53' ' ' THR . 22.5 tt0 -65.74 -29.96 70.55 Favored 'General case' 0 N--CA 1.496 1.836 0 O-C-N 121.317 -0.865 . . . . 0.0 111.206 179.91 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 57' ' ' LEU . . . . . 0.67 HD22 ' N ' ' A' ' 57' ' ' LEU . 3.1 mm? -84.51 -12.95 53.26 Favored 'General case' 0 N--CA 1.5 2.035 0 O-C-N 120.949 -1.095 . . . . 0.0 111.58 -179.459 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 58' ' ' GLN . . . . . 0.673 ' HA ' HG22 ' A' ' 61' ' ' ILE . 0.0 OUTLIER -57.2 -30.57 64.67 Favored 'General case' 0 N--CA 1.502 2.132 0 O-C-N 121.126 -0.984 . . . . 0.0 109.525 179.545 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild core ' A' A ' 59' ' ' GLU . . . . . . . . . . . . . 0.7 OUTLIER -61.9 -37.46 84.69 Favored 'General case' 0 N--CA 1.498 1.966 0 O-C-N 121.058 -1.027 . . . . 0.0 109.013 178.214 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 60' ' ' MET . . . . . . . . . . . . . 0.7 OUTLIER -72.55 -40.54 66.63 Favored 'General case' 0 N--CA 1.495 1.786 0 O-C-N 121.798 -0.564 . . . . 0.0 110.509 179.49 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 61' ' ' ILE . . . . . 0.673 HG22 ' HA ' ' A' ' 58' ' ' GLN . 15.2 tt -76.23 -38.32 33.63 Favored 'Isoleucine or valine' 0 N--CA 1.498 1.954 0 O-C-N 121.245 -0.909 . . . . 0.0 111.019 -179.75 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 62' ' ' ASP . . . . . . . . . . . . . 0.7 OUTLIER -66.84 -35.23 79.58 Favored 'General case' 0 N--CA 1.499 2.023 0 O-C-N 121.148 -0.97 . . . . 0.0 110.433 179.928 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 63' ' ' GLU . . . . . . . . . . . . . 1.2 tt0 -56.84 -34.27 67.59 Favored 'General case' 0 N--CA 1.499 1.982 0 O-C-N 121.535 -0.728 . . . . 0.0 110.452 179.412 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 64' ' ' VAL . . . . . 0.54 HG11 ' HB2' ' A' ' 80' ' ' MET . 27.5 t -101.63 -20.64 5.47 Favored 'Isoleucine or valine' 0 N--CA 1.496 1.872 0 O-C-N 121.311 -0.868 . . . . 0.0 110.651 179.632 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 65' ' ' ASP . . . . . . . . . . . . . 30.0 t70 -58.55 -70.93 0.13 Allowed 'General case' 0 N--CA 1.5 2.071 0 O-C-N 121.359 -0.838 . . . . 0.0 110.778 -179.641 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 66' ' ' GLU . . . . . . . . . . . . . 15.8 mm-40 49.18 30.61 3.12 Favored 'General case' 0 N--CA 1.504 2.23 0 O-C-N 121.489 -0.757 . . . . 0.0 110.293 -179.209 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 67' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -105.05 -29.15 10.61 Favored 'General case' 0 N--CA 1.492 1.633 0 O-C-N 121.604 -0.685 . . . . 0.0 110.549 -179.45 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 68' ' ' GLY . . . . . . . . . . . . . . . 110.92 -11.68 29.56 Favored Glycine 0 N--CA 1.495 2.569 0 N-CA-C 109.406 -1.477 . . . . 0.0 109.406 -178.729 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 69' ' ' SER . . . . . . . . . . . . . 89.7 p -102.32 -42.89 5.85 Favored 'General case' 0 N--CA 1.495 1.818 0 O-C-N 121.468 -1.019 . . . . 0.0 111.015 -179.847 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 70' ' ' GLY . . . . . . . . . . . . . . . 95.31 38.14 4.88 Favored Glycine 0 N--CA 1.496 2.657 0 N-CA-C 108.417 -1.873 . . . . 0.0 108.417 -178.954 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 71' ' ' THR . . . . . . . . . . . . . 8.1 p -142.6 134.31 26.77 Favored 'General case' 0 N--CA 1.492 1.648 0 O-C-N 121.763 -0.845 . . . . 0.0 109.954 -179.086 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 72' ' ' VAL . . . . . . . . . . . . . 2.9 t -103.05 113.56 40.16 Favored 'Isoleucine or valine' 0 N--CA 1.494 1.733 0 O-C-N 121.386 -0.821 . . . . 0.0 110.59 -179.859 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 73' ' ' ASP . . . . . . . . . . . . . 1.6 p-10 -87.15 -159.32 0.5 Allowed 'General case' 0 N--CA 1.496 1.83 0 O-C-N 121.493 -0.754 . . . . 0.0 110.042 179.581 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 74' ' ' PHE . . . . . . . . . . . . . 46.7 t80 -61.67 -51.87 66.64 Favored 'General case' 0 N--CA 1.496 1.866 0 O-C-N 121.303 -0.873 . . . . 0.0 110.323 179.812 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 75' ' ' ASP . . . . . 0.418 ' HA ' HD23 ' A' ' 78' ' ' LEU . 0.3 OUTLIER -61.61 -47.31 86.01 Favored 'General case' 0 N--CA 1.496 1.87 0 O-C-N 121.518 -0.738 . . . . 0.0 110.675 -179.935 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild core ' A' A ' 76' ' ' GLU . . . . . . . . . . . . . 14.2 mt-10 -63.58 -33.53 75.81 Favored 'General case' 0 N--CA 1.499 2.004 0 O-C-N 121.327 -0.858 . . . . 0.0 110.433 179.586 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 77' ' ' PHE . . . . . . . . . . . . . 33.6 t80 -76.68 -46.2 26.59 Favored 'General case' 0 N--CA 1.497 1.886 0 O-C-N 121.173 -0.954 . . . . 0.0 110.033 179.358 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 78' ' ' LEU . . . . . 0.568 HD11 HD11 ' A' ' 12' ' ' LEU . 0.1 OUTLIER -66.44 -36.14 82.05 Favored 'General case' 0 N--CA 1.498 1.946 0 O-C-N 121.429 -0.794 . . . . 0.0 110.429 -179.791 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild core ' A' A ' 79' ' ' VAL . . . . . 0.488 ' N ' ' HG ' ' A' ' 78' ' ' LEU . 4.3 p -71.78 -33.91 49.97 Favored 'Isoleucine or valine' 0 N--CA 1.499 2.015 0 O-C-N 120.951 -1.093 . . . . 0.0 109.206 178.684 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 80' ' ' MET . . . . . 0.54 ' HB2' HG11 ' A' ' 64' ' ' VAL . 56.2 ttp -61.24 -33.53 73.67 Favored 'General case' 0 N--CA 1.496 1.829 0 O-C-N 121.545 -0.722 . . . . 0.0 109.198 178.415 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 81' ' ' MET . . . . . . . . . . . . . 9.1 mmt -62.96 -42.85 99.95 Favored 'General case' 0 N--CA 1.494 1.763 0 O-C-N 121.667 -0.646 . . . . 0.0 109.544 178.881 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 82' ' ' VAL . . . . . . . . . . . . . 71.9 t -60.69 -38.85 79.76 Favored 'Isoleucine or valine' 0 N--CA 1.5 2.06 0 O-C-N 121.478 -0.764 . . . . 0.0 109.363 178.832 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 83' ' ' ARG . . . . . . . . . . . . . 20.1 mtp180 -62.79 -37.06 85.18 Favored 'General case' 0 N--CA 1.498 1.965 0 O-C-N 121.372 -0.83 . . . . 0.0 109.383 178.62 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 84' ' ' CYS . . . . . 0.404 ' HB3' ' HA ' ' B' ' 149' ' ' SER . 66.7 m -78.86 -24.88 44.04 Favored 'General case' 0 N--CA 1.496 1.863 0 O-C-N 121.577 -0.702 . . . . 0.0 110.311 179.226 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 85' ' ' MET . . . . . . . . . . . . . 2.5 mtp . . . . . 0 N--CA 1.499 2.012 0 O-C-N 121.28 -0.888 . . . . 0.0 109.7 179.156 . . . . . . . . 0 0 . 1 . 018 nuclear nobuild core ' B' B ' 149' ' ' SER . . . . . 0.404 ' HA ' ' HB3' ' A' ' 84' ' ' CYS . 40.8 t . . . . . 0 N--CA 1.5 2.042 0 CA-C-O 121.325 0.583 . . . . 0.0 111.163 . . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' B' B ' 150' ' ' ALA . . . . . . . . . . . . . . . -55.75 -50.58 70.0 Favored 'General case' 0 N--CA 1.499 2.019 0 O-C-N 121.72 -0.612 . . . . 0.0 111.084 -179.792 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' B' B ' 151' ' ' ASP . . . . . . . . . . . . . 4.7 p-10 -56.97 -37.28 71.39 Favored 'General case' 0 N--CA 1.501 2.083 0 O-C-N 121.392 -0.817 . . . . 0.0 110.696 179.893 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' B' B ' 152' ' ' ALA . . . . . . . . . . . . . . . -70.44 -45.29 66.12 Favored 'General case' 0 N--CA 1.495 1.803 0 O-C-N 121.321 -0.862 . . . . 0.0 109.636 179.304 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' B' B ' 153' ' ' MET . . . . . . . . . . . . . 1.1 mmt -62.74 -40.95 98.83 Favored 'General case' 0 N--CA 1.496 1.86 0 O-C-N 121.613 -0.68 . . . . 0.0 110.137 179.364 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' B' B ' 154' ' ' MET . . . . . . . . . . . . . 9.9 mmt -61.86 -47.94 82.77 Favored 'General case' 0 N--CA 1.499 1.993 0 O-C-N 121.358 -0.839 . . . . 0.0 109.956 179.458 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' B' B ' 155' ' ' GLN . . . . . . . . . . . . . 13.9 mt-30 -68.72 -29.69 68.16 Favored 'General case' 0 N--CA 1.498 1.973 0 O-C-N 121.338 -0.851 . . . . 0.0 110.505 179.334 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' B' B ' 156' ' ' ALA . . . . . . . . . . . . . . . -80.39 -20.32 44.28 Favored 'General case' 0 N--CA 1.498 1.973 0 O-C-N 121.243 -0.911 . . . . 0.0 111.082 179.867 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' B' B ' 157' ' ' LEU . . . . . 0.424 HD13 ' CE2' ' A' ' 27' ' ' PHE . 13.6 tp -96.59 -49.18 5.22 Favored 'General case' 0 N--CA 1.497 1.907 0 O-C-N 121.041 -1.037 . . . . 0.0 111.017 -179.685 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' B' B ' 158' ' ' LEU . . . . . . . . . . . . . 19.0 mt . . . . . 0 N--CA 1.5 2.069 0 O-C-N 121.15 -0.969 . . . . 0.0 111.587 -179.24 . . . . . . . . 0 0 . 1 . 019 nuclear nobuild core ' A' A ' 4' ' ' ILE . . . . . . . . . . . . . 72.3 mt . . . . . 0 N--CA 1.502 2.17 0 CA-C-O 120.859 0.362 . . . . 0.0 110.371 . . . . . . . . . 0 0 . 1 . 019 nuclear nobuild core ' A' A ' 5' ' ' TYR . . . . . . . . . . . . . 44.1 m-85 -66.26 -42.22 88.81 Favored 'General case' 0 N--CA 1.501 2.122 0 O-C-N 121.244 -0.91 . . . . 0.0 110.525 179.931 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 6' ' ' LYS . . . . . 0.483 ' HB3' ' HE3' ' A' ' 6' ' ' LYS . 15.9 mtpp -65.3 -32.18 73.7 Favored 'General case' 0 N--CA 1.493 1.683 0 O-C-N 121.332 -0.855 . . . . 0.0 110.415 179.99 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 7' ' ' ALA . . . . . . . . . . . . . . . -51.65 -42.91 62.42 Favored 'General case' 0 N--CA 1.498 1.954 0 O-C-N 121.253 -0.904 . . . . 0.0 109.306 178.803 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 8' ' ' ALA . . . . . 0.472 ' HB3' HG21 ' A' ' 82' ' ' VAL . . . -70.23 -42.24 72.5 Favored 'General case' 0 N--CA 1.495 1.812 0 O-C-N 121.503 -0.748 . . . . 0.0 109.158 178.218 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 9' ' ' VAL . . . . . 0.768 HG13 ' HB3' ' A' ' 78' ' ' LEU . 69.7 t -61.52 -40.53 86.79 Favored 'Isoleucine or valine' 0 N--CA 1.5 2.034 0 O-C-N 121.704 -0.623 . . . . 0.0 110.103 179.15 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 10' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER -69.16 -28.83 66.77 Favored 'General case' 0 N--CA 1.497 1.912 0 O-C-N 121.512 -0.743 . . . . 0.0 110.587 179.7 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 11' ' ' GLN . . . . . . . . . . . . . 0.1 OUTLIER -92.42 41.61 1.08 Allowed 'General case' 0 N--CA 1.496 1.836 0 O-C-N 121.279 -0.888 . . . . 0.0 110.946 -179.754 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 12' ' ' LEU . . . . . 0.557 HD12 ' HA ' ' A' ' 9' ' ' VAL . 10.7 mt -106.8 123.82 48.71 Favored 'General case' 0 N--CA 1.497 1.904 0 O-C-N 121.134 -0.979 . . . . 0.0 110.177 179.516 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 13' ' ' THR . . . . . . . . . . . . . 0.3 OUTLIER -79.69 164.49 23.7 Favored 'General case' 0 N--CA 1.498 1.927 0 O-C-N 121.193 -0.942 . . . . 0.0 110.07 179.621 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 14' ' ' GLU . . . . . . . . . . . . . 0.2 OUTLIER -52.54 -30.75 32.2 Favored 'General case' 0 N--CA 1.497 1.879 0 O-C-N 121.625 -0.672 . . . . 0.0 111.196 -179.281 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 1.5 mp0 -59.65 -51.23 70.71 Favored 'General case' 0 N--CA 1.497 1.892 0 O-C-N 121.449 -0.782 . . . . 0.0 109.838 179.483 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 16' ' ' GLN . . . . . . . . . . . . . 3.0 mp0 -79.99 -26.79 39.77 Favored 'General case' 0 N--CA 1.5 2.03 0 O-C-N 121.452 -0.78 . . . . 0.0 110.12 179.148 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 17' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -69.15 -42.57 75.76 Favored 'General case' 0 N--CA 1.496 1.867 0 O-C-N 121.628 -0.67 . . . . 0.0 110.097 179.707 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 18' ' ' ASN . . . . . 0.508 ' HA ' ' HG2' ' A' ' 21' ' ' LYS . 12.2 t30 -56.9 -39.69 74.89 Favored 'General case' 0 N--CA 1.499 2.002 0 O-C-N 121.6 -0.688 . . . . 0.0 110.761 179.923 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 4.4 mt-10 -54.88 -48.51 72.9 Favored 'General case' 0 N--CA 1.499 2.011 0 O-C-N 121.33 -0.856 . . . . 0.0 109.987 179.553 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 20' ' ' PHE . . . . . . . . . . . . . 43.9 m-85 -77.65 -33.58 53.41 Favored 'General case' 0 N--CA 1.497 1.919 0 O-C-N 121.436 -0.79 . . . . 0.0 110.282 179.516 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 21' ' ' LYS . . . . . 0.514 ' HG3' ' N ' ' A' ' 22' ' ' ALA . 0.0 OUTLIER -64.21 -34.31 77.79 Favored 'General case' 0 N--CA 1.496 1.858 0 O-C-N 121.183 -0.948 . . . . 0.0 109.508 179.02 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild core ' A' A ' 22' ' ' ALA . . . . . 0.514 ' N ' ' HG3' ' A' ' 21' ' ' LYS . . . -76.02 -41.52 50.74 Favored 'General case' 0 N--CA 1.496 1.873 0 O-C-N 121.556 -0.715 . . . . 0.0 109.153 178.434 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 23' ' ' ALA . . . . . 0.492 ' O ' ' HB2' ' A' ' 27' ' ' PHE . . . -73.3 -7.27 50.83 Favored 'General case' 0 N--CA 1.494 1.732 0 O-C-N 121.679 -0.638 . . . . 0.0 110.75 178.975 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 24' ' ' PHE . . . . . . . . . . . . . 38.5 t80 -107.92 -49.32 3.23 Favored 'General case' 0 N--CA 1.495 1.793 0 O-C-N 121.181 -0.949 . . . . 0.0 110.795 -179.574 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 25' ' ' ASP . . . . . . . . . . . . . 0.1 OUTLIER -61.38 -41.84 97.75 Favored 'General case' 0 N--CA 1.5 2.065 0 O-C-N 121.307 -0.871 . . . . 0.0 110.891 -179.389 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 26' ' ' ILE . . . . . . . . . . . . . 37.4 mt -76.62 -27.05 16.83 Favored 'Isoleucine or valine' 0 N--CA 1.499 1.977 0 O-C-N 121.152 -0.968 . . . . 0.0 109.798 179.037 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 27' ' ' PHE . . . . . 0.567 ' HA ' HD21 ' B' ' 157' ' ' LEU . 1.7 t80 -59.08 -50.6 73.45 Favored 'General case' 0 N--CA 1.497 1.894 0 O-C-N 121.638 -0.664 . . . . 0.0 110.421 179.484 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 28' ' ' VAL . . . . . . . . . . . . . 18.6 m -91.04 -35.4 7.12 Favored 'Isoleucine or valine' 0 N--CA 1.497 1.906 0 O-C-N 121.555 -0.716 . . . . 0.0 111.254 -179.288 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 29' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER 46.48 43.66 12.31 Favored 'General case' 0 N--CA 1.497 1.919 0 O-C-N 121.45 -0.781 . . . . 0.0 110.218 -179.654 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 30' ' ' GLY . . . . . . . . . . . . . . . 106.06 -62.04 0.33 Allowed Glycine 0 N--CA 1.494 2.503 0 N-CA-C 108.794 -1.722 . . . . 0.0 108.794 -178.768 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 31' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.501 2.121 0 O-C-N 121.81 -0.817 . . . . 0.0 111.13 179.531 . . . . . . . . 0 0 . 1 . 019 nuclear nobuild core ' A' A ' 35' ' ' CYS . . . . . . . . . . . . . 96.7 m . . . . . 0 N--CA 1.508 2.456 0 CA-C-O 120.758 0.313 . . . . 0.0 111.302 . . . . . . . . . 0 0 . 1 . 019 nuclear nobuild core ' A' A ' 36' ' ' ILE . . . . . . . . . . . . . 30.5 mt -80.95 105.56 11.0 Favored 'Isoleucine or valine' 0 N--CA 1.5 2.054 0 O-C-N 120.792 -1.193 . . . . 0.0 110.141 -179.893 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 37' ' ' SER . . . . . . . . . . . . . 5.7 t -100.57 175.71 5.58 Favored 'General case' 0 N--CA 1.496 1.835 0 O-C-N 121.429 -0.794 . . . . 0.0 110.098 179.595 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 38' ' ' THR . . . . . 0.407 HG21 ' HG2' ' A' ' 58' ' ' GLN . 33.6 p -61.81 -38.8 89.49 Favored 'General case' 0 N--CA 1.501 2.1 0 O-C-N 121.231 -0.918 . . . . 0.0 110.041 179.553 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 39' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -65.64 -40.29 92.36 Favored 'General case' 0 N--CA 1.499 2.005 0 O-C-N 121.674 -0.641 . . . . 0.0 110.379 179.535 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 2.3 mp0 -65.42 -48.8 71.57 Favored 'General case' 0 N--CA 1.499 2.014 0 O-C-N 121.434 -0.791 . . . . 0.0 110.399 179.896 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 41' ' ' LEU . . . . . 0.542 HD11 ' HE1' ' A' ' 45' ' ' MET . 7.7 tp -61.69 -47.44 85.31 Favored 'General case' 0 N--CA 1.499 1.983 0 O-C-N 121.481 -0.762 . . . . 0.0 110.323 179.898 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 42' ' ' GLY . . . . . . . . . . . . . . . -58.16 -40.06 93.16 Favored Glycine 0 N--CA 1.493 2.472 0 N-CA-C 110.155 -1.178 . . . . 0.0 110.155 -179.712 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 43' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -56.42 -45.21 80.82 Favored 'General case' 0 N--CA 1.5 2.066 0 O-C-N 121.439 -1.036 . . . . 0.0 109.97 179.426 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 44' ' ' VAL . . . . . 0.447 HG21 ' CE1' ' A' ' 27' ' ' PHE . 72.1 t -67.84 -42.69 86.14 Favored 'Isoleucine or valine' 0 N--CA 1.498 1.94 0 O-C-N 121.42 -0.8 . . . . 0.0 109.557 179.154 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 45' ' ' MET . . . . . 0.542 ' HE1' HD11 ' A' ' 41' ' ' LEU . 0.9 OUTLIER -60.04 -39.27 85.35 Favored 'General case' 0 N--CA 1.499 2.012 0 O-C-N 121.431 -0.793 . . . . 0.0 109.59 178.805 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild core ' A' A ' 46' ' ' ARG . . . . . . . . . . . . . 0.3 OUTLIER -61.49 -37.49 83.87 Favored 'General case' 0 N--CA 1.496 1.832 0 O-C-N 121.65 -0.656 . . . . 0.0 109.706 178.859 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 47' ' ' MET . . . . . . . . . . . . . 18.1 ttp -67.02 -38.65 86.33 Favored 'General case' 0 N--CA 1.496 1.863 0 O-C-N 121.711 -0.618 . . . . 0.0 110.032 179.153 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 48' ' ' LEU . . . . . . . . . . . . . 5.9 tp -68.9 -36.79 78.45 Favored 'General case' 0 N--CA 1.493 1.677 0 O-C-N 121.4 -0.812 . . . . 0.0 110.307 179.691 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 49' ' ' GLY . . . . . . . . . . . . . . . 131.98 -39.61 1.74 Allowed Glycine 0 N--CA 1.494 2.561 0 N-CA-C 110.023 -1.231 . . . . 0.0 110.023 179.925 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 50' ' ' GLN . . . . . . . . . . . . . 7.8 mt-30 -88.16 107.51 18.81 Favored 'General case' 0 N--CA 1.497 1.922 0 O-C-N 121.274 -1.133 . . . . 0.0 110.626 -179.741 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 51' ' ' ASN . . . . . . . . . . . . . 24.4 t-20 -156.79 100.76 1.99 Allowed Pre-proline 0 N--CA 1.499 1.999 0 O-C-N 121.412 -0.805 . . . . 0.0 110.196 179.81 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 52' ' ' PRO . . . . . . . . . . . . . 49.0 Cg_endo -79.53 -89.2 0.0 OUTLIER 'Trans proline' 0 C--N 1.317 -1.131 0 O-C-N 123.839 1.441 . . . . 0.0 111.178 -179.999 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 53' ' ' THR . . . . . . . . . . . . . 4.6 p -127.95 165.83 27.77 Favored Pre-proline 0 N--CA 1.496 1.846 0 O-C-N 120.945 -1.097 . . . . 0.0 110.791 -179.233 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 54' ' ' PRO . . . . . . . . . . . . . 42.7 Cg_endo -68.79 -31.76 24.64 Favored 'Trans proline' 0 N--CA 1.491 1.335 0 O-C-N 123.704 1.371 . . . . 0.0 110.939 179.495 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 55' ' ' GLU . . . . . . . . . . . . . 1.9 mp0 -67.4 -29.45 68.97 Favored 'General case' 0 N--CA 1.499 1.994 0 O-C-N 121.22 -0.925 . . . . 0.0 110.075 179.271 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 4.6 tm-20 -56.82 -35.99 69.44 Favored 'General case' 0 N--CA 1.499 1.979 0 O-C-N 121.53 -0.732 . . . . 0.0 110.663 179.587 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 57' ' ' LEU . . . . . 0.593 ' H ' HD22 ' A' ' 57' ' ' LEU . 0.7 OUTLIER -69.58 -29.26 66.77 Favored 'General case' 0 N--CA 1.499 1.98 0 O-C-N 121.33 -0.856 . . . . 0.0 110.87 179.983 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild core ' A' A ' 58' ' ' GLN . . . . . 0.748 ' O ' HG22 ' A' ' 61' ' ' ILE . 0.0 OUTLIER -56.86 -49.74 74.57 Favored 'General case' 0 N--CA 1.498 1.941 0 O-C-N 121.051 -1.031 . . . . 0.0 109.451 179.642 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild core ' A' A ' 59' ' ' GLU . . . . . . . . . . . . . 0.7 OUTLIER -64.65 -38.1 89.85 Favored 'General case' 0 N--CA 1.495 1.805 0 N-CA-C 108.418 -0.956 . . . . 0.0 108.418 177.971 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 60' ' ' MET . . . . . 0.442 ' HB2' ' HA ' ' A' ' 57' ' ' LEU . 7.5 mmm -58.8 -39.1 80.15 Favored 'General case' 0 N--CA 1.496 1.838 0 O-C-N 121.795 -0.566 . . . . 0.0 110.096 178.772 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 61' ' ' ILE . . . . . 0.748 HG22 ' O ' ' A' ' 58' ' ' GLN . 5.1 tt -76.72 -26.9 16.59 Favored 'Isoleucine or valine' 0 N--CA 1.498 1.943 0 O-C-N 121.435 -0.791 . . . . 0.0 110.575 179.729 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 62' ' ' ASP . . . . . . . . . . . . . 1.8 t70 -62.32 -25.22 67.76 Favored 'General case' 0 N--CA 1.498 1.948 0 O-C-N 121.417 -0.802 . . . . 0.0 110.487 179.683 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 63' ' ' GLU . . . . . . . . . . . . . 16.2 tt0 -47.28 -42.39 20.79 Favored 'General case' 0 N--CA 1.501 2.097 0 O-C-N 121.613 -0.68 . . . . 0.0 110.961 179.459 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 64' ' ' VAL . . . . . 0.563 HG11 ' HB2' ' A' ' 80' ' ' MET . 27.5 m -127.45 30.14 1.81 Allowed 'Isoleucine or valine' 0 N--CA 1.498 1.96 0 O-C-N 121.342 -0.849 . . . . 0.0 110.85 179.929 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 65' ' ' ASP . . . . . . . . . . . . . 19.3 t70 -119.9 -97.82 0.46 Allowed 'General case' 0 N--CA 1.495 1.78 0 O-C-N 121.173 -0.955 . . . . 0.0 110.062 179.589 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 66' ' ' GLU . . . . . . . . . . . . . 1.4 mm-40 47.24 35.34 3.66 Favored 'General case' 0 N--CA 1.502 2.126 0 O-C-N 121.354 -0.841 . . . . 0.0 110.967 -179.903 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 67' ' ' ASP . . . . . . . . . . . . . 4.4 p-10 -114.09 7.45 16.71 Favored 'General case' 0 N--CA 1.497 1.884 0 O-C-N 121.213 -0.93 . . . . 0.0 111.367 -179.691 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 68' ' ' GLY . . . . . . . . . . . . . . . 98.34 -27.1 21.0 Favored Glycine 0 N--CA 1.497 2.759 0 N-CA-C 110.45 -1.06 . . . . 0.0 110.45 179.888 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 69' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -80.34 -42.36 23.08 Favored 'General case' 0 N--CA 1.498 1.951 0 O-C-N 121.22 -1.165 . . . . 0.0 111.01 -179.612 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 70' ' ' GLY . . . . . . . . . . . . . . . 81.13 6.77 89.16 Favored Glycine 0 N--CA 1.499 2.854 0 C-N-CA 120.205 -0.997 . . . . 0.0 110.871 179.959 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 71' ' ' THR . . . . . . . . . . . . . 2.7 m -124.33 140.53 52.87 Favored 'General case' 0 N--CA 1.498 1.955 0 O-C-N 121.09 -1.241 . . . . 0.0 109.842 179.697 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 72' ' ' VAL . . . . . 0.658 HG23 HG12 ' A' ' 61' ' ' ILE . 3.0 t -92.35 123.63 44.52 Favored 'Isoleucine or valine' 0 N--CA 1.495 1.791 0 O-C-N 121.426 -0.796 . . . . 0.0 110.723 -179.633 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 73' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER -97.28 -163.5 1.05 Allowed 'General case' 0 N--CA 1.494 1.736 0 O-C-N 121.525 -0.735 . . . . 0.0 109.671 179.28 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 74' ' ' PHE . . . . . 0.412 ' CE2' HD11 ' A' ' 78' ' ' LEU . 11.1 t80 -64.97 -45.49 85.47 Favored 'General case' 0 N--CA 1.499 2.023 0 O-C-N 121.067 -1.02 . . . . 0.0 110.475 179.771 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 75' ' ' ASP . . . . . . . . . . . . . 16.3 t70 -59.85 -50.76 72.54 Favored 'General case' 0 N--CA 1.498 1.974 0 O-C-N 121.358 -0.839 . . . . 0.0 109.978 179.389 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 76' ' ' GLU . . . . . . . . . . . . . 43.5 mt-10 -62.18 -40.7 96.91 Favored 'General case' 0 N--CA 1.498 1.943 0 O-C-N 121.515 -0.741 . . . . 0.0 109.553 179.167 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 77' ' ' PHE . . . . . . . . . . . . . 71.8 t80 -60.83 -44.19 97.27 Favored 'General case' 0 N--CA 1.496 1.872 0 O-C-N 121.617 -0.677 . . . . 0.0 109.703 178.712 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 78' ' ' LEU . . . . . 0.768 ' HB3' HG13 ' A' ' 9' ' ' VAL . 52.6 mt -65.98 -43.62 87.29 Favored 'General case' 0 N--CA 1.5 2.046 0 O-C-N 121.567 -0.708 . . . . 0.0 110.087 179.389 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 79' ' ' VAL . . . . . 0.642 ' O ' HG12 ' A' ' 82' ' ' VAL . 45.2 t -60.2 -44.68 95.94 Favored 'Isoleucine or valine' 0 N--CA 1.497 1.891 0 O-C-N 121.61 -0.681 . . . . 0.0 109.393 179.374 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 80' ' ' MET . . . . . 0.563 ' HB2' HG11 ' A' ' 64' ' ' VAL . 2.3 ttp -62.78 -39.77 95.26 Favored 'General case' 0 N--CA 1.495 1.812 0 O-C-N 121.517 -0.74 . . . . 0.0 110.013 178.923 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 81' ' ' MET . . . . . . . . . . . . . 11.2 mmt -62.33 -44.29 96.84 Favored 'General case' 0 N--CA 1.498 1.948 0 O-C-N 121.57 -0.706 . . . . 0.0 110.743 179.946 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 82' ' ' VAL . . . . . 0.642 HG12 ' O ' ' A' ' 79' ' ' VAL . 2.4 p -70.21 -26.57 29.69 Favored 'Isoleucine or valine' 0 N--CA 1.5 2.05 0 O-C-N 121.169 -0.957 . . . . 0.0 110.292 179.514 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 83' ' ' ARG . . . . . 0.618 ' HD2' HG12 ' A' ' 79' ' ' VAL . 4.0 mtp180 -74.6 -33.68 62.68 Favored 'General case' 0 N--CA 1.495 1.795 0 O-C-N 121.222 -0.924 . . . . 0.0 109.444 178.742 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 84' ' ' CYS . . . . . . . . . . . . . 0.1 OUTLIER -71.59 -11.52 60.89 Favored 'General case' 0 N--CA 1.496 1.869 0 O-C-N 121.703 -0.623 . . . . 0.0 110.921 179.323 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 85' ' ' MET . . . . . . . . . . . . . 12.2 tpp . . . . . 0 N--CA 1.5 2.029 0 O-C-N 121.315 -0.865 . . . . 0.0 111.563 -179.953 . . . . . . . . 0 0 . 1 . 019 nuclear nobuild core ' B' B ' 149' ' ' SER . . . . . . . . . . . . . 89.0 p . . . . . 0 N--CA 1.496 1.839 0 CA-C-O 121.284 0.564 . . . . 0.0 110.391 . . . . . . . . . 0 0 . 1 . 019 nuclear nobuild core ' B' B ' 150' ' ' ALA . . . . . . . . . . . . . . . -58.85 -50.09 75.28 Favored 'General case' 0 N--CA 1.498 1.974 0 O-C-N 121.482 -0.761 . . . . 0.0 111.104 -179.652 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' B' B ' 151' ' ' ASP . . . . . . . . . . . . . 7.2 p-10 -60.62 -35.75 76.92 Favored 'General case' 0 N--CA 1.502 2.137 0 O-C-N 121.371 -0.83 . . . . 0.0 111.252 -179.804 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' B' B ' 152' ' ' ALA . . . . . . . . . . . . . . . -74.36 -38.82 63.1 Favored 'General case' 0 N--CA 1.496 1.825 0 O-C-N 121.131 -0.981 . . . . 0.0 110.252 179.645 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' B' B ' 153' ' ' MET . . . . . . . . . . . . . 0.4 OUTLIER -64.66 -47.97 76.49 Favored 'General case' 0 N--CA 1.498 1.962 0 O-C-N 121.41 -0.806 . . . . 0.0 110.608 179.973 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' B' B ' 154' ' ' MET . . . . . 0.427 ' HG3' ' N ' ' B' ' 155' ' ' GLN . 17.2 ptp -63.84 -30.25 71.36 Favored 'General case' 0 N--CA 1.5 2.04 0 O-C-N 121.167 -0.958 . . . . 0.0 110.298 179.57 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' B' B ' 155' ' ' GLN . . . . . 0.427 ' N ' ' HG3' ' B' ' 154' ' ' MET . 0.2 OUTLIER -65.54 -35.79 81.88 Favored 'General case' 0 N--CA 1.498 1.961 0 O-C-N 121.327 -0.858 . . . . 0.0 110.201 179.074 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild core ' B' B ' 156' ' ' ALA . . . . . . . . . . . . . . . -87.28 -43.77 11.92 Favored 'General case' 0 N--CA 1.495 1.799 0 O-C-N 121.431 -0.793 . . . . 0.0 110.143 179.719 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' B' B ' 157' ' ' LEU . . . . . 0.567 HD21 ' HA ' ' A' ' 27' ' ' PHE . 0.9 OUTLIER -64.67 -48.65 73.96 Favored 'General case' 0 N--CA 1.498 1.972 0 O-C-N 121.614 -0.679 . . . . 0.0 110.481 179.969 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild core ' B' B ' 158' ' ' LEU . . . . . . . . . . . . . 6.3 mt . . . . . 0 N--CA 1.498 1.947 0 O-C-N 121.161 -0.962 . . . . 0.0 110.856 -179.988 . . . . . . . . 0 0 . 1 . 020 nuclear nobuild core ' A' A ' 4' ' ' ILE . . . . . . . . . . . . . 1.8 pp . . . . . 0 N--CA 1.499 2.009 0 CA-C-O 120.866 0.365 . . . . 0.0 110.626 . . . . . . . . . 0 0 . 1 . 020 nuclear nobuild core ' A' A ' 5' ' ' TYR . . . . . 0.423 ' CE1' ' HG2' ' A' ' 83' ' ' ARG . 16.5 m-85 -72.07 -42.55 66.08 Favored 'General case' 0 N--CA 1.496 1.872 0 O-C-N 121.252 -0.905 . . . . 0.0 109.767 179.407 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -66.5 -44.13 83.44 Favored 'General case' 0 N--CA 1.495 1.791 0 O-C-N 121.541 -0.724 . . . . 0.0 109.771 179.121 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 7' ' ' ALA . . . . . . . . . . . . . . . -52.42 -41.26 63.06 Favored 'General case' 0 N--CA 1.498 1.973 0 O-C-N 121.464 -0.773 . . . . 0.0 109.936 179.12 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 8' ' ' ALA . . . . . . . . . . . . . . . -60.12 -33.07 71.63 Favored 'General case' 0 N--CA 1.498 1.948 0 O-C-N 121.515 -0.741 . . . . 0.0 110.633 179.203 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 9' ' ' VAL . . . . . 0.503 ' HA ' HD23 ' A' ' 12' ' ' LEU . 84.5 t -84.61 -37.46 12.64 Favored 'Isoleucine or valine' 0 N--CA 1.498 1.958 0 O-C-N 121.459 -0.776 . . . . 0.0 110.566 179.996 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 10' ' ' GLU . . . . . . . . . . . . . 0.5 OUTLIER -67.98 -26.31 65.86 Favored 'General case' 0 N--CA 1.499 2.022 0 O-C-N 121.431 -0.793 . . . . 0.0 112.447 -178.73 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 11' ' ' GLN . . . . . . . . . . . . . 0.8 OUTLIER -134.13 65.82 1.56 Allowed 'General case' 0 N--CA 1.498 1.974 0 O-C-N 120.638 -1.289 . . . . 0.0 112.18 -179.346 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 12' ' ' LEU . . . . . 0.566 ' C ' HD12 ' A' ' 12' ' ' LEU . 4.4 pp -110.41 160.17 16.82 Favored 'General case' 0 N--CA 1.499 2.01 0 O-C-N 121.236 -0.915 . . . . 0.0 109.317 177.854 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 13' ' ' THR . . . . . . . . . . . . . 60.5 p -73.91 157.05 36.97 Favored 'General case' 0 N--CA 1.505 2.276 0 O-C-N 121.084 -1.01 . . . . 0.0 111.456 -178.627 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 14' ' ' GLU . . . . . . . . . . . . . 3.0 tp10 -53.18 -34.82 58.59 Favored 'General case' 0 N--CA 1.495 1.801 0 O-C-N 121.828 -0.545 . . . . 0.0 110.338 179.848 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 1.2 mp0 -63.29 -43.88 96.64 Favored 'General case' 0 N--CA 1.496 1.829 0 O-C-N 121.601 -0.687 . . . . 0.0 109.59 179.389 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 16' ' ' GLN . . . . . 0.505 ' HB3' HD13 ' A' ' 12' ' ' LEU . 0.1 OUTLIER -58.52 -37.88 76.56 Favored 'General case' 0 N--CA 1.498 1.931 0 CA-C-O 121.587 0.708 . . . . 0.0 110.144 179.269 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild core ' A' A ' 17' ' ' LYS . . . . . 0.527 ' HB2' HD11 ' A' ' 12' ' ' LEU . 1.3 ttpt -77.8 -33.72 52.41 Favored 'General case' 0 N--CA 1.493 1.709 0 O-C-N 121.5 -0.75 . . . . 0.0 109.986 179.173 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 18' ' ' ASN . . . . . . . . . . . . . 52.5 m-20 -68.42 -46.31 70.25 Favored 'General case' 0 N--CA 1.498 1.973 0 O-C-N 121.417 -0.802 . . . . 0.0 110.847 179.92 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 12.6 pt-20 -60.61 -35.84 77.12 Favored 'General case' 0 N--CA 1.502 2.131 0 O-C-N 121.173 -0.954 . . . . 0.0 110.121 179.856 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 20' ' ' PHE . . . . . . . . . . . . . 18.4 m-30 -77.12 -32.18 56.28 Favored 'General case' 0 N--CA 1.496 1.847 0 O-C-N 121.317 -0.864 . . . . 0.0 109.927 178.923 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 21' ' ' LYS . . . . . . . . . . . . . 2.9 tptp -60.97 -46.95 88.67 Favored 'General case' 0 N--CA 1.498 1.956 0 O-C-N 121.484 -0.76 . . . . 0.0 109.649 178.961 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 22' ' ' ALA . . . . . 0.497 ' O ' HD12 ' A' ' 26' ' ' ILE . . . -61.73 -50.23 73.24 Favored 'General case' 0 N--CA 1.499 1.989 0 O-C-N 121.395 -0.816 . . . . 0.0 109.869 179.324 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 23' ' ' ALA . . . . . . . . . . . . . . . -59.04 -40.44 85.05 Favored 'General case' 0 N--CA 1.498 1.929 0 O-C-N 121.557 -0.715 . . . . 0.0 109.647 178.94 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 24' ' ' PHE . . . . . 0.53 ' O ' HG13 ' A' ' 28' ' ' VAL . 73.9 t80 -64.55 -43.8 92.78 Favored 'General case' 0 N--CA 1.498 1.946 0 O-C-N 121.788 -0.57 . . . . 0.0 109.89 179.212 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 25' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER -56.6 -45.47 81.42 Favored 'General case' 0 N--CA 1.499 2.013 0 O-C-N 121.475 -0.766 . . . . 0.0 110.496 179.573 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 26' ' ' ILE . . . . . 0.543 ' HB ' HD12 ' B' ' 157' ' ' LEU . 6.6 mt -70.56 -31.75 47.41 Favored 'Isoleucine or valine' 0 N--CA 1.498 1.966 0 O-C-N 121.168 -0.957 . . . . 0.0 109.518 179.143 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 27' ' ' PHE . . . . . 0.585 ' CZ ' HG11 ' A' ' 44' ' ' VAL . 0.2 OUTLIER -74.46 -22.5 59.08 Favored 'General case' 0 N--CA 1.496 1.845 0 O-C-N 121.102 -0.999 . . . . 0.0 110.774 179.186 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild core ' A' A ' 28' ' ' VAL . . . . . 0.692 HG12 HG13 ' A' ' 36' ' ' ILE . 10.6 m -107.36 10.6 9.13 Favored 'Isoleucine or valine' 0 N--CA 1.501 2.076 0 O-C-N 121.153 -0.967 . . . . 0.0 111.902 -179.354 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 29' ' ' LEU . . . . . 0.622 ' O ' HD12 ' A' ' 29' ' ' LEU . 4.6 pp -57.13 136.85 56.4 Favored 'General case' 0 N--CA 1.504 2.242 0 O-C-N 120.77 -1.206 . . . . 0.0 109.398 179.379 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 30' ' ' GLY . . . . . . . . . . . . . . . 90.39 -49.6 3.22 Favored Glycine 0 N--CA 1.495 2.628 0 N-CA-C 108.093 -2.003 . . . . 0.0 108.093 -177.838 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 31' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.491 1.616 0 O-C-N 121.617 -0.931 . . . . 0.0 108.727 178.481 . . . . . . . . 0 0 . 1 . 020 nuclear nobuild core ' A' A ' 35' ' ' CYS . . . . . . . . . . . . . 28.3 p . . . . . 0 N--CA 1.495 1.79 0 CA-C-O 121.281 0.563 . . . . 0.0 110.203 . . . . . . . . . 0 0 . 1 . 020 nuclear nobuild core ' A' A ' 36' ' ' ILE . . . . . 0.692 HG13 HG12 ' A' ' 28' ' ' VAL . 17.9 mt -121.42 118.59 56.46 Favored 'Isoleucine or valine' 0 N--CA 1.494 1.752 0 O-C-N 121.383 -0.823 . . . . 0.0 109.987 -179.965 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 37' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -101.07 163.19 12.4 Favored 'General case' 0 N--CA 1.493 1.72 0 O-C-N 121.558 -0.714 . . . . 0.0 109.637 179.167 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 38' ' ' THR . . . . . 0.832 HG21 ' HA ' ' A' ' 58' ' ' GLN . 77.7 p -64.27 -32.76 74.47 Favored 'General case' 0 N--CA 1.5 2.045 0 O-C-N 121.31 -0.869 . . . . 0.0 110.595 -179.829 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 39' ' ' LYS . . . . . 0.473 ' HA ' ' HB3' ' A' ' 54' ' ' PRO . 11.6 mttp -60.88 -34.33 74.46 Favored 'General case' 0 N--CA 1.496 1.864 0 O-C-N 121.518 -0.739 . . . . 0.0 109.465 178.777 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 1.2 mp0 -83.42 -30.55 27.23 Favored 'General case' 0 N--CA 1.497 1.921 0 O-C-N 121.485 -0.76 . . . . 0.0 109.604 178.471 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 41' ' ' LEU . . . . . 0.485 ' HG ' HD13 ' A' ' 57' ' ' LEU . 6.4 tp -62.46 -39.83 94.67 Favored 'General case' 0 N--CA 1.497 1.877 0 O-C-N 121.412 -0.805 . . . . 0.0 110.412 179.574 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 42' ' ' GLY . . . . . 0.507 ' HA2' ' HB2' ' A' ' 45' ' ' MET . . . -53.92 -36.18 55.17 Favored Glycine 0 N--CA 1.495 2.616 0 N-CA-C 110.831 -0.908 . . . . 0.0 110.831 -179.049 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 43' ' ' LYS . . . . . . . . . . . . . 1.6 mtmt -55.21 -34.13 63.65 Favored 'General case' 0 N--CA 1.502 2.145 0 O-C-N 121.381 -1.07 . . . . 0.0 110.561 179.711 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 44' ' ' VAL . . . . . 0.585 HG11 ' CZ ' ' A' ' 27' ' ' PHE . 42.1 t -93.07 -36.72 7.74 Favored 'Isoleucine or valine' 0 N--CA 1.498 1.936 0 O-C-N 121.334 -0.854 . . . . 0.0 109.6 178.921 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 45' ' ' MET . . . . . 0.507 ' HB2' ' HA2' ' A' ' 42' ' ' GLY . 0.3 OUTLIER -58.29 -38.08 76.3 Favored 'General case' 0 N--CA 1.5 2.036 0 O-C-N 121.47 -0.769 . . . . 0.0 110.777 179.646 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild core ' A' A ' 46' ' ' ARG . . . . . 0.47 ' HA ' ' C ' ' A' ' 50' ' ' GLN . 16.6 ptt180 -63.44 -23.68 67.5 Favored 'General case' 0 N--CA 1.499 2.012 0 O-C-N 121.304 -0.872 . . . . 0.0 110.911 179.97 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 47' ' ' MET . . . . . . . . . . . . . 7.1 ttp -82.14 1.18 37.41 Favored 'General case' 0 N--CA 1.495 1.798 0 O-C-N 121.397 -0.815 . . . . 0.0 110.731 179.389 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 48' ' ' LEU . . . . . . . . . . . . . 45.1 mt -131.16 -50.7 1.02 Allowed 'General case' 0 N--CA 1.496 1.83 0 O-C-N 121.078 -1.014 . . . . 0.0 111.052 -179.82 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 49' ' ' GLY . . . . . 0.508 ' O ' ' HB2' ' A' ' 50' ' ' GLN . . . -125.52 38.04 2.37 Favored Glycine 0 N--CA 1.498 2.772 0 C-N-CA 119.866 -1.159 . . . . 0.0 110.987 -179.14 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 50' ' ' GLN . . . . . 0.508 ' HB2' ' O ' ' A' ' 49' ' ' GLY . 10.9 mt-30 67.12 -50.06 0.48 Allowed 'General case' 0 N--CA 1.512 2.636 0 CA-C-N 117.913 0.857 . . . . 0.0 112.498 179.122 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 51' ' ' ASN . . . . . 0.555 ' OD1' HD11 ' A' ' 57' ' ' LEU . 8.3 t30 64.94 101.24 0.04 OUTLIER Pre-proline 0 N--CA 1.504 2.258 0 O-C-N 121.414 -0.804 . . . . 0.0 110.542 -179.185 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 52' ' ' PRO . . . . . . . . . . . . . 44.3 Cg_endo -74.64 -52.87 0.11 Allowed 'Trans proline' 0 C--N 1.312 -1.352 0 O-C-N 123.938 1.494 . . . . 0.0 111.464 -179.642 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 53' ' ' THR . . . . . 0.703 HG23 ' HB2' ' A' ' 56' ' ' GLU . 0.0 OUTLIER -149.31 153.04 36.96 Favored Pre-proline 0 N--CA 1.5 2.048 0 O-C-N 121.131 -0.981 . . . . 0.0 111.073 -179.63 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild core ' A' A ' 54' ' ' PRO . . . . . 0.473 ' HB3' ' HA ' ' A' ' 39' ' ' LYS . 46.4 Cg_endo -71.75 -36.28 6.55 Favored 'Trans proline' 0 C--N 1.313 -1.331 0 O-C-N 124.205 1.634 . . . . 0.0 110.69 179.563 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 55' ' ' GLU . . . . . 0.458 ' O ' ' HB3' ' A' ' 58' ' ' GLN . 0.7 OUTLIER -65.11 -27.78 68.98 Favored 'General case' 0 N--CA 1.5 2.063 0 O-C-N 121.338 -0.851 . . . . 0.0 110.959 179.931 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild core ' A' A ' 56' ' ' GLU . . . . . 0.703 ' HB2' HG23 ' A' ' 53' ' ' THR . 24.0 tt0 -66.8 -30.12 70.24 Favored 'General case' 0 N--CA 1.498 1.93 0 O-C-N 121.119 -0.988 . . . . 0.0 110.275 179.28 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 57' ' ' LEU . . . . . 0.555 HD11 ' OD1' ' A' ' 51' ' ' ASN . 29.7 mt -80.31 -9.54 59.74 Favored 'General case' 0 N--CA 1.496 1.843 0 O-C-N 121.253 -0.904 . . . . 0.0 111.414 -179.889 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 58' ' ' GLN . . . . . 0.832 ' HA ' HG21 ' A' ' 38' ' ' THR . 0.0 OUTLIER -56.74 -42.11 78.69 Favored 'General case' 0 N--CA 1.5 2.052 0 O-C-N 121.032 -1.042 . . . . 0.0 110.142 -179.819 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild core ' A' A ' 59' ' ' GLU . . . . . . . . . . . . . 7.8 tt0 -59.2 -35.94 74.49 Favored 'General case' 0 N--CA 1.498 1.963 0 O-C-N 121.37 -0.831 . . . . 0.0 110.035 179.175 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 60' ' ' MET . . . . . . . . . . . . . 2.5 tpp -59.18 -46.2 89.04 Favored 'General case' 0 N--CA 1.498 1.95 0 O-C-N 121.584 -0.698 . . . . 0.0 109.989 179.304 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 61' ' ' ILE . . . . . 0.469 HG23 HG23 ' A' ' 72' ' ' VAL . 1.9 mt -72.65 -41.1 62.81 Favored 'Isoleucine or valine' 0 N--CA 1.497 1.884 0 O-C-N 121.352 -0.843 . . . . 0.0 109.716 179.276 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 62' ' ' ASP . . . . . . . . . . . . . 75.1 m-20 -53.62 -31.11 45.83 Favored 'General case' 0 N--CA 1.501 2.098 0 O-C-N 121.476 -0.765 . . . . 0.0 110.956 179.566 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 63' ' ' GLU . . . . . . . . . . . . . 0.3 OUTLIER -68.27 -25.54 65.22 Favored 'General case' 0 N--CA 1.5 2.028 0 O-C-N 121.359 -0.838 . . . . 0.0 111.254 179.958 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 64' ' ' VAL . . . . . 0.463 HG22 ' NH1' ' A' ' 83' ' ' ARG . 20.1 t -121.76 6.34 5.89 Favored 'Isoleucine or valine' 0 N--CA 1.501 2.098 0 O-C-N 121.162 -0.962 . . . . 0.0 111.436 -179.328 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 65' ' ' ASP . . . . . . . . . . . . . 5.6 t70 -98.35 73.94 2.16 Favored 'General case' 0 N--CA 1.496 1.833 0 O-C-N 120.706 -1.246 . . . . 0.0 110.459 179.87 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 66' ' ' GLU . . . . . . . . . . . . . 4.6 mp0 -88.56 55.91 3.58 Favored 'General case' 0 N--CA 1.496 1.832 0 O-C-N 121.239 -0.913 . . . . 0.0 108.978 179.23 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 67' ' ' ASP . . . . . . . . . . . . . 2.1 t70 -126.58 -59.33 1.29 Allowed 'General case' 0 N--CA 1.493 1.71 0 O-C-N 121.6 -0.688 . . . . 0.0 110.944 -178.759 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 68' ' ' GLY . . . . . . . . . . . . . . . 143.09 -40.18 1.26 Allowed Glycine 0 N--CA 1.494 2.518 0 N-CA-C 109.715 -1.354 . . . . 0.0 109.715 -179.434 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 69' ' ' SER . . . . . . . . . . . . . 59.6 p -63.89 -29.0 70.22 Favored 'General case' 0 N--CA 1.5 2.031 0 O-C-N 121.404 -1.057 . . . . 0.0 111.206 -179.9 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 70' ' ' GLY . . . . . . . . . . . . . . . 86.72 -12.91 60.14 Favored Glycine 0 N--CA 1.497 2.717 0 C-N-CA 119.875 -1.155 . . . . 0.0 110.569 -179.806 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 71' ' ' THR . . . . . . . . . . . . . 3.5 m -101.09 138.0 38.71 Favored 'General case' 0 N--CA 1.497 1.91 0 O-C-N 121.028 -1.278 . . . . 0.0 109.681 179.694 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 72' ' ' VAL . . . . . 0.469 HG23 HG23 ' A' ' 61' ' ' ILE . 8.1 t -82.36 125.63 39.88 Favored 'Isoleucine or valine' 0 N--CA 1.496 1.861 0 O-C-N 121.704 -0.622 . . . . 0.0 110.793 -179.634 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 73' ' ' ASP . . . . . . . . . . . . . 0.8 OUTLIER -99.75 -163.17 1.01 Allowed 'General case' 0 N--CA 1.494 1.757 0 O-C-N 121.41 -0.806 . . . . 0.0 109.564 179.206 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 74' ' ' PHE . . . . . 0.754 ' CE2' HD11 ' A' ' 78' ' ' LEU . 65.4 t80 -63.16 -45.78 90.23 Favored 'General case' 0 N--CA 1.5 2.039 0 O-C-N 121.161 -0.962 . . . . 0.0 110.361 179.827 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 75' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -62.22 -51.72 66.65 Favored 'General case' 0 N--CA 1.499 1.979 0 O-C-N 121.373 -0.83 . . . . 0.0 110.616 179.897 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 76' ' ' GLU . . . . . . . . . . . . . 55.5 mt-10 -64.88 -23.22 67.17 Favored 'General case' 0 N--CA 1.501 2.076 0 O-C-N 121.326 -0.859 . . . . 0.0 110.085 179.449 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 77' ' ' PHE . . . . . . . . . . . . . 88.4 t80 -79.34 -35.31 41.22 Favored 'General case' 0 N--CA 1.496 1.868 0 O-C-N 121.3 -0.875 . . . . 0.0 109.677 178.872 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 78' ' ' LEU . . . . . 0.754 HD11 ' CE2' ' A' ' 74' ' ' PHE . 65.5 mt -62.41 -50.42 71.58 Favored 'General case' 0 N--CA 1.498 1.944 0 O-C-N 121.412 -0.805 . . . . 0.0 109.984 179.454 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 79' ' ' VAL . . . . . . . . . . . . . 7.4 p -62.74 -31.91 53.86 Favored 'Isoleucine or valine' 0 N--CA 1.5 2.065 0 O-C-N 121.369 -0.832 . . . . 0.0 109.797 179.066 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 80' ' ' MET . . . . . . . . . . . . . 5.2 ttp -65.71 -38.94 90.58 Favored 'General case' 0 N--CA 1.496 1.839 0 O-C-N 121.255 -0.903 . . . . 0.0 109.47 178.633 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 81' ' ' MET . . . . . . . . . . . . . 7.6 mmt -62.08 -41.62 98.36 Favored 'General case' 0 N--CA 1.497 1.881 0 O-C-N 121.501 -0.749 . . . . 0.0 110.036 179.261 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 82' ' ' VAL . . . . . . . . . . . . . 30.6 t -61.41 -35.85 69.21 Favored 'Isoleucine or valine' 0 N--CA 1.5 2.04 0 O-C-N 121.245 -0.909 . . . . 0.0 109.21 178.79 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 83' ' ' ARG . . . . . 0.463 ' NH1' HG22 ' A' ' 64' ' ' VAL . 8.5 mtt180 -68.18 -26.1 65.57 Favored 'General case' 0 N--CA 1.498 1.938 0 O-C-N 121.422 -0.799 . . . . 0.0 109.761 178.496 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 84' ' ' CYS . . . . . 0.515 ' HB3' ' HA ' ' B' ' 149' ' ' SER . 73.2 m -85.25 11.6 9.69 Favored 'General case' 0 N--CA 1.499 2.009 0 O-C-N 121.364 -0.835 . . . . 0.0 111.097 179.468 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 85' ' ' MET . . . . . . . . . . . . . 2.6 tpp . . . . . 0 N--CA 1.499 2.008 0 O-C-N 121.043 -1.036 . . . . 0.0 111.071 179.782 . . . . . . . . 0 0 . 1 . 020 nuclear nobuild core ' B' B ' 149' ' ' SER . . . . . 0.515 ' HA ' ' HB3' ' A' ' 84' ' ' CYS . 74.0 p . . . . . 0 N--CA 1.495 1.789 0 CA-C-O 121.429 0.633 . . . . 0.0 111.068 . . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' B' B ' 150' ' ' ALA . . . . . . . . . . . . . . . -65.49 -49.4 69.18 Favored 'General case' 0 N--CA 1.494 1.772 0 O-C-N 121.704 -0.623 . . . . 0.0 110.766 -179.831 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' B' B ' 151' ' ' ASP . . . . . . . . . . . . . 5.7 p-10 -54.95 -38.84 68.24 Favored 'General case' 0 N--CA 1.502 2.17 0 O-C-N 121.539 -0.726 . . . . 0.0 110.885 179.932 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' B' B ' 152' ' ' ALA . . . . . . . . . . . . . . . -74.64 -44.21 51.56 Favored 'General case' 0 N--CA 1.496 1.851 0 O-C-N 121.296 -0.878 . . . . 0.0 110.43 179.678 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' B' B ' 153' ' ' MET . . . . . . . . . . . . . 2.1 mmt -67.67 -31.73 71.91 Favored 'General case' 0 N--CA 1.498 1.962 0 O-C-N 121.267 -0.896 . . . . 0.0 110.65 179.841 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' B' B ' 154' ' ' MET . . . . . . . . . . . . . 4.4 ttm -57.61 -44.0 85.13 Favored 'General case' 0 N--CA 1.5 2.049 0 O-C-N 121.361 -0.837 . . . . 0.0 110.501 179.876 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' B' B ' 155' ' ' GLN . . . . . . . . . . . . . 1.3 tm0? -66.11 -37.19 85.12 Favored 'General case' 0 N--CA 1.5 2.06 0 O-C-N 121.384 -0.822 . . . . 0.0 110.354 179.631 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' B' B ' 156' ' ' ALA . . . . . . . . . . . . . . . -76.74 -34.29 58.09 Favored 'General case' 0 N--CA 1.499 2.022 0 O-C-N 121.478 -0.764 . . . . 0.0 111.178 -179.753 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' B' B ' 157' ' ' LEU . . . . . 0.543 HD12 ' HB ' ' A' ' 26' ' ' ILE . 3.1 mm? -85.22 -49.68 8.0 Favored 'General case' 0 N--CA 1.5 2.044 0 O-C-N 121.186 -0.946 . . . . 0.0 110.522 -179.565 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' B' B ' 158' ' ' LEU . . . . . . . . . . . . . 3.7 mp . . . . . 0 N--CA 1.496 1.865 0 O-C-N 121.275 -0.89 . . . . 0.0 110.01 179.967 . . . . . . . . 0 0 . 1 . 001 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 0.2 OUTLIER . . . . . 0 N--CA 1.498 1.932 0 CA-C-O 121.058 0.456 . . . . 0.0 110.55 . . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 2' ' ' ASP . . . . . . . . . . . . . 0.8 OUTLIER -123.52 -172.59 2.55 Favored 'General case' 0 N--CA 1.494 1.773 0 O-C-N 121.573 -0.705 . . . . 0.0 110.31 179.81 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 3' ' ' ASP . . . . . . . . . . . . . 3.5 t70 53.65 46.01 26.86 Favored 'General case' 0 N--CA 1.501 2.101 0 O-C-N 121.513 -0.742 . . . . 0.0 110.52 -179.873 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 4' ' ' ILE . . . . . . . . . . . . . 2.8 mp -86.88 -43.48 15.98 Favored 'Isoleucine or valine' 0 N--CA 1.496 1.87 0 O-C-N 121.033 -1.042 . . . . 0.0 110.05 179.943 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 5' ' ' TYR . . . . . . . . . . . . . 9.6 m-85 -71.04 -37.85 72.56 Favored 'General case' 0 N--CA 1.496 1.863 0 O-C-N 121.226 -0.921 . . . . 0.0 110.585 179.849 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -70.49 -32.09 69.46 Favored 'General case' 0 N--CA 1.498 1.963 0 O-C-N 121.16 -0.962 . . . . 0.0 110.04 179.336 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 7' ' ' ALA . . . . . . . . . . . . . . . -55.6 -41.38 73.34 Favored 'General case' 0 N--CA 1.497 1.92 0 O-C-N 121.384 -0.823 . . . . 0.0 109.254 178.54 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 8' ' ' ALA . . . . . . . . . . . . . . . -69.94 -37.04 75.75 Favored 'General case' 0 N--CA 1.495 1.78 0 O-C-N 121.705 -0.622 . . . . 0.0 109.423 178.487 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 9' ' ' VAL . . . . . 0.679 HG11 ' CG2' ' A' ' 79' ' ' VAL . 53.3 t -60.58 -45.11 97.74 Favored 'Isoleucine or valine' 0 N--CA 1.5 2.048 0 O-C-N 121.637 -0.664 . . . . 0.0 109.806 179.148 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 10' ' ' GLU . . . . . . . . . . . . . 25.3 mt-10 -66.06 -46.25 78.47 Favored 'General case' 0 N--CA 1.498 1.932 0 O-C-N 121.567 -0.708 . . . . 0.0 110.068 179.602 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 11' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -80.71 -84.76 0.1 Allowed 'General case' 0 N--CA 1.488 1.455 0 O-C-N 121.531 -0.731 . . . . 0.0 109.661 179.655 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 12' ' ' LEU . . . . . 0.623 HD12 ' HA ' ' A' ' 9' ' ' VAL . 0.8 OUTLIER 53.23 -159.59 0.14 Allowed 'General case' 0 N--CA 1.501 2.08 0 O-C-N 121.428 -0.795 . . . . 0.0 111.047 179.472 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 13' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -142.96 154.69 44.3 Favored 'General case' 0 N--CA 1.495 1.824 0 O-C-N 121.301 -0.874 . . . . 0.0 109.913 179.813 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 14' ' ' GLU . . . . . . . . . . . . . 0.7 OUTLIER -54.15 -39.82 66.88 Favored 'General case' 0 N--CA 1.491 1.6 0 O-C-N 121.696 -0.627 . . . . 0.0 111.015 -179.58 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 1.4 mp0 -55.56 -45.4 77.28 Favored 'General case' 0 N--CA 1.498 1.943 0 O-C-N 121.475 -0.766 . . . . 0.0 110.629 179.742 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 16' ' ' GLN . . . . . . . . . . . . . 69.0 mt-30 -86.01 -33.19 21.12 Favored 'General case' 0 N--CA 1.499 1.991 0 O-C-N 121.344 -0.848 . . . . 0.0 110.983 179.929 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 17' ' ' LYS . . . . . . . . . . . . . 0.4 OUTLIER -65.03 -52.88 53.46 Favored 'General case' 0 N--CA 1.5 2.063 0 O-C-N 121.596 -0.69 . . . . 0.0 110.035 -179.963 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 18' ' ' ASN . . . . . . . . . . . . . 1.3 t-20 -62.37 -32.22 72.99 Favored 'General case' 0 N--CA 1.497 1.902 0 O-C-N 121.545 -0.722 . . . . 0.0 109.462 178.9 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 0.7 OUTLIER -61.37 -45.07 95.91 Favored 'General case' 0 N--CA 1.495 1.817 0 O-C-N 121.558 -0.714 . . . . 0.0 109.687 178.966 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 20' ' ' PHE . . . . . . . . . . . . . 13.4 m-85 -62.77 -35.92 81.37 Favored 'General case' 0 N--CA 1.498 1.974 0 O-C-N 121.409 -0.807 . . . . 0.0 109.438 178.873 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 21' ' ' LYS . . . . . . . . . . . . . 9.5 tptp -64.76 -46.22 83.08 Favored 'General case' 0 N--CA 1.498 1.938 0 O-C-N 121.516 -0.74 . . . . 0.0 109.389 178.602 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 22' ' ' ALA . . . . . . . . . . . . . . . -66.8 -31.15 71.59 Favored 'General case' 0 N--CA 1.498 1.949 0 O-C-N 121.599 -0.688 . . . . 0.0 110.202 179.085 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 23' ' ' ALA . . . . . . . . . . . . . . . -87.17 -7.97 57.41 Favored 'General case' 0 N--CA 1.497 1.899 0 O-C-N 121.231 -0.918 . . . . 0.0 110.806 179.448 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 24' ' ' PHE . . . . . 0.414 ' O ' HG12 ' A' ' 28' ' ' VAL . 93.1 t80 -87.6 -49.89 6.87 Favored 'General case' 0 N--CA 1.498 1.937 0 O-C-N 121.236 -0.915 . . . . 0.0 111.631 -179.265 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 25' ' ' ASP . . . . . . . . . . . . . 5.4 p-10 -58.05 -38.45 76.3 Favored 'General case' 0 N--CA 1.503 2.22 0 O-C-N 121.086 -1.009 . . . . 0.0 111.535 -178.817 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 26' ' ' ILE . . . . . 0.438 ' CG2' HD11 ' B' ' 157' ' ' LEU . 34.2 mt -65.84 -35.54 75.38 Favored 'Isoleucine or valine' 0 N--CA 1.5 2.055 0 O-C-N 120.854 -1.154 . . . . 0.0 109.386 178.918 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 27' ' ' PHE . . . . . 0.705 ' CE1' HG21 ' A' ' 44' ' ' VAL . 0.2 OUTLIER -66.13 -48.48 70.7 Favored 'General case' 0 N--CA 1.497 1.912 0 O-C-N 121.346 -0.846 . . . . 0.0 109.292 178.843 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 28' ' ' VAL . . . . . 1.033 HG23 ' HB3' ' A' ' 31' ' ' ALA . 2.2 p -112.18 95.75 4.1 Favored 'Isoleucine or valine' 0 N--CA 1.497 1.882 0 O-C-N 121.678 -0.638 . . . . 0.0 109.658 178.986 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 29' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -96.18 -39.56 9.63 Favored 'General case' 0 N--CA 1.5 2.06 0 O-C-N 121.371 -0.83 . . . . 0.0 109.879 -179.898 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 30' ' ' GLY . . . . . . . . . . . . . . . -135.32 55.86 0.72 Allowed Glycine 0 N--CA 1.494 2.559 0 N-CA-C 109.121 -1.591 . . . . 0.0 109.121 179.615 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 31' ' ' ALA . . . . . 1.033 ' HB3' HG23 ' A' ' 28' ' ' VAL . . . -119.83 105.25 10.93 Favored 'General case' 0 N--CA 1.492 1.642 0 O-C-N 121.479 -1.012 . . . . 0.0 110.43 -179.712 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 32' ' ' GLU . . . . . . . . . . . . . 1.1 mp0 51.62 -114.95 0.85 Allowed 'General case' 0 N--CA 1.499 1.991 0 O-C-N 121.866 -0.521 . . . . 0.0 111.054 179.679 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -112.4 37.25 3.09 Favored 'General case' 0 N--CA 1.497 1.901 0 O-C-N 120.862 -1.149 . . . . 0.0 110.882 -179.503 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 34' ' ' GLY . . . . . . . . . . . . . . . 92.14 42.35 4.67 Favored Glycine 0 N--CA 1.496 2.685 0 N-CA-C 110.17 -1.172 . . . . 0.0 110.17 179.58 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 35' ' ' CYS . . . . . 0.707 ' N ' HG21 ' A' ' 28' ' ' VAL . 84.0 m -127.02 123.92 38.16 Favored 'General case' 0 N--CA 1.492 1.644 0 O-C-N 121.341 -1.094 . . . . 0.0 109.612 179.4 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 36' ' ' ILE . . . . . 0.557 HG12 ' HB3' ' A' ' 27' ' ' PHE . 87.2 mt -59.2 113.89 0.8 Allowed 'Isoleucine or valine' 0 N--CA 1.498 1.974 0 O-C-N 121.369 -0.832 . . . . 0.0 110.133 -179.724 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 37' ' ' SER . . . . . . . . . . . . . 0.2 OUTLIER -107.47 -172.96 2.17 Favored 'General case' 0 N--CA 1.496 1.854 0 O-C-N 121.581 -0.699 . . . . 0.0 110.373 -179.684 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 38' ' ' THR . . . . . . . . . . . . . 17.6 p -59.23 -42.63 91.49 Favored 'General case' 0 N--CA 1.504 2.228 0 O-C-N 121.338 -0.851 . . . . 0.0 110.831 -179.861 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 39' ' ' LYS . . . . . . . . . . . . . 4.1 ttmt -64.54 -41.44 96.34 Favored 'General case' 0 N--CA 1.5 2.056 0 O-C-N 121.454 -0.779 . . . . 0.0 111.298 -179.602 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 40' ' ' GLU . . . . . 0.547 ' CG ' ' HB2' ' A' ' 31' ' ' ALA . 8.8 mm-40 -67.31 -46.0 74.82 Favored 'General case' 0 N--CA 1.499 2.025 0 O-C-N 121.257 -0.902 . . . . 0.0 109.925 -179.85 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 41' ' ' LEU . . . . . 0.569 ' O ' HD12 ' A' ' 41' ' ' LEU . 3.9 tp -63.58 -40.33 96.69 Favored 'General case' 0 N--CA 1.496 1.838 0 O-C-N 121.344 -0.848 . . . . 0.0 109.561 179.0 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 42' ' ' GLY . . . . . . . . . . . . . . . -60.5 -31.57 74.97 Favored Glycine 0 N--CA 1.494 2.524 0 N-CA-C 110.144 -1.182 . . . . 0.0 110.144 179.576 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 43' ' ' LYS . . . . . . . . . . . . . 0.5 OUTLIER -58.59 -47.97 82.51 Favored 'General case' 0 N--CA 1.5 2.038 0 O-C-N 121.272 -1.134 . . . . 0.0 109.563 179.219 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 44' ' ' VAL . . . . . 0.705 HG21 ' CE1' ' A' ' 27' ' ' PHE . 86.9 t -71.5 -29.78 36.42 Favored 'Isoleucine or valine' 0 N--CA 1.498 1.961 0 O-C-N 121.511 -0.743 . . . . 0.0 109.847 178.889 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 45' ' ' MET . . . . . . . . . . . . . 5.6 mmt -58.9 -39.04 80.31 Favored 'General case' 0 N--CA 1.501 2.079 0 O-C-N 121.344 -0.848 . . . . 0.0 109.861 179.147 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 46' ' ' ARG . . . . . . . . . . . . . 1.6 ttp180 -64.32 -32.41 74.01 Favored 'General case' 0 N--CA 1.496 1.875 0 O-C-N 121.624 -0.673 . . . . 0.0 110.434 179.408 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 47' ' ' MET . . . . . . . . . . . . . 12.0 mmm -61.24 -37.83 84.47 Favored 'General case' 0 N--CA 1.502 2.165 0 O-C-N 121.392 -0.818 . . . . 0.0 110.102 179.524 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 48' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -68.17 -37.98 81.56 Favored 'General case' 0 N--CA 1.497 1.904 0 O-C-N 121.413 -0.805 . . . . 0.0 110.186 179.537 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 49' ' ' GLY . . . . . . . . . . . . . . . 130.77 11.1 2.42 Favored Glycine 0 N--CA 1.497 2.716 0 C-N-CA 120.506 -0.854 . . . . 0.0 111.18 179.537 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 50' ' ' GLN . . . . . . . . . . . . . 0.1 OUTLIER -127.78 138.01 52.6 Favored 'General case' 0 N--CA 1.495 1.789 0 O-C-N 120.887 -1.361 . . . . 0.0 110.524 179.934 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 51' ' ' ASN . . . . . . . . . . . . . 1.4 m120 -122.18 80.32 44.07 Favored Pre-proline 0 N--CA 1.495 1.787 0 O-C-N 121.551 -0.718 . . . . 0.0 109.721 179.713 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 52' ' ' PRO . . . . . . . . . . . . . 49.8 Cg_endo -78.03 168.18 22.39 Favored 'Trans proline' 0 C--N 1.316 -1.136 0 O-C-N 123.885 1.466 . . . . 0.0 111.078 -179.292 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 53' ' ' THR . . . . . 0.561 ' HB ' ' HD2' ' A' ' 54' ' ' PRO . 41.3 p -76.56 168.81 24.8 Favored Pre-proline 0 N--CA 1.498 1.951 0 O-C-N 121.473 -0.767 . . . . 0.0 109.694 179.411 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 54' ' ' PRO . . . . . 0.561 ' HD2' ' HB ' ' A' ' 53' ' ' THR . 40.8 Cg_endo -64.83 -25.62 60.33 Favored 'Trans proline' 0 N--CA 1.491 1.338 0 O-C-N 123.45 1.237 . . . . 0.0 110.888 -179.984 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 55' ' ' GLU . . . . . . . . . . . . . 0.6 OUTLIER -64.79 -39.49 93.68 Favored 'General case' 0 N--CA 1.498 1.962 0 O-C-N 121.437 -0.789 . . . . 0.0 109.974 179.091 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 56' ' ' GLU . . . . . 0.45 ' O ' ' HE3' ' A' ' 60' ' ' MET . 0.6 OUTLIER -54.22 -46.48 72.51 Favored 'General case' 0 N--CA 1.499 1.988 0 O-C-N 121.634 -0.666 . . . . 0.0 109.985 179.526 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 57' ' ' LEU . . . . . 0.62 ' H ' HD22 ' A' ' 57' ' ' LEU . 0.7 OUTLIER -77.83 -28.01 50.1 Favored 'General case' 0 N--CA 1.492 1.673 0 O-C-N 121.334 -0.854 . . . . 0.0 110.245 179.545 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 58' ' ' GLN . . . . . 0.594 ' HG3' ' N ' ' A' ' 59' ' ' GLU . 0.0 OUTLIER -59.76 -34.2 72.68 Favored 'General case' 0 N--CA 1.497 1.884 0 O-C-N 121.08 -1.012 . . . . 0.0 109.077 179.054 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 59' ' ' GLU . . . . . 0.594 ' N ' ' HG3' ' A' ' 58' ' ' GLN . 0.5 OUTLIER -69.63 -37.05 76.65 Favored 'General case' 0 N--CA 1.494 1.763 0 N-CA-C 108.505 -0.924 . . . . 0.0 108.505 177.781 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 60' ' ' MET . . . . . 0.45 ' HE3' ' O ' ' A' ' 56' ' ' GLU . 4.1 mtm -63.1 -44.62 95.16 Favored 'General case' 0 N--CA 1.496 1.867 0 O-C-N 121.809 -0.557 . . . . 0.0 109.835 178.602 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 61' ' ' ILE . . . . . 0.59 HG13 HG23 ' A' ' 72' ' ' VAL . 0.2 OUTLIER -66.93 -33.6 64.45 Favored 'Isoleucine or valine' 0 N--CA 1.498 1.968 0 O-C-N 121.624 -0.673 . . . . 0.0 110.472 179.826 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 62' ' ' ASP . . . . . . . . . . . . . 0.9 OUTLIER -70.2 -35.86 74.22 Favored 'General case' 0 N--CA 1.498 1.947 0 O-C-N 121.27 -0.894 . . . . 0.0 110.276 179.607 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 63' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER -65.78 -35.73 81.54 Favored 'General case' 0 N--CA 1.497 1.912 0 O-C-N 121.355 -0.841 . . . . 0.0 111.174 -179.882 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 64' ' ' VAL . . . . . 0.652 HG11 ' SD ' ' A' ' 80' ' ' MET . 33.4 m -102.54 -15.58 7.8 Favored 'Isoleucine or valine' 0 N--CA 1.502 2.126 0 O-C-N 121.212 -0.93 . . . . 0.0 111.964 -179.359 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 65' ' ' ASP . . . . . . . . . . . . . 21.6 t0 -131.74 140.74 49.34 Favored 'General case' 0 N--CA 1.498 1.956 0 O-C-N 120.843 -1.16 . . . . 0.0 111.6 -179.774 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 66' ' ' GLU . . . . . . . . . . . . . 3.3 tp10 -155.46 40.01 0.4 Allowed 'General case' 0 N--CA 1.492 1.631 0 CA-C-O 121.477 0.656 . . . . 0.0 109.43 179.017 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 67' ' ' ASP . . . . . . . . . . . . . 12.1 p-10 -99.15 4.49 46.85 Favored 'General case' 0 N--CA 1.498 1.962 0 O-C-N 121.437 -0.789 . . . . 0.0 111.536 -179.532 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 68' ' ' GLY . . . . . . . . . . . . . . . 105.8 -32.39 7.45 Favored Glycine 0 N--CA 1.493 2.452 0 N-CA-C 109.543 -1.423 . . . . 0.0 109.543 -179.724 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 69' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER -69.07 -42.8 75.73 Favored 'General case' 0 N--CA 1.495 1.823 0 O-C-N 121.396 -1.061 . . . . 0.0 110.428 179.826 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 70' ' ' GLY . . . . . . . . . . . . . . . 72.78 29.76 64.82 Favored Glycine 0 N--CA 1.496 2.688 0 N-CA-C 109.248 -1.541 . . . . 0.0 109.248 -179.781 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 71' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -136.39 143.07 43.8 Favored 'General case' 0 N--CA 1.492 1.638 0 O-C-N 121.622 -0.928 . . . . 0.0 108.968 179.938 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 72' ' ' VAL . . . . . 0.59 HG23 HG13 ' A' ' 61' ' ' ILE . 3.9 t -75.5 110.63 10.71 Favored 'Isoleucine or valine' 0 N--CA 1.497 1.891 0 O-C-N 121.635 -0.665 . . . . 0.0 110.235 -179.585 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 73' ' ' ASP . . . . . . . . . . . . . 46.0 m-20 -83.03 -174.57 5.37 Favored 'General case' 0 N--CA 1.496 1.848 0 O-C-N 121.596 -0.69 . . . . 0.0 109.431 179.72 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 74' ' ' PHE . . . . . . . . . . . . . 52.2 t80 -60.62 -47.69 85.09 Favored 'General case' 0 N--CA 1.5 2.027 0 O-C-N 121.093 -1.004 . . . . 0.0 109.792 179.701 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 75' ' ' ASP . . . . . 0.572 ' HA ' HD23 ' A' ' 78' ' ' LEU . 23.6 t70 -62.14 -52.33 64.29 Favored 'General case' 0 N--CA 1.494 1.729 0 O-C-N 121.66 -0.65 . . . . 0.0 110.148 179.534 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 76' ' ' GLU . . . . . . . . . . . . . 18.4 mt-10 -57.65 -38.38 74.98 Favored 'General case' 0 N--CA 1.5 2.028 0 O-C-N 121.534 -0.729 . . . . 0.0 110.508 179.631 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 77' ' ' PHE . . . . . . . . . . . . . 58.0 t80 -63.48 -48.15 78.85 Favored 'General case' 0 N--CA 1.496 1.848 0 O-C-N 121.367 -0.833 . . . . 0.0 109.619 179.019 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 78' ' ' LEU . . . . . 0.572 HD23 ' HA ' ' A' ' 75' ' ' ASP . 0.1 OUTLIER -71.13 -30.93 67.11 Favored 'General case' 0 N--CA 1.496 1.867 0 O-C-N 121.45 -0.781 . . . . 0.0 109.734 179.117 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 79' ' ' VAL . . . . . 0.679 ' CG2' HG11 ' A' ' 9' ' ' VAL . 4.8 t -68.4 -39.71 81.23 Favored 'Isoleucine or valine' 0 N--CA 1.501 2.093 0 O-C-N 121.216 -0.927 . . . . 0.0 109.102 178.276 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 80' ' ' MET . . . . . 0.652 ' SD ' HG11 ' A' ' 64' ' ' VAL . 26.0 ttp -68.5 -27.46 66.15 Favored 'General case' 0 N--CA 1.495 1.822 0 O-C-N 121.562 -0.711 . . . . 0.0 109.936 179.057 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 81' ' ' MET . . . . . 0.414 ' O ' ' HB2' ' A' ' 85' ' ' MET . 8.1 mmt -67.01 -55.17 15.58 Favored 'General case' 0 N--CA 1.496 1.845 0 O-C-N 121.467 -0.77 . . . . 0.0 110.793 179.948 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 82' ' ' VAL . . . . . 0.408 HG22 ' O ' ' A' ' 79' ' ' VAL . 20.2 m -59.46 -30.66 44.9 Favored 'Isoleucine or valine' 0 N--CA 1.503 2.177 0 O-C-N 121.424 -0.798 . . . . 0.0 110.681 -179.829 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 83' ' ' ARG . . . . . . . . . . . . . 5.3 mtp-105 -52.6 -47.27 67.05 Favored 'General case' 0 N--CA 1.5 2.047 0 O-C-N 121.468 -0.77 . . . . 0.0 110.297 179.424 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 84' ' ' CYS . . . . . . . . . . . . . 36.1 m -94.3 -4.35 48.88 Favored 'General case' 0 N--CA 1.499 2.0 0 O-C-N 121.426 -0.796 . . . . 0.0 110.465 178.968 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 85' ' ' MET . . . . . 0.496 ' O ' ' HB2' ' A' ' 86' ' ' LYS . 3.3 ttm -82.47 -11.83 58.23 Favored 'General case' 0 N--CA 1.497 1.923 0 O-C-N 121.219 -0.925 . . . . 0.0 111.118 179.503 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 86' ' ' LYS . . . . . 0.496 ' HB2' ' O ' ' A' ' 85' ' ' MET . 0.0 OUTLIER 63.57 -176.34 0.16 Allowed 'General case' 0 N--CA 1.505 2.301 0 O-C-N 121.435 -0.791 . . . . 0.0 110.553 -179.686 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 87' ' ' ASP . . . . . . . . . . . . . 7.7 p-10 -109.7 -175.37 2.73 Favored 'General case' 0 N--CA 1.499 1.992 0 O-C-N 121.082 -1.011 . . . . 0.0 111.212 -179.393 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 88' ' ' ASP . . . . . . . . . . . . . 6.6 p-10 -95.98 -25.17 16.04 Favored 'General case' 0 N--CA 1.499 2.011 0 O-C-N 121.503 -0.748 . . . . 0.0 111.665 -179.113 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 89' ' ' SER . . . . . . . . . . . . . 8.0 m . . . . . 0 N--CA 1.503 2.178 0 CA-C-O 117.75 -1.119 . . . . 0.0 111.244 -179.582 . . . . . . . . 0 0 . 1 . 001 nuclear nobuild full ' B' B ' 144' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.497 1.877 0 CA-C-O 121.043 0.449 . . . . 0.0 110.112 . . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 145' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -114.58 57.31 0.71 Allowed 'General case' 0 N--CA 1.494 1.769 0 O-C-N 121.39 -0.819 . . . . 0.0 110.346 -179.616 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' B' B ' 146' ' ' VAL . . . . . . . . . . . . . 72.0 t -121.76 103.29 13.32 Favored 'Isoleucine or valine' 0 N--CA 1.499 1.991 0 O-C-N 121.217 -0.927 . . . . 0.0 110.127 -179.941 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 147' ' ' ARG . . . . . . . . . . . . . 16.7 tpp180 -164.84 135.91 4.12 Favored 'General case' 0 N--CA 1.497 1.893 0 O-C-N 121.505 -0.747 . . . . 0.0 109.944 -179.879 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 148' ' ' ILE . . . . . 0.414 HD13 ' HAH' ' A' ' 91' ' ' SXK . 2.7 mp -132.06 142.29 43.24 Favored 'Isoleucine or valine' 0 N--CA 1.496 1.863 0 O-C-N 121.469 -0.77 . . . . 0.0 110.63 -179.352 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' B' B ' 149' ' ' SER . . . . . . . . . . . . . 2.2 t -112.75 158.06 20.56 Favored 'General case' 0 N--CA 1.497 1.895 0 O-C-N 121.563 -0.71 . . . . 0.0 109.563 179.348 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 150' ' ' ALA . . . . . . . . . . . . . . . -57.79 -55.47 34.47 Favored 'General case' 0 N--CA 1.499 2.008 0 O-C-N 121.261 -0.899 . . . . 0.0 110.542 -179.828 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 151' ' ' ASP . . . . . . . . . . . . . 18.5 t70 -65.27 -41.54 94.12 Favored 'General case' 0 N--CA 1.497 1.894 0 O-C-N 121.328 -0.858 . . . . 0.0 110.58 179.752 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 152' ' ' ALA . . . . . . . . . . . . . . . -59.84 -52.37 65.74 Favored 'General case' 0 N--CA 1.499 2.013 0 O-C-N 121.414 -0.804 . . . . 0.0 110.649 179.981 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 153' ' ' MET . . . . . . . . . . . . . 1.3 tpt -63.22 -40.56 97.8 Favored 'General case' 0 N--CA 1.497 1.892 0 O-C-N 121.291 -0.881 . . . . 0.0 110.183 179.779 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 154' ' ' MET . . . . . . . . . . . . . 1.7 mtp -63.34 -43.85 96.53 Favored 'General case' 0 N--CA 1.501 2.118 0 O-C-N 121.346 -0.846 . . . . 0.0 110.121 179.345 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 155' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -60.25 -40.17 89.35 Favored 'General case' 0 N--CA 1.498 1.965 0 O-C-N 121.635 -0.666 . . . . 0.0 110.049 179.493 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' B' B ' 156' ' ' ALA . . . . . . . . . . . . . . . -78.29 -25.11 46.5 Favored 'General case' 0 N--CA 1.495 1.816 0 O-C-N 121.434 -0.791 . . . . 0.0 110.33 179.213 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 157' ' ' LEU . . . . . 0.438 HD11 ' CG2' ' A' ' 26' ' ' ILE . 0.5 OUTLIER -69.65 -50.36 44.84 Favored 'General case' 0 N--CA 1.497 1.921 0 O-C-N 121.349 -0.844 . . . . 0.0 110.503 179.951 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' B' B ' 158' ' ' LEU . . . . . . . . . . . . . 1.6 mt -116.63 46.83 1.55 Allowed 'General case' 0 N--CA 1.496 1.874 0 O-C-N 121.224 -0.922 . . . . 0.0 110.245 179.713 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 159' ' ' GLY . . . . . . . . . . . . . . . -156.18 -57.2 0.01 OUTLIER Glycine 0 N--CA 1.496 2.644 0 N-CA-C 109.901 -1.28 . . . . 0.0 109.901 -179.957 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 160' ' ' ALA . . . . . . . . . . . . . . . -67.01 97.54 0.5 Allowed 'General case' 0 N--CA 1.496 1.845 0 O-C-N 121.467 -1.019 . . . . 0.0 110.399 -179.972 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 161' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER 51.02 45.93 27.11 Favored 'General case' 0 N--CA 1.501 2.09 0 O-C-N 121.561 -0.712 . . . . 0.0 110.852 179.966 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' B' B ' 162' ' ' ALA . . . . . . . . . . . . . . . -136.2 -49.69 0.68 Allowed 'General case' 0 N--CA 1.495 1.823 0 O-C-N 121.235 -0.915 . . . . 0.0 110.374 -179.926 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 163' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER . . . . . 0 N--CA 1.496 1.848 0 CA-C-O 118.204 -0.903 . . . . 0.0 110.391 179.704 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 90' ' ' ' CA' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 nuclear nobuild full ' A' A ' 91' ' ' SXK . . . . . 0.521 ' HAI' ' HG2' ' A' ' 80' ' ' MET . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 1.4 mpp? . . . . . 0 N--CA 1.494 1.771 0 CA-C-O 120.907 0.385 . . . . 0.0 110.107 . . . . . . . . . 0 0 . 1 . 002 nuclear nobuild full ' A' A ' 2' ' ' ASP . . . . . . . . . . . . . 30.5 t70 -108.24 -77.84 0.59 Allowed 'General case' 0 N--CA 1.496 1.856 0 O-C-N 121.371 -0.83 . . . . 0.0 110.433 -179.754 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 3' ' ' ASP . . . . . 0.602 ' HB3' ' HB2' ' A' ' 6' ' ' LYS . 5.1 t70 -132.12 142.07 49.37 Favored 'General case' 0 N--CA 1.493 1.72 0 O-C-N 121.211 -0.93 . . . . 0.0 110.119 -179.98 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 4' ' ' ILE . . . . . 0.426 HG13 ' N ' ' A' ' 5' ' ' TYR . 35.3 pt -67.34 -38.01 80.06 Favored 'Isoleucine or valine' 0 N--CA 1.501 2.094 0 O-C-N 121.544 -0.722 . . . . 0.0 110.615 -179.659 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 5' ' ' TYR . . . . . 0.426 ' N ' HG13 ' A' ' 4' ' ' ILE . 56.8 m-85 -71.1 -21.78 62.18 Favored 'General case' 0 N--CA 1.496 1.834 0 O-C-N 121.297 -0.877 . . . . 0.0 109.749 179.022 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 6' ' ' LYS . . . . . 0.602 ' HB2' ' HB3' ' A' ' 3' ' ' ASP . 0.1 OUTLIER -69.32 -49.64 53.88 Favored 'General case' 0 N--CA 1.494 1.762 0 O-C-N 121.492 -0.755 . . . . 0.0 109.722 178.916 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 7' ' ' ALA . . . . . . . . . . . . . . . -50.56 -38.84 47.4 Favored 'General case' 0 N--CA 1.499 2.017 0 O-C-N 121.572 -0.705 . . . . 0.0 110.345 179.422 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 8' ' ' ALA . . . . . . . . . . . . . . . -59.07 -42.31 90.05 Favored 'General case' 0 N--CA 1.497 1.889 0 O-C-N 121.561 -0.712 . . . . 0.0 109.758 178.978 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 9' ' ' VAL . . . . . 0.616 HG21 ' CG2' ' A' ' 79' ' ' VAL . 55.3 t -66.91 -42.67 89.22 Favored 'Isoleucine or valine' 0 N--CA 1.498 1.967 0 O-C-N 121.602 -0.686 . . . . 0.0 109.552 178.969 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 10' ' ' GLU . . . . . . . . . . . . . 0.9 OUTLIER -57.93 -39.83 78.96 Favored 'General case' 0 N--CA 1.499 1.989 0 O-C-N 121.484 -0.76 . . . . 0.0 110.041 178.949 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 11' ' ' GLN . . . . . . . . . . . . . 5.4 mt-30 -109.1 48.22 0.88 Allowed 'General case' 0 N--CA 1.495 1.786 0 O-C-N 121.486 -0.759 . . . . 0.0 109.926 179.501 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 12' ' ' LEU . . . . . 0.479 HD22 ' HB3' ' A' ' 16' ' ' GLN . 2.8 mt -82.8 158.73 22.66 Favored 'General case' 0 N--CA 1.5 2.027 0 O-C-N 121.309 -0.869 . . . . 0.0 110.636 -179.874 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 13' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -80.15 153.36 28.7 Favored 'General case' 0 N--CA 1.498 1.945 0 O-C-N 121.49 -0.756 . . . . 0.0 110.488 179.876 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 14' ' ' GLU . . . . . . . . . . . . . 12.4 tp10 -58.17 -47.18 84.2 Favored 'General case' 0 N--CA 1.492 1.673 0 C-N-CA 120.106 -0.637 . . . . 0.0 109.966 179.81 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 5.0 tt0 -57.68 -45.51 85.51 Favored 'General case' 0 N--CA 1.499 2.0 0 O-C-N 121.443 -0.786 . . . . 0.0 109.906 179.157 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 16' ' ' GLN . . . . . 0.479 ' HB3' HD22 ' A' ' 12' ' ' LEU . 3.0 mp0 -63.29 -48.41 78.25 Favored 'General case' 0 N--CA 1.496 1.875 0 CA-C-O 121.648 0.737 . . . . 0.0 110.158 179.381 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 17' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -60.97 -49.33 77.87 Favored 'General case' 0 N--CA 1.496 1.871 0 CA-C-N 116.245 -0.434 . . . . 0.0 110.199 179.647 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 18' ' ' ASN . . . . . . . . . . . . . 0.5 OUTLIER -62.12 -39.95 94.25 Favored 'General case' 0 N--CA 1.497 1.896 0 O-C-N 121.504 -0.748 . . . . 0.0 110.129 179.619 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 19' ' ' GLU . . . . . 0.403 ' HB3' ' CE ' ' B' ' 154' ' ' MET . 7.6 mm-40 -63.89 -49.32 73.18 Favored 'General case' 0 N--CA 1.497 1.907 0 O-C-N 121.51 -0.744 . . . . 0.0 110.001 179.529 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 20' ' ' PHE . . . . . 0.4 ' CE1' ' HB3' ' A' ' 81' ' ' MET . 15.6 m-85 -66.49 -35.04 79.28 Favored 'General case' 0 N--CA 1.499 2.0 0 O-C-N 121.365 -0.834 . . . . 0.0 110.235 179.497 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 21' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -58.58 -54.2 49.7 Favored 'General case' 0 N--CA 1.498 1.951 0 O-C-N 121.423 -0.798 . . . . 0.0 109.907 179.434 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 22' ' ' ALA . . . . . . . . . . . . . . . -66.04 -42.07 90.02 Favored 'General case' 0 N--CA 1.496 1.834 0 O-C-N 121.53 -0.732 . . . . 0.0 110.619 179.974 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 23' ' ' ALA . . . . . . . . . . . . . . . -61.99 -40.77 96.78 Favored 'General case' 0 N--CA 1.499 1.994 0 O-C-N 121.324 -0.86 . . . . 0.0 110.105 179.478 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 24' ' ' PHE . . . . . . . . . . . . . 67.9 t80 -60.82 -45.31 94.95 Favored 'General case' 0 N--CA 1.498 1.956 0 O-C-N 121.561 -0.712 . . . . 0.0 110.088 179.392 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 25' ' ' ASP . . . . . . . . . . . . . 3.2 m-20 -60.52 -38.2 83.62 Favored 'General case' 0 N--CA 1.498 1.942 0 O-C-N 121.595 -0.691 . . . . 0.0 110.246 179.694 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 26' ' ' ILE . . . . . 0.574 ' HA ' HD12 ' A' ' 29' ' ' LEU . 57.1 mt -74.68 -26.87 20.13 Favored 'Isoleucine or valine' 0 N--CA 1.5 2.043 0 O-C-N 121.311 -0.868 . . . . 0.0 109.919 179.285 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 27' ' ' PHE . . . . . 0.479 ' CE1' HG21 ' A' ' 44' ' ' VAL . 0.2 OUTLIER -71.4 -37.92 71.5 Favored 'General case' 0 N--CA 1.496 1.866 0 O-C-N 121.288 -0.883 . . . . 0.0 111.245 -179.836 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 28' ' ' VAL . . . . . 0.567 ' CG2' ' HA ' ' A' ' 33' ' ' ASP . 28.1 m -79.71 9.79 0.7 Allowed 'Isoleucine or valine' 0 N--CA 1.503 2.211 0 O-C-N 121.29 -0.881 . . . . 0.0 111.726 -179.518 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 29' ' ' LEU . . . . . 0.574 HD12 ' HA ' ' A' ' 26' ' ' ILE . 2.5 mt -70.63 96.11 1.17 Allowed 'General case' 0 N--CA 1.496 1.834 0 O-C-N 121.001 -1.062 . . . . 0.0 109.737 179.449 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 30' ' ' GLY . . . . . . . . . . . . . . . 143.47 -25.21 2.16 Favored Glycine 0 N--CA 1.493 2.471 0 N-CA-C 109.264 -1.534 . . . . 0.0 109.264 -178.963 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 31' ' ' ALA . . . . . . . . . . . . . . . -98.8 -83.21 0.42 Allowed 'General case' 0 N--CA 1.494 1.757 0 O-C-N 121.42 -1.047 . . . . 0.0 109.951 179.679 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 32' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -157.63 27.41 0.28 Allowed 'General case' 0 N--CA 1.5 2.056 0 O-C-N 121.465 -0.772 . . . . 0.0 110.445 179.82 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 33' ' ' ASP . . . . . 0.567 ' HA ' ' CG2' ' A' ' 28' ' ' VAL . 11.2 m-20 51.76 54.07 11.58 Favored 'General case' 0 N--CA 1.5 2.048 0 O-C-N 121.535 -0.728 . . . . 0.0 111.066 179.819 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 34' ' ' GLY . . . . . . . . . . . . . . . -166.85 -38.51 0.02 OUTLIER Glycine 0 N--CA 1.499 2.883 0 C-N-CA 119.782 -1.199 . . . . 0.0 111.668 -179.817 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 35' ' ' CYS . . . . . . . . . . . . . 0.1 OUTLIER -135.69 156.24 49.15 Favored 'General case' 0 N--CA 1.498 1.975 0 O-C-N 120.981 -1.305 . . . . 0.0 111.353 -178.832 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 36' ' ' ILE . . . . . 0.566 ' HB ' ' HB ' ' A' ' 72' ' ' VAL . 1.2 mp -113.75 126.74 71.28 Favored 'Isoleucine or valine' 0 N--CA 1.496 1.875 0 O-C-N 121.405 -0.809 . . . . 0.0 109.81 179.253 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 37' ' ' SER . . . . . . . . . . . . . 52.1 p -103.06 -168.34 1.5 Allowed 'General case' 0 N--CA 1.497 1.887 0 O-C-N 121.482 -0.761 . . . . 0.0 110.593 -179.902 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 38' ' ' THR . . . . . . . . . . . . . 30.1 p -65.49 -46.21 80.64 Favored 'General case' 0 N--CA 1.501 2.103 0 O-C-N 121.291 -0.88 . . . . 0.0 110.255 179.675 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 39' ' ' LYS . . . . . . . . . . . . . 10.8 mttm -65.75 -38.34 88.83 Favored 'General case' 0 N--CA 1.499 1.99 0 O-C-N 121.484 -0.76 . . . . 0.0 110.031 179.459 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 40' ' ' GLU . . . . . 0.405 ' HB3' HG23 ' A' ' 36' ' ' ILE . 4.2 tp10 -64.69 -30.74 71.76 Favored 'General case' 0 N--CA 1.496 1.832 0 O-C-N 121.528 -0.732 . . . . 0.0 110.22 179.465 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 41' ' ' LEU . . . . . 0.698 ' CD2' HD22 ' A' ' 57' ' ' LEU . 6.0 tp -85.96 -45.84 11.11 Favored 'General case' 0 N--CA 1.496 1.841 0 O-C-N 121.445 -0.784 . . . . 0.0 110.602 179.615 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 42' ' ' GLY . . . . . . . . . . . . . . . -51.71 -39.12 45.95 Favored Glycine 0 N--CA 1.497 2.754 0 N-CA-C 111.141 -0.783 . . . . 0.0 111.141 -178.939 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 43' ' ' LYS . . . . . . . . . . . . . 2.7 pttm -58.9 -30.83 68.08 Favored 'General case' 0 N--CA 1.5 2.056 0 O-C-N 121.242 -1.152 . . . . 0.0 110.793 -179.975 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 44' ' ' VAL . . . . . 0.479 HG21 ' CE1' ' A' ' 27' ' ' PHE . 93.4 t -86.66 -32.49 6.59 Favored 'Isoleucine or valine' 0 N--CA 1.499 2.002 0 O-C-N 121.232 -0.917 . . . . 0.0 109.658 178.765 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 45' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -57.28 -50.67 72.16 Favored 'General case' 0 N--CA 1.5 2.04 0 O-C-N 121.443 -0.785 . . . . 0.0 110.282 179.8 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 46' ' ' ARG . . . . . 0.417 ' N ' ' HB2' ' A' ' 51' ' ' ASN . 0.0 OUTLIER -69.28 -41.04 77.38 Favored 'General case' 0 N--CA 1.499 1.987 0 O-C-N 121.394 -0.816 . . . . 0.0 109.796 179.393 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 47' ' ' MET . . . . . . . . . . . . . 0.2 OUTLIER -62.2 -37.44 85.3 Favored 'General case' 0 N--CA 1.499 1.988 0 O-C-N 121.574 -0.704 . . . . 0.0 110.112 179.238 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 48' ' ' LEU . . . . . 0.534 HD13 ' HG3' ' B' ' 153' ' ' MET . 0.4 OUTLIER -75.86 -46.75 28.59 Favored 'General case' 0 N--CA 1.493 1.686 0 O-C-N 121.446 -0.784 . . . . 0.0 110.229 179.592 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 49' ' ' GLY . . . . . . . . . . . . . . . -161.8 -82.69 0.04 OUTLIER Glycine 0 N--CA 1.494 2.508 0 N-CA-C 110.237 -1.145 . . . . 0.0 110.237 -179.832 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 50' ' ' GLN . . . . . . . . . . . . . 78.2 mt-30 -127.28 143.07 51.31 Favored 'General case' 0 N--CA 1.497 1.891 0 O-C-N 121.408 -1.054 . . . . 0.0 111.144 -179.361 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 51' ' ' ASN . . . . . 0.417 ' HB2' ' N ' ' A' ' 46' ' ' ARG . 33.1 t30 -116.4 110.97 42.35 Favored Pre-proline 0 N--CA 1.493 1.712 0 O-C-N 121.485 -0.759 . . . . 0.0 109.574 178.859 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 52' ' ' PRO . . . . . . . . . . . . . 44.0 Cg_endo -71.34 -92.62 0.01 OUTLIER 'Trans proline' 0 C--N 1.312 -1.361 0 O-C-N 124.003 1.528 . . . . 0.0 111.014 -179.541 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 53' ' ' THR . . . . . . . . . . . . . 0.6 OUTLIER -144.92 160.38 46.91 Favored Pre-proline 0 N--CA 1.495 1.801 0 O-C-N 120.841 -1.162 . . . . 0.0 110.667 -179.532 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 54' ' ' PRO . . . . . . . . . . . . . 43.5 Cg_endo -69.42 -38.14 8.97 Favored 'Trans proline' 0 N--CA 1.492 1.392 0 O-C-N 124.039 1.547 . . . . 0.0 111.307 179.993 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 55' ' ' GLU . . . . . . . . . . . . . 32.6 mt-10 -61.31 -38.44 86.86 Favored 'General case' 0 N--CA 1.499 1.996 0 O-C-N 121.381 -0.825 . . . . 0.0 110.634 -179.837 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 15.1 mm-40 -62.19 -37.99 87.39 Favored 'General case' 0 N--CA 1.498 1.961 0 O-C-N 121.417 -0.802 . . . . 0.0 110.765 179.736 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 57' ' ' LEU . . . . . 0.698 HD22 ' CD2' ' A' ' 41' ' ' LEU . 74.4 mt -68.65 -31.91 71.38 Favored 'General case' 0 N--CA 1.496 1.871 0 O-C-N 121.228 -0.92 . . . . 0.0 110.405 179.952 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 58' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -55.13 -52.56 62.89 Favored 'General case' 0 N--CA 1.498 1.946 0 O-C-N 121.287 -0.883 . . . . 0.0 109.041 179.024 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 59' ' ' GLU . . . . . . . . . . . . . 1.5 tm-20 -66.37 -35.96 81.67 Favored 'General case' 0 N--CA 1.494 1.744 0 N-CA-C 108.958 -0.756 . . . . 0.0 108.958 178.033 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 60' ' ' MET . . . . . . . . . . . . . 3.0 tpp -55.98 -40.68 73.63 Favored 'General case' 0 N--CA 1.498 1.949 0 O-C-N 121.571 -0.705 . . . . 0.0 109.775 178.715 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 61' ' ' ILE . . . . . 0.464 HG12 ' CG2' ' A' ' 72' ' ' VAL . 69.2 mt -71.19 -50.14 43.64 Favored 'Isoleucine or valine' 0 N--CA 1.498 1.959 0 O-C-N 121.446 -0.784 . . . . 0.0 109.302 178.928 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 62' ' ' ASP . . . . . 0.445 ' HA ' ' CB ' ' A' ' 65' ' ' ASP . 5.1 m-20 -58.9 -26.97 64.79 Favored 'General case' 0 N--CA 1.498 1.965 0 O-C-N 121.704 -0.623 . . . . 0.0 110.865 179.64 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 63' ' ' GLU . . . . . . . . . . . . . 3.0 tt0 -50.94 -39.08 53.98 Favored 'General case' 0 N--CA 1.501 2.076 0 O-C-N 121.347 -0.846 . . . . 0.0 109.981 179.179 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 64' ' ' VAL . . . . . . . . . . . . . 9.8 p -125.83 25.78 2.87 Favored 'Isoleucine or valine' 0 N--CA 1.495 1.824 0 O-C-N 121.587 -0.696 . . . . 0.0 110.393 179.259 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 65' ' ' ASP . . . . . 0.445 ' CB ' ' HA ' ' A' ' 62' ' ' ASP . 9.3 t70 -86.74 116.36 24.79 Favored 'General case' 0 N--CA 1.498 1.934 0 O-C-N 121.099 -1.001 . . . . 0.0 110.397 179.886 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 66' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER -80.07 -20.98 43.91 Favored 'General case' 0 N--CA 1.497 1.895 0 O-C-N 121.505 -0.747 . . . . 0.0 110.627 179.457 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 67' ' ' ASP . . . . . . . . . . . . . 70.0 m-20 -80.52 -15.75 55.93 Favored 'General case' 0 N--CA 1.497 1.918 0 O-C-N 121.18 -0.95 . . . . 0.0 111.729 -179.7 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 68' ' ' GLY . . . . . . . . . . . . . . . 66.66 16.68 66.0 Favored Glycine 0 N--CA 1.494 2.56 0 N-CA-C 108.731 -1.747 . . . . 0.0 108.731 -178.17 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 69' ' ' SER . . . . . . . . . . . . . 88.7 p -94.22 -34.53 12.85 Favored 'General case' 0 N--CA 1.492 1.66 0 O-C-N 121.674 -0.898 . . . . 0.0 109.984 -179.86 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 70' ' ' GLY . . . . . . . . . . . . . . . 94.87 30.34 8.48 Favored Glycine 0 N--CA 1.499 2.877 0 N-CA-C 110.137 -1.185 . . . . 0.0 110.137 179.962 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 71' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -128.75 134.34 48.39 Favored 'General case' 0 N--CA 1.499 2.025 0 O-C-N 121.516 -0.991 . . . . 0.0 108.64 179.346 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 72' ' ' VAL . . . . . 0.566 ' HB ' ' HB ' ' A' ' 36' ' ' ILE . 74.0 t -75.61 113.66 14.75 Favored 'Isoleucine or valine' 0 N--CA 1.5 2.043 0 O-C-N 121.199 -0.938 . . . . 0.0 111.375 -178.87 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 73' ' ' ASP . . . . . . . . . . . . . 3.5 m-20 -96.9 -174.61 3.03 Favored 'General case' 0 N--CA 1.493 1.721 0 O-C-N 121.724 -0.61 . . . . 0.0 109.423 178.788 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 74' ' ' PHE . . . . . . . . . . . . . 27.6 t80 -72.37 -40.51 67.25 Favored 'General case' 0 N--CA 1.498 1.943 0 O-C-N 120.928 -1.107 . . . . 0.0 109.747 179.729 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 75' ' ' ASP . . . . . . . . . . . . . 3.0 p-10 -67.69 -36.37 80.53 Favored 'General case' 0 N--CA 1.494 1.734 0 O-C-N 121.705 -0.622 . . . . 0.0 109.977 179.251 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 76' ' ' GLU . . . . . . . . . . . . . 7.6 mt-10 -73.12 -41.46 63.99 Favored 'General case' 0 N--CA 1.494 1.763 0 O-C-N 121.485 -0.76 . . . . 0.0 109.826 179.247 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 77' ' ' PHE . . . . . 0.446 ' O ' ' HG2' ' A' ' 81' ' ' MET . 61.3 t80 -57.76 -49.92 74.98 Favored 'General case' 0 N--CA 1.498 1.963 0 O-C-N 121.669 -0.644 . . . . 0.0 110.653 179.803 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 78' ' ' LEU . . . . . . . . . . . . . 46.6 mt -54.42 -45.98 73.1 Favored 'General case' 0 N--CA 1.501 2.079 0 O-C-N 121.363 -0.836 . . . . 0.0 110.372 179.928 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 79' ' ' VAL . . . . . 0.616 ' CG2' HG21 ' A' ' 9' ' ' VAL . 75.5 t -66.33 -37.99 80.87 Favored 'Isoleucine or valine' 0 N--CA 1.5 2.035 0 O-C-N 121.51 -0.744 . . . . 0.0 109.773 179.196 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 80' ' ' MET . . . . . 0.527 ' HA ' ' HG2' ' A' ' 83' ' ' ARG . 25.8 ttp -65.74 -41.84 91.67 Favored 'General case' 0 N--CA 1.495 1.786 0 O-C-N 121.53 -0.731 . . . . 0.0 110.837 179.93 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 81' ' ' MET . . . . . 0.446 ' HG2' ' O ' ' A' ' 77' ' ' PHE . 22.8 mmm -66.06 -49.87 66.13 Favored 'General case' 0 N--CA 1.497 1.923 0 O-C-N 121.286 -0.884 . . . . 0.0 111.121 -179.351 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 82' ' ' VAL . . . . . 0.45 ' HA ' ' HE2' ' A' ' 85' ' ' MET . 34.9 m -64.4 -35.19 73.59 Favored 'Isoleucine or valine' 0 N--CA 1.503 2.215 0 O-C-N 121.135 -0.978 . . . . 0.0 111.197 -179.418 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 83' ' ' ARG . . . . . 0.527 ' HG2' ' HA ' ' A' ' 80' ' ' MET . 0.0 OUTLIER -79.33 -21.11 46.32 Favored 'General case' 0 N--CA 1.499 1.996 0 O-C-N 121.094 -1.004 . . . . 0.0 110.642 179.564 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 84' ' ' CYS . . . . . 0.485 ' N ' ' HG3' ' A' ' 83' ' ' ARG . 41.3 t -78.72 -25.17 44.58 Favored 'General case' 0 N--CA 1.498 1.967 0 O-C-N 121.103 -0.998 . . . . 0.0 110.614 179.74 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 85' ' ' MET . . . . . 0.45 ' HE2' ' HA ' ' A' ' 82' ' ' VAL . 7.6 mtm -55.77 -53.93 50.57 Favored 'General case' 0 N--CA 1.501 2.111 0 O-C-N 121.449 -0.782 . . . . 0.0 110.988 -179.882 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 86' ' ' LYS . . . . . . . . . . . . . 1.3 tmtm? -145.67 88.84 1.86 Allowed 'General case' 0 N--CA 1.497 1.89 0 O-C-N 121.209 -0.932 . . . . 0.0 110.72 -179.902 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 87' ' ' ASP . . . . . . . . . . . . . 0.6 OUTLIER -101.77 -58.87 1.8 Allowed 'General case' 0 N--CA 1.495 1.823 0 O-C-N 121.316 -0.865 . . . . 0.0 109.808 179.484 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 88' ' ' ASP . . . . . . . . . . . . . 3.9 m-20 -72.79 125.11 26.75 Favored 'General case' 0 N--CA 1.496 1.833 0 O-C-N 121.457 -0.777 . . . . 0.0 109.813 179.344 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 89' ' ' SER . . . . . . . . . . . . . 31.8 m . . . . . 0 N--CA 1.497 1.905 0 CA-C-O 117.94 -1.028 . . . . 0.0 110.365 -179.807 . . . . . . . . 0 0 . 1 . 002 nuclear nobuild full ' B' B ' 144' ' ' ARG . . . . . . . . . . . . . 10.8 mtt-85 . . . . . 0 N--CA 1.495 1.819 0 CA-C-O 120.887 0.375 . . . . 0.0 110.282 . . . . . . . . . 0 0 . 1 . 002 nuclear nobuild full ' B' B ' 145' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER 63.18 170.01 0.15 Allowed 'General case' 0 N--CA 1.503 2.194 0 CA-C-O 121.448 0.642 . . . . 0.0 110.908 -179.75 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' B' B ' 146' ' ' VAL . . . . . 0.477 HG13 HG12 ' B' ' 148' ' ' ILE . 3.2 p -103.12 153.01 5.76 Favored 'Isoleucine or valine' 0 N--CA 1.495 1.817 0 O-C-N 121.191 -0.943 . . . . 0.0 110.231 179.936 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' B' B ' 147' ' ' ARG . . . . . . . . . . . . . 0.7 OUTLIER -100.79 107.66 19.28 Favored 'General case' 0 N--CA 1.494 1.769 0 O-C-N 121.376 -0.828 . . . . 0.0 110.68 -179.246 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' B' B ' 148' ' ' ILE . . . . . 0.477 HG12 HG13 ' B' ' 146' ' ' VAL . 37.1 mm -107.89 -59.43 3.33 Favored 'Isoleucine or valine' 0 N--CA 1.495 1.79 0 O-C-N 121.505 -0.747 . . . . 0.0 109.751 179.479 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' B' B ' 149' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER 64.3 111.85 0.03 OUTLIER 'General case' 0 N--CA 1.504 2.257 0 CA-C-O 121.474 0.654 . . . . 0.0 111.132 179.551 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' B' B ' 150' ' ' ALA . . . . . . . . . . . . . . . -56.89 -41.76 78.64 Favored 'General case' 0 N--CA 1.5 2.045 0 O-C-N 121.298 -0.876 . . . . 0.0 110.283 179.632 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 151' ' ' ASP . . . . . . . . . . . . . 7.9 p-10 -61.56 -38.72 88.51 Favored 'General case' 0 N--CA 1.498 1.944 0 O-C-N 121.505 -0.747 . . . . 0.0 110.444 179.438 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 152' ' ' ALA . . . . . . . . . . . . . . . -67.02 -48.32 68.76 Favored 'General case' 0 N--CA 1.497 1.886 0 O-C-N 121.312 -0.868 . . . . 0.0 109.703 179.392 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 153' ' ' MET . . . . . 0.534 ' HG3' HD13 ' A' ' 48' ' ' LEU . 1.6 ttt -64.23 -36.85 85.42 Favored 'General case' 0 N--CA 1.498 1.927 0 O-C-N 121.545 -0.722 . . . . 0.0 110.155 179.221 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' B' B ' 154' ' ' MET . . . . . 0.403 ' CE ' ' HB3' ' A' ' 19' ' ' GLU . 15.8 mtp -58.82 -48.3 81.79 Favored 'General case' 0 N--CA 1.499 1.977 0 O-C-N 121.571 -0.706 . . . . 0.0 110.092 179.449 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' B' B ' 155' ' ' GLN . . . . . . . . . . . . . 19.1 mt-30 -71.97 -33.33 68.07 Favored 'General case' 0 N--CA 1.498 1.95 0 O-C-N 121.479 -0.763 . . . . 0.0 110.387 179.46 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 156' ' ' ALA . . . . . . . . . . . . . . . -62.98 -42.72 99.91 Favored 'General case' 0 N--CA 1.496 1.848 0 O-C-N 121.42 -0.8 . . . . 0.0 110.497 -179.889 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 157' ' ' LEU . . . . . . . . . . . . . 0.8 OUTLIER -86.4 -54.03 4.66 Favored 'General case' 0 N--CA 1.497 1.9 0 O-C-N 121.356 -0.84 . . . . 0.0 110.298 179.803 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' B' B ' 158' ' ' LEU . . . . . 0.423 ' HA ' ' O ' ' B' ' 162' ' ' ALA . 4.8 mt -89.87 67.26 7.18 Favored 'General case' 0 N--CA 1.495 1.803 0 O-C-N 121.368 -0.833 . . . . 0.0 109.907 179.751 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' B' B ' 159' ' ' GLY . . . . . . . . . . . . . . . -162.05 -63.27 0.02 OUTLIER Glycine 0 N--CA 1.495 2.572 0 N-CA-C 109.976 -1.25 . . . . 0.0 109.976 179.997 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 160' ' ' ALA . . . . . 0.497 ' O ' ' HB2' ' B' ' 161' ' ' ARG . . . -68.41 103.7 1.71 Allowed 'General case' 0 N--CA 1.496 1.838 0 O-C-N 121.496 -1.002 . . . . 0.0 110.439 -179.78 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' B' B ' 161' ' ' ARG . . . . . 0.497 ' HB2' ' O ' ' B' ' 160' ' ' ALA . 3.7 mtt-85 69.93 -54.27 0.61 Allowed 'General case' 0 N--CA 1.51 2.54 0 O-C-N 122.038 -0.414 . . . . 0.0 111.699 179.911 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' B' B ' 162' ' ' ALA . . . . . 0.423 ' O ' ' HA ' ' B' ' 158' ' ' LEU . . . -100.91 115.1 29.62 Favored 'General case' 0 N--CA 1.494 1.751 0 O-C-N 121.029 -1.045 . . . . 0.0 110.119 -179.665 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' B' B ' 163' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.496 1.843 0 CA-C-O 117.853 -1.07 . . . . 0.0 110.948 -179.867 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 90' ' ' ' CA' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 002 nuclear nobuild full ' A' A ' 91' ' ' SXK . . . . . 0.543 ' HAK' HD22 ' A' ' 41' ' ' LEU . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 8.8 tpt . . . . . 0 N--CA 1.495 1.793 0 CA-C-O 121.231 0.539 . . . . 0.0 110.202 . . . . . . . . . 0 0 . 1 . 003 nuclear nobuild full ' A' A ' 2' ' ' ASP . . . . . 0.451 ' HB2' ' HB2' ' A' ' 5' ' ' TYR . 8.1 p-10 -170.99 -45.93 0.02 OUTLIER 'General case' 0 N--CA 1.5 2.058 0 O-C-N 121.467 -0.771 . . . . 0.0 110.157 -179.916 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 3' ' ' ASP . . . . . . . . . . . . . 11.8 m-20 55.07 -82.72 0.01 OUTLIER 'General case' 0 N--CA 1.501 2.102 0 N-CA-C 112.447 0.536 . . . . 0.0 112.447 178.889 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 4' ' ' ILE . . . . . 0.729 HG21 ' HA ' ' A' ' 89' ' ' SER . 49.4 mt -51.41 -36.98 18.15 Favored 'Isoleucine or valine' 0 N--CA 1.504 2.252 0 O-C-N 121.349 -0.844 . . . . 0.0 111.899 -179.011 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 5' ' ' TYR . . . . . 0.489 ' CE1' ' HA ' ' A' ' 83' ' ' ARG . 31.7 m-85 -60.53 -32.66 71.68 Favored 'General case' 0 N--CA 1.502 2.147 0 O-C-N 121.053 -1.03 . . . . 0.0 111.246 -179.501 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -62.68 -38.93 92.3 Favored 'General case' 0 N--CA 1.498 1.941 0 O-C-N 121.117 -0.989 . . . . 0.0 109.741 178.811 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 7' ' ' ALA . . . . . . . . . . . . . . . -59.73 -38.49 81.86 Favored 'General case' 0 N--CA 1.497 1.909 0 O-C-N 121.544 -0.722 . . . . 0.0 110.251 179.13 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 8' ' ' ALA . . . . . 0.702 ' HB1' HG21 ' A' ' 82' ' ' VAL . . . -60.34 -33.93 73.11 Favored 'General case' 0 N--CA 1.498 1.928 0 O-C-N 121.364 -0.835 . . . . 0.0 110.308 179.232 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 9' ' ' VAL . . . . . 0.44 HG21 ' HB ' ' A' ' 79' ' ' VAL . 93.3 t -65.96 -34.88 73.22 Favored 'Isoleucine or valine' 0 N--CA 1.5 2.046 0 O-C-N 121.403 -0.81 . . . . 0.0 109.745 179.3 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 10' ' ' GLU . . . . . . . . . . . . . 22.7 mt-10 -62.98 -31.68 72.85 Favored 'General case' 0 N--CA 1.498 1.93 0 O-C-N 121.376 -0.828 . . . . 0.0 109.951 178.951 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 11' ' ' GLN . . . . . . . . . . . . . 1.0 OUTLIER -67.1 -28.63 68.33 Favored 'General case' 0 N--CA 1.499 1.978 0 O-C-N 121.413 -0.804 . . . . 0.0 110.247 179.202 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 12' ' ' LEU . . . . . 0.486 HD22 ' HB3' ' A' ' 16' ' ' GLN . 81.0 mt -77.11 98.56 5.08 Favored 'General case' 0 N--CA 1.496 1.838 0 O-C-N 121.227 -0.92 . . . . 0.0 109.797 179.661 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 13' ' ' THR . . . . . . . . . . . . . 11.6 p -77.31 -176.2 4.04 Favored 'General case' 0 N--CA 1.498 1.964 0 O-C-N 121.438 -0.789 . . . . 0.0 110.874 -179.588 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 14' ' ' GLU . . . . . 0.419 ' HA ' ' HB2' ' A' ' 17' ' ' LYS . 0.5 OUTLIER -50.54 -36.32 33.72 Favored 'General case' 0 N--CA 1.496 1.828 0 O-C-N 121.734 -0.604 . . . . 0.0 111.299 -178.848 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 1.9 mp0 -60.82 -46.62 89.83 Favored 'General case' 0 N--CA 1.5 2.033 0 O-C-N 121.422 -0.799 . . . . 0.0 109.972 179.516 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 16' ' ' GLN . . . . . 0.486 ' HB3' HD22 ' A' ' 12' ' ' LEU . 1.1 mp0 -75.96 -35.73 59.55 Favored 'General case' 0 N--CA 1.497 1.913 0 O-C-N 121.567 -0.708 . . . . 0.0 109.986 179.208 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 17' ' ' LYS . . . . . 0.419 ' HB2' ' HA ' ' A' ' 14' ' ' GLU . 14.0 mmtt -62.92 -41.45 99.48 Favored 'General case' 0 N--CA 1.495 1.812 0 O-C-N 121.925 -0.484 . . . . 0.0 109.811 179.271 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 18' ' ' ASN . . . . . . . . . . . . . 9.4 t30 -62.46 -40.46 96.7 Favored 'General case' 0 N--CA 1.496 1.863 0 O-C-N 121.598 -0.689 . . . . 0.0 110.399 179.587 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 19' ' ' GLU . . . . . 0.514 ' HB3' ' HE3' ' B' ' 154' ' ' MET . 4.5 mm-40 -61.0 -42.87 99.28 Favored 'General case' 0 N--CA 1.501 2.085 0 O-C-N 121.438 -0.789 . . . . 0.0 110.129 179.503 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 20' ' ' PHE . . . . . . . . . . . . . 5.7 m-85 -77.41 -36.42 53.33 Favored 'General case' 0 N--CA 1.499 2.008 0 O-C-N 121.326 -0.859 . . . . 0.0 109.978 179.221 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 21' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -57.79 -48.65 79.08 Favored 'General case' 0 N--CA 1.499 1.993 0 O-C-N 121.645 -0.659 . . . . 0.0 110.15 179.408 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 22' ' ' ALA . . . . . . . . . . . . . . . -59.98 -43.97 94.8 Favored 'General case' 0 N--CA 1.497 1.881 0 O-C-N 121.605 -0.685 . . . . 0.0 110.036 179.597 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 23' ' ' ALA . . . . . . . . . . . . . . . -66.67 -35.44 80.17 Favored 'General case' 0 N--CA 1.497 1.902 0 O-C-N 121.334 -0.854 . . . . 0.0 109.142 178.597 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 24' ' ' PHE . . . . . 0.568 ' CE1' HD12 ' A' ' 36' ' ' ILE . 56.5 t80 -62.4 -34.51 76.87 Favored 'General case' 0 N--CA 1.497 1.876 0 O-C-N 121.737 -0.602 . . . . 0.0 110.173 179.029 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 25' ' ' ASP . . . . . . . . . . . . . 16.5 m-20 -58.45 -52.62 64.85 Favored 'General case' 0 N--CA 1.5 2.026 0 O-C-N 121.523 -0.736 . . . . 0.0 110.503 179.675 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 26' ' ' ILE . . . . . 0.502 HD13 ' O ' ' B' ' 157' ' ' LEU . 3.2 mt -63.38 -37.75 80.36 Favored 'Isoleucine or valine' 0 N--CA 1.498 1.966 0 O-C-N 121.393 -0.817 . . . . 0.0 109.678 179.527 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 27' ' ' PHE . . . . . 0.696 ' HB3' HD11 ' A' ' 36' ' ' ILE . 0.1 OUTLIER -61.62 -34.43 75.65 Favored 'General case' 0 N--CA 1.498 1.932 0 O-C-N 121.603 -0.685 . . . . 0.0 110.672 179.632 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 28' ' ' VAL . . . . . 0.704 HG12 HG13 ' A' ' 36' ' ' ILE . 16.0 m -101.93 -6.39 9.2 Favored 'Isoleucine or valine' 0 N--CA 1.502 2.169 0 O-C-N 121.166 -0.959 . . . . 0.0 111.527 -179.879 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 29' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -52.73 -56.97 11.76 Favored 'General case' 0 N--CA 1.501 2.112 0 O-C-N 121.129 -0.982 . . . . 0.0 110.886 -179.671 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 30' ' ' GLY . . . . . . . . . . . . . . . -105.28 51.4 0.77 Allowed Glycine 0 N--CA 1.494 2.525 0 N-CA-C 108.851 -1.7 . . . . 0.0 108.851 179.381 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 31' ' ' ALA . . . . . 0.546 ' HA ' ' HG2' ' A' ' 40' ' ' GLU . . . -98.17 33.21 2.22 Favored 'General case' 0 N--CA 1.495 1.775 0 O-C-N 121.37 -1.076 . . . . 0.0 111.562 -179.235 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 32' ' ' GLU . . . . . . . . . . . . . 3.7 mt-10 54.07 -86.25 0.01 OUTLIER 'General case' 0 N--CA 1.505 2.303 0 O-C-N 121.614 -0.679 . . . . 0.0 111.395 179.256 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 5.1 p-10 -69.84 -32.7 71.24 Favored 'General case' 0 N--CA 1.497 1.879 0 O-C-N 121.135 -0.978 . . . . 0.0 110.57 179.866 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 34' ' ' GLY . . . . . 0.521 ' O ' ' HB ' ' A' ' 28' ' ' VAL . . . 136.21 -43.7 1.22 Allowed Glycine 0 N--CA 1.495 2.632 0 C-N-CA 119.886 -1.15 . . . . 0.0 110.54 179.335 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 35' ' ' CYS . . . . . . . . . . . . . 94.9 m -86.63 159.5 19.19 Favored 'General case' 0 N--CA 1.499 1.998 0 O-C-N 121.266 -1.137 . . . . 0.0 110.652 -179.686 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 36' ' ' ILE . . . . . 0.704 HG13 HG12 ' A' ' 28' ' ' VAL . 4.7 mt -68.91 112.23 3.55 Favored 'Isoleucine or valine' 0 N--CA 1.499 1.999 0 O-C-N 121.339 -0.851 . . . . 0.0 110.27 -179.82 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 37' ' ' SER . . . . . . . . . . . . . 18.6 t -101.03 -174.61 2.65 Favored 'General case' 0 N--CA 1.495 1.823 0 O-C-N 121.517 -0.739 . . . . 0.0 109.825 179.558 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 38' ' ' THR . . . . . . . . . . . . . 8.3 p -60.55 -53.33 58.8 Favored 'General case' 0 N--CA 1.504 2.239 0 O-C-N 121.345 -0.847 . . . . 0.0 111.303 -179.447 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 39' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -59.14 -39.63 82.99 Favored 'General case' 0 N--CA 1.502 2.153 0 O-C-N 121.422 -0.799 . . . . 0.0 111.512 -179.22 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 40' ' ' GLU . . . . . 0.546 ' HG2' ' HA ' ' A' ' 31' ' ' ALA . 1.1 mp0 -63.09 -46.18 88.6 Favored 'General case' 0 N--CA 1.502 2.127 0 O-C-N 121.064 -1.023 . . . . 0.0 110.346 179.652 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 41' ' ' LEU . . . . . 0.594 HD21 ' HAK' ' A' ' 91' ' ' SXK . 0.1 OUTLIER -58.71 -61.02 2.92 Favored 'General case' 0 N--CA 1.499 1.983 0 O-C-N 121.544 -0.723 . . . . 0.0 109.693 179.192 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 42' ' ' GLY . . . . . . . . . . . . . . . -48.99 -33.33 13.32 Favored Glycine 0 N--CA 1.5 2.907 0 N-CA-C 111.036 -0.826 . . . . 0.0 111.036 179.938 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 43' ' ' LYS . . . . . . . . . . . . . 2.4 tmtt? -56.7 -42.36 79.0 Favored 'General case' 0 N--CA 1.504 2.243 0 O-C-N 121.224 -1.162 . . . . 0.0 110.322 179.912 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 44' ' ' VAL . . . . . . . . . . . . . 76.8 t -76.84 -33.84 21.88 Favored 'Isoleucine or valine' 0 N--CA 1.494 1.762 0 O-C-N 121.296 -0.877 . . . . 0.0 109.265 179.191 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 45' ' ' MET . . . . . 0.681 ' HE2' HG12 ' B' ' 148' ' ' ILE . 1.2 mtt -57.73 -55.28 36.97 Favored 'General case' 0 N--CA 1.497 1.913 0 O-C-N 121.514 -0.741 . . . . 0.0 109.825 179.103 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 46' ' ' ARG . . . . . . . . . . . . . 15.4 ptp180 -61.45 -34.22 75.05 Favored 'General case' 0 N--CA 1.502 2.163 0 O-C-N 121.343 -0.848 . . . . 0.0 110.279 179.279 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 47' ' ' MET . . . . . . . . . . . . . 16.5 ttp -61.31 -32.9 72.76 Favored 'General case' 0 N--CA 1.499 2.007 0 O-C-N 121.281 -0.887 . . . . 0.0 109.388 178.557 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 48' ' ' LEU . . . . . . . . . . . . . 8.2 tp -85.06 -42.46 14.81 Favored 'General case' 0 N--CA 1.492 1.649 0 O-C-N 121.617 -0.677 . . . . 0.0 110.003 179.164 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 49' ' ' GLY . . . . . . . . . . . . . . . 169.9 -65.8 0.17 Allowed Glycine 0 N--CA 1.497 2.705 0 C-N-CA 119.759 -1.21 . . . . 0.0 110.896 179.882 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 50' ' ' GLN . . . . . . . . . . . . . 1.2 mt-30 -59.59 136.52 58.01 Favored 'General case' 0 N--CA 1.504 2.236 0 O-C-N 121.356 -1.085 . . . . 0.0 111.165 -179.03 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 51' ' ' ASN . . . . . . . . . . . . . 2.2 m-80 -118.74 77.98 15.22 Favored Pre-proline 0 N--CA 1.498 1.937 0 O-C-N 121.282 -0.887 . . . . 0.0 110.693 -179.97 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 52' ' ' PRO . . . . . 0.519 ' HG3' ' SD ' ' A' ' 45' ' ' MET . 54.2 Cg_endo -81.94 163.68 18.06 Favored 'Trans proline' 0 C--N 1.313 -1.294 0 O-C-N 123.814 1.428 . . . . 0.0 110.809 179.768 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 53' ' ' THR . . . . . 0.514 ' O ' HD12 ' A' ' 57' ' ' LEU . 34.2 p -95.25 161.98 26.26 Favored Pre-proline 0 N--CA 1.496 1.854 0 O-C-N 121.325 -0.859 . . . . 0.0 109.826 179.245 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 54' ' ' PRO . . . . . . . . . . . . . 38.9 Cg_endo -65.85 -32.73 45.23 Favored 'Trans proline' 0 C--N 1.312 -1.362 0 O-C-N 123.703 1.37 . . . . 0.0 110.255 179.355 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 55' ' ' GLU . . . . . . . . . . . . . 12.2 mp0 -66.73 -38.47 86.74 Favored 'General case' 0 N--CA 1.496 1.834 0 O-C-N 121.401 -0.812 . . . . 0.0 109.425 178.558 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 0.3 OUTLIER -74.14 -40.78 62.39 Favored 'General case' 0 N--CA 1.495 1.804 0 O-C-N 121.568 -0.707 . . . . 0.0 110.078 179.298 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 57' ' ' LEU . . . . . 0.552 ' HA ' ' HG3' ' A' ' 60' ' ' MET . 6.7 mt -62.39 -20.25 64.26 Favored 'General case' 0 N--CA 1.5 2.037 0 O-C-N 121.259 -0.9 . . . . 0.0 110.93 179.69 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 58' ' ' GLN . . . . . 0.576 ' HG3' ' N ' ' A' ' 59' ' ' GLU . 0.0 OUTLIER -59.81 -37.55 79.47 Favored 'General case' 0 N--CA 1.496 1.865 0 O-C-N 121.05 -1.031 . . . . 0.0 109.095 179.131 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 59' ' ' GLU . . . . . 0.576 ' N ' ' HG3' ' A' ' 58' ' ' GLN . 0.4 OUTLIER -73.56 -35.81 65.53 Favored 'General case' 0 N--CA 1.497 1.879 0 N-CA-C 108.9 -0.778 . . . . 0.0 108.9 178.128 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 60' ' ' MET . . . . . 0.552 ' HG3' ' HA ' ' A' ' 57' ' ' LEU . 1.6 mmm -58.92 -42.64 90.2 Favored 'General case' 0 N--CA 1.497 1.881 0 O-C-N 121.708 -0.62 . . . . 0.0 109.679 179.04 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 61' ' ' ILE . . . . . 0.568 HG23 HG23 ' A' ' 72' ' ' VAL . 3.2 mt -76.86 -42.29 32.87 Favored 'Isoleucine or valine' 0 N--CA 1.497 1.923 0 O-C-N 121.511 -0.743 . . . . 0.0 109.913 179.226 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 62' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -58.9 -31.5 68.67 Favored 'General case' 0 N--CA 1.502 2.141 0 O-C-N 121.438 -0.789 . . . . 0.0 110.909 179.943 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 63' ' ' GLU . . . . . . . . . . . . . 2.7 tt0 -53.54 -34.73 59.27 Favored 'General case' 0 N--CA 1.5 2.035 0 O-C-N 121.7 -0.625 . . . . 0.0 111.099 179.893 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 64' ' ' VAL . . . . . 0.512 HG21 HG13 ' A' ' 79' ' ' VAL . 9.8 p -118.46 16.87 7.04 Favored 'Isoleucine or valine' 0 N--CA 1.497 1.888 0 O-C-N 121.25 -0.906 . . . . 0.0 111.16 179.999 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 65' ' ' ASP . . . . . . . . . . . . . 25.7 t70 -92.6 -88.43 0.21 Allowed 'General case' 0 N--CA 1.498 1.934 0 O-C-N 120.902 -1.124 . . . . 0.0 110.091 179.673 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 66' ' ' GLU . . . . . . . . . . . . . 3.3 mt-10 47.84 38.67 9.26 Favored 'General case' 0 N--CA 1.504 2.24 0 O-C-N 121.374 -0.828 . . . . 0.0 111.326 179.654 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 67' ' ' ASP . . . . . . . . . . . . . 0.8 OUTLIER -114.77 -32.74 5.72 Favored 'General case' 0 N--CA 1.5 2.058 0 O-C-N 121.062 -1.024 . . . . 0.0 111.455 -179.774 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 68' ' ' GLY . . . . . . . . . . . . . . . 140.13 -30.87 2.31 Favored Glycine 0 N--CA 1.497 2.703 0 C-N-CA 120.006 -1.092 . . . . 0.0 110.658 179.923 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 69' ' ' SER . . . . . . . . . . . . . 11.4 p -93.55 -29.68 15.38 Favored 'General case' 0 N--CA 1.499 2.006 0 O-C-N 121.189 -1.183 . . . . 0.0 111.847 -179.358 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 70' ' ' GLY . . . . . . . . . . . . . . . 89.2 -42.62 3.03 Favored Glycine 0 N--CA 1.498 2.824 0 C-N-CA 119.614 -1.279 . . . . 0.0 109.919 -179.383 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 71' ' ' THR . . . . . . . . . . . . . 26.7 m -71.41 153.25 42.42 Favored 'General case' 0 N--CA 1.502 2.128 0 O-C-N 121.373 -1.075 . . . . 0.0 110.38 179.966 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 72' ' ' VAL . . . . . 0.568 HG23 HG23 ' A' ' 61' ' ' ILE . 1.7 t -77.22 138.11 21.13 Favored 'Isoleucine or valine' 0 N--CA 1.501 2.11 0 O-C-N 121.29 -0.881 . . . . 0.0 111.016 -179.579 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 73' ' ' ASP . . . . . . . . . . . . . 5.0 m-20 -104.0 -162.0 0.87 Allowed 'General case' 0 N--CA 1.5 2.042 0 O-C-N 121.597 -0.689 . . . . 0.0 109.858 179.291 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 74' ' ' PHE . . . . . . . . . . . . . 16.9 t80 -78.66 -65.21 1.02 Allowed 'General case' 0 N--CA 1.502 2.16 0 O-C-N 120.927 -1.108 . . . . 0.0 110.015 179.642 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 75' ' ' ASP . . . . . 0.754 ' HA ' HD12 ' A' ' 78' ' ' LEU . 0.6 OUTLIER -60.17 -31.43 70.1 Favored 'General case' 0 N--CA 1.498 1.933 0 O-C-N 121.327 -0.858 . . . . 0.0 109.73 179.34 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 76' ' ' GLU . . . . . 0.646 ' O ' HG12 ' A' ' 79' ' ' VAL . 3.8 tt0 -65.73 -36.37 83.39 Favored 'General case' 0 N--CA 1.498 1.971 0 O-C-N 121.365 -0.834 . . . . 0.0 108.793 178.07 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 77' ' ' PHE . . . . . 0.428 ' O ' ' HG2' ' A' ' 81' ' ' MET . 19.1 t80 -69.97 -37.98 75.94 Favored 'General case' 0 N--CA 1.494 1.732 0 N-CA-C 108.907 -0.775 . . . . 0.0 108.907 178.301 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 78' ' ' LEU . . . . . 0.754 HD12 ' HA ' ' A' ' 75' ' ' ASP . 17.4 mt -58.88 -44.51 91.12 Favored 'General case' 0 N--CA 1.498 1.954 0 O-C-N 121.581 -0.699 . . . . 0.0 110.292 179.308 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 79' ' ' VAL . . . . . 0.646 HG12 ' O ' ' A' ' 76' ' ' GLU . 9.0 p -72.74 -18.88 18.76 Favored 'Isoleucine or valine' 0 N--CA 1.5 2.034 0 O-C-N 121.334 -0.854 . . . . 0.0 110.211 178.803 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 80' ' ' MET . . . . . 0.411 ' SD ' HG11 ' A' ' 64' ' ' VAL . 13.6 ttt -76.58 -39.03 53.89 Favored 'General case' 0 N--CA 1.497 1.91 0 O-C-N 121.226 -0.921 . . . . 0.0 109.783 179.035 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 81' ' ' MET . . . . . 0.428 ' HG2' ' O ' ' A' ' 77' ' ' PHE . 55.3 mmm -60.69 -45.64 93.4 Favored 'General case' 0 N--CA 1.497 1.91 0 O-C-N 121.441 -0.787 . . . . 0.0 110.209 179.479 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 82' ' ' VAL . . . . . 0.702 HG21 ' HB1' ' A' ' 8' ' ' ALA . 1.8 p -69.91 -30.6 44.93 Favored 'Isoleucine or valine' 0 N--CA 1.496 1.826 0 O-C-N 121.364 -0.835 . . . . 0.0 110.111 179.558 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 83' ' ' ARG . . . . . 0.489 ' HA ' ' CE1' ' A' ' 5' ' ' TYR . 4.0 mtt-85 -65.5 -44.44 87.01 Favored 'General case' 0 N--CA 1.496 1.871 0 O-C-N 121.278 -0.888 . . . . 0.0 109.369 178.811 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 84' ' ' CYS . . . . . . . . . . . . . 23.9 t -72.63 -38.23 67.8 Favored 'General case' 0 N--CA 1.495 1.816 0 O-C-N 121.619 -0.676 . . . . 0.0 109.788 178.795 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 85' ' ' MET . . . . . 0.416 ' O ' ' CB ' ' A' ' 86' ' ' LYS . 4.0 ttm -69.96 -25.48 63.65 Favored 'General case' 0 N--CA 1.498 1.96 0 O-C-N 121.506 -0.746 . . . . 0.0 110.514 179.453 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 86' ' ' LYS . . . . . 0.416 ' CB ' ' O ' ' A' ' 85' ' ' MET . 0.1 OUTLIER 70.44 115.26 0.05 OUTLIER 'General case' 0 N--CA 1.501 2.109 0 CA-C-O 121.525 0.678 . . . . 0.0 110.796 -179.872 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 87' ' ' ASP . . . . . . . . . . . . . 5.3 p-10 -108.7 -163.55 0.88 Allowed 'General case' 0 N--CA 1.495 1.779 0 O-C-N 121.407 -0.808 . . . . 0.0 110.268 179.872 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 88' ' ' ASP . . . . . . . . . . . . . 3.7 m-20 -60.05 -42.58 94.76 Favored 'General case' 0 N--CA 1.499 1.991 0 O-C-N 121.392 -0.818 . . . . 0.0 110.44 179.905 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 89' ' ' SER . . . . . 0.729 ' HA ' HG21 ' A' ' 4' ' ' ILE . 14.8 m . . . . . 0 N--CA 1.502 2.165 0 CA-C-O 118.11 -0.948 . . . . 0.0 110.8 179.916 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 144' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.498 1.958 0 CA-C-O 120.904 0.383 . . . . 0.0 110.596 . . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 145' ' ' ARG . . . . . 0.652 ' HG3' HG23 ' B' ' 146' ' ' VAL . 36.9 tpt85 -132.12 -63.27 0.81 Allowed 'General case' 0 N--CA 1.5 2.038 0 O-C-N 121.306 -0.871 . . . . 0.0 110.438 -179.91 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' B' B ' 146' ' ' VAL . . . . . 0.652 HG23 ' HG3' ' B' ' 145' ' ' ARG . 40.1 t -105.81 156.7 6.57 Favored 'Isoleucine or valine' 0 N--CA 1.5 2.026 0 O-C-N 121.376 -0.828 . . . . 0.0 110.352 -179.789 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' B' B ' 147' ' ' ARG . . . . . . . . . . . . . 0.3 OUTLIER -114.34 -79.16 0.58 Allowed 'General case' 0 N--CA 1.496 1.842 0 O-C-N 121.394 -0.816 . . . . 0.0 110.59 -179.985 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' B' B ' 148' ' ' ILE . . . . . 0.681 HG12 ' HE2' ' A' ' 45' ' ' MET . 1.1 mp 64.56 156.9 0.0 OUTLIER 'Isoleucine or valine' 0 N--CA 1.504 2.263 0 CA-C-O 121.435 0.636 . . . . 0.0 110.481 -179.479 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' B' B ' 149' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER -127.84 144.77 51.08 Favored 'General case' 0 N--CA 1.496 1.826 0 O-C-N 121.111 -0.993 . . . . 0.0 110.443 -179.824 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' B' B ' 150' ' ' ALA . . . . . . . . . . . . . . . -57.72 -45.57 85.58 Favored 'General case' 0 N--CA 1.499 1.993 0 O-C-N 121.577 -0.702 . . . . 0.0 110.742 -179.915 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 151' ' ' ASP . . . . . . . . . . . . . 6.9 p-10 -67.64 -37.53 82.57 Favored 'General case' 0 N--CA 1.499 2.007 0 O-C-N 121.511 -0.743 . . . . 0.0 110.414 179.703 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 152' ' ' ALA . . . . . . . . . . . . . . . -62.55 -47.56 83.33 Favored 'General case' 0 N--CA 1.498 1.945 0 O-C-N 121.345 -0.847 . . . . 0.0 109.875 179.367 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 153' ' ' MET . . . . . . . . . . . . . 5.1 mtt -66.16 -39.9 90.14 Favored 'General case' 0 N--CA 1.496 1.846 0 O-C-N 121.692 -0.63 . . . . 0.0 110.029 179.254 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 154' ' ' MET . . . . . 0.514 ' HE3' ' HB3' ' A' ' 19' ' ' GLU . 0.3 OUTLIER -63.01 -51.88 65.11 Favored 'General case' 0 N--CA 1.496 1.83 0 O-C-N 121.622 -0.674 . . . . 0.0 110.314 179.815 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' B' B ' 155' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -64.15 -40.95 97.24 Favored 'General case' 0 N--CA 1.497 1.909 0 O-C-N 121.367 -0.833 . . . . 0.0 110.196 179.377 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' B' B ' 156' ' ' ALA . . . . . . . . . . . . . . . -62.43 -37.76 87.08 Favored 'General case' 0 N--CA 1.499 1.993 0 O-C-N 121.349 -0.844 . . . . 0.0 110.514 179.526 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 157' ' ' LEU . . . . . 0.502 ' O ' HD13 ' A' ' 26' ' ' ILE . 0.3 OUTLIER -89.13 -1.71 58.21 Favored 'General case' 0 N--CA 1.5 2.03 0 O-C-N 121.205 -0.934 . . . . 0.0 111.284 179.722 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' B' B ' 158' ' ' LEU . . . . . . . . . . . . . 1.5 mt -83.69 -53.83 5.36 Favored 'General case' 0 N--CA 1.5 2.037 0 O-C-N 120.943 -1.098 . . . . 0.0 110.541 179.985 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 159' ' ' GLY . . . . . . . . . . . . . . . -168.46 50.05 0.23 Allowed Glycine 0 N--CA 1.498 2.769 0 N-CA-C 110.09 -1.204 . . . . 0.0 110.09 179.875 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 160' ' ' ALA . . . . . . . . . . . . . . . -108.43 -53.07 2.68 Favored 'General case' 0 N--CA 1.496 1.838 0 O-C-N 121.37 -1.077 . . . . 0.0 110.094 179.843 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 161' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -147.91 93.95 2.27 Favored 'General case' 0 N--CA 1.496 1.861 0 O-C-N 121.402 -0.811 . . . . 0.0 109.78 179.512 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' B' B ' 162' ' ' ALA . . . . . . . . . . . . . . . -74.11 170.01 16.37 Favored 'General case' 0 N--CA 1.498 1.974 0 O-C-N 121.259 -0.901 . . . . 0.0 110.488 -179.834 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 163' ' ' LYS . . . . . . . . . . . . . 0.4 OUTLIER . . . . . 0 N--CA 1.503 2.189 0 CA-C-O 117.636 -1.173 . . . . 0.0 110.643 -179.781 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 90' ' ' ' CA' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 003 nuclear nobuild full ' A' A ' 91' ' ' SXK . . . . . 0.594 ' HAK' HD21 ' A' ' 41' ' ' LEU . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 46.0 mtm . . . . . 0 N--CA 1.495 1.818 0 N-CA-C 110.003 -0.369 . . . . 0.0 110.003 . . . . . . . . . 0 0 . 1 . 004 nuclear nobuild full ' A' A ' 2' ' ' ASP . . . . . 0.459 ' CG ' ' HD2' ' A' ' 6' ' ' LYS . 5.7 t0 -134.75 149.64 50.47 Favored 'General case' 0 N--CA 1.495 1.787 0 O-C-N 121.451 -0.781 . . . . 0.0 110.654 -179.766 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 3' ' ' ASP . . . . . . . . . . . . . 27.4 t70 -156.09 -63.81 0.11 Allowed 'General case' 0 N--CA 1.495 1.817 0 O-C-N 121.588 -0.695 . . . . 0.0 109.776 179.712 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 4' ' ' ILE . . . . . 0.465 ' CG2' ' HB2' ' A' ' 88' ' ' ASP . 16.7 mt -77.48 -40.5 28.66 Favored 'Isoleucine or valine' 0 N--CA 1.497 1.889 0 O-C-N 121.464 -0.772 . . . . 0.0 110.595 179.902 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 5' ' ' TYR . . . . . 0.434 ' CE1' ' HD3' ' A' ' 83' ' ' ARG . 72.2 m-85 -59.05 -42.97 91.59 Favored 'General case' 0 N--CA 1.5 2.062 0 O-C-N 121.428 -0.795 . . . . 0.0 110.148 -179.919 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 6' ' ' LYS . . . . . 0.459 ' HD2' ' CG ' ' A' ' 2' ' ' ASP . 0.0 OUTLIER -62.52 -41.22 98.71 Favored 'General case' 0 N--CA 1.497 1.921 0 O-C-N 121.363 -0.836 . . . . 0.0 108.995 178.586 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 7' ' ' ALA . . . . . . . . . . . . . . . -63.6 -38.19 90.19 Favored 'General case' 0 N--CA 1.496 1.838 0 O-C-N 121.562 -0.711 . . . . 0.0 109.94 178.752 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 8' ' ' ALA . . . . . . . . . . . . . . . -58.67 -35.08 72.02 Favored 'General case' 0 N--CA 1.499 1.993 0 O-C-N 121.405 -0.809 . . . . 0.0 109.887 179.193 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 9' ' ' VAL . . . . . 0.58 ' HA ' HD12 ' A' ' 12' ' ' LEU . 40.9 t -61.27 -41.59 90.26 Favored 'Isoleucine or valine' 0 N--CA 1.498 1.946 0 O-C-N 121.495 -0.753 . . . . 0.0 109.493 178.908 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 10' ' ' GLU . . . . . . . . . . . . . 10.1 mt-10 -69.37 -26.91 64.9 Favored 'General case' 0 N--CA 1.498 1.972 0 O-C-N 121.55 -0.719 . . . . 0.0 110.224 179.082 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 11' ' ' GLN . . . . . . . . . . . . . 8.9 mt-30 -73.55 -36.2 65.6 Favored 'General case' 0 N--CA 1.499 2.013 0 O-C-N 121.403 -0.811 . . . . 0.0 110.694 179.91 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 12' ' ' LEU . . . . . 0.58 HD12 ' HA ' ' A' ' 9' ' ' VAL . 18.9 mt -58.5 136.75 57.61 Favored 'General case' 0 N--CA 1.496 1.87 0 O-C-N 121.51 -0.744 . . . . 0.0 110.619 -179.673 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 13' ' ' THR . . . . . . . . . . . . . 82.7 p -81.65 171.98 13.97 Favored 'General case' 0 N--CA 1.499 1.977 0 O-C-N 121.348 -0.845 . . . . 0.0 110.359 179.971 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 14' ' ' GLU . . . . . . . . . . . . . 1.0 OUTLIER -57.27 -34.34 68.54 Favored 'General case' 0 N--CA 1.491 1.583 0 O-C-N 121.511 -0.743 . . . . 0.0 109.981 179.84 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 1.4 mp0 -57.7 -55.48 34.32 Favored 'General case' 0 N--CA 1.497 1.885 0 O-C-N 121.652 -0.655 . . . . 0.0 109.745 179.273 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 16' ' ' GLN . . . . . 0.471 ' HA ' ' HB2' ' A' ' 19' ' ' GLU . 1.7 mt-30 -65.6 -37.77 87.57 Favored 'General case' 0 N--CA 1.498 1.967 0 O-C-N 121.494 -0.754 . . . . 0.0 110.178 179.345 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 17' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -58.91 -49.14 78.9 Favored 'General case' 0 N--CA 1.496 1.872 0 N-CA-C 109.333 -0.618 . . . . 0.0 109.333 179.009 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 18' ' ' ASN . . . . . . . . . . . . . 2.1 t30 -71.05 -34.37 71.19 Favored 'General case' 0 N--CA 1.494 1.762 0 O-C-N 121.62 -0.675 . . . . 0.0 109.449 178.861 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 19' ' ' GLU . . . . . 0.471 ' HB2' ' HA ' ' A' ' 16' ' ' GLN . 7.7 mt-10 -56.63 -48.03 78.4 Favored 'General case' 0 N--CA 1.5 2.062 0 O-C-N 121.567 -0.708 . . . . 0.0 110.064 178.991 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 20' ' ' PHE . . . . . . . . . . . . . 18.4 m-85 -66.8 -38.24 86.11 Favored 'General case' 0 N--CA 1.498 1.937 0 O-C-N 121.537 -0.727 . . . . 0.0 110.211 179.586 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 21' ' ' LYS . . . . . . . . . . . . . 14.2 tptt -56.7 -53.04 62.32 Favored 'General case' 0 N--CA 1.5 2.074 0 O-C-N 121.455 -0.778 . . . . 0.0 109.895 179.522 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 22' ' ' ALA . . . . . . . . . . . . . . . -60.1 -45.95 91.22 Favored 'General case' 0 N--CA 1.499 1.989 0 O-C-N 121.518 -0.739 . . . . 0.0 110.046 179.513 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 23' ' ' ALA . . . . . . . . . . . . . . . -61.73 -37.56 84.67 Favored 'General case' 0 N--CA 1.496 1.871 0 O-C-N 121.583 -0.698 . . . . 0.0 109.867 179.131 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 24' ' ' PHE . . . . . 0.529 ' O ' HG12 ' A' ' 28' ' ' VAL . 25.6 t80 -62.72 -45.39 92.96 Favored 'General case' 0 N--CA 1.495 1.823 0 O-C-N 121.565 -0.709 . . . . 0.0 109.971 179.328 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 25' ' ' ASP . . . . . . . . . . . . . 18.7 m-20 -56.37 -43.75 79.47 Favored 'General case' 0 N--CA 1.498 1.962 0 O-C-N 121.562 -0.711 . . . . 0.0 109.973 179.468 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 26' ' ' ILE . . . . . . . . . . . . . 41.0 mt -71.68 -32.24 44.68 Favored 'Isoleucine or valine' 0 N--CA 1.498 1.974 0 O-C-N 121.523 -0.736 . . . . 0.0 109.825 179.14 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 27' ' ' PHE . . . . . 0.758 ' HE2' HD11 ' B' ' 157' ' ' LEU . 0.2 OUTLIER -63.11 -43.56 98.11 Favored 'General case' 0 N--CA 1.498 1.947 0 O-C-N 121.511 -0.743 . . . . 0.0 110.421 179.727 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 28' ' ' VAL . . . . . 0.761 HG23 ' HB2' ' A' ' 31' ' ' ALA . 5.7 p -110.02 63.6 0.17 Allowed 'Isoleucine or valine' 0 N--CA 1.498 1.951 0 O-C-N 121.283 -0.885 . . . . 0.0 110.952 -179.956 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 29' ' ' LEU . . . . . . . . . . . . . 28.0 mt -80.0 77.17 6.7 Favored 'General case' 0 N--CA 1.499 2.007 0 N-CA-C 107.618 -1.253 . . . . 0.0 107.618 177.87 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 30' ' ' GLY . . . . . . . . . . . . . . . 97.48 -55.43 1.23 Allowed Glycine 0 N--CA 1.491 2.337 0 N-CA-C 107.185 -2.366 . . . . 0.0 107.185 -176.963 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 31' ' ' ALA . . . . . 0.761 ' HB2' HG23 ' A' ' 28' ' ' VAL . . . 52.98 -168.69 0.05 OUTLIER 'General case' 0 N--CA 1.5 2.043 0 CA-C-O 121.556 0.693 . . . . 0.0 111.946 178.367 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 32' ' ' GLU . . . . . . . . . . . . . 2.2 mt-10 -104.76 -50.12 3.36 Favored 'General case' 0 N--CA 1.493 1.689 0 O-C-N 121.528 -0.732 . . . . 0.0 110.405 -179.724 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 9.2 m-20 -104.64 -1.92 25.73 Favored 'General case' 0 N--CA 1.499 1.981 0 O-C-N 121.507 -0.745 . . . . 0.0 111.483 -179.382 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 34' ' ' GLY . . . . . 0.662 ' O ' HG21 ' A' ' 28' ' ' VAL . . . 108.46 -23.58 24.25 Favored Glycine 0 N--CA 1.497 2.705 0 N-CA-C 109.681 -1.367 . . . . 0.0 109.681 -179.391 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 35' ' ' CYS . . . . . . . . . . . . . 1.2 m -110.33 -167.61 1.21 Allowed 'General case' 0 N--CA 1.495 1.786 0 O-C-N 121.477 -1.014 . . . . 0.0 109.464 179.32 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 36' ' ' ILE . . . . . 0.456 ' HB ' ' HB ' ' A' ' 72' ' ' VAL . 2.5 mp -91.84 98.87 8.87 Favored 'Isoleucine or valine' 0 N--CA 1.495 1.795 0 O-C-N 121.023 -1.048 . . . . 0.0 110.168 179.823 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 37' ' ' SER . . . . . . . . . . . . . 10.1 p -94.0 -165.75 1.38 Allowed 'General case' 0 N--CA 1.498 1.935 0 O-C-N 121.396 -0.815 . . . . 0.0 110.132 179.776 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 38' ' ' THR . . . . . . . . . . . . . 17.7 p -58.93 -39.28 81.12 Favored 'General case' 0 N--CA 1.502 2.138 0 O-C-N 121.284 -0.885 . . . . 0.0 110.527 179.727 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 39' ' ' LYS . . . . . . . . . . . . . 32.7 mttt -67.62 -45.82 74.29 Favored 'General case' 0 N--CA 1.499 1.975 0 O-C-N 121.43 -0.794 . . . . 0.0 110.071 179.567 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 2.4 mp0 -65.21 -40.35 94.04 Favored 'General case' 0 N--CA 1.502 2.129 0 O-C-N 121.383 -0.823 . . . . 0.0 109.93 179.408 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 41' ' ' LEU . . . . . 0.846 HD21 ' HAK' ' A' ' 91' ' ' SXK . 0.1 OUTLIER -67.68 -59.27 3.46 Favored 'General case' 0 N--CA 1.496 1.843 0 O-C-N 121.556 -0.715 . . . . 0.0 109.645 179.343 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 42' ' ' GLY . . . . . 0.56 ' HA2' ' HB2' ' A' ' 45' ' ' MET . . . -49.53 -33.48 17.79 Favored Glycine 0 N--CA 1.498 2.819 0 N-CA-C 110.527 -1.029 . . . . 0.0 110.527 179.661 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 43' ' ' LYS . . . . . . . . . . . . . 16.0 ttpt -55.12 -37.39 66.84 Favored 'General case' 0 N--CA 1.502 2.142 0 O-C-N 121.294 -1.121 . . . . 0.0 110.514 179.464 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 44' ' ' VAL . . . . . . . . . . . . . 42.6 t -90.81 -29.92 4.87 Favored 'Isoleucine or valine' 0 N--CA 1.497 1.912 0 O-C-N 121.277 -0.889 . . . . 0.0 109.815 179.165 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 45' ' ' MET . . . . . 0.56 ' HB2' ' HA2' ' A' ' 42' ' ' GLY . 5.4 mmt -57.57 -43.97 84.93 Favored 'General case' 0 N--CA 1.499 2.015 0 O-C-N 121.499 -0.75 . . . . 0.0 111.111 -179.949 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 46' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -53.3 -16.93 1.48 Allowed 'General case' 0 N--CA 1.504 2.261 0 O-C-N 121.35 -0.844 . . . . 0.0 112.298 -179.423 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 47' ' ' MET . . . . . . . . . . . . . 42.7 mtt -82.66 -30.39 29.33 Favored 'General case' 0 N--CA 1.499 2.022 0 O-C-N 120.833 -1.167 . . . . 0.0 111.072 179.717 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 48' ' ' LEU . . . . . . . . . . . . . 5.5 tp -143.43 -48.02 0.3 Allowed 'General case' 0 N--CA 1.495 1.786 0 O-C-N 121.134 -0.979 . . . . 0.0 111.453 -179.177 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 49' ' ' GLY . . . . . 0.534 ' HA3' HD11 ' B' ' 148' ' ' ILE . . . -95.11 102.48 2.86 Favored Glycine 0 N--CA 1.494 2.541 0 N-CA-C 110.09 -1.204 . . . . 0.0 110.09 -179.31 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 50' ' ' GLN . . . . . 0.591 ' HG2' ' HA ' ' B' ' 145' ' ' ARG . 0.9 OUTLIER -46.19 143.48 2.36 Favored 'General case' 0 N--CA 1.502 2.165 0 O-C-N 121.768 -0.842 . . . . 0.0 111.756 -179.941 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 51' ' ' ASN . . . . . . . . . . . . . 1.6 p-10 -130.59 92.69 34.14 Favored Pre-proline 0 N--CA 1.499 2.005 0 O-C-N 121.51 -0.744 . . . . 0.0 109.686 179.463 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 52' ' ' PRO . . . . . . . . . . . . . 43.6 Cg_endo -70.1 -38.67 6.75 Favored 'Trans proline' 0 N--CA 1.491 1.368 0 O-C-N 123.762 1.401 . . . . 0.0 111.4 -179.385 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 53' ' ' THR . . . . . 0.479 HG23 ' HB2' ' A' ' 56' ' ' GLU . 0.0 OUTLIER -145.16 153.54 52.99 Favored Pre-proline 0 N--CA 1.498 1.946 0 O-C-N 121.21 -0.931 . . . . 0.0 110.429 -179.862 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 54' ' ' PRO . . . . . . . . . . . . . 42.9 Cg_endo -68.59 -32.76 23.76 Favored 'Trans proline' 0 C--N 1.313 -1.332 0 O-C-N 124.126 1.593 . . . . 0.0 110.46 179.665 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 55' ' ' GLU . . . . . 0.449 ' HA ' ' HB2' ' A' ' 58' ' ' GLN . 33.7 mm-40 -61.26 -33.75 74.04 Favored 'General case' 0 N--CA 1.497 1.924 0 O-C-N 121.575 -0.703 . . . . 0.0 110.282 179.462 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 56' ' ' GLU . . . . . 0.479 ' HB2' HG23 ' A' ' 53' ' ' THR . 20.4 tt0 -57.06 -44.17 82.79 Favored 'General case' 0 N--CA 1.498 1.933 0 O-C-N 121.508 -0.745 . . . . 0.0 109.592 179.113 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 57' ' ' LEU . . . . . 0.546 ' H ' HD22 ' A' ' 57' ' ' LEU . 0.8 OUTLIER -77.1 -31.35 55.85 Favored 'General case' 0 N--CA 1.495 1.789 0 O-C-N 121.51 -0.744 . . . . 0.0 109.753 178.954 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 58' ' ' GLN . . . . . 0.449 ' HB2' ' HA ' ' A' ' 55' ' ' GLU . 0.0 OUTLIER -54.47 -49.94 68.92 Favored 'General case' 0 N--CA 1.496 1.842 0 O-C-N 121.341 -0.849 . . . . 0.0 109.014 179.076 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 59' ' ' GLU . . . . . . . . . . . . . 4.2 mt-10 -65.53 -34.69 78.86 Favored 'General case' 0 N--CA 1.496 1.872 0 O-C-N 121.712 -0.617 . . . . 0.0 109.432 178.16 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 60' ' ' MET . . . . . 0.456 ' HB2' ' O ' ' A' ' 57' ' ' LEU . 2.1 mmm -59.99 -47.05 87.43 Favored 'General case' 0 N--CA 1.498 1.931 0 O-C-N 121.649 -0.657 . . . . 0.0 110.071 179.449 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 61' ' ' ILE . . . . . 0.473 HG12 HG23 ' A' ' 72' ' ' VAL . 59.5 mt -72.79 -42.15 61.48 Favored 'Isoleucine or valine' 0 N--CA 1.498 1.962 0 O-C-N 121.332 -0.855 . . . . 0.0 110.046 179.437 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 62' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -57.58 -31.27 66.01 Favored 'General case' 0 N--CA 1.501 2.079 0 O-C-N 121.299 -0.876 . . . . 0.0 110.219 179.174 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 63' ' ' GLU . . . . . . . . . . . . . 1.3 tt0 -66.16 -33.03 74.85 Favored 'General case' 0 N--CA 1.496 1.841 0 O-C-N 121.183 -0.948 . . . . 0.0 109.471 178.697 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 64' ' ' VAL . . . . . 0.573 HG22 ' NH2' ' A' ' 83' ' ' ARG . 51.4 t -84.14 -37.01 12.59 Favored 'Isoleucine or valine' 0 N--CA 1.495 1.784 0 O-C-N 121.571 -0.706 . . . . 0.0 110.471 179.418 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 65' ' ' ASP . . . . . . . . . . . . . 0.0 OUTLIER -128.2 146.16 50.81 Favored 'General case' 0 N--CA 1.496 1.848 0 O-C-N 121.155 -0.966 . . . . 0.0 111.93 -179.39 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 66' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -139.79 46.29 1.88 Allowed 'General case' 0 N--CA 1.491 1.597 0 N-CA-C 108.301 -1.0 . . . . 0.0 108.301 178.331 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 67' ' ' ASP . . . . . . . . . . . . . 0.9 OUTLIER -104.59 43.8 1.07 Allowed 'General case' 0 N--CA 1.498 1.93 0 O-C-N 121.702 -0.624 . . . . 0.0 111.118 -178.844 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 68' ' ' GLY . . . . . . . . . . . . . . . 56.83 43.61 92.22 Favored Glycine 0 N--CA 1.499 2.895 0 N-CA-C 110.415 -1.074 . . . . 0.0 110.415 179.26 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 69' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -146.44 -52.2 0.23 Allowed 'General case' 0 N--CA 1.496 1.826 0 O-C-N 121.338 -1.096 . . . . 0.0 110.359 179.968 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 70' ' ' GLY . . . . . . . . . . . . . . . 69.31 23.91 76.2 Favored Glycine 0 N--CA 1.497 2.707 0 N-CA-C 109.95 -1.26 . . . . 0.0 109.95 -179.807 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 71' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -123.86 138.65 54.46 Favored 'General case' 0 N--CA 1.499 1.994 0 O-C-N 121.42 -1.047 . . . . 0.0 109.107 179.755 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 72' ' ' VAL . . . . . 0.473 HG23 HG12 ' A' ' 61' ' ' ILE . 26.1 t -76.17 126.67 37.11 Favored 'Isoleucine or valine' 0 N--CA 1.499 1.991 0 O-C-N 121.422 -0.798 . . . . 0.0 111.527 -178.985 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 73' ' ' ASP . . . . . 0.422 ' O ' ' HB2' ' A' ' 77' ' ' PHE . 0.2 OUTLIER -110.47 -168.0 1.26 Allowed 'General case' 0 N--CA 1.496 1.835 0 O-C-N 121.471 -0.768 . . . . 0.0 109.042 178.369 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 74' ' ' PHE . . . . . . . . . . . . . 25.8 t80 -66.66 -45.81 77.74 Favored 'General case' 0 N--CA 1.501 2.094 0 O-C-N 120.825 -1.172 . . . . 0.0 110.857 -179.83 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 75' ' ' ASP . . . . . . . . . . . . . 24.8 t70 -60.46 -53.95 51.37 Favored 'General case' 0 N--CA 1.5 2.039 0 O-C-N 121.405 -0.809 . . . . 0.0 110.482 179.867 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 76' ' ' GLU . . . . . . . . . . . . . 25.0 mt-10 -59.67 -40.66 88.51 Favored 'General case' 0 N--CA 1.499 1.99 0 O-C-N 121.484 -0.76 . . . . 0.0 110.252 179.572 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 77' ' ' PHE . . . . . 0.445 ' O ' ' HG2' ' A' ' 81' ' ' MET . 38.3 t80 -60.86 -41.37 95.75 Favored 'General case' 0 N--CA 1.496 1.853 0 O-C-N 121.472 -0.768 . . . . 0.0 110.317 179.718 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 78' ' ' LEU . . . . . 0.424 HD23 ' HA ' ' A' ' 78' ' ' LEU . 38.1 mt -60.28 -49.59 76.99 Favored 'General case' 0 N--CA 1.497 1.892 0 O-C-N 121.338 -0.851 . . . . 0.0 110.749 -179.849 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 79' ' ' VAL . . . . . 0.43 ' O ' ' HG3' ' A' ' 83' ' ' ARG . 3.5 m -73.45 -32.42 36.68 Favored 'Isoleucine or valine' 0 N--CA 1.501 2.092 0 O-C-N 121.119 -0.988 . . . . 0.0 109.782 179.626 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 80' ' ' MET . . . . . . . . . . . . . 9.6 ttt -59.03 -49.52 77.57 Favored 'General case' 0 N--CA 1.498 1.944 0 O-C-N 121.372 -0.83 . . . . 0.0 109.616 179.215 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 81' ' ' MET . . . . . 0.445 ' HG2' ' O ' ' A' ' 77' ' ' PHE . 83.8 mmm -62.64 -33.88 75.93 Favored 'General case' 0 N--CA 1.493 1.681 0 O-C-N 121.57 -0.706 . . . . 0.0 109.512 178.88 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 82' ' ' VAL . . . . . . . . . . . . . 3.2 t -66.34 -36.78 78.19 Favored 'Isoleucine or valine' 0 N--CA 1.497 1.893 0 O-C-N 121.6 -0.687 . . . . 0.0 109.985 179.13 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 83' ' ' ARG . . . . . 0.573 ' NH2' HG22 ' A' ' 64' ' ' VAL . 9.7 mtm180 -58.75 -39.5 81.12 Favored 'General case' 0 N--CA 1.502 2.136 0 O-C-N 121.431 -0.793 . . . . 0.0 110.328 179.511 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 84' ' ' CYS . . . . . . . . . . . . . 25.8 m -92.52 -15.88 26.46 Favored 'General case' 0 N--CA 1.499 1.992 0 O-C-N 121.367 -0.833 . . . . 0.0 111.118 179.71 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 85' ' ' MET . . . . . . . . . . . . . 30.7 ttp -95.23 -63.34 1.17 Allowed 'General case' 0 N--CA 1.498 1.957 0 O-C-N 121.196 -0.94 . . . . 0.0 110.405 -179.866 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 86' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -158.91 96.73 1.37 Allowed 'General case' 0 N--CA 1.496 1.845 0 O-C-N 121.125 -0.985 . . . . 0.0 110.755 179.99 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 87' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER -99.86 179.7 4.44 Favored 'General case' 0 N--CA 1.495 1.784 0 O-C-N 121.477 -0.765 . . . . 0.0 109.798 179.223 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 88' ' ' ASP . . . . . 0.465 ' HB2' ' CG2' ' A' ' 4' ' ' ILE . 12.5 m-20 -121.3 120.92 36.51 Favored 'General case' 0 N--CA 1.496 1.836 0 O-C-N 121.189 -0.944 . . . . 0.0 110.516 -179.682 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 89' ' ' SER . . . . . . . . . . . . . 27.0 m . . . . . 0 N--CA 1.502 2.16 0 CA-C-O 118.441 -0.79 . . . . 0.0 110.912 179.846 . . . . . . . . 0 0 . 1 . 004 nuclear nobuild full ' B' B ' 144' ' ' ARG . . . . . . . . . . . . . 0.2 OUTLIER . . . . . 0 N--CA 1.497 1.897 0 CA-C-O 120.799 0.333 . . . . 0.0 110.742 . . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 145' ' ' ARG . . . . . 0.591 ' HA ' ' HG2' ' A' ' 50' ' ' GLN . 2.1 mmp_? -115.23 -150.18 0.46 Allowed 'General case' 0 N--CA 1.497 1.883 0 O-C-N 121.391 -0.818 . . . . 0.0 110.122 -179.79 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' B' B ' 146' ' ' VAL . . . . . . . . . . . . . 4.8 p -93.96 31.15 0.21 Allowed 'Isoleucine or valine' 0 N--CA 1.501 2.08 0 O-C-N 120.964 -1.085 . . . . 0.0 111.695 -179.274 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 147' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -96.89 86.03 3.92 Favored 'General case' 0 N--CA 1.497 1.885 0 O-C-N 120.783 -1.198 . . . . 0.0 109.84 179.264 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' B' B ' 148' ' ' ILE . . . . . 0.551 HD13 ' HAH' ' A' ' 91' ' ' SXK . 2.5 mp -92.79 119.76 40.99 Favored 'Isoleucine or valine' 0 N--CA 1.497 1.883 0 O-C-N 121.316 -0.865 . . . . 0.0 110.243 -179.683 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' B' B ' 149' ' ' SER . . . . . 0.463 ' HB3' ' HB3' ' B' ' 152' ' ' ALA . 13.3 t -100.28 149.89 23.13 Favored 'General case' 0 N--CA 1.497 1.881 0 O-C-N 121.521 -0.737 . . . . 0.0 110.103 179.551 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' B' B ' 150' ' ' ALA . . . . . . . . . . . . . . . -59.03 -40.13 84.07 Favored 'General case' 0 N--CA 1.499 2.017 0 O-C-N 121.442 -0.786 . . . . 0.0 110.721 179.926 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 151' ' ' ASP . . . . . . . . . . . . . 16.9 t70 -75.76 -49.33 18.49 Favored 'General case' 0 N--CA 1.497 1.88 0 O-C-N 121.318 -0.864 . . . . 0.0 110.256 179.648 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 152' ' ' ALA . . . . . 0.463 ' HB3' ' HB3' ' B' ' 149' ' ' SER . . . -58.58 -44.91 89.95 Favored 'General case' 0 N--CA 1.498 1.966 0 O-C-N 121.502 -0.749 . . . . 0.0 110.57 179.896 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' B' B ' 153' ' ' MET . . . . . 0.516 ' SD ' HG23 ' B' ' 148' ' ' ILE . 0.2 OUTLIER -65.83 -37.95 87.59 Favored 'General case' 0 N--CA 1.498 1.97 0 O-C-N 121.299 -0.876 . . . . 0.0 109.789 179.312 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' B' B ' 154' ' ' MET . . . . . . . . . . . . . 19.9 mmm -61.86 -42.27 98.85 Favored 'General case' 0 N--CA 1.497 1.915 0 O-C-N 121.454 -0.779 . . . . 0.0 109.635 178.862 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 155' ' ' GLN . . . . . . . . . . . . . 18.2 tt0 -67.02 -35.72 80.52 Favored 'General case' 0 N--CA 1.497 1.91 0 O-C-N 121.546 -0.721 . . . . 0.0 109.998 178.979 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 156' ' ' ALA . . . . . 0.425 ' HA ' ' HB2' ' B' ' 160' ' ' ALA . . . -67.72 -42.41 82.0 Favored 'General case' 0 N--CA 1.496 1.835 0 O-C-N 121.496 -0.753 . . . . 0.0 110.121 179.538 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' B' B ' 157' ' ' LEU . . . . . 0.758 HD11 ' HE2' ' A' ' 27' ' ' PHE . 2.4 mt -57.43 -33.76 68.25 Favored 'General case' 0 N--CA 1.499 1.981 0 O-C-N 121.615 -0.678 . . . . 0.0 111.031 179.705 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' B' B ' 158' ' ' LEU . . . . . . . . . . . . . 0.8 OUTLIER -127.45 58.92 1.45 Allowed 'General case' 0 N--CA 1.495 1.824 0 O-C-N 121.377 -0.827 . . . . 0.0 110.793 -179.592 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' B' B ' 159' ' ' GLY . . . . . . . . . . . . . . . 173.59 -52.93 0.15 Allowed Glycine 0 N--CA 1.498 2.786 0 C-N-CA 119.812 -1.185 . . . . 0.0 110.748 179.655 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 160' ' ' ALA . . . . . 0.425 ' HB2' ' HA ' ' B' ' 156' ' ' ALA . . . -59.59 -54.31 47.98 Favored 'General case' 0 N--CA 1.502 2.144 0 O-C-N 121.398 -1.06 . . . . 0.0 110.868 -179.394 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' B' B ' 161' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -135.59 39.5 2.83 Favored 'General case' 0 N--CA 1.495 1.797 0 O-C-N 121.356 -0.84 . . . . 0.0 110.147 -179.895 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' B' B ' 162' ' ' ALA . . . . . . . . . . . . . . . -156.23 96.94 1.74 Allowed 'General case' 0 N--CA 1.496 1.849 0 O-C-N 121.323 -0.861 . . . . 0.0 110.248 -179.873 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 163' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.497 1.91 0 CA-C-O 117.838 -1.077 . . . . 0.0 110.798 179.924 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 90' ' ' ' CA' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 004 nuclear nobuild full ' A' A ' 91' ' ' SXK . . . . . 0.846 ' HAK' HD21 ' A' ' 41' ' ' LEU . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.495 1.823 0 CA-C-O 120.586 0.232 . . . . 0.0 110.401 . . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 2' ' ' ASP . . . . . . . . . . . . . 23.8 t70 58.99 -82.17 0.02 OUTLIER 'General case' 0 N--CA 1.505 2.295 0 O-C-N 121.992 -0.443 . . . . 0.0 111.631 179.668 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 3' ' ' ASP . . . . . 0.403 ' HA ' ' HB2' ' A' ' 6' ' ' LYS . 8.8 m-20 -57.03 -32.55 66.29 Favored 'General case' 0 N--CA 1.499 2.022 0 O-C-N 121.273 -0.892 . . . . 0.0 111.218 -179.489 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 4' ' ' ILE . . . . . 0.436 HG23 ' N ' ' A' ' 5' ' ' TYR . 6.1 tp -56.21 -41.79 71.18 Favored 'Isoleucine or valine' 0 N--CA 1.499 2.008 0 O-C-N 121.291 -0.88 . . . . 0.0 110.516 -179.89 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 5' ' ' TYR . . . . . 0.536 ' O ' HG23 ' A' ' 9' ' ' VAL . 42.1 m-85 -83.82 -32.15 25.47 Favored 'General case' 0 N--CA 1.496 1.868 0 O-C-N 121.33 -0.856 . . . . 0.0 109.289 178.596 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 6' ' ' LYS . . . . . 0.403 ' HB2' ' HA ' ' A' ' 3' ' ' ASP . 3.4 ttmt -59.73 -45.73 91.3 Favored 'General case' 0 N--CA 1.499 2.001 0 O-C-N 121.716 -0.615 . . . . 0.0 110.382 179.548 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 7' ' ' ALA . . . . . . . . . . . . . . . -54.25 -42.75 70.28 Favored 'General case' 0 N--CA 1.498 1.949 0 O-C-N 121.666 -0.646 . . . . 0.0 110.113 179.695 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 8' ' ' ALA . . . . . . . . . . . . . . . -66.32 -39.74 89.46 Favored 'General case' 0 N--CA 1.497 1.887 0 O-C-N 121.552 -0.717 . . . . 0.0 110.358 179.374 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 9' ' ' VAL . . . . . 0.672 HG21 HG22 ' A' ' 79' ' ' VAL . 97.7 t -60.89 -41.52 89.13 Favored 'Isoleucine or valine' 0 N--CA 1.502 2.165 0 O-C-N 121.474 -0.766 . . . . 0.0 110.447 179.834 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 10' ' ' GLU . . . . . . . . . . . . . 17.9 mt-10 -79.86 -44.13 21.04 Favored 'General case' 0 N--CA 1.495 1.808 0 O-C-N 121.495 -0.753 . . . . 0.0 111.02 -179.641 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 11' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -89.64 39.15 0.94 Allowed 'General case' 0 N--CA 1.499 1.996 0 O-C-N 121.289 -0.882 . . . . 0.0 111.49 -179.532 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 12' ' ' LEU . . . . . 0.54 ' HB3' ' HD3' ' A' ' 17' ' ' LYS . 0.8 OUTLIER -78.65 138.71 38.44 Favored 'General case' 0 N--CA 1.497 1.899 0 O-C-N 120.916 -1.115 . . . . 0.0 109.783 179.165 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 13' ' ' THR . . . . . 0.409 HG23 ' H ' ' A' ' 16' ' ' GLN . 14.9 t -69.66 164.15 24.02 Favored 'General case' 0 N--CA 1.501 2.079 0 O-C-N 121.264 -0.897 . . . . 0.0 111.396 -179.567 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 14' ' ' GLU . . . . . . . . . . . . . 17.7 tt0 -62.35 -35.89 80.52 Favored 'General case' 0 N--CA 1.495 1.8 0 O-C-N 121.844 -0.535 . . . . 0.0 110.897 -179.422 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 1.3 mp0 -56.89 -41.71 78.55 Favored 'General case' 0 N--CA 1.499 2.024 0 O-C-N 121.415 -0.803 . . . . 0.0 110.776 -179.838 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 16' ' ' GLN . . . . . 0.409 ' H ' HG23 ' A' ' 13' ' ' THR . 81.0 mt-30 -86.35 -44.94 11.67 Favored 'General case' 0 N--CA 1.497 1.907 0 O-C-N 121.333 -0.854 . . . . 0.0 110.796 -179.946 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 17' ' ' LYS . . . . . 0.54 ' HD3' ' HB3' ' A' ' 12' ' ' LEU . 0.2 OUTLIER -59.78 -47.21 86.58 Favored 'General case' 0 N--CA 1.5 2.031 0 O-C-N 121.81 -0.556 . . . . 0.0 110.611 -179.889 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 18' ' ' ASN . . . . . 0.626 ' HA ' ' HG2' ' A' ' 21' ' ' LYS . 32.5 t30 -67.72 -29.49 68.74 Favored 'General case' 0 N--CA 1.495 1.799 0 O-C-N 121.461 -0.775 . . . . 0.0 110.447 179.593 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 12.7 tt0 -73.65 -43.43 59.5 Favored 'General case' 0 N--CA 1.492 1.669 0 O-C-N 121.237 -0.915 . . . . 0.0 109.876 179.444 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 20' ' ' PHE . . . . . . . . . . . . . 16.9 m-85 -73.59 -35.74 65.44 Favored 'General case' 0 N--CA 1.498 1.925 0 O-C-N 121.354 -0.841 . . . . 0.0 110.784 179.869 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 21' ' ' LYS . . . . . 0.626 ' HG2' ' HA ' ' A' ' 18' ' ' ASN . 0.0 OUTLIER -64.13 -30.86 71.9 Favored 'General case' 0 N--CA 1.496 1.868 0 O-C-N 121.14 -0.975 . . . . 0.0 110.207 179.546 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 22' ' ' ALA . . . . . 0.515 ' N ' ' HG3' ' A' ' 21' ' ' LYS . . . -77.15 -31.69 55.76 Favored 'General case' 0 N--CA 1.5 2.034 0 O-C-N 121.401 -0.812 . . . . 0.0 109.603 178.701 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 23' ' ' ALA . . . . . . . . . . . . . . . -85.73 -8.69 58.01 Favored 'General case' 0 N--CA 1.494 1.773 0 O-C-N 121.416 -0.803 . . . . 0.0 110.328 178.96 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 24' ' ' PHE . . . . . . . . . . . . . 73.1 t80 -88.07 -52.05 5.46 Favored 'General case' 0 N--CA 1.494 1.773 0 O-C-N 121.179 -0.951 . . . . 0.0 110.382 -179.823 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 25' ' ' ASP . . . . . . . . . . . . . 3.1 p-10 -60.71 -36.18 78.16 Favored 'General case' 0 N--CA 1.501 2.077 0 O-C-N 121.26 -0.9 . . . . 0.0 110.348 179.85 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 26' ' ' ILE . . . . . 0.568 HD13 ' CB ' ' B' ' 162' ' ' ALA . 81.9 mt -70.1 -34.55 59.77 Favored 'Isoleucine or valine' 0 N--CA 1.5 2.039 0 O-C-N 121.063 -1.023 . . . . 0.0 109.34 178.669 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 27' ' ' PHE . . . . . . . . . . . . . 0.3 OUTLIER -62.09 -43.86 97.91 Favored 'General case' 0 N--CA 1.497 1.888 0 O-C-N 121.463 -0.773 . . . . 0.0 110.248 179.244 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 28' ' ' VAL . . . . . . . . . . . . . 32.6 m -84.9 43.67 0.06 OUTLIER 'Isoleucine or valine' 0 N--CA 1.5 2.051 0 O-C-N 121.503 -0.748 . . . . 0.0 111.443 -179.675 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 29' ' ' LEU . . . . . 0.458 HD12 ' O ' ' A' ' 26' ' ' ILE . 0.1 OUTLIER -63.11 -55.12 27.98 Favored 'General case' 0 N--CA 1.499 2.02 0 O-C-N 121.019 -1.05 . . . . 0.0 109.718 179.161 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 30' ' ' GLY . . . . . . . . . . . . . . . -103.1 52.89 0.77 Allowed Glycine 0 N--CA 1.497 2.721 0 N-CA-C 108.601 -1.8 . . . . 0.0 108.601 178.787 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 31' ' ' ALA . . . . . 0.528 ' O ' ' HB2' ' A' ' 32' ' ' GLU . . . -102.93 -23.49 13.73 Favored 'General case' 0 N--CA 1.496 1.847 0 O-C-N 121.632 -0.922 . . . . 0.0 111.172 -179.269 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 32' ' ' GLU . . . . . 0.528 ' HB2' ' O ' ' A' ' 31' ' ' ALA . 1.5 mp0 65.84 -68.22 0.13 Allowed 'General case' 0 N--CA 1.505 2.301 0 O-C-N 121.848 -0.533 . . . . 0.0 110.891 -179.674 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 1.6 m-20 -62.16 -38.74 90.16 Favored 'General case' 0 N--CA 1.497 1.922 0 O-C-N 121.264 -0.897 . . . . 0.0 110.553 179.723 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 34' ' ' GLY . . . . . . . . . . . . . . . 118.45 -24.58 8.53 Favored Glycine 0 N--CA 1.496 2.693 0 N-CA-C 110.391 -1.084 . . . . 0.0 110.391 179.858 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 35' ' ' CYS . . . . . 0.413 ' HB3' ' HB ' ' A' ' 71' ' ' THR . 99.6 m -88.8 152.52 21.72 Favored 'General case' 0 N--CA 1.499 2.001 0 O-C-N 121.252 -1.146 . . . . 0.0 110.524 -179.797 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 36' ' ' ILE . . . . . 0.423 ' HB ' ' HB ' ' A' ' 72' ' ' VAL . 66.8 mt -67.07 128.57 30.52 Favored 'Isoleucine or valine' 0 N--CA 1.502 2.152 0 O-C-N 121.323 -0.861 . . . . 0.0 110.462 -179.841 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 37' ' ' SER . . . . . . . . . . . . . 9.1 t -103.81 171.25 7.46 Favored 'General case' 0 N--CA 1.498 1.932 0 O-C-N 121.665 -0.647 . . . . 0.0 110.535 179.812 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 38' ' ' THR . . . . . 0.686 HG21 ' HG2' ' A' ' 58' ' ' GLN . 68.9 p -67.94 -48.75 65.06 Favored 'General case' 0 N--CA 1.502 2.143 0 O-C-N 121.278 -0.889 . . . . 0.0 110.4 -179.983 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 39' ' ' LYS . . . . . . . . . . . . . 0.7 OUTLIER -61.2 -37.97 84.89 Favored 'General case' 0 N--CA 1.5 2.063 0 O-C-N 121.295 -0.878 . . . . 0.0 109.316 178.98 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 12.9 tt0 -63.97 -46.52 84.26 Favored 'General case' 0 N--CA 1.495 1.802 0 CA-C-O 121.305 0.574 . . . . 0.0 109.479 178.874 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 41' ' ' LEU . . . . . 0.686 HD21 ' HAK' ' A' ' 91' ' ' SXK . 0.1 OUTLIER -65.56 -58.02 6.79 Favored 'General case' 0 N--CA 1.494 1.763 0 O-C-N 121.634 -0.666 . . . . 0.0 109.275 178.798 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 42' ' ' GLY . . . . . 0.404 ' O ' ' HB2' ' A' ' 45' ' ' MET . . . -47.27 -33.08 7.42 Favored Glycine 0 N--CA 1.502 3.057 0 N-CA-C 111.259 -0.737 . . . . 0.0 111.259 179.985 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 43' ' ' LYS . . . . . . . . . . . . . 1.8 tmtm? -58.98 -36.6 75.15 Favored 'General case' 0 N--CA 1.502 2.129 0 O-C-N 121.063 -1.257 . . . . 0.0 110.232 179.573 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 44' ' ' VAL . . . . . . . . . . . . . 93.9 t -85.05 -22.06 7.71 Favored 'Isoleucine or valine' 0 N--CA 1.498 1.961 0 O-C-N 121.499 -0.751 . . . . 0.0 109.911 179.335 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 45' ' ' MET . . . . . 0.404 ' HB2' ' O ' ' A' ' 42' ' ' GLY . 6.4 mmt -56.52 -36.9 69.73 Favored 'General case' 0 N--CA 1.499 2.02 0 O-C-N 121.262 -0.899 . . . . 0.0 110.326 179.35 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 46' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -62.21 -33.34 74.37 Favored 'General case' 0 N--CA 1.5 2.036 0 O-C-N 121.326 -0.858 . . . . 0.0 110.298 179.207 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 47' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -63.22 -32.28 73.64 Favored 'General case' 0 N--CA 1.501 2.102 0 O-C-N 121.342 -0.849 . . . . 0.0 110.141 179.332 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 48' ' ' LEU . . . . . . . . . . . . . 8.0 mt -93.2 -43.51 8.8 Favored 'General case' 0 N--CA 1.496 1.855 0 O-C-N 121.405 -0.81 . . . . 0.0 109.631 179.347 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 49' ' ' GLY . . . . . . . . . . . . . . . -143.73 -101.6 0.37 Allowed Glycine 0 N--CA 1.493 2.456 0 N-CA-C 109.082 -1.607 . . . . 0.0 109.082 179.557 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 50' ' ' GLN . . . . . . . . . . . . . 12.8 mt-30 -147.21 170.17 17.81 Favored 'General case' 0 N--CA 1.496 1.872 0 O-C-N 121.403 -1.057 . . . . 0.0 110.54 179.83 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 51' ' ' ASN . . . . . . . . . . . . . 44.7 t30 -138.79 104.76 7.49 Favored Pre-proline 0 N--CA 1.495 1.817 0 O-C-N 121.489 -0.757 . . . . 0.0 109.876 179.894 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 52' ' ' PRO . . . . . . . . . . . . . 48.9 Cg_endo -77.94 -50.74 0.08 OUTLIER 'Trans proline' 0 C--N 1.314 -1.267 0 O-C-N 123.771 1.406 . . . . 0.0 111.108 -179.614 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 53' ' ' THR . . . . . 0.478 ' OG1' ' HD2' ' A' ' 54' ' ' PRO . 0.1 OUTLIER -156.89 159.16 31.45 Favored Pre-proline 0 N--CA 1.498 1.931 0 O-C-N 121.142 -0.974 . . . . 0.0 110.739 -179.448 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 54' ' ' PRO . . . . . 0.478 ' HD2' ' OG1' ' A' ' 53' ' ' THR . 42.5 Cg_endo -67.12 -24.57 44.56 Favored 'Trans proline' 0 N--CA 1.49 1.296 0 O-C-N 123.932 1.49 . . . . 0.0 110.69 179.246 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 55' ' ' GLU . . . . . . . . . . . . . 0.9 OUTLIER -59.31 -36.5 75.74 Favored 'General case' 0 N--CA 1.498 1.958 0 O-C-N 121.319 -0.863 . . . . 0.0 109.971 179.178 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 1.2 mm-40 -59.85 -42.93 94.69 Favored 'General case' 0 N--CA 1.497 1.882 0 O-C-N 121.502 -0.749 . . . . 0.0 109.808 179.103 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 57' ' ' LEU . . . . . 0.562 HD22 ' N ' ' A' ' 57' ' ' LEU . 2.6 mm? -74.05 -28.89 61.63 Favored 'General case' 0 N--CA 1.494 1.761 0 O-C-N 121.367 -0.833 . . . . 0.0 109.769 178.988 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 58' ' ' GLN . . . . . 0.686 ' HG2' HG21 ' A' ' 38' ' ' THR . 0.0 OUTLIER -54.83 -53.36 56.24 Favored 'General case' 0 N--CA 1.5 2.027 0 O-C-N 121.28 -0.887 . . . . 0.0 109.056 179.127 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 59' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER -61.17 -33.71 73.87 Favored 'General case' 0 N--CA 1.495 1.804 0 N-CA-C 108.848 -0.797 . . . . 0.0 108.848 177.966 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 60' ' ' MET . . . . . 0.524 ' HB2' ' HA ' ' A' ' 57' ' ' LEU . 0.0 OUTLIER -64.65 -37.91 89.2 Favored 'General case' 0 N--CA 1.496 1.838 0 O-C-N 121.753 -0.592 . . . . 0.0 110.052 178.752 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 61' ' ' ILE . . . . . 0.673 HG12 HG23 ' A' ' 72' ' ' VAL . 1.0 OUTLIER -74.57 -43.84 47.79 Favored 'Isoleucine or valine' 0 N--CA 1.496 1.835 0 O-C-N 121.308 -0.87 . . . . 0.0 109.573 179.375 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 62' ' ' ASP . . . . . 0.411 ' N ' ' CG2' ' A' ' 61' ' ' ILE . 2.6 m-20 -55.6 -31.67 62.44 Favored 'General case' 0 N--CA 1.5 2.06 0 O-C-N 121.262 -0.899 . . . . 0.0 109.902 178.874 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 63' ' ' GLU . . . . . . . . . . . . . 7.4 tt0 -59.74 -35.07 73.82 Favored 'General case' 0 N--CA 1.497 1.92 0 O-C-N 121.737 -0.602 . . . . 0.0 110.672 179.226 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 64' ' ' VAL . . . . . 0.634 HG11 ' SD ' ' A' ' 80' ' ' MET . 9.9 p -124.11 23.38 3.87 Favored 'Isoleucine or valine' 0 N--CA 1.497 1.885 0 O-C-N 121.216 -0.927 . . . . 0.0 110.842 -179.75 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 65' ' ' ASP . . . . . . . . . . . . . 8.5 t70 -131.36 -82.44 0.52 Allowed 'General case' 0 N--CA 1.497 1.909 0 O-C-N 121.172 -0.955 . . . . 0.0 109.654 -179.918 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 66' ' ' GLU . . . . . . . . . . . . . 0.3 OUTLIER 40.81 48.46 2.71 Favored 'General case' 0 N--CA 1.505 2.315 0 O-C-N 121.42 -0.8 . . . . 0.0 112.366 178.734 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 67' ' ' ASP . . . . . . . . . . . . . 4.3 p-10 -117.46 7.39 12.73 Favored 'General case' 0 N--CA 1.501 2.08 0 O-C-N 120.982 -1.074 . . . . 0.0 111.079 179.532 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 68' ' ' GLY . . . . . . . . . . . . . . . 96.3 -5.46 65.35 Favored Glycine 0 N--CA 1.497 2.764 0 N-CA-C 110.521 -1.032 . . . . 0.0 110.521 -179.856 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 69' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -106.07 -43.82 4.74 Favored 'General case' 0 N--CA 1.496 1.838 0 O-C-N 121.049 -1.265 . . . . 0.0 110.496 -179.825 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 70' ' ' GLY . . . . . . . . . . . . . . . 78.78 19.84 72.25 Favored Glycine 0 N--CA 1.497 2.758 0 N-CA-C 109.527 -1.429 . . . . 0.0 109.527 -179.472 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 71' ' ' THR . . . . . 0.413 ' HB ' ' HB3' ' A' ' 35' ' ' CYS . 0.1 OUTLIER -132.22 124.01 28.11 Favored 'General case' 0 N--CA 1.492 1.643 0 O-C-N 121.601 -0.941 . . . . 0.0 108.652 -179.761 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 72' ' ' VAL . . . . . 0.673 HG23 HG12 ' A' ' 61' ' ' ILE . 4.9 t -75.59 124.54 33.79 Favored 'Isoleucine or valine' 0 N--CA 1.496 1.844 0 O-C-N 121.448 -0.783 . . . . 0.0 111.008 -178.68 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 73' ' ' ASP . . . . . . . . . . . . . 18.0 t70 -95.6 -176.84 3.87 Favored 'General case' 0 N--CA 1.495 1.791 0 O-C-N 121.673 -0.642 . . . . 0.0 109.399 179.145 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 74' ' ' PHE . . . . . . . . . . . . . 28.6 t80 -60.07 -44.62 94.63 Favored 'General case' 0 N--CA 1.498 1.945 0 O-C-N 120.957 -1.09 . . . . 0.0 109.784 179.61 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 75' ' ' ASP . . . . . . . . . . . . . 31.4 t70 -62.71 -48.03 81.02 Favored 'General case' 0 N--CA 1.496 1.864 0 O-C-N 121.543 -0.723 . . . . 0.0 110.287 179.32 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 76' ' ' GLU . . . . . . . . . . . . . 54.0 mt-10 -66.92 -32.67 74.07 Favored 'General case' 0 N--CA 1.498 1.933 0 O-C-N 121.444 -0.785 . . . . 0.0 109.656 179.342 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 77' ' ' PHE . . . . . . . . . . . . . 68.3 t80 -60.74 -39.16 87.64 Favored 'General case' 0 N--CA 1.493 1.708 0 O-C-N 121.513 -0.742 . . . . 0.0 109.44 178.642 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 78' ' ' LEU . . . . . . . . . . . . . 88.9 mt -63.77 -37.94 89.26 Favored 'General case' 0 N--CA 1.498 1.942 0 O-C-N 121.432 -0.792 . . . . 0.0 109.46 178.736 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 79' ' ' VAL . . . . . 0.672 HG22 HG21 ' A' ' 9' ' ' VAL . 85.0 t -64.17 -34.74 70.81 Favored 'Isoleucine or valine' 0 N--CA 1.499 2.014 0 O-C-N 121.36 -0.838 . . . . 0.0 109.13 178.405 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 80' ' ' MET . . . . . 0.634 ' SD ' HG11 ' A' ' 64' ' ' VAL . 1.5 ttt -67.88 -39.48 83.69 Favored 'General case' 0 N--CA 1.496 1.842 0 O-C-N 121.552 -0.718 . . . . 0.0 109.53 178.835 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 81' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -65.95 -50.23 65.12 Favored 'General case' 0 N--CA 1.497 1.913 0 O-C-N 121.562 -0.711 . . . . 0.0 110.684 179.702 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 82' ' ' VAL . . . . . 0.472 HG12 ' O ' ' A' ' 79' ' ' VAL . 9.4 p -62.19 -30.02 47.9 Favored 'Isoleucine or valine' 0 N--CA 1.5 2.035 0 O-C-N 121.25 -0.906 . . . . 0.0 110.189 179.774 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 83' ' ' ARG . . . . . . . . . . . . . 3.2 mtp-105 -69.24 -46.48 67.21 Favored 'General case' 0 N--CA 1.495 1.78 0 O-C-N 121.354 -0.842 . . . . 0.0 109.392 178.724 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 84' ' ' CYS . . . . . . . . . . . . . 88.6 m -66.92 -32.78 74.27 Favored 'General case' 0 N--CA 1.497 1.906 0 O-C-N 121.61 -0.681 . . . . 0.0 110.155 179.254 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 85' ' ' MET . . . . . . . . . . . . . 32.2 mtm -67.23 -31.3 71.56 Favored 'General case' 0 N--CA 1.5 2.033 0 O-C-N 121.453 -0.779 . . . . 0.0 110.249 179.216 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 86' ' ' LYS . . . . . . . . . . . . . 4.9 tptp 58.95 58.56 3.13 Favored 'General case' 0 N--CA 1.5 2.07 0 O-C-N 121.72 -0.613 . . . . 0.0 110.878 179.962 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 87' ' ' ASP . . . . . . . . . . . . . 15.6 m-20 54.3 -153.22 0.3 Allowed 'General case' 0 N--CA 1.502 2.166 0 O-C-N 121.691 -0.631 . . . . 0.0 111.205 179.206 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 88' ' ' ASP . . . . . . . . . . . . . 7.6 p-10 -152.65 -40.12 0.1 Allowed 'General case' 0 N--CA 1.499 1.987 0 O-C-N 121.373 -0.829 . . . . 0.0 110.909 -179.698 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 89' ' ' SER . . . . . . . . . . . . . 3.2 t . . . . . 0 N--CA 1.497 1.876 0 CA-C-O 117.813 -1.089 . . . . 0.0 110.678 179.974 . . . . . . . . 0 0 . 1 . 005 nuclear nobuild full ' B' B ' 144' ' ' ARG . . . . . . . . . . . . . 1.3 ttt-85 . . . . . 0 N--CA 1.494 1.758 0 CA-C-O 121.118 0.485 . . . . 0.0 110.121 . . . . . . . . . 0 0 . 1 . 005 nuclear nobuild full ' B' B ' 145' ' ' ARG . . . . . . . . . . . . . 13.3 ttt85 -76.45 141.57 41.3 Favored 'General case' 0 N--CA 1.495 1.821 0 O-C-N 121.454 -0.779 . . . . 0.0 110.466 -179.924 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 146' ' ' VAL . . . . . . . . . . . . . 16.2 m -130.5 154.51 40.68 Favored 'Isoleucine or valine' 0 N--CA 1.5 2.045 0 O-C-N 121.594 -0.692 . . . . 0.0 110.125 179.808 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 147' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -116.92 90.99 3.45 Favored 'General case' 0 N--CA 1.494 1.769 0 O-C-N 121.264 -0.898 . . . . 0.0 110.909 -179.63 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' B' B ' 148' ' ' ILE . . . . . 0.433 HG21 ' HE2' ' B' ' 153' ' ' MET . 1.8 mp -99.1 121.76 50.06 Favored 'Isoleucine or valine' 0 N--CA 1.497 1.884 0 O-C-N 121.261 -0.9 . . . . 0.0 109.447 179.428 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' B' B ' 149' ' ' SER . . . . . . . . . . . . . 27.5 m -100.33 170.48 8.4 Favored 'General case' 0 N--CA 1.498 1.965 0 O-C-N 121.504 -0.748 . . . . 0.0 110.772 -179.709 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 150' ' ' ALA . . . . . . . . . . . . . . . -60.47 -50.76 72.29 Favored 'General case' 0 N--CA 1.498 1.958 0 O-C-N 121.573 -0.704 . . . . 0.0 110.549 179.909 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 151' ' ' ASP . . . . . . . . . . . . . 7.5 p-10 -61.54 -34.79 76.16 Favored 'General case' 0 N--CA 1.5 2.029 0 O-C-N 121.453 -0.779 . . . . 0.0 110.68 179.771 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 152' ' ' ALA . . . . . . . . . . . . . . . -68.06 -54.4 18.55 Favored 'General case' 0 N--CA 1.497 1.878 0 O-C-N 121.316 -0.865 . . . . 0.0 110.44 179.995 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 153' ' ' MET . . . . . 0.433 ' HE2' HG21 ' B' ' 148' ' ' ILE . 1.1 tpt -66.16 -31.04 71.65 Favored 'General case' 0 N--CA 1.499 1.991 0 O-C-N 121.317 -0.865 . . . . 0.0 110.346 179.597 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' B' B ' 154' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -64.12 -41.21 97.31 Favored 'General case' 0 N--CA 1.499 2.009 0 O-C-N 121.348 -0.845 . . . . 0.0 110.326 179.486 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' B' B ' 155' ' ' GLN . . . . . . . . . . . . . 33.6 mt-30 -77.94 -31.75 51.16 Favored 'General case' 0 N--CA 1.499 1.98 0 O-C-N 121.346 -0.846 . . . . 0.0 110.83 179.878 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 156' ' ' ALA . . . . . . . . . . . . . . . -54.93 -45.85 74.87 Favored 'General case' 0 N--CA 1.501 2.11 0 O-C-N 121.386 -0.821 . . . . 0.0 110.959 -179.683 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 157' ' ' LEU . . . . . . . . . . . . . 1.2 tp -80.35 -46.35 16.22 Favored 'General case' 0 N--CA 1.496 1.83 0 O-C-N 121.173 -0.955 . . . . 0.0 110.208 179.71 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 158' ' ' LEU . . . . . . . . . . . . . 1.1 mp -79.74 86.12 5.36 Favored 'General case' 0 N--CA 1.495 1.816 0 O-C-N 121.34 -0.85 . . . . 0.0 109.308 179.207 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 159' ' ' GLY . . . . . . . . . . . . . . . 145.73 -41.49 1.03 Allowed Glycine 0 N--CA 1.494 2.547 0 N-CA-C 109.154 -1.578 . . . . 0.0 109.154 -179.157 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 160' ' ' ALA . . . . . . . . . . . . . . . -120.1 26.42 9.27 Favored 'General case' 0 N--CA 1.496 1.856 0 O-C-N 121.438 -1.036 . . . . 0.0 110.849 179.659 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 161' ' ' ARG . . . . . . . . . . . . . 0.4 OUTLIER -150.08 -58.06 0.19 Allowed 'General case' 0 N--CA 1.496 1.85 0 O-C-N 120.938 -1.101 . . . . 0.0 110.957 179.815 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' B' B ' 162' ' ' ALA . . . . . 0.568 ' CB ' HD13 ' A' ' 26' ' ' ILE . . . -118.67 -66.59 1.06 Allowed 'General case' 0 N--CA 1.495 1.796 0 O-C-N 121.375 -0.828 . . . . 0.0 110.733 -179.653 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' B' B ' 163' ' ' LYS . . . . . . . . . . . . . 3.3 mtpt . . . . . 0 N--CA 1.496 1.866 0 CA-C-O 117.883 -1.056 . . . . 0.0 110.284 -179.832 . . . . . . . . 0 0 . 1 . 005 nuclear nobuild full ' A' A ' 90' ' ' ' CA' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 005 nuclear nobuild full ' A' A ' 91' ' ' SXK . . . . . 0.686 ' HAK' HD21 ' A' ' 41' ' ' LEU . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 3.7 mmm . . . . . 0 N--CA 1.498 1.948 0 CA-C-O 120.905 0.383 . . . . 0.0 110.014 . . . . . . . . . 0 0 . 1 . 006 nuclear nobuild full ' A' A ' 2' ' ' ASP . . . . . 0.431 ' HB3' ' HB2' ' A' ' 6' ' ' LYS . 32.1 t0 -160.33 157.43 27.96 Favored 'General case' 0 N--CA 1.497 1.898 0 O-C-N 121.464 -0.772 . . . . 0.0 110.842 -179.617 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 3' ' ' ASP . . . . . . . . . . . . . 23.8 t70 -141.82 -67.78 0.39 Allowed 'General case' 0 N--CA 1.494 1.77 0 O-C-N 121.49 -0.756 . . . . 0.0 110.499 179.924 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 4' ' ' ILE . . . . . 0.438 HG23 ' N ' ' A' ' 5' ' ' TYR . 1.1 tp -65.09 -41.81 92.83 Favored 'Isoleucine or valine' 0 N--CA 1.499 2.023 0 O-C-N 121.333 -0.854 . . . . 0.0 111.107 -179.549 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 5' ' ' TYR . . . . . 0.552 ' CD2' ' HG2' ' A' ' 83' ' ' ARG . 27.2 m-85 -78.84 -34.03 45.47 Favored 'General case' 0 N--CA 1.497 1.885 0 O-C-N 121.037 -1.039 . . . . 0.0 109.781 179.615 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 6' ' ' LYS . . . . . 0.431 ' HB2' ' HB3' ' A' ' 2' ' ' ASP . 11.7 ttpp -61.03 -43.54 98.73 Favored 'General case' 0 N--CA 1.493 1.722 0 O-C-N 121.564 -0.71 . . . . 0.0 109.929 179.159 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 7' ' ' ALA . . . . . . . . . . . . . . . -55.31 -38.94 69.33 Favored 'General case' 0 N--CA 1.5 2.075 0 O-C-N 121.47 -0.769 . . . . 0.0 110.083 179.325 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 8' ' ' ALA . . . . . . . . . . . . . . . -61.0 -39.1 88.42 Favored 'General case' 0 N--CA 1.497 1.915 0 O-C-N 121.481 -0.762 . . . . 0.0 109.614 178.91 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 9' ' ' VAL . . . . . 0.94 ' HA ' HD12 ' A' ' 12' ' ' LEU . 59.1 t -64.27 -39.11 84.35 Favored 'Isoleucine or valine' 0 N--CA 1.499 2.0 0 O-C-N 121.532 -0.73 . . . . 0.0 109.288 178.784 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 10' ' ' GLU . . . . . . . . . . . . . 3.4 mt-10 -64.98 -29.07 69.97 Favored 'General case' 0 N--CA 1.5 2.041 0 O-C-N 121.459 -0.776 . . . . 0.0 109.769 178.675 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 11' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -82.62 -19.05 39.09 Favored 'General case' 0 N--CA 1.498 1.972 0 O-C-N 121.445 -0.784 . . . . 0.0 110.69 179.417 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 12' ' ' LEU . . . . . 0.94 HD12 ' HA ' ' A' ' 9' ' ' VAL . 18.3 mt -62.99 116.14 5.05 Favored 'General case' 0 N--CA 1.497 1.887 0 O-C-N 121.255 -0.903 . . . . 0.0 110.057 179.857 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 13' ' ' THR . . . . . . . . . . . . . 71.3 p -74.62 167.49 21.66 Favored 'General case' 0 N--CA 1.497 1.902 0 O-C-N 121.297 -0.877 . . . . 0.0 109.888 179.75 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 14' ' ' GLU . . . . . . . . . . . . . 9.7 tp10 -58.23 -34.71 70.73 Favored 'General case' 0 N--CA 1.492 1.671 0 O-C-N 121.588 -0.695 . . . . 0.0 110.643 -179.421 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 17.9 tt0 -59.32 -46.39 88.7 Favored 'General case' 0 N--CA 1.498 1.968 0 O-C-N 121.338 -0.851 . . . . 0.0 109.44 178.981 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 16' ' ' GLN . . . . . . . . . . . . . 3.2 mt-30 -65.15 -37.58 87.87 Favored 'General case' 0 N--CA 1.498 1.949 0 O-C-N 121.531 -0.73 . . . . 0.0 109.871 178.826 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 17' ' ' LYS . . . . . 0.474 ' HD2' HD11 ' A' ' 78' ' ' LEU . 15.8 mtmt -60.58 -40.3 91.22 Favored 'General case' 0 N--CA 1.497 1.882 0 N-CA-C 109.163 -0.68 . . . . 0.0 109.163 178.795 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 18' ' ' ASN . . . . . 0.481 ' HA ' ' HB3' ' A' ' 21' ' ' LYS . 8.2 t30 -64.9 -39.32 93.34 Favored 'General case' 0 N--CA 1.497 1.884 0 O-C-N 121.588 -0.695 . . . . 0.0 109.894 179.107 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 14.9 mt-10 -57.49 -42.49 82.8 Favored 'General case' 0 N--CA 1.499 1.988 0 O-C-N 121.46 -0.775 . . . . 0.0 109.224 178.862 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 20' ' ' PHE . . . . . . . . . . . . . 3.8 m-85 -75.5 -30.11 59.74 Favored 'General case' 0 N--CA 1.494 1.76 0 O-C-N 121.581 -0.699 . . . . 0.0 109.49 178.543 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 21' ' ' LYS . . . . . 0.481 ' HB3' ' HA ' ' A' ' 18' ' ' ASN . 0.0 OUTLIER -57.43 -32.55 67.01 Favored 'General case' 0 N--CA 1.498 1.965 0 O-C-N 121.58 -0.7 . . . . 0.0 109.638 179.042 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 22' ' ' ALA . . . . . 0.433 ' N ' ' HG3' ' A' ' 21' ' ' LYS . . . -58.3 -52.98 63.3 Favored 'General case' 0 N--CA 1.497 1.876 0 O-C-N 121.394 -0.816 . . . . 0.0 109.408 178.787 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 23' ' ' ALA . . . . . . . . . . . . . . . -68.89 -35.88 77.38 Favored 'General case' 0 N--CA 1.496 1.865 0 O-C-N 121.602 -0.687 . . . . 0.0 109.548 178.622 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 24' ' ' PHE . . . . . 0.476 ' HB3' ' HA ' ' A' ' 21' ' ' LYS . 70.8 t80 -61.58 -51.06 70.09 Favored 'General case' 0 N--CA 1.497 1.911 0 O-C-N 121.721 -0.612 . . . . 0.0 110.404 179.446 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 25' ' ' ASP . . . . . . . . . . . . . 0.7 OUTLIER -62.33 -44.91 95.4 Favored 'General case' 0 N--CA 1.498 1.964 0 O-C-N 121.562 -0.711 . . . . 0.0 110.241 179.812 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 26' ' ' ILE . . . . . . . . . . . . . 22.1 mt -65.84 -29.53 47.22 Favored 'Isoleucine or valine' 0 N--CA 1.498 1.947 0 O-C-N 121.268 -0.895 . . . . 0.0 109.68 179.009 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 27' ' ' PHE . . . . . 0.406 ' HZ ' ' SD ' ' B' ' 153' ' ' MET . 0.1 OUTLIER -62.14 -42.58 99.39 Favored 'General case' 0 N--CA 1.498 1.945 0 O-C-N 121.372 -0.83 . . . . 0.0 110.13 179.033 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 28' ' ' VAL . . . . . 0.414 ' H ' HG22 ' A' ' 28' ' ' VAL . 34.0 m -88.24 37.01 0.07 OUTLIER 'Isoleucine or valine' 0 N--CA 1.5 2.046 0 O-C-N 121.29 -0.881 . . . . 0.0 111.137 -179.846 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 29' ' ' LEU . . . . . 0.412 HD13 ' HA ' ' B' ' 162' ' ' ALA . 2.7 mt -74.17 -44.89 51.77 Favored 'General case' 0 N--CA 1.498 1.957 0 O-C-N 120.954 -1.091 . . . . 0.0 109.58 178.944 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 30' ' ' GLY . . . . . . . . . . . . . . . -110.46 30.3 8.32 Favored Glycine 0 N--CA 1.494 2.533 0 N-CA-C 109.381 -1.488 . . . . 0.0 109.381 179.071 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 31' ' ' ALA . . . . . . . . . . . . . . . -93.21 101.0 13.27 Favored 'General case' 0 N--CA 1.497 1.901 0 O-C-N 121.363 -1.081 . . . . 0.0 110.585 -179.884 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 32' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -60.36 -25.1 65.6 Favored 'General case' 0 N--CA 1.501 2.118 0 O-C-N 121.409 -0.807 . . . . 0.0 110.683 179.552 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 14.2 m-20 -69.54 -28.77 66.29 Favored 'General case' 0 N--CA 1.499 1.991 0 O-C-N 121.384 -0.822 . . . . 0.0 110.461 179.511 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 34' ' ' GLY . . . . . . . . . . . . . . . 109.97 -35.82 4.64 Favored Glycine 0 N--CA 1.497 2.705 0 N-CA-C 109.503 -1.439 . . . . 0.0 109.503 -179.504 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 35' ' ' CYS . . . . . 0.413 ' SG ' ' HB ' ' A' ' 71' ' ' THR . 30.3 p -122.71 -172.3 2.45 Favored 'General case' 0 N--CA 1.499 1.989 0 O-C-N 121.482 -1.011 . . . . 0.0 109.807 179.623 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 36' ' ' ILE . . . . . 0.67 ' HA ' ' HG2' ' A' ' 40' ' ' GLU . 4.2 mt -81.15 104.07 9.13 Favored 'Isoleucine or valine' 0 N--CA 1.497 1.916 0 O-C-N 120.94 -1.1 . . . . 0.0 110.207 179.833 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 37' ' ' SER . . . . . . . . . . . . . 0.9 OUTLIER -107.95 -170.54 1.7 Allowed 'General case' 0 N--CA 1.494 1.752 0 O-C-N 121.644 -0.66 . . . . 0.0 110.014 179.758 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 38' ' ' THR . . . . . . . . . . . . . 23.9 p -63.45 -37.7 88.3 Favored 'General case' 0 N--CA 1.502 2.175 0 O-C-N 121.23 -0.919 . . . . 0.0 110.54 179.726 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 39' ' ' LYS . . . . . . . . . . . . . 9.8 mtmt -63.47 -47.39 82.01 Favored 'General case' 0 N--CA 1.5 2.032 0 O-C-N 121.557 -0.714 . . . . 0.0 111.173 -179.77 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 40' ' ' GLU . . . . . 0.67 ' HG2' ' HA ' ' A' ' 36' ' ' ILE . 0.0 OUTLIER -60.49 -33.66 72.93 Favored 'General case' 0 N--CA 1.502 2.133 0 O-C-N 121.391 -0.818 . . . . 0.0 111.529 -179.074 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 41' ' ' LEU . . . . . 0.765 HD12 ' HG ' ' A' ' 57' ' ' LEU . 3.1 tm? -69.36 -66.73 0.55 Allowed 'General case' 0 N--CA 1.495 1.782 0 O-C-N 121.32 -0.863 . . . . 0.0 110.18 -179.771 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 42' ' ' GLY . . . . . . . . . . . . . . . -44.84 -42.42 7.77 Favored Glycine 0 N--CA 1.5 2.934 0 N-CA-C 110.61 -0.996 . . . . 0.0 110.61 -179.729 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 43' ' ' LYS . . . . . . . . . . . . . 5.1 mttm -56.96 -49.9 74.28 Favored 'General case' 0 N--CA 1.501 2.077 0 O-C-N 121.476 -1.014 . . . . 0.0 110.348 179.617 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 44' ' ' VAL . . . . . . . . . . . . . 21.3 t -67.42 -36.32 76.11 Favored 'Isoleucine or valine' 0 N--CA 1.5 2.07 0 O-C-N 121.334 -0.854 . . . . 0.0 110.179 179.221 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 45' ' ' MET . . . . . . . . . . . . . 1.2 mtt -63.11 -32.34 73.7 Favored 'General case' 0 N--CA 1.499 2.006 0 O-C-N 121.472 -0.767 . . . . 0.0 111.21 -179.89 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 46' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -47.92 -41.64 25.14 Favored 'General case' 0 N--CA 1.503 2.179 0 O-C-N 121.212 -0.93 . . . . 0.0 111.365 -179.786 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 47' ' ' MET . . . . . . . . . . . . . 13.3 ptt? -90.66 -27.69 18.86 Favored 'General case' 0 N--CA 1.5 2.041 0 O-C-N 121.162 -0.961 . . . . 0.0 110.395 179.384 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 48' ' ' LEU . . . . . . . . . . . . . 14.6 tp -128.86 87.45 2.57 Favored 'General case' 0 N--CA 1.492 1.654 0 O-C-N 121.367 -0.833 . . . . 0.0 109.236 179.423 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 49' ' ' GLY . . . . . . . . . . . . . . . 93.53 70.34 1.12 Allowed Glycine 0 N--CA 1.497 2.758 0 N-CA-C 108.504 -1.838 . . . . 0.0 108.504 -178.767 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 50' ' ' GLN . . . . . . . . . . . . . 3.2 mm-40 -36.93 136.41 0.39 Allowed 'General case' 0 N--CA 1.504 2.272 0 CA-C-O 121.574 0.702 . . . . 0.0 112.865 -178.518 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 51' ' ' ASN . . . . . 0.819 ' OD1' HD21 ' A' ' 57' ' ' LEU . 37.2 t30 -100.75 116.28 64.34 Favored Pre-proline 0 N--CA 1.493 1.725 0 O-C-N 121.843 -0.536 . . . . 0.0 110.048 179.353 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 52' ' ' PRO . . . . . . . . . . . . . 42.8 Cg_endo -73.26 -64.31 0.03 OUTLIER 'Trans proline' 0 C--N 1.311 -1.407 0 O-C-N 123.928 1.488 . . . . 0.0 111.705 -179.829 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 53' ' ' THR . . . . . . . . . . . . . 1.0 OUTLIER -118.25 152.64 50.92 Favored Pre-proline 0 N--CA 1.498 1.964 0 O-C-N 121.111 -0.993 . . . . 0.0 110.942 -179.252 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 54' ' ' PRO . . . . . . . . . . . . . 45.0 Cg_endo -71.69 -37.2 5.51 Favored 'Trans proline' 0 N--CA 1.492 1.401 0 O-C-N 123.941 1.495 . . . . 0.0 111.267 179.983 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 55' ' ' GLU . . . . . . . . . . . . . 2.5 mp0 -62.8 -32.3 73.45 Favored 'General case' 0 N--CA 1.5 2.03 0 O-C-N 121.374 -0.829 . . . . 0.0 110.732 -179.895 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 2.5 tt0 -51.9 -40.25 60.38 Favored 'General case' 0 N--CA 1.499 2.023 0 O-C-N 121.604 -0.685 . . . . 0.0 111.117 -179.997 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 57' ' ' LEU . . . . . 0.819 HD21 ' OD1' ' A' ' 51' ' ' ASN . 0.4 OUTLIER -73.62 -31.51 63.58 Favored 'General case' 0 N--CA 1.499 2.016 0 O-C-N 121.082 -1.012 . . . . 0.0 110.153 179.778 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 58' ' ' GLN . . . . . 0.46 ' O ' HG22 ' A' ' 61' ' ' ILE . 0.0 OUTLIER -58.08 -44.19 87.43 Favored 'General case' 0 N--CA 1.496 1.842 0 O-C-N 121.191 -0.943 . . . . 0.0 108.465 178.951 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 59' ' ' GLU . . . . . . . . . . . . . 2.0 mp0 -61.12 -36.09 78.79 Favored 'General case' 0 N--CA 1.496 1.874 0 O-C-N 121.282 -0.887 . . . . 0.0 108.68 177.831 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 60' ' ' MET . . . . . 0.409 ' HB2' ' O ' ' A' ' 57' ' ' LEU . 0.4 OUTLIER -62.61 -36.89 84.2 Favored 'General case' 0 N--CA 1.497 1.907 0 O-C-N 121.725 -0.609 . . . . 0.0 109.867 178.618 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 61' ' ' ILE . . . . . 0.478 HG13 HG23 ' A' ' 72' ' ' VAL . 0.8 OUTLIER -83.77 -31.78 8.37 Favored 'Isoleucine or valine' 0 N--CA 1.498 1.946 0 O-C-N 121.41 -0.806 . . . . 0.0 111.039 -179.916 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 62' ' ' ASP . . . . . . . . . . . . . 2.7 m-20 -58.04 -47.57 82.72 Favored 'General case' 0 N--CA 1.5 2.065 0 O-C-N 121.289 -0.882 . . . . 0.0 111.233 -179.37 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 63' ' ' GLU . . . . . . . . . . . . . 0.9 OUTLIER -63.5 -36.21 83.02 Favored 'General case' 0 N--CA 1.5 2.028 0 O-C-N 121.274 -0.891 . . . . 0.0 110.799 -179.875 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 64' ' ' VAL . . . . . . . . . . . . . 84.4 t -84.36 -30.44 7.28 Favored 'Isoleucine or valine' 0 N--CA 1.498 1.944 0 O-C-N 121.33 -0.856 . . . . 0.0 111.465 -179.49 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 65' ' ' ASP . . . . . . . . . . . . . 16.9 t70 -133.72 137.78 45.44 Favored 'General case' 0 N--CA 1.497 1.885 0 O-C-N 121.006 -1.058 . . . . 0.0 111.76 -179.368 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 66' ' ' GLU . . . . . . . . . . . . . 0.3 OUTLIER -148.17 45.39 1.07 Allowed 'General case' 0 N--CA 1.495 1.796 0 CA-C-O 121.573 0.701 . . . . 0.0 109.245 178.694 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 67' ' ' ASP . . . . . . . . . . . . . 12.7 p-10 -102.78 13.18 35.03 Favored 'General case' 0 N--CA 1.499 1.992 0 O-C-N 121.448 -0.783 . . . . 0.0 111.567 -179.359 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 68' ' ' GLY . . . . . . . . . . . . . . . 107.79 -51.55 0.71 Allowed Glycine 0 N--CA 1.496 2.657 0 C-N-CA 120.039 -1.077 . . . . 0.0 110.497 179.422 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 69' ' ' SER . . . . . . . . . . . . . 82.3 p -64.07 -55.78 19.68 Favored 'General case' 0 N--CA 1.501 2.11 0 O-C-N 121.241 -1.152 . . . . 0.0 110.876 -179.418 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 70' ' ' GLY . . . . . . . . . . . . . . . 89.75 34.74 8.2 Favored Glycine 0 N--CA 1.495 2.595 0 N-CA-C 108.326 -1.91 . . . . 0.0 108.326 -179.283 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 71' ' ' THR . . . . . 0.413 ' HB ' ' SG ' ' A' ' 35' ' ' CYS . 3.1 p -131.0 143.03 50.41 Favored 'General case' 0 N--CA 1.489 1.49 0 O-C-N 122.029 -0.689 . . . . 0.0 109.694 -179.29 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 72' ' ' VAL . . . . . 0.534 HG11 ' HD1' ' A' ' 77' ' ' PHE . 93.3 t -75.59 107.37 6.32 Favored 'Isoleucine or valine' 0 N--CA 1.496 1.87 0 O-C-N 121.545 -0.722 . . . . 0.0 110.598 -179.724 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 73' ' ' ASP . . . . . 0.405 ' HB2' ' HB2' ' A' ' 76' ' ' GLU . 1.1 m-20 -75.25 -175.34 2.66 Favored 'General case' 0 N--CA 1.497 1.913 0 O-C-N 121.415 -0.803 . . . . 0.0 110.244 179.601 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 74' ' ' PHE . . . . . . . . . . . . . 39.0 t80 -65.16 -58.09 6.88 Favored 'General case' 0 N--CA 1.499 2.002 0 O-C-N 121.194 -0.941 . . . . 0.0 109.779 179.951 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 75' ' ' ASP . . . . . 0.694 ' HA ' HD12 ' A' ' 78' ' ' LEU . 0.5 OUTLIER -65.79 -34.64 78.65 Favored 'General case' 0 N--CA 1.495 1.783 0 O-C-N 121.553 -0.717 . . . . 0.0 109.86 179.174 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 76' ' ' GLU . . . . . 0.405 ' HB2' ' HB2' ' A' ' 73' ' ' ASP . 19.3 mt-10 -63.67 -40.42 96.78 Favored 'General case' 0 N--CA 1.497 1.903 0 O-C-N 121.451 -0.78 . . . . 0.0 109.502 178.715 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 77' ' ' PHE . . . . . 0.534 ' HD1' HG11 ' A' ' 72' ' ' VAL . 57.6 t80 -56.86 -40.46 76.17 Favored 'General case' 0 N--CA 1.498 1.972 0 O-C-N 121.621 -0.674 . . . . 0.0 110.541 179.48 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 78' ' ' LEU . . . . . 0.721 HD22 HD13 ' A' ' 12' ' ' LEU . 27.2 mt -55.45 -40.5 71.65 Favored 'General case' 0 N--CA 1.502 2.16 0 O-C-N 121.463 -0.773 . . . . 0.0 110.63 179.831 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 79' ' ' VAL . . . . . 0.75 HG22 HG21 ' A' ' 9' ' ' VAL . 77.8 t -62.5 -34.85 67.0 Favored 'Isoleucine or valine' 0 N--CA 1.502 2.125 0 O-C-N 121.497 -0.752 . . . . 0.0 110.033 179.496 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 80' ' ' MET . . . . . . . . . . . . . 18.9 ttp -73.58 -35.27 65.4 Favored 'General case' 0 N--CA 1.494 1.732 0 O-C-N 121.342 -0.849 . . . . 0.0 110.305 179.539 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 81' ' ' MET . . . . . 0.46 ' CE ' ' HB2' ' B' ' 150' ' ' ALA . 12.0 mmm -66.62 -46.76 74.8 Favored 'General case' 0 N--CA 1.499 1.979 0 O-C-N 121.424 -0.798 . . . . 0.0 110.715 -179.719 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 82' ' ' VAL . . . . . . . . . . . . . 33.2 m -62.81 -32.64 56.5 Favored 'Isoleucine or valine' 0 N--CA 1.504 2.243 0 O-C-N 121.128 -0.983 . . . . 0.0 110.441 179.88 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 83' ' ' ARG . . . . . 0.552 ' HG2' ' CD2' ' A' ' 5' ' ' TYR . 69.8 mtt180 -66.84 -34.52 77.99 Favored 'General case' 0 N--CA 1.497 1.908 0 O-C-N 121.38 -0.825 . . . . 0.0 109.835 179.132 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 84' ' ' CYS . . . . . . . . . . . . . 79.5 m -77.41 -28.93 52.81 Favored 'General case' 0 N--CA 1.496 1.856 0 O-C-N 121.502 -0.749 . . . . 0.0 109.983 178.914 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 85' ' ' MET . . . . . . . . . . . . . 42.0 mtm -76.62 -32.39 58.01 Favored 'General case' 0 N--CA 1.497 1.903 0 O-C-N 121.582 -0.699 . . . . 0.0 110.76 179.838 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 86' ' ' LYS . . . . . . . . . . . . . 5.8 tmtt? 59.91 75.69 0.39 Allowed 'General case' 0 N--CA 1.503 2.217 0 O-C-N 121.589 -0.695 . . . . 0.0 110.76 -179.961 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 87' ' ' ASP . . . . . . . . . . . . . 5.9 p-10 -76.88 -26.29 54.03 Favored 'General case' 0 N--CA 1.5 2.051 0 O-C-N 121.289 -0.882 . . . . 0.0 111.123 179.972 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 88' ' ' ASP . . . . . . . . . . . . . 7.9 p-10 -85.96 163.26 18.12 Favored 'General case' 0 N--CA 1.497 1.891 0 O-C-N 121.055 -1.028 . . . . 0.0 110.72 -179.902 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 89' ' ' SER . . . . . . . . . . . . . 67.2 m . . . . . 0 N--CA 1.499 2.017 0 CA-C-O 117.818 -1.087 . . . . 0.0 110.927 -179.622 . . . . . . . . 0 0 . 1 . 006 nuclear nobuild full ' B' B ' 144' ' ' ARG . . . . . . . . . . . . . 2.0 ptt-85 . . . . . 0 N--CA 1.499 1.981 0 CA-C-O 120.69 0.281 . . . . 0.0 111.12 . . . . . . . . . 0 0 . 1 . 006 nuclear nobuild full ' B' B ' 145' ' ' ARG . . . . . 0.523 ' O ' ' HB ' ' B' ' 146' ' ' VAL . 0.0 OUTLIER -91.03 98.58 11.86 Favored 'General case' 0 N--CA 1.494 1.747 0 O-C-N 121.094 -1.004 . . . . 0.0 110.059 179.444 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' B' B ' 146' ' ' VAL . . . . . 0.523 ' HB ' ' O ' ' B' ' 145' ' ' ARG . 3.0 t 65.57 143.24 0.01 OUTLIER 'Isoleucine or valine' 0 N--CA 1.507 2.39 0 CA-C-O 121.559 0.695 . . . . 0.0 110.87 -179.69 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' B' B ' 147' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -138.53 126.93 23.1 Favored 'General case' 0 N--CA 1.496 1.846 0 O-C-N 121.136 -0.977 . . . . 0.0 110.382 -179.755 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' B' B ' 148' ' ' ILE . . . . . . . . . . . . . 1.0 OUTLIER -108.3 -27.66 2.91 Favored 'Isoleucine or valine' 0 N--CA 1.501 2.089 0 O-C-N 121.354 -0.841 . . . . 0.0 111.243 -179.921 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' B' B ' 149' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER 64.59 109.66 0.03 OUTLIER 'General case' 0 N--CA 1.505 2.315 0 O-C-N 121.639 -0.663 . . . . 0.0 111.154 179.865 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' B' B ' 150' ' ' ALA . . . . . 0.46 ' HB2' ' CE ' ' A' ' 81' ' ' MET . . . -55.29 -42.76 74.08 Favored 'General case' 0 N--CA 1.501 2.118 0 O-C-N 121.412 -0.805 . . . . 0.0 110.824 179.955 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' B' B ' 151' ' ' ASP . . . . . . . . . . . . . 4.2 p-10 -53.92 -39.33 65.74 Favored 'General case' 0 N--CA 1.502 2.135 0 O-C-N 121.613 -0.679 . . . . 0.0 110.741 179.743 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 152' ' ' ALA . . . . . . . . . . . . . . . -87.14 -40.1 14.93 Favored 'General case' 0 N--CA 1.496 1.833 0 O-C-N 121.365 -0.834 . . . . 0.0 110.318 179.555 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 153' ' ' MET . . . . . 0.406 ' SD ' ' HZ ' ' A' ' 27' ' ' PHE . 5.7 ttt -60.09 -44.9 94.46 Favored 'General case' 0 N--CA 1.498 1.971 0 O-C-N 121.484 -0.76 . . . . 0.0 110.627 179.875 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' B' B ' 154' ' ' MET . . . . . . . . . . . . . 19.7 ttt -62.46 -43.63 98.34 Favored 'General case' 0 N--CA 1.497 1.917 0 O-C-N 121.474 -0.766 . . . . 0.0 110.428 179.773 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 155' ' ' GLN . . . . . . . . . . . . . 0.6 OUTLIER -65.42 -43.07 91.7 Favored 'General case' 0 N--CA 1.499 2.005 0 O-C-N 121.522 -0.737 . . . . 0.0 110.587 179.771 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' B' B ' 156' ' ' ALA . . . . . . . . . . . . . . . -63.43 -34.86 78.68 Favored 'General case' 0 N--CA 1.499 1.983 0 O-C-N 121.336 -0.853 . . . . 0.0 110.587 179.817 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 157' ' ' LEU . . . . . . . . . . . . . 24.8 tp -80.83 -49.46 11.05 Favored 'General case' 0 N--CA 1.495 1.809 0 O-C-N 121.301 -0.875 . . . . 0.0 110.611 179.849 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 158' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -71.69 106.29 4.03 Favored 'General case' 0 N--CA 1.499 2.009 0 O-C-N 121.287 -0.883 . . . . 0.0 110.069 179.825 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' B' B ' 159' ' ' GLY . . . . . . . . . . . . . . . 126.99 -33.56 3.33 Favored Glycine 0 N--CA 1.496 2.656 0 N-CA-C 109.939 -1.264 . . . . 0.0 109.939 -179.704 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 160' ' ' ALA . . . . . . . . . . . . . . . -110.75 -33.45 6.54 Favored 'General case' 0 N--CA 1.499 1.982 0 O-C-N 121.208 -1.172 . . . . 0.0 111.213 -179.69 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 161' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -116.14 -19.62 10.2 Favored 'General case' 0 N--CA 1.502 2.147 0 O-C-N 121.122 -0.987 . . . . 0.0 111.506 -179.453 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' B' B ' 162' ' ' ALA . . . . . 0.412 ' HA ' HD13 ' A' ' 29' ' ' LEU . . . -91.4 -51.84 5.08 Favored 'General case' 0 N--CA 1.497 1.904 0 O-C-N 121.115 -0.991 . . . . 0.0 111.1 -179.482 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' B' B ' 163' ' ' LYS . . . . . 0.492 ' HA ' ' HE3' ' B' ' 163' ' ' LYS . 0.1 OUTLIER . . . . . 0 N--CA 1.497 1.917 0 CA-C-O 117.801 -1.095 . . . . 0.0 110.543 179.943 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 90' ' ' ' CA' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 006 nuclear nobuild full ' A' A ' 91' ' ' SXK . . . . . 0.422 ' HAK' HD23 ' A' ' 41' ' ' LEU . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.496 1.873 0 CA-C-O 120.705 0.288 . . . . 0.0 110.252 . . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 2' ' ' ASP . . . . . . . . . . . . . 3.6 m-20 -74.81 124.97 27.8 Favored 'General case' 0 N--CA 1.496 1.857 0 O-C-N 121.318 -0.864 . . . . 0.0 109.686 179.645 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 3' ' ' ASP . . . . . 0.621 ' HB3' ' HB2' ' A' ' 6' ' ' LYS . 5.8 t70 68.57 150.9 0.08 Allowed 'General case' 0 N--CA 1.503 2.205 0 CA-C-O 121.638 0.732 . . . . 0.0 110.4 -179.031 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 4' ' ' ILE . . . . . . . . . . . . . 5.3 mt -94.57 -47.39 13.33 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.682 0 O-C-N 121.316 -0.865 . . . . 0.0 109.294 179.704 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 5' ' ' TYR . . . . . . . . . . . . . 39.7 m-85 -68.77 -36.53 78.44 Favored 'General case' 0 N--CA 1.494 1.758 0 O-C-N 121.605 -0.684 . . . . 0.0 109.454 178.896 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 6' ' ' LYS . . . . . 0.621 ' HB2' ' HB3' ' A' ' 3' ' ' ASP . 0.3 OUTLIER -64.99 -42.7 94.28 Favored 'General case' 0 N--CA 1.496 1.846 0 O-C-N 121.451 -0.78 . . . . 0.0 109.031 178.483 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 7' ' ' ALA . . . . . . . . . . . . . . . -61.46 -35.99 79.18 Favored 'General case' 0 N--CA 1.496 1.868 0 O-C-N 121.464 -0.772 . . . . 0.0 109.338 178.306 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 8' ' ' ALA . . . . . . . . . . . . . . . -66.57 -26.39 67.1 Favored 'General case' 0 N--CA 1.498 1.938 0 O-C-N 121.497 -0.752 . . . . 0.0 110.232 179.03 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 9' ' ' VAL . . . . . 0.681 ' HA ' HD12 ' A' ' 12' ' ' LEU . 57.1 t -59.51 -40.27 81.46 Favored 'Isoleucine or valine' 0 N--CA 1.498 1.963 0 O-C-N 121.301 -0.874 . . . . 0.0 109.416 179.036 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 10' ' ' GLU . . . . . . . . . . . . . 0.9 OUTLIER -61.69 -30.28 70.64 Favored 'General case' 0 N--CA 1.496 1.848 0 O-C-N 121.417 -0.802 . . . . 0.0 110.01 178.828 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 11' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -60.04 -33.81 72.55 Favored 'General case' 0 N--CA 1.5 2.035 0 O-C-N 121.407 -0.808 . . . . 0.0 109.388 178.406 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 12' ' ' LEU . . . . . 0.688 ' HB3' ' CB ' ' A' ' 16' ' ' GLN . 19.4 mt -67.62 -23.76 65.39 Favored 'General case' 0 N--CA 1.498 1.959 0 O-C-N 121.687 -0.633 . . . . 0.0 109.703 178.494 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 13' ' ' THR . . . . . 0.646 HG23 ' C ' ' A' ' 12' ' ' LEU . 1.3 p 74.2 165.78 0.29 Allowed 'General case' 0 N--CA 1.51 2.555 0 C-N-CA 123.47 0.708 . . . . 0.0 110.86 -179.594 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 14' ' ' GLU . . . . . . . . . . . . . 1.1 tp10 -57.33 -30.63 64.96 Favored 'General case' 0 N--CA 1.494 1.751 0 O-C-N 121.645 -0.659 . . . . 0.0 110.779 -178.958 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER -57.53 -47.4 82.1 Favored 'General case' 0 N--CA 1.495 1.782 0 O-C-N 121.436 -0.79 . . . . 0.0 109.395 178.803 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 16' ' ' GLN . . . . . 0.688 ' CB ' ' HB3' ' A' ' 12' ' ' LEU . 27.3 mt-30 -72.79 -38.55 67.2 Favored 'General case' 0 N--CA 1.495 1.815 0 O-C-N 121.459 -0.776 . . . . 0.0 110.076 178.951 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 17' ' ' LYS . . . . . 0.407 ' HD2' HG12 ' A' ' 9' ' ' VAL . 0.0 OUTLIER -56.68 -45.99 81.39 Favored 'General case' 0 N--CA 1.498 1.943 0 N-CA-C 109.259 -0.645 . . . . 0.0 109.259 179.132 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 18' ' ' ASN . . . . . . . . . . . . . 21.2 m-80 -71.21 -36.48 71.91 Favored 'General case' 0 N--CA 1.494 1.766 0 O-C-N 121.603 -0.686 . . . . 0.0 109.249 178.281 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 19' ' ' GLU . . . . . 0.471 ' HB2' ' HA ' ' A' ' 16' ' ' GLN . 15.2 mt-10 -62.24 -52.13 64.98 Favored 'General case' 0 N--CA 1.498 1.96 0 O-C-N 121.568 -0.707 . . . . 0.0 109.95 179.108 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 20' ' ' PHE . . . . . 0.482 ' CE1' ' HG2' ' A' ' 81' ' ' MET . 17.7 m-85 -62.51 -40.03 95.42 Favored 'General case' 0 N--CA 1.497 1.921 0 O-C-N 121.497 -0.752 . . . . 0.0 109.841 179.467 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 21' ' ' LYS . . . . . . . . . . . . . 13.8 tptt -59.1 -46.16 89.01 Favored 'General case' 0 N--CA 1.499 1.993 0 O-C-N 121.433 -0.792 . . . . 0.0 109.534 178.93 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 22' ' ' ALA . . . . . . . . . . . . . . . -68.74 -46.42 68.93 Favored 'General case' 0 N--CA 1.496 1.829 0 O-C-N 121.626 -0.671 . . . . 0.0 109.918 179.436 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 23' ' ' ALA . . . . . . . . . . . . . . . -62.53 -34.72 77.47 Favored 'General case' 0 N--CA 1.498 1.963 0 O-C-N 121.432 -0.792 . . . . 0.0 109.538 178.808 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 24' ' ' PHE . . . . . 0.602 ' CE1' HD12 ' A' ' 36' ' ' ILE . 65.5 t80 -60.39 -48.25 82.55 Favored 'General case' 0 N--CA 1.496 1.829 0 N-CA-C 109.138 -0.69 . . . . 0.0 109.138 178.839 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 25' ' ' ASP . . . . . . . . . . . . . 0.9 OUTLIER -64.36 -34.42 78.12 Favored 'General case' 0 N--CA 1.496 1.852 0 O-C-N 121.54 -0.725 . . . . 0.0 109.361 178.663 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 26' ' ' ILE . . . . . 0.921 ' HA ' HD12 ' A' ' 29' ' ' LEU . 15.9 mm -67.06 -34.69 71.4 Favored 'Isoleucine or valine' 0 N--CA 1.498 1.926 0 O-C-N 121.328 -0.857 . . . . 0.0 109.112 178.372 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 27' ' ' PHE . . . . . . . . . . . . . 0.2 OUTLIER -65.4 -34.52 78.5 Favored 'General case' 0 N--CA 1.498 1.966 0 O-C-N 121.569 -0.707 . . . . 0.0 110.587 179.366 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 28' ' ' VAL . . . . . 0.551 ' HA ' ' HB2' ' A' ' 31' ' ' ALA . 32.9 m -93.4 1.5 9.47 Favored 'Isoleucine or valine' 0 N--CA 1.502 2.142 0 O-C-N 121.283 -0.886 . . . . 0.0 112.064 -179.39 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 29' ' ' LEU . . . . . 0.921 HD12 ' HA ' ' A' ' 26' ' ' ILE . 2.3 mt -63.28 -45.92 89.19 Favored 'General case' 0 N--CA 1.501 2.089 0 O-C-N 120.821 -1.174 . . . . 0.0 109.688 179.33 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 30' ' ' GLY . . . . . . . . . . . . . . . -103.66 43.66 1.63 Allowed Glycine 0 N--CA 1.492 2.414 0 N-CA-C 108.561 -1.815 . . . . 0.0 108.561 178.643 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 31' ' ' ALA . . . . . 0.551 ' HB2' ' HA ' ' A' ' 28' ' ' VAL . . . -104.44 130.85 52.31 Favored 'General case' 0 N--CA 1.496 1.838 0 O-C-N 121.528 -0.984 . . . . 0.0 111.197 -179.18 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 32' ' ' GLU . . . . . . . . . . . . . 2.7 mp0 -77.65 -31.09 52.48 Favored 'General case' 0 N--CA 1.498 1.93 0 O-C-N 121.568 -0.708 . . . . 0.0 110.076 179.205 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 1.2 m-20 -78.66 -36.4 43.87 Favored 'General case' 0 N--CA 1.496 1.85 0 O-C-N 121.513 -0.742 . . . . 0.0 110.54 -179.949 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 34' ' ' GLY . . . . . . . . . . . . . . . 120.65 -36.86 3.22 Favored Glycine 0 N--CA 1.497 2.71 0 N-CA-C 109.411 -1.476 . . . . 0.0 109.411 -179.52 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 35' ' ' CYS . . . . . . . . . . . . . 1.3 m -120.26 -171.31 2.14 Favored 'General case' 0 N--CA 1.497 1.881 0 O-C-N 121.595 -0.944 . . . . 0.0 109.965 179.57 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 36' ' ' ILE . . . . . 0.602 HD12 ' CE1' ' A' ' 24' ' ' PHE . 96.6 mt -90.27 101.64 12.49 Favored 'Isoleucine or valine' 0 N--CA 1.496 1.829 0 O-C-N 121.117 -0.99 . . . . 0.0 110.57 -179.781 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 37' ' ' SER . . . . . . . . . . . . . 83.8 p -113.55 -179.36 3.62 Favored 'General case' 0 N--CA 1.494 1.733 0 N-CA-C 108.983 -0.747 . . . . 0.0 108.983 178.854 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 38' ' ' THR . . . . . 0.65 HG21 ' HG2' ' A' ' 58' ' ' GLN . 8.6 p -62.6 -41.18 98.82 Favored 'General case' 0 N--CA 1.5 2.041 0 O-C-N 120.963 -1.086 . . . . 0.0 110.056 179.515 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 39' ' ' LYS . . . . . 0.528 ' HA ' ' HB3' ' A' ' 54' ' ' PRO . 1.0 OUTLIER -60.94 -35.16 76.01 Favored 'General case' 0 N--CA 1.501 2.079 0 O-C-N 121.485 -0.759 . . . . 0.0 110.018 179.263 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 1.1 tp10 -83.41 -39.2 20.93 Favored 'General case' 0 N--CA 1.493 1.709 0 O-C-N 121.507 -0.746 . . . . 0.0 109.636 179.041 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 41' ' ' LEU . . . . . 0.485 HD11 ' CG ' ' A' ' 45' ' ' MET . 9.1 tp -62.63 -49.0 76.91 Favored 'General case' 0 N--CA 1.498 1.957 0 O-C-N 121.623 -0.673 . . . . 0.0 110.588 179.72 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 42' ' ' GLY . . . . . . . . . . . . . . . -54.36 -38.41 62.23 Favored Glycine 0 N--CA 1.494 2.549 0 N-CA-C 110.84 -0.904 . . . . 0.0 110.84 -179.038 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 43' ' ' LYS . . . . . . . . . . . . . 0.4 OUTLIER -54.49 -41.48 69.62 Favored 'General case' 0 N--CA 1.503 2.199 0 O-C-N 121.309 -1.112 . . . . 0.0 110.298 179.686 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 44' ' ' VAL . . . . . . . . . . . . . 44.0 t -83.08 -36.65 13.09 Favored 'Isoleucine or valine' 0 N--CA 1.499 2.014 0 O-C-N 121.349 -0.844 . . . . 0.0 109.876 179.21 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 45' ' ' MET . . . . . 0.704 ' HB3' ' HB2' ' A' ' 51' ' ' ASN . 69.4 mmm -61.91 -41.22 97.67 Favored 'General case' 0 N--CA 1.501 2.098 0 O-C-N 121.527 -0.733 . . . . 0.0 110.47 179.815 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 46' ' ' ARG . . . . . . . . . . . . . 8.9 tpt180 -67.34 -36.98 82.52 Favored 'General case' 0 N--CA 1.497 1.885 0 O-C-N 121.304 -0.872 . . . . 0.0 109.592 179.153 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 47' ' ' MET . . . . . . . . . . . . . 43.2 ttp -75.59 -1.97 26.99 Favored 'General case' 0 N--CA 1.499 1.977 0 O-C-N 121.559 -0.713 . . . . 0.0 110.46 178.704 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 48' ' ' LEU . . . . . . . . . . . . . 4.2 tp -119.66 -54.74 2.15 Favored 'General case' 0 N--CA 1.493 1.702 0 O-C-N 121.024 -1.048 . . . . 0.0 109.728 179.95 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 49' ' ' GLY . . . . . . . . . . . . . . . -114.04 -116.62 3.25 Favored Glycine 0 N--CA 1.494 2.515 0 N-CA-C 109.221 -1.552 . . . . 0.0 109.221 179.426 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 50' ' ' GLN . . . . . 0.482 ' O ' ' HD3' ' A' ' 52' ' ' PRO . 0.8 OUTLIER -139.11 13.68 2.63 Favored 'General case' 0 N--CA 1.5 2.067 0 O-C-N 121.375 -1.074 . . . . 0.0 111.933 -179.866 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 51' ' ' ASN . . . . . 0.704 ' HB2' ' HB3' ' A' ' 45' ' ' MET . 8.2 m120 -78.0 108.88 8.35 Favored Pre-proline 0 N--CA 1.505 2.291 0 O-C-N 121.02 -1.05 . . . . 0.0 109.633 179.897 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 52' ' ' PRO . . . . . 0.482 ' HD3' ' O ' ' A' ' 50' ' ' GLN . 45.2 Cg_endo -93.15 -73.6 0.0 OUTLIER 'Trans proline' 0 C--N 1.313 -1.292 0 C-N-CA 121.728 1.619 . . . . 0.0 112.627 -177.983 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 53' ' ' THR . . . . . . . . . . . . . 11.7 p -67.9 142.55 95.61 Favored Pre-proline 0 N--CA 1.499 1.986 0 O-C-N 121.311 -0.868 . . . . 0.0 111.599 -178.298 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 54' ' ' PRO . . . . . 0.528 ' HB3' ' HA ' ' A' ' 39' ' ' LYS . 43.4 Cg_endo -67.41 -32.81 31.38 Favored 'Trans proline' 0 N--CA 1.491 1.359 0 O-C-N 124.285 1.676 . . . . 0.0 110.893 179.577 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 55' ' ' GLU . . . . . . . . . . . . . 1.6 mp0 -57.92 -31.95 67.29 Favored 'General case' 0 N--CA 1.502 2.144 0 O-C-N 121.4 -0.813 . . . . 0.0 109.988 179.508 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 1.0 OUTLIER -62.8 -38.48 90.86 Favored 'General case' 0 N--CA 1.496 1.874 0 O-C-N 121.543 -0.723 . . . . 0.0 110.13 179.408 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 57' ' ' LEU . . . . . 0.523 ' H ' HD22 ' A' ' 57' ' ' LEU . 0.5 OUTLIER -87.5 -12.55 45.6 Favored 'General case' 0 N--CA 1.495 1.801 0 O-C-N 121.291 -0.88 . . . . 0.0 110.66 179.624 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 58' ' ' GLN . . . . . 0.65 ' HG2' HG21 ' A' ' 38' ' ' THR . 0.0 OUTLIER -56.27 -38.09 70.68 Favored 'General case' 0 N--CA 1.502 2.154 0 O-C-N 121.218 -0.926 . . . . 0.0 110.55 179.838 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 59' ' ' GLU . . . . . . . . . . . . . 0.9 OUTLIER -58.95 -32.16 69.36 Favored 'General case' 0 N--CA 1.498 1.951 0 O-C-N 121.018 -1.052 . . . . 0.0 109.439 178.82 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 60' ' ' MET . . . . . 0.439 ' CE ' HD12 ' A' ' 57' ' ' LEU . 40.7 mtm -78.41 -47.47 17.51 Favored 'General case' 0 N--CA 1.495 1.786 0 O-C-N 121.586 -0.696 . . . . 0.0 110.244 179.03 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 61' ' ' ILE . . . . . 0.717 HG13 HG23 ' A' ' 72' ' ' VAL . 11.0 tt -62.36 -41.57 92.21 Favored 'Isoleucine or valine' 0 N--CA 1.501 2.108 0 O-C-N 121.219 -0.926 . . . . 0.0 110.39 179.812 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 62' ' ' ASP . . . . . . . . . . . . . 0.8 OUTLIER -64.77 -36.3 83.88 Favored 'General case' 0 N--CA 1.499 2.015 0 O-C-N 121.249 -0.907 . . . . 0.0 110.159 179.286 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 63' ' ' GLU . . . . . . . . . . . . . 3.1 tt0 -63.0 -28.56 70.18 Favored 'General case' 0 N--CA 1.498 1.954 0 O-C-N 121.48 -0.762 . . . . 0.0 110.435 179.196 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 64' ' ' VAL . . . . . . . . . . . . . 4.0 t -114.95 25.85 4.03 Favored 'Isoleucine or valine' 0 N--CA 1.498 1.971 0 O-C-N 121.203 -0.936 . . . . 0.0 110.567 179.838 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 65' ' ' ASP . . . . . 0.498 ' HB2' ' O ' ' A' ' 61' ' ' ILE . 16.9 t70 -110.64 -73.9 0.67 Allowed 'General case' 0 N--CA 1.5 2.03 0 O-C-N 120.966 -1.084 . . . . 0.0 110.551 179.973 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 66' ' ' GLU . . . . . . . . . . . . . 7.7 tt0 57.92 23.31 9.67 Favored 'General case' 0 N--CA 1.501 2.109 0 O-C-N 121.607 -0.683 . . . . 0.0 110.86 -179.396 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 67' ' ' ASP . . . . . . . . . . . . . 64.9 m-20 -111.85 5.29 18.9 Favored 'General case' 0 N--CA 1.496 1.853 0 O-C-N 121.257 -0.902 . . . . 0.0 110.948 179.669 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 68' ' ' GLY . . . . . . . . . . . . . . . 63.49 38.06 95.74 Favored Glycine 0 N--CA 1.495 2.599 0 N-CA-C 108.703 -1.759 . . . . 0.0 108.703 -178.931 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 69' ' ' SER . . . . . . . . . . . . . 71.0 p -139.11 -53.53 0.57 Allowed 'General case' 0 N--CA 1.495 1.8 0 O-C-N 121.626 -0.926 . . . . 0.0 110.73 -179.1 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 70' ' ' GLY . . . . . . . . . . . . . . . 90.25 45.35 4.43 Favored Glycine 0 N--CA 1.497 2.738 0 N-CA-C 108.639 -1.785 . . . . 0.0 108.639 -179.308 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 71' ' ' THR . . . . . . . . . . . . . 0.9 OUTLIER -140.44 126.1 19.17 Favored 'General case' 0 N--CA 1.493 1.72 0 O-C-N 121.861 -0.788 . . . . 0.0 109.993 -179.154 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 72' ' ' VAL . . . . . 0.717 HG23 HG13 ' A' ' 61' ' ' ILE . 53.9 t -80.66 105.88 11.06 Favored 'Isoleucine or valine' 0 N--CA 1.497 1.879 0 O-C-N 121.535 -0.728 . . . . 0.0 110.567 -179.98 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 73' ' ' ASP . . . . . 0.4 ' O ' ' HB2' ' A' ' 77' ' ' PHE . 1.1 t70 -85.29 -162.9 0.76 Allowed 'General case' 0 N--CA 1.495 1.799 0 O-C-N 121.366 -0.834 . . . . 0.0 109.854 179.287 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 74' ' ' PHE . . . . . . . . . . . . . 25.7 t80 -64.91 -50.86 64.84 Favored 'General case' 0 N--CA 1.499 1.988 0 O-C-N 121.085 -1.009 . . . . 0.0 110.278 -179.917 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 75' ' ' ASP . . . . . . . . . . . . . 25.0 t70 -60.19 -49.61 76.93 Favored 'General case' 0 N--CA 1.497 1.902 0 O-C-N 121.543 -0.723 . . . . 0.0 109.947 179.31 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 76' ' ' GLU . . . . . . . . . . . . . 30.5 mt-10 -60.73 -37.93 83.42 Favored 'General case' 0 N--CA 1.498 1.929 0 O-C-N 121.473 -0.767 . . . . 0.0 110.468 179.633 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 77' ' ' PHE . . . . . 0.4 ' HB2' ' O ' ' A' ' 73' ' ' ASP . 42.6 t80 -59.63 -48.29 82.24 Favored 'General case' 0 N--CA 1.498 1.973 0 O-C-N 121.317 -0.864 . . . . 0.0 110.142 179.445 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 78' ' ' LEU . . . . . . . . . . . . . 16.2 mt -66.84 -37.88 85.32 Favored 'General case' 0 N--CA 1.501 2.09 0 O-C-N 121.41 -0.806 . . . . 0.0 110.023 179.579 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 79' ' ' VAL . . . . . . . . . . . . . 39.2 t -59.71 -36.7 67.27 Favored 'Isoleucine or valine' 0 N--CA 1.499 2.025 0 O-C-N 121.49 -0.756 . . . . 0.0 110.012 179.192 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 80' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -69.99 -40.34 75.35 Favored 'General case' 0 N--CA 1.496 1.849 0 O-C-N 121.359 -0.838 . . . . 0.0 109.868 179.332 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 81' ' ' MET . . . . . 0.482 ' HG2' ' CE1' ' A' ' 20' ' ' PHE . 0.0 OUTLIER -62.53 -48.4 79.71 Favored 'General case' 0 N--CA 1.496 1.848 0 O-C-N 121.557 -0.714 . . . . 0.0 109.976 179.515 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 82' ' ' VAL . . . . . . . . . . . . . 34.3 m -67.44 -28.18 41.27 Favored 'Isoleucine or valine' 0 N--CA 1.499 2.018 0 O-C-N 121.251 -0.905 . . . . 0.0 109.805 179.016 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 83' ' ' ARG . . . . . . . . . . . . . 7.2 mtt85 -61.58 -39.97 93.08 Favored 'General case' 0 N--CA 1.497 1.91 0 O-C-N 121.348 -0.845 . . . . 0.0 109.518 178.779 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 84' ' ' CYS . . . . . . . . . . . . . 5.2 t -62.49 -35.57 79.77 Favored 'General case' 0 N--CA 1.498 1.95 0 O-C-N 121.542 -0.724 . . . . 0.0 110.002 178.882 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 85' ' ' MET . . . . . 0.431 ' O ' ' HB3' ' A' ' 86' ' ' LYS . 0.0 OUTLIER -75.75 -35.17 60.26 Favored 'General case' 0 N--CA 1.499 1.982 0 O-C-N 121.408 -0.807 . . . . 0.0 110.353 179.341 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 86' ' ' LYS . . . . . 0.527 ' HE2' ' HA ' ' A' ' 86' ' ' LYS . 0.0 OUTLIER 61.81 -85.09 0.02 OUTLIER 'General case' 0 N--CA 1.499 2.008 0 O-C-N 121.962 -0.461 . . . . 0.0 110.895 -179.611 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 87' ' ' ASP . . . . . . . . . . . . . 3.9 m-20 -129.45 62.79 1.52 Allowed 'General case' 0 N--CA 1.495 1.775 0 O-C-N 121.134 -0.979 . . . . 0.0 110.311 -179.84 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 88' ' ' ASP . . . . . . . . . . . . . 3.0 t70 -109.46 106.84 16.75 Favored 'General case' 0 N--CA 1.495 1.802 0 O-C-N 121.23 -0.918 . . . . 0.0 110.196 179.892 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 89' ' ' SER . . . . . . . . . . . . . 26.4 p . . . . . 0 N--CA 1.496 1.871 0 CA-C-O 118.265 -0.874 . . . . 0.0 110.527 -179.884 . . . . . . . . 0 0 . 1 . 007 nuclear nobuild full ' B' B ' 144' ' ' ARG . . . . . . . . . . . . . 20.2 tpt85 . . . . . 0 N--CA 1.5 2.051 0 N-CA-C 110.155 -0.313 . . . . 0.0 110.155 . . . . . . . . . 0 0 . 1 . 007 nuclear nobuild full ' B' B ' 145' ' ' ARG . . . . . . . . . . . . . 21.1 mtt85 -75.07 -56.66 4.51 Favored 'General case' 0 N--CA 1.498 1.97 0 O-C-N 121.223 -0.923 . . . . 0.0 109.808 179.372 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 146' ' ' VAL . . . . . 0.675 HG23 ' HAF' ' A' ' 91' ' ' SXK . 27.6 m -119.23 -177.01 1.12 Allowed 'Isoleucine or valine' 0 N--CA 1.498 1.964 0 O-C-N 121.687 -0.633 . . . . 0.0 109.325 179.138 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' B' B ' 147' ' ' ARG . . . . . 0.412 ' HD2' ' HA ' ' B' ' 147' ' ' ARG . 12.4 mmm180 -137.85 60.02 1.64 Allowed 'General case' 0 N--CA 1.498 1.927 0 O-C-N 121.049 -1.032 . . . . 0.0 111.118 -179.744 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' B' B ' 148' ' ' ILE . . . . . . . . . . . . . 1.8 mp -90.68 117.5 34.07 Favored 'Isoleucine or valine' 0 N--CA 1.496 1.859 0 O-C-N 121.29 -0.881 . . . . 0.0 109.475 179.078 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 149' ' ' SER . . . . . . . . . . . . . 34.8 p -84.95 164.89 18.05 Favored 'General case' 0 N--CA 1.497 1.91 0 O-C-N 121.506 -0.746 . . . . 0.0 110.957 -179.432 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 150' ' ' ALA . . . . . . . . . . . . . . . -67.94 -28.5 67.53 Favored 'General case' 0 N--CA 1.494 1.761 0 O-C-N 121.568 -0.707 . . . . 0.0 110.438 179.482 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 151' ' ' ASP . . . . . . . . . . . . . 22.9 t70 -75.27 -39.43 59.75 Favored 'General case' 0 N--CA 1.499 2.005 0 O-C-N 121.32 -0.863 . . . . 0.0 110.563 179.561 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 152' ' ' ALA . . . . . . . . . . . . . . . -52.47 -36.71 55.48 Favored 'General case' 0 N--CA 1.501 2.117 0 O-C-N 121.508 -0.745 . . . . 0.0 110.992 -179.871 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 153' ' ' MET . . . . . 0.477 ' O ' HD12 ' B' ' 157' ' ' LEU . 0.0 OUTLIER -77.47 -35.77 53.45 Favored 'General case' 0 N--CA 1.495 1.815 0 O-C-N 121.17 -0.956 . . . . 0.0 110.477 179.712 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' B' B ' 154' ' ' MET . . . . . . . . . . . . . 0.7 OUTLIER -62.91 -53.4 54.65 Favored 'General case' 0 N--CA 1.5 2.034 0 O-C-N 121.264 -0.898 . . . . 0.0 110.095 179.685 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' B' B ' 155' ' ' GLN . . . . . . . . . . . . . 2.1 pp0? -62.81 -22.15 66.43 Favored 'General case' 0 N--CA 1.5 2.075 0 O-C-N 121.187 -0.945 . . . . 0.0 110.379 179.101 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 156' ' ' ALA . . . . . . . . . . . . . . . -82.58 -40.96 20.17 Favored 'General case' 0 N--CA 1.495 1.79 0 O-C-N 121.235 -0.916 . . . . 0.0 110.448 179.266 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 157' ' ' LEU . . . . . 0.477 HD12 ' O ' ' B' ' 153' ' ' MET . 2.0 mt -91.69 -59.11 2.21 Favored 'General case' 0 N--CA 1.499 2.008 0 O-C-N 121.29 -0.882 . . . . 0.0 110.408 179.996 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' B' B ' 158' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -65.97 -42.11 90.33 Favored 'General case' 0 N--CA 1.499 2.014 0 O-C-N 121.305 -0.872 . . . . 0.0 110.46 179.745 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' B' B ' 159' ' ' GLY . . . . . . . . . . . . . . . -59.84 -27.62 64.59 Favored Glycine 0 N--CA 1.498 2.8 0 N-CA-C 110.154 -1.179 . . . . 0.0 110.154 179.718 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 160' ' ' ALA . . . . . . . . . . . . . . . -91.67 -30.25 16.42 Favored 'General case' 0 N--CA 1.496 1.829 0 O-C-N 121.286 -1.126 . . . . 0.0 111.404 -179.892 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 161' ' ' ARG . . . . . . . . . . . . . 77.6 mtt-85 -110.98 -61.33 1.71 Allowed 'General case' 0 N--CA 1.502 2.149 0 O-C-N 121.027 -1.045 . . . . 0.0 111.69 -179.193 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 162' ' ' ALA . . . . . . . . . . . . . . . -78.31 93.24 4.63 Favored 'General case' 0 N--CA 1.501 2.093 0 O-C-N 121.238 -0.914 . . . . 0.0 111.229 -179.036 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 163' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.498 1.938 0 O-C-N 121.379 -0.826 . . . . 0.0 110.721 179.568 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 90' ' ' ' CA' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 007 nuclear nobuild full ' A' A ' 91' ' ' SXK . . . . . 0.675 ' HAF' HG23 ' B' ' 146' ' ' VAL . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 4.3 mtt . . . . . 0 N--CA 1.495 1.813 0 CA-C-O 120.984 0.421 . . . . 0.0 110.265 . . . . . . . . . 0 0 . 1 . 008 nuclear nobuild full ' A' A ' 2' ' ' ASP . . . . . 0.668 ' HB3' ' HB2' ' A' ' 6' ' ' LYS . 5.2 t70 -92.9 163.82 13.55 Favored 'General case' 0 N--CA 1.496 1.861 0 O-C-N 121.384 -0.823 . . . . 0.0 110.335 -179.906 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 3' ' ' ASP . . . . . . . . . . . . . 2.4 p-10 -121.15 -42.76 2.46 Favored 'General case' 0 N--CA 1.497 1.923 0 O-C-N 121.525 -0.734 . . . . 0.0 111.459 -179.515 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 4' ' ' ILE . . . . . 0.428 HG23 ' N ' ' A' ' 5' ' ' TYR . 1.7 tt -94.15 -39.82 10.88 Favored 'Isoleucine or valine' 0 N--CA 1.501 2.108 0 O-C-N 121.087 -1.008 . . . . 0.0 111.615 -179.002 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 5' ' ' TYR . . . . . 0.51 ' CG ' ' HG2' ' A' ' 83' ' ' ARG . 57.5 m-85 -76.75 -38.8 53.52 Favored 'General case' 0 N--CA 1.5 2.026 0 O-C-N 121.098 -1.001 . . . . 0.0 110.156 179.989 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 6' ' ' LYS . . . . . 0.668 ' HB2' ' HB3' ' A' ' 2' ' ' ASP . 12.3 ttpp -66.37 -37.81 86.14 Favored 'General case' 0 N--CA 1.494 1.771 0 O-C-N 121.411 -0.806 . . . . 0.0 109.456 178.9 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 7' ' ' ALA . . . . . . . . . . . . . . . -56.17 -43.64 78.56 Favored 'General case' 0 N--CA 1.498 1.971 0 O-C-N 121.534 -0.729 . . . . 0.0 110.209 179.313 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 8' ' ' ALA . . . . . . . . . . . . . . . -61.09 -39.85 91.48 Favored 'General case' 0 N--CA 1.499 2.018 0 O-C-N 121.437 -0.789 . . . . 0.0 109.977 179.149 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 9' ' ' VAL . . . . . 0.807 HG21 ' HA ' ' A' ' 79' ' ' VAL . 53.0 t -75.36 -43.65 42.8 Favored 'Isoleucine or valine' 0 N--CA 1.496 1.864 0 O-C-N 121.483 -0.761 . . . . 0.0 110.32 179.587 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 10' ' ' GLU . . . . . 0.445 ' CD ' ' HG2' ' A' ' 6' ' ' LYS . 58.6 mt-10 -57.8 -36.73 72.6 Favored 'General case' 0 N--CA 1.498 1.935 0 O-C-N 121.437 -0.789 . . . . 0.0 109.701 179.383 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 11' ' ' GLN . . . . . . . . . . . . . 0.2 OUTLIER -108.19 47.83 0.88 Allowed 'General case' 0 N--CA 1.482 1.152 0 O-C-N 121.417 -0.802 . . . . 0.0 109.704 179.363 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 12' ' ' LEU . . . . . . . . . . . . . 1.5 mt -82.03 150.68 27.47 Favored 'General case' 0 N--CA 1.497 1.911 0 O-C-N 121.304 -0.873 . . . . 0.0 110.714 -179.748 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 13' ' ' THR . . . . . . . . . . . . . 45.4 p -83.12 152.69 25.19 Favored 'General case' 0 N--CA 1.498 1.956 0 O-C-N 121.462 -0.774 . . . . 0.0 109.922 179.396 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 14' ' ' GLU . . . . . 0.622 ' HA ' ' HD3' ' A' ' 17' ' ' LYS . 5.0 tp10 -56.71 -32.2 65.26 Favored 'General case' 0 N--CA 1.492 1.666 0 O-C-N 121.554 -0.716 . . . . 0.0 110.767 -179.415 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 1.5 mp0 -60.58 -47.85 84.38 Favored 'General case' 0 N--CA 1.497 1.889 0 O-C-N 121.355 -0.84 . . . . 0.0 109.805 179.351 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 16' ' ' GLN . . . . . 0.446 ' HA ' ' HB3' ' A' ' 19' ' ' GLU . 5.4 mt-30 -77.45 -27.89 52.28 Favored 'General case' 0 N--CA 1.496 1.832 0 O-C-N 121.259 -0.9 . . . . 0.0 110.607 179.347 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 17' ' ' LYS . . . . . 0.622 ' HD3' ' HA ' ' A' ' 14' ' ' GLU . 0.2 OUTLIER -60.53 -46.67 89.31 Favored 'General case' 0 N--CA 1.498 1.965 0 O-C-N 121.513 -0.742 . . . . 0.0 109.547 179.138 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 18' ' ' ASN . . . . . . . . . . . . . 50.5 t30 -72.77 -34.26 66.84 Favored 'General case' 0 N--CA 1.496 1.863 0 O-C-N 121.581 -0.699 . . . . 0.0 109.926 179.061 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 19' ' ' GLU . . . . . 0.446 ' HB3' ' HA ' ' A' ' 16' ' ' GLN . 3.6 tt0 -60.47 -49.15 78.72 Favored 'General case' 0 N--CA 1.497 1.903 0 O-C-N 121.477 -0.764 . . . . 0.0 109.578 179.265 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 20' ' ' PHE . . . . . . . . . . . . . 16.9 m-85 -68.1 -32.36 72.61 Favored 'General case' 0 N--CA 1.499 2.0 0 O-C-N 121.316 -0.865 . . . . 0.0 110.092 179.123 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 21' ' ' LYS . . . . . . . . . . . . . 13.9 tptp -58.42 -45.44 88.46 Favored 'General case' 0 N--CA 1.495 1.822 0 O-C-N 121.604 -0.685 . . . . 0.0 109.611 179.43 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 22' ' ' ALA . . . . . . . . . . . . . . . -59.43 -44.23 92.95 Favored 'General case' 0 N--CA 1.496 1.847 0 O-C-N 121.514 -0.742 . . . . 0.0 110.271 179.373 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 23' ' ' ALA . . . . . . . . . . . . . . . -64.87 -44.48 89.54 Favored 'General case' 0 N--CA 1.501 2.088 0 O-C-N 121.283 -0.886 . . . . 0.0 109.926 179.209 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 24' ' ' PHE . . . . . . . . . . . . . 40.8 t80 -66.75 -38.73 87.22 Favored 'General case' 0 N--CA 1.496 1.835 0 O-C-N 121.609 -0.682 . . . . 0.0 110.303 179.505 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 25' ' ' ASP . . . . . 0.414 ' O ' HG22 ' A' ' 28' ' ' VAL . 9.1 t70 -54.73 -52.36 62.73 Favored 'General case' 0 N--CA 1.501 2.115 0 O-C-N 121.606 -0.684 . . . . 0.0 111.012 -179.805 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 26' ' ' ILE . . . . . 0.424 ' HB ' HD12 ' B' ' 157' ' ' LEU . 19.7 mt -69.8 -27.8 34.61 Favored 'Isoleucine or valine' 0 N--CA 1.498 1.959 0 O-C-N 121.145 -0.972 . . . . 0.0 110.266 179.856 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 27' ' ' PHE . . . . . 0.469 ' CD2' HD21 ' B' ' 157' ' ' LEU . 0.3 OUTLIER -65.23 -32.75 74.58 Favored 'General case' 0 N--CA 1.498 1.956 0 O-C-N 121.244 -0.91 . . . . 0.0 111.05 179.81 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 28' ' ' VAL . . . . . 0.414 HG22 ' O ' ' A' ' 25' ' ' ASP . 33.0 m -91.75 34.02 0.11 Allowed 'Isoleucine or valine' 0 N--CA 1.501 2.12 0 O-C-N 121.121 -0.987 . . . . 0.0 110.816 179.945 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 29' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -67.02 -42.18 85.37 Favored 'General case' 0 N--CA 1.498 1.945 0 O-C-N 121.111 -0.993 . . . . 0.0 110.176 179.459 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 30' ' ' GLY . . . . . . . . . . . . . . . -105.92 40.2 2.58 Favored Glycine 0 N--CA 1.495 2.578 0 N-CA-C 109.488 -1.445 . . . . 0.0 109.488 179.475 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 31' ' ' ALA . . . . . . . . . . . . . . . -120.89 94.55 4.38 Favored 'General case' 0 N--CA 1.496 1.849 0 O-C-N 121.364 -1.08 . . . . 0.0 110.203 -179.982 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 32' ' ' GLU . . . . . . . . . . . . . 8.0 tt0 -63.02 -31.64 72.83 Favored 'General case' 0 N--CA 1.5 2.04 0 O-C-N 121.452 -0.78 . . . . 0.0 110.691 -179.921 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 8.9 p-10 -67.28 -30.05 69.83 Favored 'General case' 0 N--CA 1.496 1.872 0 O-C-N 121.403 -0.81 . . . . 0.0 110.501 179.435 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 34' ' ' GLY . . . . . . . . . . . . . . . 112.68 -35.32 4.67 Favored Glycine 0 N--CA 1.498 2.803 0 O-C-N 121.13 -0.981 . . . . 0.0 110.755 179.265 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 35' ' ' CYS . . . . . . . . . . . . . 58.2 m -87.4 -170.22 2.94 Favored 'General case' 0 N--CA 1.497 1.889 0 O-C-N 121.219 -1.165 . . . . 0.0 110.339 -179.863 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 36' ' ' ILE . . . . . . . . . . . . . 25.9 mt -102.13 129.26 53.79 Favored 'Isoleucine or valine' 0 N--CA 1.496 1.863 0 O-C-N 121.168 -0.957 . . . . 0.0 110.425 -179.685 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 37' ' ' SER . . . . . . . . . . . . . 3.4 t -107.17 163.68 12.8 Favored 'General case' 0 N--CA 1.495 1.795 0 O-C-N 121.484 -0.76 . . . . 0.0 109.722 179.133 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 38' ' ' THR . . . . . 0.725 HG21 ' HA ' ' A' ' 58' ' ' GLN . 77.1 p -63.05 -30.38 71.55 Favored 'General case' 0 N--CA 1.501 2.105 0 O-C-N 121.294 -0.879 . . . . 0.0 110.27 179.64 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 39' ' ' LYS . . . . . . . . . . . . . 1.6 mptp? -58.93 -42.96 91.02 Favored 'General case' 0 N--CA 1.497 1.912 0 O-C-N 121.535 -0.728 . . . . 0.0 109.837 179.343 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 40' ' ' GLU . . . . . 0.402 ' HA ' ' HD2' ' A' ' 43' ' ' LYS . 1.6 mp0 -74.25 -37.22 63.84 Favored 'General case' 0 N--CA 1.498 1.942 0 O-C-N 121.463 -0.773 . . . . 0.0 109.942 179.442 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 41' ' ' LEU . . . . . 0.504 HD22 ' HAK' ' A' ' 91' ' ' SXK . 6.2 tp -60.69 -47.56 85.7 Favored 'General case' 0 N--CA 1.495 1.789 0 O-C-N 121.499 -0.751 . . . . 0.0 109.807 179.499 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 42' ' ' GLY . . . . . . . . . . . . . . . -54.62 -39.84 68.22 Favored Glycine 0 N--CA 1.494 2.536 0 N-CA-C 109.887 -1.285 . . . . 0.0 109.887 179.688 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 43' ' ' LYS . . . . . 0.402 ' HD2' ' HA ' ' A' ' 40' ' ' GLU . 16.0 mttp -58.34 -40.19 81.49 Favored 'General case' 0 N--CA 1.501 2.084 0 O-C-N 121.34 -1.094 . . . . 0.0 110.033 179.171 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 44' ' ' VAL . . . . . . . . . . . . . 45.0 t -75.25 -38.45 41.11 Favored 'Isoleucine or valine' 0 N--CA 1.497 1.901 0 O-C-N 121.36 -0.838 . . . . 0.0 109.39 179.108 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 45' ' ' MET . . . . . 0.401 ' CE ' HD11 ' A' ' 41' ' ' LEU . 1.6 mmt -57.14 -43.29 82.28 Favored 'General case' 0 N--CA 1.498 1.936 0 O-C-N 121.713 -0.617 . . . . 0.0 110.031 179.343 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 46' ' ' ARG . . . . . . . . . . . . . 0.4 OUTLIER -63.12 -39.9 96.04 Favored 'General case' 0 N--CA 1.496 1.853 0 O-C-N 121.571 -0.706 . . . . 0.0 109.783 179.234 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 47' ' ' MET . . . . . . . . . . . . . 6.0 ttp -63.54 -29.35 70.63 Favored 'General case' 0 N--CA 1.497 1.875 0 O-C-N 121.569 -0.707 . . . . 0.0 110.188 179.036 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 48' ' ' LEU . . . . . . . . . . . . . 1.9 tt -72.13 -39.64 68.66 Favored 'General case' 0 N--CA 1.495 1.823 0 O-C-N 121.391 -0.818 . . . . 0.0 110.65 179.618 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 49' ' ' GLY . . . . . . . . . . . . . . . 144.29 -29.85 1.9 Allowed Glycine 0 N--CA 1.499 2.859 0 C-N-CA 120.113 -1.041 . . . . 0.0 110.627 179.982 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 50' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -127.07 129.8 48.69 Favored 'General case' 0 N--CA 1.501 2.082 0 O-C-N 121.21 -1.171 . . . . 0.0 111.166 -179.628 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 51' ' ' ASN . . . . . . . . . . . . . 43.3 t30 -172.15 104.87 0.35 Allowed Pre-proline 0 N--CA 1.496 1.845 0 O-C-N 121.549 -0.719 . . . . 0.0 110.363 179.319 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 52' ' ' PRO . . . . . . . . . . . . . 43.3 Cg_endo -76.95 -71.8 0.01 OUTLIER 'Trans proline' 0 C--N 1.311 -1.396 0 O-C-N 123.859 1.452 . . . . 0.0 110.565 179.562 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 53' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -139.96 150.77 63.47 Favored Pre-proline 0 N--CA 1.501 2.079 0 O-C-N 121.172 -0.955 . . . . 0.0 109.812 179.641 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 54' ' ' PRO . . . . . 0.465 ' O ' ' HB ' ' A' ' 38' ' ' THR . 45.3 Cg_endo -70.4 -48.17 0.63 Allowed 'Trans proline' 0 N--CA 1.491 1.368 0 O-C-N 123.837 1.44 . . . . 0.0 111.208 -179.483 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 55' ' ' GLU . . . . . 0.487 ' O ' ' HB2' ' A' ' 58' ' ' GLN . 11.3 mm-40 -66.63 -20.01 65.9 Favored 'General case' 0 N--CA 1.499 2.013 0 O-C-N 121.19 -0.944 . . . . 0.0 110.855 -179.983 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 7.6 tt0 -61.3 -25.41 67.1 Favored 'General case' 0 N--CA 1.499 1.976 0 O-C-N 121.149 -0.97 . . . . 0.0 110.321 178.981 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 57' ' ' LEU . . . . . 0.451 HD13 ' HG ' ' A' ' 41' ' ' LEU . 4.6 mt -85.78 -9.21 57.44 Favored 'General case' 0 N--CA 1.498 1.939 0 O-C-N 121.39 -0.819 . . . . 0.0 111.672 -179.875 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 58' ' ' GLN . . . . . 0.742 ' O ' HG22 ' A' ' 61' ' ' ILE . 1.7 mm100 -48.69 -53.86 17.1 Favored 'General case' 0 N--CA 1.505 2.302 0 O-C-N 121.136 -0.978 . . . . 0.0 111.38 -179.362 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 59' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -51.27 -33.91 30.55 Favored 'General case' 0 N--CA 1.502 2.153 0 O-C-N 121.299 -0.876 . . . . 0.0 110.881 179.868 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 60' ' ' MET . . . . . . . . . . . . . 1.5 ttp -75.31 -35.36 61.26 Favored 'General case' 0 N--CA 1.496 1.871 0 O-C-N 121.294 -0.879 . . . . 0.0 110.646 179.406 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 61' ' ' ILE . . . . . 0.742 HG22 ' O ' ' A' ' 58' ' ' GLN . 8.6 tt -65.22 -31.75 55.26 Favored 'Isoleucine or valine' 0 N--CA 1.501 2.083 0 O-C-N 121.021 -1.049 . . . . 0.0 110.276 179.62 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 62' ' ' ASP . . . . . . . . . . . . . 22.6 m-20 -76.99 -28.86 55.23 Favored 'General case' 0 N--CA 1.496 1.873 0 O-C-N 121.268 -0.895 . . . . 0.0 109.955 179.066 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 63' ' ' GLU . . . . . . . . . . . . . 6.6 mt-10 -59.11 -49.58 77.33 Favored 'General case' 0 N--CA 1.5 2.063 0 O-C-N 121.518 -0.739 . . . . 0.0 110.411 179.37 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 64' ' ' VAL . . . . . . . . . . . . . 14.6 p -84.33 -10.79 11.67 Favored 'Isoleucine or valine' 0 N--CA 1.497 1.9 0 O-C-N 121.661 -0.65 . . . . 0.0 111.122 -179.679 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 65' ' ' ASP . . . . . . . . . . . . . 24.9 t70 -69.13 133.72 48.39 Favored 'General case' 0 N--CA 1.497 1.887 0 O-C-N 120.945 -1.097 . . . . 0.0 110.032 179.553 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 66' ' ' GLU . . . . . . . . . . . . . 25.4 mt-10 -128.73 25.89 5.63 Favored 'General case' 0 N--CA 1.495 1.823 0 O-C-N 121.322 -0.861 . . . . 0.0 111.219 -179.493 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 67' ' ' ASP . . . . . . . . . . . . . 1.6 p-10 -124.97 -21.2 4.75 Favored 'General case' 0 N--CA 1.498 1.967 0 O-C-N 120.822 -1.174 . . . . 0.0 112.162 -179.878 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 68' ' ' GLY . . . . . . . . . . . . . . . 114.91 -37.13 3.62 Favored Glycine 0 N--CA 1.497 2.762 0 O-C-N 120.825 -1.172 . . . . 0.0 110.466 179.665 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 69' ' ' SER . . . . . . . . . . . . . 38.9 p -58.87 -32.0 69.08 Favored 'General case' 0 N--CA 1.502 2.162 0 O-C-N 121.361 -1.082 . . . . 0.0 110.996 -179.883 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 70' ' ' GLY . . . . . . . . . . . . . . . 93.27 -40.1 2.86 Favored Glycine 0 N--CA 1.499 2.845 0 N-CA-C 110.185 -1.166 . . . . 0.0 110.185 -179.824 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 71' ' ' THR . . . . . . . . . . . . . 14.0 m -64.34 144.69 56.97 Favored 'General case' 0 N--CA 1.501 2.113 0 O-C-N 121.262 -1.14 . . . . 0.0 110.273 -179.841 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 72' ' ' VAL . . . . . 0.666 HG23 ' CG1' ' A' ' 61' ' ' ILE . 2.1 t -77.62 119.36 26.16 Favored 'Isoleucine or valine' 0 N--CA 1.497 1.901 0 O-C-N 121.377 -0.827 . . . . 0.0 110.105 179.867 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 73' ' ' ASP . . . . . . . . . . . . . 45.6 m-20 -92.78 -173.31 3.28 Favored 'General case' 0 N--CA 1.496 1.831 0 O-C-N 121.616 -0.678 . . . . 0.0 109.887 179.839 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 74' ' ' PHE . . . . . . . . . . . . . 26.0 t80 -64.97 -48.45 73.99 Favored 'General case' 0 N--CA 1.495 1.821 0 O-C-N 121.195 -0.94 . . . . 0.0 110.052 179.602 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 75' ' ' ASP . . . . . 0.462 ' HA ' HD12 ' A' ' 78' ' ' LEU . 29.0 t70 -60.45 -49.82 76.02 Favored 'General case' 0 N--CA 1.498 1.927 0 O-C-N 121.579 -0.701 . . . . 0.0 109.97 179.323 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 76' ' ' GLU . . . . . . . . . . . . . 43.8 mt-10 -60.77 -41.6 95.82 Favored 'General case' 0 N--CA 1.498 1.973 0 O-C-N 121.592 -0.693 . . . . 0.0 109.8 179.135 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 77' ' ' PHE . . . . . 0.404 ' O ' ' HG2' ' A' ' 81' ' ' MET . 43.9 t80 -58.99 -45.57 90.31 Favored 'General case' 0 N--CA 1.498 1.945 0 O-C-N 121.575 -0.703 . . . . 0.0 109.528 178.888 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 78' ' ' LEU . . . . . 0.463 ' HB3' HG13 ' A' ' 9' ' ' VAL . 14.2 mt -56.92 -46.47 82.0 Favored 'General case' 0 N--CA 1.498 1.945 0 O-C-N 121.678 -0.639 . . . . 0.0 110.083 179.438 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 79' ' ' VAL . . . . . 0.807 ' HA ' HG21 ' A' ' 9' ' ' VAL . 86.3 t -61.7 -35.16 65.77 Favored 'Isoleucine or valine' 0 N--CA 1.501 2.119 0 O-C-N 121.463 -0.773 . . . . 0.0 109.835 179.453 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 80' ' ' MET . . . . . 0.486 ' CG ' ' HAI' ' A' ' 91' ' ' SXK . 12.4 ttp -70.66 -37.61 73.7 Favored 'General case' 0 N--CA 1.494 1.738 0 O-C-N 121.507 -0.745 . . . . 0.0 110.532 179.566 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 81' ' ' MET . . . . . 0.404 ' HG2' ' O ' ' A' ' 77' ' ' PHE . 68.4 mmm -62.77 -53.03 60.63 Favored 'General case' 0 N--CA 1.499 1.982 0 O-C-N 121.253 -0.904 . . . . 0.0 110.336 179.929 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 82' ' ' VAL . . . . . 0.426 HG11 HG23 ' A' ' 9' ' ' VAL . 13.4 p -63.26 -29.78 48.1 Favored 'Isoleucine or valine' 0 N--CA 1.501 2.113 0 O-C-N 121.302 -0.874 . . . . 0.0 110.132 179.333 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 83' ' ' ARG . . . . . 0.51 ' HG2' ' CG ' ' A' ' 5' ' ' TYR . 0.0 OUTLIER -62.24 -52.13 64.98 Favored 'General case' 0 N--CA 1.498 1.937 0 O-C-N 121.299 -0.876 . . . . 0.0 110.293 179.32 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 84' ' ' CYS . . . . . . . . . . . . . 0.1 OUTLIER -77.33 -22.79 51.33 Favored 'General case' 0 N--CA 1.498 1.956 0 O-C-N 121.495 -0.753 . . . . 0.0 110.88 179.928 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 85' ' ' MET . . . . . 0.43 ' HB2' ' HB2' ' B' ' 150' ' ' ALA . 22.9 ttp -66.3 -41.25 90.0 Favored 'General case' 0 N--CA 1.496 1.861 0 O-C-N 121.35 -0.844 . . . . 0.0 110.138 179.665 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 86' ' ' LYS . . . . . . . . . . . . . 1.4 tmtt? -140.8 90.3 2.33 Favored 'General case' 0 N--CA 1.493 1.717 0 O-C-N 121.438 -0.789 . . . . 0.0 110.241 -179.998 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 87' ' ' ASP . . . . . . . . . . . . . 4.6 m-20 -79.7 68.77 5.86 Favored 'General case' 0 N--CA 1.496 1.867 0 O-C-N 121.271 -0.893 . . . . 0.0 110.076 179.828 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 88' ' ' ASP . . . . . . . . . . . . . 18.1 t70 -160.73 157.59 27.23 Favored 'General case' 0 N--CA 1.495 1.803 0 O-C-N 121.416 -0.802 . . . . 0.0 109.993 -179.879 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 89' ' ' SER . . . . . . . . . . . . . 2.9 p . . . . . 0 N--CA 1.499 2.016 0 CA-C-O 117.849 -1.072 . . . . 0.0 110.449 179.911 . . . . . . . . 0 0 . 1 . 008 nuclear nobuild full ' B' B ' 144' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.497 1.905 0 CA-C-O 121.109 0.481 . . . . 0.0 110.269 . . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 145' ' ' ARG . . . . . . . . . . . . . 6.3 tpt180 -74.97 -45.5 41.82 Favored 'General case' 0 N--CA 1.497 1.903 0 O-C-N 121.438 -0.789 . . . . 0.0 110.275 179.865 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 146' ' ' VAL . . . . . 0.73 HG12 HD11 ' B' ' 148' ' ' ILE . 2.2 t -92.63 136.83 23.73 Favored 'Isoleucine or valine' 0 N--CA 1.497 1.909 0 O-C-N 121.254 -0.904 . . . . 0.0 109.204 179.437 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' B' B ' 147' ' ' ARG . . . . . . . . . . . . . 1.5 mtm-85 -105.05 109.91 22.1 Favored 'General case' 0 N--CA 1.496 1.85 0 O-C-N 121.19 -0.944 . . . . 0.0 111.413 -178.843 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 148' ' ' ILE . . . . . 0.73 HD11 HG12 ' B' ' 146' ' ' VAL . 3.4 mp -133.22 -69.14 0.4 Allowed 'Isoleucine or valine' 0 N--CA 1.497 1.894 0 O-C-N 121.603 -0.686 . . . . 0.0 109.573 179.384 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' B' B ' 149' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER 57.13 -171.68 0.09 Allowed 'General case' 0 N--CA 1.501 2.112 0 O-C-N 121.753 -0.592 . . . . 0.0 111.188 179.674 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' B' B ' 150' ' ' ALA . . . . . 0.43 ' HB2' ' HB2' ' A' ' 85' ' ' MET . . . -108.68 -59.73 1.84 Allowed 'General case' 0 N--CA 1.495 1.809 0 O-C-N 121.299 -0.876 . . . . 0.0 110.162 179.898 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' B' B ' 151' ' ' ASP . . . . . . . . . . . . . 6.4 p-10 -58.34 -30.9 67.08 Favored 'General case' 0 N--CA 1.5 2.059 0 O-C-N 121.491 -0.755 . . . . 0.0 110.805 179.59 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 152' ' ' ALA . . . . . . . . . . . . . . . -71.81 -47.5 52.84 Favored 'General case' 0 N--CA 1.496 1.845 0 O-C-N 121.343 -0.848 . . . . 0.0 110.169 179.708 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 153' ' ' MET . . . . . . . . . . . . . 7.1 mmt -68.31 -37.43 80.6 Favored 'General case' 0 N--CA 1.499 1.988 0 O-C-N 121.333 -0.854 . . . . 0.0 110.482 179.679 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 154' ' ' MET . . . . . . . . . . . . . 39.7 mtp -58.68 -45.02 90.33 Favored 'General case' 0 N--CA 1.499 2.009 0 O-C-N 121.401 -0.812 . . . . 0.0 110.513 179.836 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 155' ' ' GLN . . . . . . . . . . . . . 6.7 tp-100 -60.37 -42.22 95.34 Favored 'General case' 0 N--CA 1.5 2.068 0 O-C-N 121.422 -0.799 . . . . 0.0 110.503 179.895 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 156' ' ' ALA . . . . . . . . . . . . . . . -66.68 -39.3 88.06 Favored 'General case' 0 N--CA 1.499 1.997 0 O-C-N 121.428 -0.795 . . . . 0.0 110.34 179.608 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 157' ' ' LEU . . . . . 0.469 HD21 ' CD2' ' A' ' 27' ' ' PHE . 0.2 OUTLIER -67.86 -35.93 79.41 Favored 'General case' 0 N--CA 1.499 2.013 0 O-C-N 121.449 -0.782 . . . . 0.0 110.782 179.872 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' B' B ' 158' ' ' LEU . . . . . . . . . . . . . 12.0 mt -69.57 -45.86 67.69 Favored 'General case' 0 N--CA 1.498 1.97 0 O-C-N 121.326 -0.859 . . . . 0.0 110.777 -179.862 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 159' ' ' GLY . . . . . . . . . . . . . . . -89.04 48.93 3.5 Favored Glycine 0 N--CA 1.498 2.829 0 N-CA-C 110.085 -1.206 . . . . 0.0 110.085 -179.878 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 160' ' ' ALA . . . . . . . . . . . . . . . -112.97 27.18 9.84 Favored 'General case' 0 N--CA 1.496 1.853 0 O-C-N 121.387 -1.066 . . . . 0.0 110.692 179.939 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 161' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER 55.41 62.34 2.5 Favored 'General case' 0 N--CA 1.503 2.182 0 O-C-N 121.469 -0.769 . . . . 0.0 111.145 179.913 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' B' B ' 162' ' ' ALA . . . . . . . . . . . . . . . -69.98 -34.15 72.98 Favored 'General case' 0 N--CA 1.499 2.017 0 O-C-N 121.149 -0.969 . . . . 0.0 110.041 179.238 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 163' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.493 1.71 0 CA-C-O 118.211 -0.899 . . . . 0.0 109.982 179.673 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 90' ' ' ' CA' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 008 nuclear nobuild full ' A' A ' 91' ' ' SXK . . . . . 0.504 ' HAK' HD22 ' A' ' 41' ' ' LEU . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . 0.444 ' O ' ' HB3' ' A' ' 2' ' ' ASP . 1.5 tpt . . . . . 0 N--CA 1.499 2.008 0 CA-C-O 120.757 0.313 . . . . 0.0 110.355 . . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 2' ' ' ASP . . . . . 0.444 ' HB3' ' O ' ' A' ' 1' ' ' MET . 17.9 t70 65.93 149.79 0.05 OUTLIER 'General case' 0 N--CA 1.505 2.301 0 CA-C-O 121.627 0.727 . . . . 0.0 111.355 -179.929 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 3' ' ' ASP . . . . . . . . . . . . . 0.9 OUTLIER -133.23 3.38 3.65 Favored 'General case' 0 N--CA 1.497 1.916 0 O-C-N 121.352 -0.843 . . . . 0.0 111.344 179.836 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 4' ' ' ILE . . . . . 0.412 HD12 ' OD1' ' A' ' 2' ' ' ASP . 11.7 mt -65.55 -49.67 76.6 Favored 'Isoleucine or valine' 0 N--CA 1.5 2.035 0 O-C-N 120.829 -1.169 . . . . 0.0 110.147 179.89 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 5' ' ' TYR . . . . . 0.415 ' HE1' ' HG3' ' A' ' 83' ' ' ARG . 13.0 m-85 -60.21 -36.4 77.58 Favored 'General case' 0 N--CA 1.499 2.007 0 O-C-N 121.248 -0.907 . . . . 0.0 110.668 179.778 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 6' ' ' LYS . . . . . 0.453 ' HB3' ' HE3' ' A' ' 6' ' ' LYS . 26.1 ttpp -79.77 -46.46 16.95 Favored 'General case' 0 N--CA 1.494 1.774 0 O-C-N 121.201 -0.937 . . . . 0.0 110.415 179.718 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 7' ' ' ALA . . . . . . . . . . . . . . . -56.55 -46.67 80.58 Favored 'General case' 0 N--CA 1.498 1.937 0 O-C-N 121.45 -0.781 . . . . 0.0 110.309 179.858 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 8' ' ' ALA . . . . . 0.482 ' O ' ' HG ' ' A' ' 12' ' ' LEU . . . -58.33 -44.27 88.59 Favored 'General case' 0 N--CA 1.498 1.959 0 O-C-N 121.286 -0.884 . . . . 0.0 109.532 179.1 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 9' ' ' VAL . . . . . . . . . . . . . 10.9 t -67.19 -40.91 86.12 Favored 'Isoleucine or valine' 0 N--CA 1.497 1.891 0 O-C-N 121.657 -0.652 . . . . 0.0 110.512 179.446 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 10' ' ' GLU . . . . . . . . . . . . . 55.2 mt-10 -67.85 -43.51 79.32 Favored 'General case' 0 N--CA 1.5 2.056 0 O-C-N 121.416 -0.802 . . . . 0.0 111.588 -179.348 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 11' ' ' GLN . . . . . . . . . . . . . 3.1 mp0 -86.24 -80.16 0.24 Allowed 'General case' 0 N--CA 1.496 1.844 0 O-C-N 121.308 -0.87 . . . . 0.0 111.091 -178.786 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 12' ' ' LEU . . . . . 0.482 ' HG ' ' O ' ' A' ' 8' ' ' ALA . 4.8 mt 57.33 -168.45 0.12 Allowed 'General case' 0 N--CA 1.504 2.271 0 O-C-N 121.476 -0.765 . . . . 0.0 109.981 -179.076 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 13' ' ' THR . . . . . 0.442 ' OG1' ' HB2' ' A' ' 16' ' ' GLN . 76.0 p -120.49 159.58 24.89 Favored 'General case' 0 N--CA 1.499 1.995 0 O-C-N 120.867 -1.146 . . . . 0.0 110.078 179.406 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 14' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -53.15 -43.08 66.71 Favored 'General case' 0 N--CA 1.493 1.703 0 C-N-CA 120.278 -0.569 . . . . 0.0 110.441 -179.632 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 1.2 mp0 -65.38 -59.23 4.24 Favored 'General case' 0 N--CA 1.496 1.83 0 O-C-N 121.56 -0.713 . . . . 0.0 110.31 -179.956 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 16' ' ' GLN . . . . . 0.476 ' HB3' HD22 ' A' ' 12' ' ' LEU . 0.9 OUTLIER -50.65 -52.73 36.95 Favored 'General case' 0 N--CA 1.501 2.098 0 O-C-N 121.352 -0.843 . . . . 0.0 111.257 -179.728 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 17' ' ' LYS . . . . . 0.438 ' O ' ' HB3' ' A' ' 21' ' ' LYS . 3.2 tttp -57.92 -41.25 82.3 Favored 'General case' 0 N--CA 1.501 2.09 0 O-C-N 121.827 -0.546 . . . . 0.0 110.7 179.847 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 18' ' ' ASN . . . . . . . . . . . . . 12.8 m-20 -70.95 -48.45 53.36 Favored 'General case' 0 N--CA 1.501 2.079 0 O-C-N 121.259 -0.9 . . . . 0.0 110.207 179.592 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 0.5 OUTLIER -59.12 -46.14 89.09 Favored 'General case' 0 N--CA 1.495 1.8 0 O-C-N 121.611 -0.68 . . . . 0.0 110.436 179.933 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 20' ' ' PHE . . . . . 0.499 ' CE1' ' HG2' ' A' ' 81' ' ' MET . 19.6 m-30 -64.54 -38.0 89.49 Favored 'General case' 0 N--CA 1.498 1.965 0 O-C-N 121.29 -0.881 . . . . 0.0 110.004 179.562 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 21' ' ' LYS . . . . . 0.516 ' HG3' ' N ' ' A' ' 22' ' ' ALA . 0.0 OUTLIER -62.9 -36.68 84.14 Favored 'General case' 0 N--CA 1.5 2.05 0 O-C-N 121.38 -0.825 . . . . 0.0 109.242 178.725 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 22' ' ' ALA . . . . . 0.516 ' N ' ' HG3' ' A' ' 21' ' ' LYS . . . -70.03 -49.39 51.77 Favored 'General case' 0 N--CA 1.494 1.736 0 O-C-N 121.47 -0.769 . . . . 0.0 109.382 178.841 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 23' ' ' ALA . . . . . 0.492 ' HA ' HD11 ' B' ' 157' ' ' LEU . . . -61.74 -41.59 97.86 Favored 'General case' 0 N--CA 1.496 1.835 0 O-C-N 121.685 -0.635 . . . . 0.0 109.848 179.087 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 24' ' ' PHE . . . . . 0.695 ' CE1' HD11 ' A' ' 36' ' ' ILE . 82.7 t80 -61.33 -45.65 93.53 Favored 'General case' 0 N--CA 1.498 1.941 0 O-C-N 121.69 -0.631 . . . . 0.0 110.257 179.582 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 25' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -53.73 -51.47 63.21 Favored 'General case' 0 N--CA 1.498 1.973 0 O-C-N 121.661 -0.649 . . . . 0.0 110.504 179.87 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 26' ' ' ILE . . . . . 0.724 HG21 ' HB2' ' B' ' 157' ' ' LEU . 2.8 mt -69.07 -31.63 51.03 Favored 'Isoleucine or valine' 0 N--CA 1.498 1.975 0 O-C-N 121.221 -0.924 . . . . 0.0 110.148 179.532 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 27' ' ' PHE . . . . . 0.531 ' CZ ' HG21 ' A' ' 44' ' ' VAL . 0.2 OUTLIER -67.15 -43.2 82.92 Favored 'General case' 0 N--CA 1.497 1.898 0 O-C-N 121.126 -0.984 . . . . 0.0 110.259 179.505 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 28' ' ' VAL . . . . . 0.439 HG11 ' CZ ' ' A' ' 24' ' ' PHE . 12.8 m -81.72 -16.69 11.99 Favored 'Isoleucine or valine' 0 N--CA 1.502 2.14 0 O-C-N 121.182 -0.948 . . . . 0.0 110.397 179.322 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 29' ' ' LEU . . . . . . . . . . . . . 1.5 tp -61.13 118.52 6.91 Favored 'General case' 0 N--CA 1.49 1.528 0 N-CA-C 108.354 -0.98 . . . . 0.0 108.354 178.979 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 30' ' ' GLY . . . . . . . . . . . . . . . 99.68 22.97 11.38 Favored Glycine 0 N--CA 1.496 2.683 0 N-CA-C 109.678 -1.369 . . . . 0.0 109.678 -178.206 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 31' ' ' ALA . . . . . . . . . . . . . . . -110.14 133.07 53.59 Favored 'General case' 0 N--CA 1.496 1.857 0 O-C-N 121.349 -1.089 . . . . 0.0 109.516 179.596 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 32' ' ' GLU . . . . . . . . . . . . . 2.0 mp0 -85.02 82.78 8.3 Favored 'General case' 0 N--CA 1.497 1.885 0 O-C-N 121.259 -0.901 . . . . 0.0 110.716 -179.143 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 3.2 m-20 49.16 43.64 22.68 Favored 'General case' 0 N--CA 1.503 2.224 0 O-C-N 121.875 -0.516 . . . . 0.0 111.391 179.658 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 34' ' ' GLY . . . . . . . . . . . . . . . -137.7 26.96 2.86 Favored Glycine 0 N--CA 1.496 2.679 0 C-N-CA 120.019 -1.086 . . . . 0.0 110.56 179.774 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 35' ' ' CYS . . . . . . . . . . . . . 59.1 m 43.39 -100.06 0.03 OUTLIER 'General case' 0 N--CA 1.504 2.274 0 CA-C-N 117.928 0.864 . . . . 0.0 111.131 179.592 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 36' ' ' ILE . . . . . 0.695 HD11 ' CE1' ' A' ' 24' ' ' PHE . 69.1 mt -129.31 92.52 1.82 Allowed 'Isoleucine or valine' 0 N--CA 1.495 1.804 0 O-C-N 120.99 -1.069 . . . . 0.0 109.987 179.478 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 37' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -95.08 -173.77 3.05 Favored 'General case' 0 N--CA 1.495 1.794 0 O-C-N 121.277 -0.889 . . . . 0.0 109.345 179.283 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 38' ' ' THR . . . . . 0.8 HG21 ' HG2' ' A' ' 58' ' ' GLN . 1.6 p -59.72 -33.52 71.73 Favored 'General case' 0 N--CA 1.499 2.001 0 O-C-N 121.062 -1.024 . . . . 0.0 109.792 179.376 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 39' ' ' LYS . . . . . . . . . . . . . 23.5 ttpp -62.69 -38.6 91.02 Favored 'General case' 0 N--CA 1.499 1.981 0 O-C-N 121.526 -0.734 . . . . 0.0 109.708 178.755 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 0.6 OUTLIER -66.7 -33.6 75.99 Favored 'General case' 0 N--CA 1.498 1.929 0 O-C-N 121.661 -0.65 . . . . 0.0 109.839 179.355 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 41' ' ' LEU . . . . . 0.691 ' C ' HD13 ' A' ' 41' ' ' LEU . 2.8 tm? -66.21 -63.73 1.01 Allowed 'General case' 0 N--CA 1.497 1.875 0 O-C-N 121.385 -0.822 . . . . 0.0 108.946 178.464 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 42' ' ' GLY . . . . . 0.596 ' N ' HD13 ' A' ' 41' ' ' LEU . . . -46.96 -28.03 3.73 Favored Glycine 0 N--CA 1.499 2.876 0 N-CA-C 111.08 -0.808 . . . . 0.0 111.08 179.911 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 43' ' ' LYS . . . . . 0.485 ' HA ' ' HD2' ' A' ' 46' ' ' ARG . 0.0 OUTLIER -49.96 -50.93 45.06 Favored 'General case' 0 N--CA 1.501 2.115 0 O-C-N 121.364 -1.08 . . . . 0.0 110.389 179.733 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 44' ' ' VAL . . . . . 0.649 HG23 ' SD ' ' A' ' 45' ' ' MET . 13.6 m -75.68 -35.89 32.39 Favored 'Isoleucine or valine' 0 N--CA 1.502 2.129 0 O-C-N 121.376 -0.828 . . . . 0.0 109.732 179.106 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 45' ' ' MET . . . . . 0.649 ' SD ' HG23 ' A' ' 44' ' ' VAL . 0.0 OUTLIER -57.27 -30.23 64.51 Favored 'General case' 0 N--CA 1.498 1.927 0 O-C-N 121.215 -0.928 . . . . 0.0 110.757 178.679 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 46' ' ' ARG . . . . . 0.485 ' HD2' ' HA ' ' A' ' 43' ' ' LYS . 43.5 mtt85 -58.46 -47.56 83.61 Favored 'General case' 0 N--CA 1.501 2.107 0 O-C-N 121.276 -0.89 . . . . 0.0 109.547 179.135 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 47' ' ' MET . . . . . . . . . . . . . 45.7 mtm -66.05 -30.42 70.94 Favored 'General case' 0 N--CA 1.499 2.014 0 O-C-N 121.59 -0.694 . . . . 0.0 109.687 178.866 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 48' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -71.63 -46.63 58.52 Favored 'General case' 0 N--CA 1.497 1.887 0 O-C-N 121.538 -0.726 . . . . 0.0 110.186 179.334 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 49' ' ' GLY . . . . . . . . . . . . . . . 117.05 -17.14 12.91 Favored Glycine 0 N--CA 1.497 2.765 0 C-N-CA 120.51 -0.852 . . . . 0.0 111.176 179.543 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 50' ' ' GLN . . . . . . . . . . . . . 2.3 mt-30 -109.83 104.38 13.32 Favored 'General case' 0 N--CA 1.499 2.016 0 O-C-N 120.886 -1.361 . . . . 0.0 111.122 -179.427 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 51' ' ' ASN . . . . . . . . . . . . . 31.7 t30 -154.92 101.58 2.32 Favored Pre-proline 0 N--CA 1.496 1.873 0 O-C-N 121.465 -0.772 . . . . 0.0 110.003 179.283 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 52' ' ' PRO . . . . . 0.479 ' HD3' ' HD3' ' B' ' 144' ' ' ARG . 50.5 Cg_endo -77.1 -91.46 0.0 OUTLIER 'Trans proline' 0 C--N 1.315 -1.207 0 O-C-N 123.787 1.414 . . . . 0.0 111.268 -179.411 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 53' ' ' THR . . . . . . . . . . . . . 3.1 p -130.91 163.67 47.31 Favored Pre-proline 0 N--CA 1.493 1.691 0 O-C-N 120.93 -1.106 . . . . 0.0 110.774 -179.228 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 54' ' ' PRO . . . . . . . . . . . . . 43.0 Cg_endo -72.48 -33.76 8.31 Favored 'Trans proline' 0 C--N 1.314 -1.28 0 O-C-N 123.955 1.503 . . . . 0.0 110.266 179.487 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 55' ' ' GLU . . . . . . . . . . . . . 3.5 mp0 -61.68 -30.46 70.76 Favored 'General case' 0 N--CA 1.497 1.886 0 O-C-N 121.564 -0.71 . . . . 0.0 110.653 179.751 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 3.0 tt0 -61.17 -39.52 90.45 Favored 'General case' 0 N--CA 1.498 1.941 0 O-C-N 121.384 -0.823 . . . . 0.0 110.639 179.559 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 57' ' ' LEU . . . . . 0.536 HD23 ' CE ' ' A' ' 60' ' ' MET . 1.1 mt -90.25 -9.68 47.1 Favored 'General case' 0 N--CA 1.497 1.911 0 O-C-N 121.249 -0.907 . . . . 0.0 111.379 -179.878 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 58' ' ' GLN . . . . . 0.848 ' O ' HG22 ' A' ' 61' ' ' ILE . 9.8 mm-40 -59.43 -47.06 86.91 Favored 'General case' 0 N--CA 1.501 2.107 0 O-C-N 120.999 -1.063 . . . . 0.0 110.056 179.665 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 59' ' ' GLU . . . . . . . . . . . . . 0.5 OUTLIER -63.95 -32.84 74.52 Favored 'General case' 0 N--CA 1.502 2.157 0 O-C-N 121.07 -1.019 . . . . 0.0 109.89 178.912 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 60' ' ' MET . . . . . 0.536 ' CE ' HD23 ' A' ' 57' ' ' LEU . 4.2 tmm? -65.92 -35.96 82.05 Favored 'General case' 0 N--CA 1.496 1.862 0 O-C-N 121.424 -0.798 . . . . 0.0 110.32 179.428 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 61' ' ' ILE . . . . . 0.848 HG22 ' O ' ' A' ' 58' ' ' GLN . 1.1 tt -63.26 -29.12 46.44 Favored 'Isoleucine or valine' 0 N--CA 1.499 1.992 0 O-C-N 121.326 -0.859 . . . . 0.0 110.708 179.645 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 62' ' ' ASP . . . . . . . . . . . . . 3.7 m-20 -62.21 -45.25 94.18 Favored 'General case' 0 N--CA 1.498 1.933 0 O-C-N 121.185 -0.947 . . . . 0.0 110.145 179.644 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 63' ' ' GLU . . . . . . . . . . . . . 4.0 tm-20 -69.51 -42.61 74.48 Favored 'General case' 0 N--CA 1.498 1.956 0 O-C-N 121.537 -0.727 . . . . 0.0 110.247 179.431 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 64' ' ' VAL . . . . . . . . . . . . . 77.0 t -72.19 -23.96 22.02 Favored 'Isoleucine or valine' 0 N--CA 1.498 1.952 0 O-C-N 121.383 -0.823 . . . . 0.0 110.901 -179.947 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 65' ' ' ASP . . . . . 0.464 ' O ' ' HG2' ' A' ' 66' ' ' GLU . 17.1 t70 -86.93 -68.17 0.77 Allowed 'General case' 0 N--CA 1.497 1.882 0 O-C-N 121.079 -1.013 . . . . 0.0 110.298 -179.878 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 66' ' ' GLU . . . . . 0.464 ' HG2' ' O ' ' A' ' 65' ' ' ASP . 0.4 OUTLIER 44.02 28.76 0.28 Allowed 'General case' 0 N--CA 1.507 2.414 0 N-CA-C 112.615 0.598 . . . . 0.0 112.615 179.903 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 67' ' ' ASP . . . . . . . . . . . . . 0.0 OUTLIER -110.57 -23.53 11.06 Favored 'General case' 0 N--CA 1.498 1.932 0 O-C-N 120.723 -1.236 . . . . 0.0 111.236 179.623 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 68' ' ' GLY . . . . . . . . . . . . . . . 131.22 -50.19 0.9 Allowed Glycine 0 N--CA 1.495 2.59 0 N-CA-C 110.255 -1.138 . . . . 0.0 110.255 -179.981 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 69' ' ' SER . . . . . . . . . . . . . 5.4 p -66.84 -37.2 84.02 Favored 'General case' 0 N--CA 1.499 1.979 0 O-C-N 121.392 -1.063 . . . . 0.0 111.192 -179.491 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 70' ' ' GLY . . . . . . . . . . . . . . . 99.42 -43.73 1.78 Allowed Glycine 0 N--CA 1.496 2.691 0 N-CA-C 110.365 -1.094 . . . . 0.0 110.365 179.781 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 71' ' ' THR . . . . . . . . . . . . . 0.6 OUTLIER -71.82 139.3 48.88 Favored 'General case' 0 N--CA 1.503 2.205 0 O-C-N 121.197 -1.178 . . . . 0.0 110.443 -179.63 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 72' ' ' VAL . . . . . 0.824 HG23 HG13 ' A' ' 61' ' ' ILE . 6.6 t -75.88 131.34 35.11 Favored 'Isoleucine or valine' 0 N--CA 1.498 1.964 0 O-C-N 121.543 -0.723 . . . . 0.0 110.395 179.844 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 73' ' ' ASP . . . . . . . . . . . . . 29.5 m-20 -117.29 -164.11 0.97 Allowed 'General case' 0 N--CA 1.5 2.03 0 O-C-N 121.373 -0.83 . . . . 0.0 110.55 -179.935 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 74' ' ' PHE . . . . . 0.459 ' HA ' ' CE1' ' A' ' 24' ' ' PHE . 87.9 t80 -66.2 -45.83 79.41 Favored 'General case' 0 N--CA 1.502 2.156 0 O-C-N 121.38 -0.825 . . . . 0.0 110.305 179.849 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 75' ' ' ASP . . . . . . . . . . . . . 1.1 m-20 -58.56 -47.8 83.01 Favored 'General case' 0 N--CA 1.497 1.887 0 O-C-N 121.58 -0.7 . . . . 0.0 109.886 179.441 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 76' ' ' GLU . . . . . . . . . . . . . 2.1 mt-10 -67.65 -33.96 76.0 Favored 'General case' 0 N--CA 1.496 1.844 0 O-C-N 121.501 -0.749 . . . . 0.0 109.821 179.044 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 77' ' ' PHE . . . . . . . . . . . . . 47.9 t80 -56.82 -40.27 75.71 Favored 'General case' 0 N--CA 1.5 2.071 0 O-C-N 121.409 -0.807 . . . . 0.0 108.915 178.324 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 78' ' ' LEU . . . . . . . . . . . . . 66.6 mt -69.36 -42.88 74.65 Favored 'General case' 0 N--CA 1.495 1.779 0 N-CA-C 109.041 -0.725 . . . . 0.0 109.041 178.21 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 79' ' ' VAL . . . . . 0.539 HG12 ' HD2' ' A' ' 83' ' ' ARG . 71.9 t -63.71 -34.97 71.18 Favored 'Isoleucine or valine' 0 N--CA 1.501 2.085 0 O-C-N 121.588 -0.695 . . . . 0.0 109.924 178.984 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 80' ' ' MET . . . . . . . . . . . . . 0.5 OUTLIER -69.07 -43.07 75.33 Favored 'General case' 0 N--CA 1.495 1.807 0 O-C-N 121.344 -0.848 . . . . 0.0 109.685 179.223 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 81' ' ' MET . . . . . 0.499 ' HG2' ' CE1' ' A' ' 20' ' ' PHE . 12.9 tpp -65.09 -49.39 70.17 Favored 'General case' 0 N--CA 1.497 1.919 0 O-C-N 121.556 -0.715 . . . . 0.0 109.949 179.556 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 82' ' ' VAL . . . . . 0.898 HG23 ' HB3' ' A' ' 87' ' ' ASP . 7.2 p -61.57 -27.95 43.08 Favored 'Isoleucine or valine' 0 N--CA 1.501 2.115 0 O-C-N 121.256 -0.902 . . . . 0.0 109.492 178.549 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 83' ' ' ARG . . . . . 0.539 ' HD2' HG12 ' A' ' 79' ' ' VAL . 1.6 mtt180 -71.65 -39.63 70.2 Favored 'General case' 0 N--CA 1.499 1.989 0 O-C-N 121.427 -0.796 . . . . 0.0 109.54 178.466 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 84' ' ' CYS . . . . . . . . . . . . . 0.0 OUTLIER -69.08 -50.69 46.06 Favored 'General case' 0 N--CA 1.5 2.053 0 O-C-N 121.499 -0.751 . . . . 0.0 110.47 179.872 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 85' ' ' MET . . . . . 0.524 ' HG3' ' HB2' ' A' ' 87' ' ' ASP . 2.5 ptt? -77.2 -3.41 39.44 Favored 'General case' 0 N--CA 1.499 2.025 0 O-C-N 121.259 -0.901 . . . . 0.0 111.202 179.85 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 86' ' ' LYS . . . . . . . . . . . . . 1.4 ttpp 56.97 45.05 21.91 Favored 'General case' 0 N--CA 1.5 2.049 0 O-C-N 121.336 -0.853 . . . . 0.0 111.215 179.672 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 87' ' ' ASP . . . . . 0.898 ' HB3' HG23 ' A' ' 82' ' ' VAL . 17.3 t70 -84.87 87.03 7.3 Favored 'General case' 0 N--CA 1.494 1.733 0 O-C-N 121.12 -0.987 . . . . 0.0 109.376 179.15 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 88' ' ' ASP . . . . . . . . . . . . . 19.6 m-20 -83.39 76.64 9.9 Favored 'General case' 0 N--CA 1.494 1.77 0 O-C-N 121.332 -0.855 . . . . 0.0 110.132 -179.538 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 89' ' ' SER . . . . . . . . . . . . . 4.2 m . . . . . 0 N--CA 1.496 1.85 0 CA-C-O 117.918 -1.039 . . . . 0.0 110.393 -179.837 . . . . . . . . 0 0 . 1 . 009 nuclear nobuild full ' B' B ' 144' ' ' ARG . . . . . 0.479 ' HD3' ' HD3' ' A' ' 52' ' ' PRO . 10.3 ttp-105 . . . . . 0 N--CA 1.495 1.808 0 CA-C-O 121.002 0.43 . . . . 0.0 110.148 . . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 145' ' ' ARG . . . . . . . . . . . . . 16.8 mmt180 -91.21 147.73 22.85 Favored 'General case' 0 N--CA 1.497 1.917 0 O-C-N 121.356 -0.84 . . . . 0.0 109.923 179.737 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 146' ' ' VAL . . . . . . . . . . . . . 11.3 p -150.04 145.77 17.1 Favored 'Isoleucine or valine' 0 N--CA 1.498 1.926 0 O-C-N 121.37 -0.831 . . . . 0.0 110.515 -179.788 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 147' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -92.17 -27.58 17.6 Favored 'General case' 0 N--CA 1.498 1.974 0 O-C-N 121.399 -0.813 . . . . 0.0 111.38 -179.595 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' B' B ' 148' ' ' ILE . . . . . . . . . . . . . 21.2 mm 61.64 80.34 0.07 OUTLIER 'Isoleucine or valine' 0 N--CA 1.506 2.341 0 O-C-N 121.559 -0.713 . . . . 0.0 110.413 -179.695 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 149' ' ' SER . . . . . 0.519 ' HB3' ' HB3' ' B' ' 152' ' ' ALA . 0.1 OUTLIER -80.79 112.78 18.48 Favored 'General case' 0 N--CA 1.496 1.867 0 O-C-N 121.157 -0.964 . . . . 0.0 109.994 179.756 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' B' B ' 150' ' ' ALA . . . . . . . . . . . . . . . -58.58 -41.01 84.76 Favored 'General case' 0 N--CA 1.499 1.977 0 O-C-N 121.603 -0.686 . . . . 0.0 110.749 -179.644 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 151' ' ' ASP . . . . . . . . . . . . . 7.2 p-10 -64.3 -38.1 89.84 Favored 'General case' 0 N--CA 1.5 2.03 0 O-C-N 121.46 -0.775 . . . . 0.0 110.599 179.574 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 152' ' ' ALA . . . . . 0.519 ' HB3' ' HB3' ' B' ' 149' ' ' SER . . . -78.06 -46.78 19.93 Favored 'General case' 0 N--CA 1.496 1.852 0 O-C-N 121.368 -0.833 . . . . 0.0 110.295 179.742 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' B' B ' 153' ' ' MET . . . . . . . . . . . . . 8.5 tpp -56.69 -43.7 80.75 Favored 'General case' 0 N--CA 1.499 1.992 0 O-C-N 121.494 -0.754 . . . . 0.0 110.332 179.728 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 154' ' ' MET . . . . . 0.526 ' O ' ' HB2' ' B' ' 158' ' ' LEU . 9.0 mmm -58.01 -52.75 64.21 Favored 'General case' 0 N--CA 1.498 1.946 0 O-C-N 121.442 -0.786 . . . . 0.0 110.448 179.88 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' B' B ' 155' ' ' GLN . . . . . . . . . . . . . 0.9 OUTLIER -62.44 -32.64 73.53 Favored 'General case' 0 N--CA 1.499 1.993 0 O-C-N 121.434 -0.791 . . . . 0.0 111.001 -179.959 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' B' B ' 156' ' ' ALA . . . . . . . . . . . . . . . -55.52 -34.92 65.08 Favored 'General case' 0 N--CA 1.501 2.094 0 O-C-N 121.38 -0.825 . . . . 0.0 111.095 179.954 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 157' ' ' LEU . . . . . 0.724 ' HB2' HG21 ' A' ' 26' ' ' ILE . 1.6 pp -112.43 8.22 19.37 Favored 'General case' 0 N--CA 1.5 2.054 0 O-C-N 121.17 -0.956 . . . . 0.0 111.796 -179.709 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' B' B ' 158' ' ' LEU . . . . . 0.526 ' HB2' ' O ' ' B' ' 154' ' ' MET . 0.0 OUTLIER -117.23 -46.68 2.69 Favored 'General case' 0 N--CA 1.498 1.968 0 O-C-N 120.922 -1.111 . . . . 0.0 110.682 179.682 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' B' B ' 159' ' ' GLY . . . . . . . . . . . . . . . -135.04 63.7 0.6 Allowed Glycine 0 N--CA 1.497 2.709 0 N-CA-C 110.273 -1.131 . . . . 0.0 110.273 -179.587 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 160' ' ' ALA . . . . . . . . . . . . . . . -138.92 -74.31 0.38 Allowed 'General case' 0 N--CA 1.498 1.955 0 O-C-N 121.423 -1.045 . . . . 0.0 110.297 179.556 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 161' ' ' ARG . . . . . . . . . . . . . 2.8 tpt180 -159.85 51.89 0.34 Allowed 'General case' 0 N--CA 1.498 1.95 0 O-C-N 121.298 -0.876 . . . . 0.0 110.088 179.83 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 162' ' ' ALA . . . . . . . . . . . . . . . -138.89 116.53 11.39 Favored 'General case' 0 N--CA 1.494 1.766 0 O-C-N 121.302 -0.874 . . . . 0.0 110.14 -179.9 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 163' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.496 1.825 0 CA-C-O 117.914 -1.041 . . . . 0.0 110.531 -179.75 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 90' ' ' ' CA' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 009 nuclear nobuild full ' A' A ' 91' ' ' SXK . . . . . 0.549 ' CAK' HD23 ' A' ' 41' ' ' LEU . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 13.8 mmt . . . . . 0 N--CA 1.499 2.005 0 N-CA-C 109.627 -0.509 . . . . 0.0 109.627 . . . . . . . . . 0 0 . 1 . 010 nuclear nobuild full ' A' A ' 2' ' ' ASP . . . . . . . . . . . . . 7.3 m-20 -128.38 112.48 14.45 Favored 'General case' 0 N--CA 1.495 1.787 0 O-C-N 121.36 -0.837 . . . . 0.0 110.722 -179.033 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 3' ' ' ASP . . . . . 0.467 ' O ' ' HB2' ' A' ' 7' ' ' ALA . 0.2 OUTLIER 52.69 60.33 3.87 Favored 'General case' 0 N--CA 1.502 2.142 0 CA-C-O 121.42 0.628 . . . . 0.0 111.653 179.554 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 4' ' ' ILE . . . . . 0.417 HG22 ' HD1' ' A' ' 5' ' ' TYR . 23.6 mm -93.19 -52.55 9.7 Favored 'Isoleucine or valine' 0 N--CA 1.497 1.882 0 O-C-N 121.201 -0.937 . . . . 0.0 109.661 179.412 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 5' ' ' TYR . . . . . 0.417 ' HD1' HG22 ' A' ' 4' ' ' ILE . 1.2 m-85 -96.14 -36.85 10.82 Favored 'General case' 0 N--CA 1.494 1.773 0 O-C-N 121.473 -0.767 . . . . 0.0 109.471 179.124 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 2.0 tmmt? -63.22 -28.36 69.98 Favored 'General case' 0 N--CA 1.497 1.893 0 O-C-N 121.433 -0.792 . . . . 0.0 109.819 178.664 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 7' ' ' ALA . . . . . 0.467 ' HB2' ' O ' ' A' ' 3' ' ' ASP . . . -53.58 -44.83 69.66 Favored 'General case' 0 N--CA 1.497 1.923 0 O-C-N 121.609 -0.682 . . . . 0.0 109.287 178.948 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 8' ' ' ALA . . . . . . . . . . . . . . . -67.29 -43.65 81.23 Favored 'General case' 0 N--CA 1.495 1.802 0 O-C-N 121.533 -0.729 . . . . 0.0 109.256 178.331 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 9' ' ' VAL . . . . . 0.533 HG13 ' CB ' ' A' ' 78' ' ' LEU . 53.0 t -56.62 -40.42 69.07 Favored 'Isoleucine or valine' 0 N--CA 1.5 2.075 0 O-C-N 121.8 -0.563 . . . . 0.0 110.404 179.585 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 10' ' ' GLU . . . . . . . . . . . . . 0.7 OUTLIER -63.77 -44.41 93.47 Favored 'General case' 0 N--CA 1.496 1.853 0 O-C-N 121.437 -0.789 . . . . 0.0 111.333 -179.604 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 11' ' ' GLN . . . . . . . . . . . . . 4.3 mt-30 -139.69 82.84 1.9 Allowed 'General case' 0 N--CA 1.496 1.839 0 O-C-N 121.138 -0.976 . . . . 0.0 111.184 -179.704 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 12' ' ' LEU . . . . . . . . . . . . . 36.1 mt -70.79 -74.23 0.15 Allowed 'General case' 0 N--CA 1.498 1.956 0 O-C-N 121.197 -0.94 . . . . 0.0 108.792 178.703 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 13' ' ' THR . . . . . 0.507 ' HB ' ' HB2' ' A' ' 16' ' ' GLN . 2.1 m -157.21 156.55 32.75 Favored 'General case' 0 N--CA 1.494 1.731 0 N-CA-C 108.657 -0.868 . . . . 0.0 108.657 178.55 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 14' ' ' GLU . . . . . . . . . . . . . 2.7 tp10 -53.97 -33.06 55.92 Favored 'General case' 0 N--CA 1.494 1.741 0 O-C-N 121.531 -0.73 . . . . 0.0 110.825 -179.394 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 1.7 mp0 -90.72 -44.37 9.52 Favored 'General case' 0 N--CA 1.495 1.78 0 O-C-N 121.316 -0.865 . . . . 0.0 110.649 179.973 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 16' ' ' GLN . . . . . 0.507 ' HB2' ' HB ' ' A' ' 13' ' ' THR . 0.8 OUTLIER -48.24 -59.89 3.07 Favored 'General case' 0 N--CA 1.503 2.194 0 O-C-N 121.503 -0.748 . . . . 0.0 111.123 -179.408 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 17' ' ' LYS . . . . . . . . . . . . . 1.0 OUTLIER -56.91 -39.73 74.99 Favored 'General case' 0 N--CA 1.498 1.962 0 O-C-N 121.891 -0.506 . . . . 0.0 110.375 179.898 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 18' ' ' ASN . . . . . . . . . . . . . 2.1 t-20 -66.56 -39.63 88.6 Favored 'General case' 0 N--CA 1.499 2.022 0 O-C-N 121.302 -0.874 . . . . 0.0 110.129 179.26 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 17.0 mt-10 -62.23 -40.41 96.04 Favored 'General case' 0 N--CA 1.497 1.916 0 O-C-N 121.327 -0.858 . . . . 0.0 109.673 179.078 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 20' ' ' PHE . . . . . . . . . . . . . 33.9 m-85 -66.35 -31.53 72.37 Favored 'General case' 0 N--CA 1.498 1.936 0 O-C-N 121.482 -0.761 . . . . 0.0 109.559 178.728 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 21' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -60.22 -43.69 95.79 Favored 'General case' 0 N--CA 1.497 1.92 0 O-C-N 121.438 -0.789 . . . . 0.0 109.05 178.836 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 22' ' ' ALA . . . . . . . . . . . . . . . -72.18 -39.91 68.31 Favored 'General case' 0 N--CA 1.495 1.804 0 O-C-N 121.637 -0.664 . . . . 0.0 109.394 178.681 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 23' ' ' ALA . . . . . 0.839 ' HB1' HD23 ' B' ' 157' ' ' LEU . . . -65.7 -28.67 69.24 Favored 'General case' 0 N--CA 1.498 1.971 0 O-C-N 121.345 -0.847 . . . . 0.0 109.778 178.821 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 24' ' ' PHE . . . . . 0.651 ' O ' HG22 ' A' ' 28' ' ' VAL . 23.7 t80 -69.53 -34.03 73.65 Favored 'General case' 0 N--CA 1.495 1.787 0 O-C-N 121.581 -0.7 . . . . 0.0 110.188 179.514 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 25' ' ' ASP . . . . . . . . . . . . . 21.5 m-20 -52.26 -53.11 47.99 Favored 'General case' 0 N--CA 1.501 2.12 0 O-C-N 121.367 -0.833 . . . . 0.0 111.024 179.875 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 26' ' ' ILE . . . . . 0.527 ' HA ' HD23 ' A' ' 29' ' ' LEU . 1.1 pt -75.01 -20.46 16.48 Favored 'Isoleucine or valine' 0 N--CA 1.503 2.179 0 O-C-N 121.256 -0.902 . . . . 0.0 111.077 -179.866 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 27' ' ' PHE . . . . . 0.639 ' CZ ' HG21 ' A' ' 44' ' ' VAL . 0.1 OUTLIER -75.83 -17.5 59.81 Favored 'General case' 0 N--CA 1.496 1.848 0 O-C-N 120.933 -1.104 . . . . 0.0 110.196 179.169 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 28' ' ' VAL . . . . . 0.651 HG22 ' O ' ' A' ' 24' ' ' PHE . 20.6 m -129.25 26.27 1.92 Allowed 'Isoleucine or valine' 0 N--CA 1.499 1.997 0 O-C-N 121.305 -0.872 . . . . 0.0 110.74 179.93 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 29' ' ' LEU . . . . . 0.527 HD23 ' HA ' ' A' ' 26' ' ' ILE . 3.5 pp -74.29 -27.32 60.67 Favored 'General case' 0 N--CA 1.501 2.094 0 O-C-N 120.996 -1.065 . . . . 0.0 111.068 -179.854 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 30' ' ' GLY . . . . . . . . . . . . . . . -105.72 42.27 1.95 Allowed Glycine 0 N--CA 1.495 2.607 0 N-CA-C 109.784 -1.326 . . . . 0.0 109.784 179.866 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 31' ' ' ALA . . . . . 0.47 ' HB2' ' HG3' ' A' ' 40' ' ' GLU . . . -145.74 127.45 15.25 Favored 'General case' 0 N--CA 1.494 1.756 0 O-C-N 121.395 -1.062 . . . . 0.0 110.426 -179.847 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 32' ' ' GLU . . . . . . . . . . . . . 1.7 mp0 -76.84 -15.17 59.79 Favored 'General case' 0 N--CA 1.501 2.09 0 O-C-N 121.391 -0.818 . . . . 0.0 110.622 179.678 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 7.6 m-20 -69.63 -30.14 67.79 Favored 'General case' 0 N--CA 1.497 1.894 0 O-C-N 121.302 -0.874 . . . . 0.0 110.792 -179.949 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 34' ' ' GLY . . . . . . . . . . . . . . . 87.51 12.11 67.64 Favored Glycine 0 N--CA 1.496 2.681 0 N-CA-C 109.996 -1.242 . . . . 0.0 109.996 -179.511 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 35' ' ' CYS . . . . . . . . . . . . . 64.2 m -136.47 168.78 18.81 Favored 'General case' 0 N--CA 1.495 1.818 0 O-C-N 121.301 -1.117 . . . . 0.0 110.116 -179.921 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 36' ' ' ILE . . . . . . . . . . . . . 78.7 mt -81.34 105.07 10.81 Favored 'Isoleucine or valine' 0 N--CA 1.498 1.946 0 O-C-N 121.142 -0.974 . . . . 0.0 110.21 -179.907 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 37' ' ' SER . . . . . . . . . . . . . 89.2 p -96.14 -177.24 3.92 Favored 'General case' 0 N--CA 1.495 1.809 0 O-C-N 121.502 -0.749 . . . . 0.0 110.237 179.773 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 38' ' ' THR . . . . . 0.448 ' HB ' ' O ' ' A' ' 54' ' ' PRO . 1.8 p -59.38 -43.94 92.83 Favored 'General case' 0 N--CA 1.502 2.129 0 O-C-N 121.438 -0.789 . . . . 0.0 110.459 179.789 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 39' ' ' LYS . . . . . 0.558 ' HA ' ' HB3' ' A' ' 54' ' ' PRO . 0.0 OUTLIER -62.98 -45.52 92.02 Favored 'General case' 0 N--CA 1.496 1.85 0 O-C-N 121.57 -0.706 . . . . 0.0 110.092 179.527 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 40' ' ' GLU . . . . . 0.47 ' HG3' ' HB2' ' A' ' 31' ' ' ALA . 19.0 mm-40 -69.42 -29.03 66.66 Favored 'General case' 0 N--CA 1.498 1.947 0 O-C-N 121.414 -0.804 . . . . 0.0 110.39 179.647 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 41' ' ' LEU . . . . . 0.966 HD21 ' HAK' ' A' ' 91' ' ' SXK . 0.1 OUTLIER -73.32 -61.29 1.88 Allowed 'General case' 0 N--CA 1.497 1.904 0 O-C-N 121.253 -0.904 . . . . 0.0 108.833 178.603 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 42' ' ' GLY . . . . . 0.552 ' HA2' ' HB2' ' A' ' 45' ' ' MET . . . -49.53 -30.96 13.75 Favored Glycine 0 N--CA 1.499 2.856 0 N-CA-C 109.933 -1.267 . . . . 0.0 109.933 179.112 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 43' ' ' LYS . . . . . 0.45 ' HB3' ' O ' ' A' ' 40' ' ' GLU . 0.9 OUTLIER -48.98 -48.87 42.9 Favored 'General case' 0 N--CA 1.502 2.145 0 O-C-N 121.623 -0.928 . . . . 0.0 110.653 179.344 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 44' ' ' VAL . . . . . 0.639 HG21 ' CZ ' ' A' ' 27' ' ' PHE . 28.5 m -82.87 -23.86 8.54 Favored 'Isoleucine or valine' 0 N--CA 1.501 2.092 0 O-C-N 121.373 -0.83 . . . . 0.0 110.461 179.563 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 45' ' ' MET . . . . . 0.552 ' HB2' ' HA2' ' A' ' 42' ' ' GLY . 0.0 OUTLIER -65.43 -38.27 89.4 Favored 'General case' 0 N--CA 1.499 1.997 0 O-C-N 121.337 -0.852 . . . . 0.0 110.321 179.404 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 46' ' ' ARG . . . . . 0.456 ' CB ' ' HB3' ' A' ' 51' ' ' ASN . 13.2 ttt180 -62.19 -51.58 67.23 Favored 'General case' 0 N--CA 1.5 2.039 0 O-C-N 121.626 -0.671 . . . . 0.0 110.962 -179.746 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 47' ' ' MET . . . . . 0.413 ' CE ' ' HB1' ' B' ' 156' ' ' ALA . 4.9 ptm -67.25 -28.23 67.88 Favored 'General case' 0 N--CA 1.498 1.971 0 O-C-N 121.296 -0.877 . . . . 0.0 111.186 -179.661 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 48' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -79.83 -46.01 17.69 Favored 'General case' 0 N--CA 1.497 1.879 0 O-C-N 121.051 -1.031 . . . . 0.0 110.708 179.932 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 49' ' ' GLY . . . . . . . . . . . . . . . -147.21 -77.83 0.02 OUTLIER Glycine 0 N--CA 1.496 2.679 0 N-CA-C 110.107 -1.197 . . . . 0.0 110.107 -179.875 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 50' ' ' GLN . . . . . . . . . . . . . 2.4 pp0? -147.98 160.72 42.53 Favored 'General case' 0 N--CA 1.498 1.946 0 O-C-N 121.306 -1.114 . . . . 0.0 111.083 -179.822 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 51' ' ' ASN . . . . . 0.456 ' HB3' ' CB ' ' A' ' 46' ' ' ARG . 24.7 t30 -175.0 93.44 0.29 Allowed Pre-proline 0 N--CA 1.494 1.764 0 O-C-N 121.779 -0.576 . . . . 0.0 109.641 179.467 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 52' ' ' PRO . . . . . . . . . . . . . 42.1 Cg_endo -73.17 -65.95 0.03 OUTLIER 'Trans proline' 0 C--N 1.312 -1.387 0 O-C-N 123.658 1.346 . . . . 0.0 110.187 -179.943 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 53' ' ' THR . . . . . . . . . . . . . 1.8 p -129.94 155.76 80.1 Favored Pre-proline 0 N--CA 1.489 1.512 0 O-C-N 121.4 -0.813 . . . . 0.0 109.579 179.29 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 54' ' ' PRO . . . . . 0.565 ' HA ' HD23 ' A' ' 57' ' ' LEU . 40.4 Cg_endo -66.29 -28.3 47.43 Favored 'Trans proline' 0 C--N 1.31 -1.475 0 O-C-N 123.742 1.39 . . . . 0.0 111.071 -179.982 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 55' ' ' GLU . . . . . . . . . . . . . 1.1 mp0 -60.03 -34.85 73.94 Favored 'General case' 0 N--CA 1.501 2.117 0 O-C-N 121.218 -0.926 . . . . 0.0 110.684 179.559 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 27.1 tt0 -62.52 -21.75 65.77 Favored 'General case' 0 N--CA 1.5 2.059 0 O-C-N 121.404 -0.81 . . . . 0.0 111.529 -179.886 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 57' ' ' LEU . . . . . 0.646 HD22 ' N ' ' A' ' 57' ' ' LEU . 3.4 mm? -79.44 -12.51 59.89 Favored 'General case' 0 N--CA 1.499 2.018 0 O-C-N 121.022 -1.049 . . . . 0.0 111.115 -179.916 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 58' ' ' GLN . . . . . 0.681 ' HA ' HG22 ' A' ' 61' ' ' ILE . 5.0 pt20 -52.65 -35.36 54.75 Favored 'General case' 0 N--CA 1.5 2.041 0 O-C-N 121.072 -1.018 . . . . 0.0 110.445 -179.712 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 59' ' ' GLU . . . . . . . . . . . . . 6.8 mm-40 -56.22 -34.4 66.27 Favored 'General case' 0 N--CA 1.5 2.038 0 O-C-N 121.02 -1.05 . . . . 0.0 109.891 178.834 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 60' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -82.22 -33.17 29.44 Favored 'General case' 0 N--CA 1.495 1.813 0 O-C-N 121.68 -0.637 . . . . 0.0 110.625 179.522 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 61' ' ' ILE . . . . . 0.907 HG13 HG23 ' A' ' 72' ' ' VAL . 3.4 tt -81.4 -31.69 11.57 Favored 'Isoleucine or valine' 0 N--CA 1.498 1.955 0 O-C-N 121.17 -0.956 . . . . 0.0 111.044 -179.505 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 62' ' ' ASP . . . . . . . . . . . . . 6.7 m-20 -69.44 -44.85 70.45 Favored 'General case' 0 N--CA 1.496 1.849 0 O-C-N 121.125 -0.984 . . . . 0.0 111.032 -179.679 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 63' ' ' GLU . . . . . 0.739 ' HG3' HG23 ' A' ' 64' ' ' VAL . 0.6 OUTLIER -62.47 -23.49 66.94 Favored 'General case' 0 N--CA 1.501 2.076 0 O-C-N 121.333 -0.854 . . . . 0.0 111.714 -179.43 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 64' ' ' VAL . . . . . 0.739 HG23 ' HG3' ' A' ' 63' ' ' GLU . 44.2 t -107.85 -24.9 3.83 Favored 'Isoleucine or valine' 0 N--CA 1.501 2.096 0 O-C-N 121.014 -1.054 . . . . 0.0 111.648 -179.235 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 65' ' ' ASP . . . . . . . . . . . . . 22.4 t70 -75.91 -91.39 0.03 OUTLIER 'General case' 0 N--CA 1.5 2.028 0 O-C-N 120.949 -1.094 . . . . 0.0 110.456 -179.627 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 66' ' ' GLU . . . . . . . . . . . . . 3.6 mm-40 49.28 33.37 5.14 Favored 'General case' 0 N--CA 1.502 2.174 0 O-C-N 121.333 -0.854 . . . . 0.0 111.544 179.958 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 67' ' ' ASP . . . . . . . . . . . . . 1.9 p-10 -115.24 -22.7 9.3 Favored 'General case' 0 N--CA 1.499 2.018 0 O-C-N 120.968 -1.082 . . . . 0.0 111.475 -179.932 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 68' ' ' GLY . . . . . . . . . . . . . . . 127.68 -30.78 3.91 Favored Glycine 0 N--CA 1.495 2.592 0 N-CA-C 110.074 -1.21 . . . . 0.0 110.074 -179.849 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 69' ' ' SER . . . . . . . . . . . . . 0.9 OUTLIER -78.24 -35.36 48.38 Favored 'General case' 0 N--CA 1.497 1.916 0 O-C-N 121.289 -1.124 . . . . 0.0 111.033 -179.786 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 70' ' ' GLY . . . . . . . . . . . . . . . 91.26 -50.49 3.04 Favored Glycine 0 N--CA 1.499 2.883 0 N-CA-C 110.197 -1.161 . . . . 0.0 110.197 179.89 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 71' ' ' THR . . . . . . . . . . . . . 54.9 m -79.13 154.58 29.23 Favored 'General case' 0 N--CA 1.502 2.13 0 O-C-N 121.298 -1.119 . . . . 0.0 110.977 -179.417 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 72' ' ' VAL . . . . . 0.907 HG23 HG13 ' A' ' 61' ' ' ILE . 2.4 t -81.57 128.82 38.39 Favored 'Isoleucine or valine' 0 N--CA 1.498 1.974 0 O-C-N 121.727 -0.608 . . . . 0.0 110.453 179.728 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 73' ' ' ASP . . . . . . . . . . . . . 1.4 p30 -102.44 -161.07 0.82 Allowed 'General case' 0 N--CA 1.498 1.927 0 O-C-N 121.574 -0.704 . . . . 0.0 109.881 179.263 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 74' ' ' PHE . . . . . . . . . . . . . 45.5 t80 -67.99 -53.06 28.84 Favored 'General case' 0 N--CA 1.499 1.983 0 O-C-N 121.129 -0.982 . . . . 0.0 110.69 -179.577 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 75' ' ' ASP . . . . . . . . . . . . . 1.0 OUTLIER -59.5 -43.01 93.44 Favored 'General case' 0 N--CA 1.498 1.927 0 O-C-N 121.498 -0.751 . . . . 0.0 110.473 179.91 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 76' ' ' GLU . . . . . 0.455 ' HG2' HG12 ' A' ' 64' ' ' VAL . 1.5 mt-10 -65.13 -42.2 94.08 Favored 'General case' 0 N--CA 1.497 1.917 0 O-C-N 121.498 -0.751 . . . . 0.0 109.961 179.335 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 77' ' ' PHE . . . . . . . . . . . . . 25.4 t80 -59.26 -37.34 77.38 Favored 'General case' 0 N--CA 1.497 1.886 0 O-C-N 121.483 -0.761 . . . . 0.0 109.658 179.155 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 78' ' ' LEU . . . . . 0.533 ' CB ' HG13 ' A' ' 9' ' ' VAL . 41.4 mt -66.36 -34.18 77.39 Favored 'General case' 0 N--CA 1.497 1.893 0 O-C-N 121.411 -0.806 . . . . 0.0 109.914 178.987 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 79' ' ' VAL . . . . . 0.509 HG23 HG11 ' A' ' 9' ' ' VAL . 55.3 t -64.25 -42.93 96.96 Favored 'Isoleucine or valine' 0 N--CA 1.498 1.955 0 O-C-N 121.359 -0.838 . . . . 0.0 109.699 179.056 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 80' ' ' MET . . . . . 0.522 ' HG3' HG21 ' A' ' 64' ' ' VAL . 0.0 OUTLIER -60.48 -34.14 73.62 Favored 'General case' 0 N--CA 1.498 1.937 0 O-C-N 121.4 -0.813 . . . . 0.0 110.034 179.318 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 81' ' ' MET . . . . . . . . . . . . . 8.9 mmt -62.92 -53.44 53.98 Favored 'General case' 0 N--CA 1.498 1.955 0 O-C-N 121.459 -0.776 . . . . 0.0 110.34 179.732 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 82' ' ' VAL . . . . . . . . . . . . . 0.6 OUTLIER -66.7 -24.55 33.01 Favored 'Isoleucine or valine' 0 N--CA 1.503 2.189 0 O-C-N 121.165 -0.959 . . . . 0.0 110.035 179.236 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 83' ' ' ARG . . . . . . . . . . . . . 0.6 OUTLIER -78.38 -35.18 47.64 Favored 'General case' 0 N--CA 1.497 1.921 0 O-C-N 121.248 -0.907 . . . . 0.0 109.613 178.829 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 84' ' ' CYS . . . . . . . . . . . . . 1.0 OUTLIER -70.03 -28.91 65.87 Favored 'General case' 0 N--CA 1.498 1.942 0 O-C-N 121.504 -0.747 . . . . 0.0 110.645 179.531 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 85' ' ' MET . . . . . . . . . . . . . 34.0 mtt -51.17 -49.29 61.2 Favored 'General case' 0 N--CA 1.502 2.158 0 O-C-N 121.68 -0.637 . . . . 0.0 110.759 179.867 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 86' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER 66.91 -68.4 0.15 Allowed 'General case' 0 N--CA 1.504 2.275 0 O-C-N 121.872 -0.517 . . . . 0.0 111.331 179.695 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 87' ' ' ASP . . . . . . . . . . . . . 21.2 t70 -114.19 -65.28 1.2 Allowed 'General case' 0 N--CA 1.496 1.856 0 O-C-N 121.195 -0.941 . . . . 0.0 110.509 -179.832 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 88' ' ' ASP . . . . . . . . . . . . . 1.4 t70 -91.04 167.83 12.1 Favored 'General case' 0 N--CA 1.497 1.884 0 O-C-N 121.17 -0.956 . . . . 0.0 110.346 179.876 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 89' ' ' SER . . . . . . . . . . . . . 72.4 m . . . . . 0 N--CA 1.496 1.853 0 CA-C-O 118.24 -0.886 . . . . 0.0 110.515 179.957 . . . . . . . . 0 0 . 1 . 010 nuclear nobuild full ' B' B ' 144' ' ' ARG . . . . . . . . . . . . . 10.5 ttt85 . . . . . 0 N--CA 1.494 1.759 0 CA-C-O 120.992 0.425 . . . . 0.0 110.308 . . . . . . . . . 0 0 . 1 . 010 nuclear nobuild full ' B' B ' 145' ' ' ARG . . . . . . . . . . . . . 4.3 tpt180 -155.51 132.54 10.75 Favored 'General case' 0 N--CA 1.494 1.75 0 O-C-N 121.403 -0.81 . . . . 0.0 110.29 -179.746 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 146' ' ' VAL . . . . . . . . . . . . . 30.3 t -121.23 147.61 25.03 Favored 'Isoleucine or valine' 0 N--CA 1.496 1.861 0 O-C-N 121.391 -0.818 . . . . 0.0 109.909 179.946 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 147' ' ' ARG . . . . . 0.455 ' O ' ' HB ' ' B' ' 148' ' ' ILE . 0.1 OUTLIER -77.38 -46.97 21.07 Favored 'General case' 0 N--CA 1.499 2.002 0 O-C-N 121.492 -0.755 . . . . 0.0 110.946 -179.619 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' B' B ' 148' ' ' ILE . . . . . 0.47 HG13 ' HE1' ' A' ' 45' ' ' MET . 41.0 mm 63.88 161.01 0.0 OUTLIER 'Isoleucine or valine' 0 N--CA 1.507 2.421 0 CA-C-O 121.276 0.56 . . . . 0.0 110.303 -179.444 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' B' B ' 149' ' ' SER . . . . . . . . . . . . . 6.5 t -153.98 144.08 22.04 Favored 'General case' 0 N--CA 1.498 1.97 0 O-C-N 120.91 -1.119 . . . . 0.0 110.728 179.911 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 150' ' ' ALA . . . . . . . . . . . . . . . -56.35 -43.15 78.82 Favored 'General case' 0 N--CA 1.498 1.944 0 O-C-N 121.494 -0.754 . . . . 0.0 110.543 179.767 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 151' ' ' ASP . . . . . . . . . . . . . 4.8 m-20 -71.11 -48.11 54.15 Favored 'General case' 0 N--CA 1.498 1.95 0 O-C-N 121.406 -0.809 . . . . 0.0 110.28 179.786 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 152' ' ' ALA . . . . . . . . . . . . . . . -60.53 -48.3 82.38 Favored 'General case' 0 N--CA 1.498 1.949 0 O-C-N 121.544 -0.723 . . . . 0.0 110.648 179.88 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 153' ' ' MET . . . . . 0.444 ' SD ' HG23 ' B' ' 148' ' ' ILE . 0.5 OUTLIER -63.25 -37.72 88.35 Favored 'General case' 0 N--CA 1.499 1.985 0 O-C-N 121.364 -0.835 . . . . 0.0 110.195 179.693 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' B' B ' 154' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -65.47 -42.76 91.89 Favored 'General case' 0 N--CA 1.497 1.922 0 O-C-N 121.285 -0.884 . . . . 0.0 110.144 179.461 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' B' B ' 155' ' ' GLN . . . . . . . . . . . . . 14.3 mt-30 -62.92 -42.0 99.65 Favored 'General case' 0 N--CA 1.5 2.053 0 O-C-N 121.54 -0.725 . . . . 0.0 110.32 179.424 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 156' ' ' ALA . . . . . 0.413 ' HB1' ' CE ' ' A' ' 47' ' ' MET . . . -70.0 -36.26 75.0 Favored 'General case' 0 N--CA 1.496 1.858 0 O-C-N 121.438 -0.789 . . . . 0.0 110.171 179.73 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' B' B ' 157' ' ' LEU . . . . . 0.839 HD23 ' HB1' ' A' ' 23' ' ' ALA . 4.1 mp -71.05 -61.74 1.65 Allowed 'General case' 0 N--CA 1.496 1.841 0 O-C-N 121.645 -0.659 . . . . 0.0 110.351 -179.967 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' B' B ' 158' ' ' LEU . . . . . 0.588 HD11 ' HB2' ' A' ' 23' ' ' ALA . 17.5 mt -108.0 62.58 0.61 Allowed 'General case' 0 N--CA 1.497 1.918 0 O-C-N 121.261 -0.899 . . . . 0.0 109.971 179.821 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' B' B ' 159' ' ' GLY . . . . . . . . . . . . . . . -170.74 -43.11 0.03 OUTLIER Glycine 0 N--CA 1.496 2.682 0 N-CA-C 110.248 -1.141 . . . . 0.0 110.248 -179.831 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 160' ' ' ALA . . . . . . . . . . . . . . . -59.77 97.55 0.04 OUTLIER 'General case' 0 N--CA 1.499 1.999 0 O-C-N 121.435 -1.038 . . . . 0.0 110.362 179.969 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 161' ' ' ARG . . . . . . . . . . . . . 1.8 ttm-85 69.99 -61.12 0.46 Allowed 'General case' 0 N--CA 1.505 2.289 0 O-C-N 121.863 -0.523 . . . . 0.0 111.102 -179.641 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 162' ' ' ALA . . . . . . . . . . . . . . . -93.73 163.63 13.46 Favored 'General case' 0 N--CA 1.497 1.895 0 O-C-N 121.172 -0.955 . . . . 0.0 110.611 -179.929 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 163' ' ' LYS . . . . . . . . . . . . . 0.3 OUTLIER . . . . . 0 N--CA 1.497 1.925 0 CA-C-O 117.821 -1.085 . . . . 0.0 110.431 179.84 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 90' ' ' ' CA' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 010 nuclear nobuild full ' A' A ' 91' ' ' SXK . . . . . 0.966 ' HAK' HD21 ' A' ' 41' ' ' LEU . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . 0.501 ' O ' HD12 ' A' ' 4' ' ' ILE . 0.0 OUTLIER . . . . . 0 N--CA 1.497 1.895 0 CA-C-O 121.111 0.481 . . . . 0.0 110.635 . . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 2' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -99.51 -27.68 13.6 Favored 'General case' 0 N--CA 1.499 1.975 0 O-C-N 121.453 -0.779 . . . . 0.0 110.938 -179.961 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 3' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -59.46 -22.5 61.62 Favored 'General case' 0 N--CA 1.501 2.098 0 O-C-N 121.391 -0.818 . . . . 0.0 111.817 -179.481 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 4' ' ' ILE . . . . . 0.501 HD12 ' O ' ' A' ' 1' ' ' MET . 11.6 mt -49.93 -53.72 9.87 Favored 'Isoleucine or valine' 0 N--CA 1.503 2.219 0 O-C-N 121.277 -0.889 . . . . 0.0 110.267 179.762 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 5' ' ' TYR . . . . . 0.413 ' CE1' ' HG2' ' A' ' 83' ' ' ARG . 6.8 m-85 -73.52 -34.31 65.18 Favored 'General case' 0 N--CA 1.5 2.051 0 O-C-N 121.288 -0.883 . . . . 0.0 109.967 179.155 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 6' ' ' LYS . . . . . 0.52 ' O ' HG12 ' A' ' 9' ' ' VAL . 0.0 OUTLIER -59.78 -32.34 70.51 Favored 'General case' 0 N--CA 1.497 1.924 0 O-C-N 121.44 -0.787 . . . . 0.0 110.214 179.576 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' A' A ' 7' ' ' ALA . . . . . . . . . . . . . . . -55.88 -34.32 65.39 Favored 'General case' 0 N--CA 1.497 1.912 0 O-C-N 121.282 -0.886 . . . . 0.0 109.693 178.865 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 8' ' ' ALA . . . . . 0.563 ' CB ' HG11 ' A' ' 82' ' ' VAL . . . -71.72 -45.42 61.84 Favored 'General case' 0 N--CA 1.497 1.892 0 O-C-N 121.523 -0.736 . . . . 0.0 110.331 179.375 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 9' ' ' VAL . . . . . 0.633 ' HA ' HD12 ' A' ' 12' ' ' LEU . 0.3 OUTLIER -63.66 -28.98 46.1 Favored 'Isoleucine or valine' 0 N--CA 1.5 2.064 0 O-C-N 121.152 -0.967 . . . . 0.0 109.999 179.398 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' A' A ' 10' ' ' GLU . . . . . . . . . . . . . 1.1 tt0 -73.26 -31.98 64.41 Favored 'General case' 0 N--CA 1.493 1.677 0 O-C-N 121.606 -0.684 . . . . 0.0 110.366 179.299 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 11' ' ' GLN . . . . . . . . . . . . . 27.4 mt-30 -85.22 2.81 42.2 Favored 'General case' 0 N--CA 1.499 2.008 0 O-C-N 121.331 -0.856 . . . . 0.0 111.577 -179.84 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 12' ' ' LEU . . . . . 0.633 HD12 ' HA ' ' A' ' 9' ' ' VAL . 4.5 mt -73.2 136.83 44.75 Favored 'General case' 0 N--CA 1.5 2.033 0 O-C-N 120.877 -1.14 . . . . 0.0 110.197 179.823 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 13' ' ' THR . . . . . . . . . . . . . 3.2 m -92.26 157.6 16.58 Favored 'General case' 0 N--CA 1.503 2.196 0 O-C-N 121.323 -0.861 . . . . 0.0 111.008 -179.602 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 14' ' ' GLU . . . . . . . . . . . . . 8.5 tp10 -51.96 -41.75 62.35 Favored 'General case' 0 N--CA 1.496 1.847 0 O-C-N 121.809 -0.557 . . . . 0.0 110.607 -179.918 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 23.5 mt-10 -58.5 -43.78 89.22 Favored 'General case' 0 N--CA 1.498 1.967 0 O-C-N 121.544 -0.723 . . . . 0.0 110.512 179.56 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 16' ' ' GLN . . . . . . . . . . . . . 0.8 OUTLIER -70.5 -37.07 74.11 Favored 'General case' 0 N--CA 1.498 1.931 0 O-C-N 121.491 -0.755 . . . . 0.0 110.284 179.745 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 17' ' ' LYS . . . . . . . . . . . . . 2.6 tptt -62.98 -45.68 91.28 Favored 'General case' 0 N--CA 1.496 1.873 0 N-CA-C 109.083 -0.71 . . . . 0.0 109.083 178.756 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 18' ' ' ASN . . . . . . . . . . . . . 15.7 m-80 -70.07 -27.98 65.06 Favored 'General case' 0 N--CA 1.497 1.901 0 O-C-N 121.439 -0.788 . . . . 0.0 109.757 178.642 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 7.3 tt0 -67.33 -51.42 52.56 Favored 'General case' 0 N--CA 1.495 1.776 0 O-C-N 121.445 -0.784 . . . . 0.0 109.247 178.967 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 20' ' ' PHE . . . . . . . . . . . . . 30.6 m-85 -67.19 -27.4 67.23 Favored 'General case' 0 N--CA 1.497 1.877 0 O-C-N 121.328 -0.858 . . . . 0.0 109.798 178.936 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 21' ' ' LYS . . . . . . . . . . . . . 3.1 tptt -58.04 -46.82 84.73 Favored 'General case' 0 N--CA 1.499 1.995 0 O-C-N 121.377 -0.827 . . . . 0.0 109.62 178.885 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 22' ' ' ALA . . . . . . . . . . . . . . . -63.27 -46.67 85.71 Favored 'General case' 0 N--CA 1.496 1.832 0 O-C-N 121.541 -0.725 . . . . 0.0 109.745 179.235 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 23' ' ' ALA . . . . . . . . . . . . . . . -60.65 -42.88 97.87 Favored 'General case' 0 N--CA 1.498 1.962 0 O-C-N 121.516 -0.74 . . . . 0.0 109.625 178.946 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 24' ' ' PHE . . . . . 0.518 ' O ' HG22 ' A' ' 28' ' ' VAL . 59.4 t80 -59.38 -47.92 83.6 Favored 'General case' 0 N--CA 1.494 1.766 0 O-C-N 121.567 -0.708 . . . . 0.0 109.666 179.139 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 25' ' ' ASP . . . . . . . . . . . . . 1.1 m-20 -56.39 -41.41 76.21 Favored 'General case' 0 N--CA 1.498 1.955 0 O-C-N 121.692 -0.63 . . . . 0.0 110.393 179.475 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 26' ' ' ILE . . . . . . . . . . . . . 38.1 mm -64.87 -30.12 49.39 Favored 'Isoleucine or valine' 0 N--CA 1.501 2.109 0 O-C-N 121.389 -0.819 . . . . 0.0 110.047 179.262 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 27' ' ' PHE . . . . . 0.455 ' CE1' ' HB ' ' A' ' 44' ' ' VAL . 0.1 OUTLIER -75.38 -28.98 59.71 Favored 'General case' 0 N--CA 1.496 1.833 0 O-C-N 121.435 -0.791 . . . . 0.0 111.115 -179.954 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' A' A ' 28' ' ' VAL . . . . . 0.518 HG22 ' O ' ' A' ' 24' ' ' PHE . 0.0 OUTLIER -113.75 -79.17 0.38 Allowed 'Isoleucine or valine' 0 N--CA 1.498 1.95 0 O-C-N 121.138 -0.976 . . . . 0.0 110.748 179.859 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' A' A ' 29' ' ' LEU . . . . . 0.42 ' H ' HG23 ' A' ' 28' ' ' VAL . 0.2 OUTLIER 67.19 -68.89 0.14 Allowed 'General case' 0 N--CA 1.504 2.262 0 O-C-N 121.644 -0.66 . . . . 0.0 110.407 -179.615 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' A' A ' 30' ' ' GLY . . . . . . . . . . . . . . . -98.36 40.84 2.37 Favored Glycine 0 N--CA 1.494 2.545 0 N-CA-C 109.538 -1.425 . . . . 0.0 109.538 179.138 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 31' ' ' ALA . . . . . 0.433 ' HB2' ' HB ' ' A' ' 28' ' ' VAL . . . -77.57 178.66 7.09 Favored 'General case' 0 N--CA 1.499 2.017 0 O-C-N 121.306 -1.114 . . . . 0.0 110.681 -179.892 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 32' ' ' GLU . . . . . . . . . . . . . 1.2 mp0 -88.5 -56.89 3.12 Favored 'General case' 0 N--CA 1.5 2.027 0 O-C-N 121.348 -0.845 . . . . 0.0 110.422 -179.676 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 2.5 m-20 -116.22 33.64 5.43 Favored 'General case' 0 N--CA 1.494 1.761 0 O-C-N 121.414 -0.804 . . . . 0.0 110.523 -179.855 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 34' ' ' GLY . . . . . . . . . . . . . . . 63.12 44.72 96.79 Favored Glycine 0 N--CA 1.497 2.761 0 N-CA-C 109.842 -1.303 . . . . 0.0 109.842 179.991 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 35' ' ' CYS . . . . . . . . . . . . . 12.9 p -140.99 142.66 34.26 Favored 'General case' 0 N--CA 1.496 1.835 0 O-C-N 121.408 -1.054 . . . . 0.0 110.4 -179.551 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 36' ' ' ILE . . . . . 0.424 HG12 HG13 ' A' ' 28' ' ' VAL . 69.5 mt -78.05 96.42 1.85 Allowed 'Isoleucine or valine' 0 N--CA 1.496 1.86 0 O-C-N 121.416 -0.802 . . . . 0.0 110.059 -179.988 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 37' ' ' SER . . . . . . . . . . . . . 91.5 p -87.92 -176.79 5.6 Favored 'General case' 0 N--CA 1.496 1.833 0 O-C-N 121.407 -0.808 . . . . 0.0 109.766 179.452 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 38' ' ' THR . . . . . 0.547 HG21 ' HG2' ' A' ' 58' ' ' GLN . 7.3 p -55.45 -36.98 67.14 Favored 'General case' 0 N--CA 1.5 2.032 0 O-C-N 121.361 -0.837 . . . . 0.0 110.487 179.819 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 39' ' ' LYS . . . . . . . . . . . . . 4.2 mtmp? -71.23 -44.92 64.41 Favored 'General case' 0 N--CA 1.499 1.983 0 O-C-N 121.416 -0.802 . . . . 0.0 110.583 179.818 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 40' ' ' GLU . . . . . 0.422 ' HG3' HG12 ' A' ' 28' ' ' VAL . 9.9 mm-40 -63.61 -38.61 91.76 Favored 'General case' 0 N--CA 1.501 2.094 0 O-C-N 121.393 -0.817 . . . . 0.0 110.647 -179.811 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 41' ' ' LEU . . . . . 0.861 HD12 HD13 ' A' ' 57' ' ' LEU . 1.8 tm? -66.14 -66.39 0.56 Allowed 'General case' 0 N--CA 1.499 2.0 0 O-C-N 121.297 -0.877 . . . . 0.0 109.346 179.124 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 42' ' ' GLY . . . . . 0.605 ' HA2' ' HB2' ' A' ' 45' ' ' MET . . . -48.03 -33.28 10.08 Favored Glycine 0 N--CA 1.501 3.011 0 N-CA-C 110.873 -0.891 . . . . 0.0 110.873 179.881 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 43' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -52.52 -46.24 66.61 Favored 'General case' 0 N--CA 1.503 2.178 0 O-C-N 121.383 -1.069 . . . . 0.0 110.566 179.54 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 44' ' ' VAL . . . . . 0.462 HG11 HD11 ' B' ' 157' ' ' LEU . 60.4 t -87.99 -21.61 7.02 Favored 'Isoleucine or valine' 0 N--CA 1.499 1.992 0 O-C-N 121.446 -0.784 . . . . 0.0 110.673 179.828 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 45' ' ' MET . . . . . 0.605 ' HB2' ' HA2' ' A' ' 42' ' ' GLY . 0.2 OUTLIER -57.44 -24.91 58.41 Favored 'General case' 0 N--CA 1.502 2.165 0 O-C-N 121.214 -0.929 . . . . 0.0 111.55 -179.957 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' A' A ' 46' ' ' ARG . . . . . 0.527 ' HA ' ' HG3' ' A' ' 50' ' ' GLN . 4.9 mtm180 -50.33 -36.06 30.39 Favored 'General case' 0 N--CA 1.502 2.13 0 O-C-N 121.321 -0.862 . . . . 0.0 111.119 179.989 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 47' ' ' MET . . . . . . . . . . . . . 20.3 mtm -80.15 -30.86 38.99 Favored 'General case' 0 N--CA 1.497 1.899 0 O-C-N 121.359 -0.838 . . . . 0.0 110.889 -179.96 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 48' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -134.47 84.43 2.11 Favored 'General case' 0 N--CA 1.485 1.287 0 O-C-N 121.211 -0.93 . . . . 0.0 110.872 -179.457 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 49' ' ' GLY . . . . . . . . . . . . . . . 81.02 89.95 0.55 Allowed Glycine 0 N--CA 1.495 2.614 0 N-CA-C 109.828 -1.309 . . . . 0.0 109.828 179.722 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 50' ' ' GLN . . . . . 0.527 ' HG3' ' HA ' ' A' ' 46' ' ' ARG . 7.9 mp0 -65.83 152.49 44.29 Favored 'General case' 0 N--CA 1.498 1.953 0 O-C-N 121.525 -0.985 . . . . 0.0 110.661 -179.943 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 51' ' ' ASN . . . . . 0.432 ' HA ' ' HD2' ' A' ' 52' ' ' PRO . 16.3 p-10 -97.41 110.84 56.47 Favored Pre-proline 0 N--CA 1.494 1.76 0 O-C-N 121.535 -0.728 . . . . 0.0 110.125 179.551 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 52' ' ' PRO . . . . . 0.432 ' HD2' ' HA ' ' A' ' 51' ' ' ASN . 41.7 Cg_endo -69.21 -43.33 3.19 Favored 'Trans proline' 0 C--N 1.312 -1.343 0 O-C-N 123.676 1.356 . . . . 0.0 110.832 -179.885 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 53' ' ' THR . . . . . . . . . . . . . 0.6 OUTLIER -126.93 146.78 58.78 Favored Pre-proline 0 N--CA 1.495 1.824 0 O-C-N 121.336 -0.853 . . . . 0.0 110.282 -179.991 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 54' ' ' PRO . . . . . . . . . . . . . 40.9 Cg_endo -67.37 -36.96 18.91 Favored 'Trans proline' 0 N--CA 1.491 1.371 0 O-C-N 123.729 1.384 . . . . 0.0 110.781 179.811 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 55' ' ' GLU . . . . . 0.478 ' HG2' ' N ' ' A' ' 56' ' ' GLU . 3.1 pm0 -64.29 -24.6 67.72 Favored 'General case' 0 N--CA 1.498 1.965 0 O-C-N 121.365 -0.834 . . . . 0.0 110.748 179.432 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 56' ' ' GLU . . . . . 0.478 ' N ' ' HG2' ' A' ' 55' ' ' GLU . 27.0 tt0 -65.35 -25.41 67.57 Favored 'General case' 0 N--CA 1.498 1.951 0 O-C-N 121.174 -0.954 . . . . 0.0 110.401 179.399 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 57' ' ' LEU . . . . . 0.861 HD13 HD12 ' A' ' 41' ' ' LEU . 4.7 mt -94.13 -18.79 21.41 Favored 'General case' 0 N--CA 1.496 1.85 0 O-C-N 121.155 -0.966 . . . . 0.0 110.189 179.362 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 58' ' ' GLN . . . . . 0.547 ' HG2' HG21 ' A' ' 38' ' ' THR . 4.0 mm100 -59.78 -39.84 86.27 Favored 'General case' 0 N--CA 1.499 2.016 0 O-C-N 121.059 -1.026 . . . . 0.0 109.966 179.638 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 59' ' ' GLU . . . . . 0.529 ' O ' ' HB2' ' A' ' 63' ' ' GLU . 0.0 OUTLIER -59.82 -29.39 68.21 Favored 'General case' 0 N--CA 1.5 2.052 0 O-C-N 121.359 -0.838 . . . . 0.0 109.392 178.576 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' A' A ' 60' ' ' MET . . . . . 0.435 ' HB2' ' O ' ' A' ' 57' ' ' LEU . 0.0 OUTLIER -72.87 -20.69 61.05 Favored 'General case' 0 N--CA 1.493 1.716 0 O-C-N 121.586 -0.696 . . . . 0.0 109.596 178.207 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' A' A ' 61' ' ' ILE . . . . . 0.539 HG23 HG23 ' A' ' 72' ' ' VAL . 28.9 mm -85.14 -59.21 2.89 Favored 'Isoleucine or valine' 0 N--CA 1.496 1.874 0 O-C-N 121.514 -0.741 . . . . 0.0 110.468 179.941 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 62' ' ' ASP . . . . . 0.446 ' HA ' ' HB3' ' A' ' 65' ' ' ASP . 25.2 m-20 -60.16 -33.44 72.19 Favored 'General case' 0 N--CA 1.501 2.11 0 O-C-N 121.736 -0.602 . . . . 0.0 112.115 -178.58 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 63' ' ' GLU . . . . . 0.529 ' HB2' ' O ' ' A' ' 59' ' ' GLU . 0.6 OUTLIER -56.35 -42.36 77.63 Favored 'General case' 0 N--CA 1.504 2.266 0 O-C-N 121.169 -0.957 . . . . 0.0 110.939 -179.492 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' A' A ' 64' ' ' VAL . . . . . 0.736 HG11 ' HB3' ' A' ' 80' ' ' MET . 34.5 m -99.79 -18.0 6.49 Favored 'Isoleucine or valine' 0 N--CA 1.501 2.094 0 O-C-N 121.308 -0.87 . . . . 0.0 111.224 179.872 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 65' ' ' ASP . . . . . 0.476 ' HA ' ' CD ' ' A' ' 76' ' ' GLU . 23.6 t70 -68.37 -87.12 0.02 OUTLIER 'General case' 0 N--CA 1.496 1.831 0 O-C-N 121.371 -0.831 . . . . 0.0 110.521 -179.596 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 66' ' ' GLU . . . . . . . . . . . . . 7.6 mm-40 48.51 33.28 3.91 Favored 'General case' 0 N--CA 1.502 2.135 0 O-C-N 121.35 -0.843 . . . . 0.0 111.171 -179.971 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 67' ' ' ASP . . . . . . . . . . . . . 0.7 OUTLIER -116.88 -18.29 10.21 Favored 'General case' 0 N--CA 1.499 1.995 0 O-C-N 121.104 -0.998 . . . . 0.0 111.601 -179.633 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 68' ' ' GLY . . . . . . . . . . . . . . . 123.05 -30.07 5.14 Favored Glycine 0 N--CA 1.498 2.804 0 N-CA-C 110.42 -1.072 . . . . 0.0 110.42 179.782 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 69' ' ' SER . . . . . . . . . . . . . 1.0 OUTLIER -78.93 -35.58 43.08 Favored 'General case' 0 N--CA 1.499 2.001 0 O-C-N 121.23 -1.159 . . . . 0.0 110.891 -179.635 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 70' ' ' GLY . . . . . . . . . . . . . . . 76.39 28.02 60.57 Favored Glycine 0 N--CA 1.498 2.8 0 N-CA-C 110.391 -1.084 . . . . 0.0 110.391 179.951 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 71' ' ' THR . . . . . . . . . . . . . 2.3 m -144.18 140.67 29.48 Favored 'General case' 0 N--CA 1.499 2.008 0 O-C-N 121.24 -1.153 . . . . 0.0 109.45 179.448 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 72' ' ' VAL . . . . . 0.539 HG23 HG23 ' A' ' 61' ' ' ILE . 24.7 t -75.69 124.49 33.82 Favored 'Isoleucine or valine' 0 N--CA 1.497 1.909 0 O-C-N 121.58 -0.7 . . . . 0.0 110.734 -179.586 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 73' ' ' ASP . . . . . . . . . . . . . 1.1 p30 -111.45 -161.38 0.75 Allowed 'General case' 0 N--CA 1.498 1.949 0 O-C-N 121.539 -0.726 . . . . 0.0 110.037 179.258 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 74' ' ' PHE . . . . . . . . . . . . . 16.9 t80 -66.72 -47.99 70.6 Favored 'General case' 0 N--CA 1.5 2.063 0 O-C-N 121.063 -1.023 . . . . 0.0 111.328 -178.91 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 75' ' ' ASP . . . . . 0.469 ' HA ' HD12 ' A' ' 78' ' ' LEU . 0.4 OUTLIER -68.25 -42.65 79.34 Favored 'General case' 0 N--CA 1.496 1.828 0 O-C-N 121.136 -0.978 . . . . 0.0 110.632 -179.621 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' A' A ' 76' ' ' GLU . . . . . 0.476 ' CD ' ' HA ' ' A' ' 65' ' ' ASP . 2.6 mt-10 -64.86 -30.45 71.45 Favored 'General case' 0 N--CA 1.498 1.935 0 O-C-N 121.207 -0.933 . . . . 0.0 109.742 178.767 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 77' ' ' PHE . . . . . 0.537 ' HA ' ' SD ' ' A' ' 80' ' ' MET . 67.4 t80 -58.96 -28.1 65.98 Favored 'General case' 0 N--CA 1.5 2.056 0 O-C-N 121.539 -0.725 . . . . 0.0 109.835 178.575 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 78' ' ' LEU . . . . . 0.469 HD12 ' HA ' ' A' ' 75' ' ' ASP . 20.0 mt -77.31 -35.36 54.98 Favored 'General case' 0 N--CA 1.495 1.797 0 O-C-N 121.352 -0.843 . . . . 0.0 110.257 179.297 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 79' ' ' VAL . . . . . . . . . . . . . 61.8 t -56.67 -57.21 10.21 Favored 'Isoleucine or valine' 0 N--CA 1.502 2.151 0 O-C-N 121.395 -0.816 . . . . 0.0 110.253 179.795 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 80' ' ' MET . . . . . 0.736 ' HB3' HG11 ' A' ' 64' ' ' VAL . 0.0 OUTLIER -57.17 -34.92 68.96 Favored 'General case' 0 N--CA 1.502 2.135 0 O-C-N 121.425 -0.797 . . . . 0.0 110.402 179.626 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' A' A ' 81' ' ' MET . . . . . . . . . . . . . 12.3 mmt -65.58 -43.87 88.44 Favored 'General case' 0 N--CA 1.498 1.967 0 O-C-N 121.365 -0.834 . . . . 0.0 110.063 179.129 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 82' ' ' VAL . . . . . 0.563 HG11 ' CB ' ' A' ' 8' ' ' ALA . 55.0 t -63.96 -34.62 69.58 Favored 'Isoleucine or valine' 0 N--CA 1.503 2.184 0 O-C-N 121.425 -0.797 . . . . 0.0 110.146 179.317 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 83' ' ' ARG . . . . . 0.413 ' HG2' ' CE1' ' A' ' 5' ' ' TYR . 31.7 mtt180 -66.5 -44.39 82.72 Favored 'General case' 0 N--CA 1.497 1.915 0 O-C-N 121.548 -0.72 . . . . 0.0 110.381 179.864 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 84' ' ' CYS . . . . . . . . . . . . . 84.1 m -71.95 -39.31 69.47 Favored 'General case' 0 N--CA 1.498 1.953 0 O-C-N 121.434 -0.791 . . . . 0.0 110.003 179.439 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 85' ' ' MET . . . . . 0.417 ' O ' ' CB ' ' A' ' 86' ' ' LYS . 38.1 ttp -76.19 -13.92 60.17 Favored 'General case' 0 N--CA 1.497 1.925 0 O-C-N 121.502 -0.749 . . . . 0.0 110.797 179.527 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 86' ' ' LYS . . . . . 0.417 ' CB ' ' O ' ' A' ' 85' ' ' MET . 0.2 OUTLIER 71.67 113.07 0.06 Allowed 'General case' 0 N--CA 1.502 2.146 0 O-C-N 121.581 -0.7 . . . . 0.0 110.429 -179.757 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' A' A ' 87' ' ' ASP . . . . . . . . . . . . . 8.4 p-10 -62.22 -34.98 77.53 Favored 'General case' 0 N--CA 1.5 2.036 0 O-C-N 121.554 -0.716 . . . . 0.0 110.814 179.989 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 88' ' ' ASP . . . . . . . . . . . . . 14.5 t70 -71.43 123.53 22.58 Favored 'General case' 0 N--CA 1.495 1.787 0 O-C-N 121.313 -0.867 . . . . 0.0 110.061 179.634 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 89' ' ' SER . . . . . . . . . . . . . 0.5 OUTLIER . . . . . 0 N--CA 1.498 1.944 0 CA-C-O 118.139 -0.934 . . . . 0.0 110.404 179.994 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' B' B ' 144' ' ' ARG . . . . . . . . . . . . . 1.7 ttt85 . . . . . 0 N--CA 1.497 1.921 0 CA-C-O 120.888 0.375 . . . . 0.0 110.068 . . . . . . . . . 0 0 . 1 . 011 nuclear nobuild full ' B' B ' 145' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -71.23 97.36 1.53 Allowed 'General case' 0 N--CA 1.498 1.95 0 O-C-N 121.361 -0.837 . . . . 0.0 110.26 -179.966 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' B' B ' 146' ' ' VAL . . . . . 0.461 ' O ' HG13 ' B' ' 146' ' ' VAL . 9.5 p -110.05 41.51 0.34 Allowed 'Isoleucine or valine' 0 N--CA 1.498 1.928 0 O-C-N 121.465 -0.772 . . . . 0.0 110.715 -179.674 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' B' B ' 147' ' ' ARG . . . . . 0.455 ' NH1' HG13 ' B' ' 146' ' ' VAL . 0.1 OUTLIER -97.5 80.18 2.82 Favored 'General case' 0 N--CA 1.496 1.85 0 O-C-N 121.13 -0.981 . . . . 0.0 109.766 179.394 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' B' B ' 148' ' ' ILE . . . . . . . . . . . . . 1.1 mp -83.39 151.87 3.93 Favored 'Isoleucine or valine' 0 N--CA 1.497 1.889 0 O-C-N 121.565 -0.709 . . . . 0.0 110.407 -179.673 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' B' B ' 149' ' ' SER . . . . . . . . . . . . . 78.9 p -103.85 -177.07 3.26 Favored 'General case' 0 N--CA 1.497 1.9 0 O-C-N 121.367 -0.833 . . . . 0.0 110.449 179.667 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' B' B ' 150' ' ' ALA . . . . . . . . . . . . . . . -88.75 -45.46 9.77 Favored 'General case' 0 N--CA 1.498 1.944 0 O-C-N 121.258 -0.901 . . . . 0.0 110.523 -179.955 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' B' B ' 151' ' ' ASP . . . . . . . . . . . . . 8.0 p-10 -56.8 -41.64 78.1 Favored 'General case' 0 N--CA 1.503 2.188 0 O-C-N 121.537 -0.727 . . . . 0.0 111.076 -179.977 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' B' B ' 152' ' ' ALA . . . . . . . . . . . . . . . -66.35 -43.09 87.05 Favored 'General case' 0 N--CA 1.498 1.94 0 O-C-N 121.293 -0.879 . . . . 0.0 110.286 179.78 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' B' B ' 153' ' ' MET . . . . . . . . . . . . . 7.3 mmt -63.17 -48.32 78.9 Favored 'General case' 0 N--CA 1.496 1.867 0 O-C-N 121.553 -0.717 . . . . 0.0 109.968 179.516 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' B' B ' 154' ' ' MET . . . . . . . . . . . . . 22.9 mmm -59.99 -37.57 80.05 Favored 'General case' 0 N--CA 1.498 1.957 0 O-C-N 121.566 -0.709 . . . . 0.0 110.092 179.309 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' B' B ' 155' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -69.47 -38.91 77.94 Favored 'General case' 0 N--CA 1.499 2.021 0 O-C-N 121.537 -0.727 . . . . 0.0 110.938 179.696 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' B' B ' 156' ' ' ALA . . . . . 0.611 ' HA ' ' HB3' ' B' ' 160' ' ' ALA . . . -75.91 -45.34 35.81 Favored 'General case' 0 N--CA 1.498 1.945 0 O-C-N 121.249 -0.907 . . . . 0.0 110.777 -179.507 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' B' B ' 157' ' ' LEU . . . . . 0.462 HD11 HG11 ' A' ' 44' ' ' VAL . 1.4 mp -60.08 -37.08 78.84 Favored 'General case' 0 N--CA 1.499 2.024 0 O-C-N 121.469 -0.77 . . . . 0.0 111.142 -179.737 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' B' B ' 158' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -131.61 55.09 1.88 Allowed 'General case' 0 N--CA 1.496 1.829 0 O-C-N 121.254 -0.904 . . . . 0.0 110.297 -179.886 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' B' B ' 159' ' ' GLY . . . . . 0.484 ' HA2' ' HG2' ' B' ' 163' ' ' LYS . . . -174.08 -59.03 0.05 OUTLIER Glycine 0 N--CA 1.497 2.766 0 C-N-CA 119.973 -1.108 . . . . 0.0 110.433 -179.982 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' B' B ' 160' ' ' ALA . . . . . 0.611 ' HB3' ' HA ' ' B' ' 156' ' ' ALA . . . -76.45 107.7 8.9 Favored 'General case' 0 N--CA 1.497 1.918 0 O-C-N 121.334 -1.098 . . . . 0.0 110.638 -179.56 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' B' B ' 161' ' ' ARG . . . . . 0.536 ' HA ' ' NH2' ' B' ' 161' ' ' ARG . 0.0 OUTLIER 71.28 -40.91 0.49 Allowed 'General case' 0 N--CA 1.507 2.389 0 O-C-N 121.82 -0.55 . . . . 0.0 112.242 179.826 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' B' B ' 162' ' ' ALA . . . . . . . . . . . . . . . -50.55 -33.03 20.2 Favored 'General case' 0 N--CA 1.504 2.257 0 O-C-N 120.885 -1.134 . . . . 0.0 110.633 179.691 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' B' B ' 163' ' ' LYS . . . . . 0.484 ' HG2' ' HA2' ' B' ' 159' ' ' GLY . 0.0 OUTLIER . . . . . 0 N--CA 1.497 1.911 0 CA-C-O 117.877 -1.059 . . . . 0.0 110.456 178.994 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 90' ' ' ' CA' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 011 nuclear nobuild full ' A' A ' 91' ' ' SXK . . . . . 0.494 ' CAK' HD23 ' A' ' 41' ' ' LEU . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 2.5 tpt . . . . . 0 N--CA 1.495 1.805 0 CA-C-O 120.915 0.388 . . . . 0.0 110.351 . . . . . . . . . 0 0 . 1 . 012 nuclear nobuild full ' A' A ' 2' ' ' ASP . . . . . . . . . . . . . 0.6 OUTLIER -126.44 147.81 49.74 Favored 'General case' 0 N--CA 1.496 1.848 0 O-C-N 121.522 -0.736 . . . . 0.0 110.564 179.933 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 3' ' ' ASP . . . . . . . . . . . . . 7.2 p-10 -127.42 -21.63 3.81 Favored 'General case' 0 N--CA 1.494 1.766 0 O-C-N 121.725 -0.609 . . . . 0.0 111.08 179.756 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 4' ' ' ILE . . . . . . . . . . . . . 2.0 mp -82.92 -57.27 4.7 Favored 'Isoleucine or valine' 0 N--CA 1.501 2.099 0 O-C-N 121.013 -1.054 . . . . 0.0 110.316 -179.873 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 5' ' ' TYR . . . . . . . . . . . . . 0.4 OUTLIER -55.88 -31.5 62.87 Favored 'General case' 0 N--CA 1.502 2.135 0 O-C-N 121.333 -0.854 . . . . 0.0 110.181 179.448 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -58.02 -38.35 76.02 Favored 'General case' 0 N--CA 1.497 1.886 0 O-C-N 121.602 -0.686 . . . . 0.0 110.589 179.408 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 7' ' ' ALA . . . . . . . . . . . . . . . -61.42 -44.16 97.62 Favored 'General case' 0 N--CA 1.499 2.024 0 O-C-N 121.396 -0.815 . . . . 0.0 110.643 179.644 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 8' ' ' ALA . . . . . . . . . . . . . . . -74.73 -12.26 60.37 Favored 'General case' 0 N--CA 1.499 2.018 0 O-C-N 121.302 -0.874 . . . . 0.0 111.371 179.988 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 9' ' ' VAL . . . . . 0.774 HG13 ' HB3' ' A' ' 78' ' ' LEU . 48.1 t -101.58 -52.68 8.23 Favored 'Isoleucine or valine' 0 N--CA 1.498 1.961 0 O-C-N 121.142 -0.974 . . . . 0.0 110.601 -179.684 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 10' ' ' GLU . . . . . . . . . . . . . 21.9 mm-40 -86.77 -18.62 30.65 Favored 'General case' 0 N--CA 1.494 1.765 0 O-C-N 121.303 -0.873 . . . . 0.0 111.163 -179.544 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 11' ' ' GLN . . . . . . . . . . . . . 0.6 OUTLIER -120.27 59.29 0.9 Allowed 'General case' 0 N--CA 1.496 1.86 0 O-C-N 120.974 -1.078 . . . . 0.0 111.088 -179.933 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 12' ' ' LEU . . . . . 0.571 HD13 ' HB3' ' A' ' 16' ' ' GLN . 0.0 OUTLIER -92.99 -73.14 0.57 Allowed 'General case' 0 N--CA 1.501 2.121 0 O-C-N 120.988 -1.07 . . . . 0.0 108.721 178.33 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' A' A ' 13' ' ' THR . . . . . 0.476 ' HB ' ' HB2' ' A' ' 16' ' ' GLN . 1.6 m -152.23 147.53 26.49 Favored 'General case' 0 N--CA 1.498 1.945 0 O-C-N 121.528 -0.732 . . . . 0.0 109.346 179.034 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 14' ' ' GLU . . . . . . . . . . . . . 0.3 OUTLIER -54.07 -46.24 71.95 Favored 'General case' 0 N--CA 1.494 1.728 0 O-C-N 121.714 -0.616 . . . . 0.0 111.013 -179.238 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 7.0 tp10 -76.87 -26.72 54.54 Favored 'General case' 0 N--CA 1.496 1.839 0 O-C-N 121.297 -0.877 . . . . 0.0 111.048 179.96 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 16' ' ' GLN . . . . . 0.571 ' HB3' HD13 ' A' ' 12' ' ' LEU . 2.5 mt-30 -56.23 -42.44 77.3 Favored 'General case' 0 N--CA 1.503 2.191 0 O-C-N 121.156 -0.965 . . . . 0.0 110.711 -179.897 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 17' ' ' LYS . . . . . 0.46 ' NZ ' HD13 ' A' ' 78' ' ' LEU . 6.7 mttm -65.95 -45.7 80.83 Favored 'General case' 0 N--CA 1.496 1.863 0 N-CA-C 109.245 -0.65 . . . . 0.0 109.245 179.145 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 18' ' ' ASN . . . . . . . . . . . . . 61.9 t30 -64.07 -37.28 86.88 Favored 'General case' 0 N--CA 1.497 1.906 0 O-C-N 121.779 -0.576 . . . . 0.0 109.628 178.736 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 5.6 tt0 -67.07 -52.62 39.87 Favored 'General case' 0 N--CA 1.495 1.799 0 O-C-N 121.543 -0.723 . . . . 0.0 109.363 179.108 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 20' ' ' PHE . . . . . . . . . . . . . 4.0 m-85 -58.58 -34.16 70.78 Favored 'General case' 0 N--CA 1.499 2.012 0 O-C-N 121.419 -0.801 . . . . 0.0 109.699 179.121 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 21' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -61.43 -46.51 89.8 Favored 'General case' 0 N--CA 1.498 1.925 0 O-C-N 121.439 -0.788 . . . . 0.0 109.19 178.852 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 22' ' ' ALA . . . . . . . . . . . . . . . -59.77 -47.9 83.82 Favored 'General case' 0 N--CA 1.499 1.978 0 O-C-N 121.387 -0.82 . . . . 0.0 109.532 179.107 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 23' ' ' ALA . . . . . . . . . . . . . . . -61.02 -41.02 95.75 Favored 'General case' 0 N--CA 1.497 1.919 0 O-C-N 121.455 -0.778 . . . . 0.0 109.412 178.563 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 24' ' ' PHE . . . . . 0.413 ' CE2' HD12 ' A' ' 36' ' ' ILE . 37.7 t80 -67.12 -45.98 75.53 Favored 'General case' 0 N--CA 1.497 1.891 0 O-C-N 121.767 -0.583 . . . . 0.0 110.112 179.339 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 25' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER -53.38 -46.38 69.6 Favored 'General case' 0 N--CA 1.5 2.071 0 O-C-N 121.606 -0.684 . . . . 0.0 110.26 179.72 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 26' ' ' ILE . . . . . 0.542 ' HB ' HD21 ' B' ' 157' ' ' LEU . 51.0 mt -72.45 -30.27 34.05 Favored 'Isoleucine or valine' 0 N--CA 1.497 1.909 0 O-C-N 121.465 -0.772 . . . . 0.0 109.68 179.171 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 27' ' ' PHE . . . . . . . . . . . . . 0.8 OUTLIER -63.52 -38.82 92.59 Favored 'General case' 0 N--CA 1.498 1.932 0 O-C-N 121.434 -0.791 . . . . 0.0 110.299 179.363 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 28' ' ' VAL . . . . . . . . . . . . . 34.9 m -93.78 36.68 0.1 Allowed 'Isoleucine or valine' 0 N--CA 1.501 2.11 0 O-C-N 121.265 -0.897 . . . . 0.0 110.811 179.838 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 29' ' ' LEU . . . . . . . . . . . . . 0.9 OUTLIER -70.22 106.45 3.32 Favored 'General case' 0 N--CA 1.499 1.996 0 O-C-N 121.012 -1.055 . . . . 0.0 109.816 179.476 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 30' ' ' GLY . . . . . . . . . . . . . . . 109.9 -30.87 7.97 Favored Glycine 0 N--CA 1.494 2.556 0 N-CA-C 109.352 -1.499 . . . . 0.0 109.352 -179.228 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 31' ' ' ALA . . . . . . . . . . . . . . . -82.85 94.78 7.75 Favored 'General case' 0 N--CA 1.495 1.779 0 O-C-N 121.411 -1.052 . . . . 0.0 109.642 179.549 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 32' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -62.03 -19.52 62.97 Favored 'General case' 0 N--CA 1.503 2.206 0 O-C-N 121.431 -0.793 . . . . 0.0 111.445 -179.627 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 15.7 t70 -54.48 -37.43 65.25 Favored 'General case' 0 N--CA 1.498 1.938 0 O-C-N 121.459 -0.776 . . . . 0.0 110.901 179.931 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 34' ' ' GLY . . . . . . . . . . . . . . . 88.93 24.91 30.91 Favored Glycine 0 N--CA 1.496 2.657 0 N-CA-C 110.148 -1.181 . . . . 0.0 110.148 -179.927 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 35' ' ' CYS . . . . . . . . . . . . . 56.3 m -138.4 167.73 21.26 Favored 'General case' 0 N--CA 1.496 1.848 0 O-C-N 121.231 -1.158 . . . . 0.0 110.656 -179.984 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 36' ' ' ILE . . . . . 0.49 ' O ' HG22 ' A' ' 36' ' ' ILE . 0.5 OUTLIER -102.28 112.58 36.02 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.613 0 CA-C-O 121.44 0.638 . . . . 0.0 109.361 179.596 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' A' A ' 37' ' ' SER . . . . . . . . . . . . . 0.2 OUTLIER -108.57 -173.18 2.21 Favored 'General case' 0 N--CA 1.494 1.728 0 O-C-N 121.413 -0.805 . . . . 0.0 110.628 -179.417 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 38' ' ' THR . . . . . . . . . . . . . 57.2 p -66.21 -42.17 89.12 Favored 'General case' 0 N--CA 1.499 1.99 0 O-C-N 121.486 -0.759 . . . . 0.0 110.911 -179.73 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 39' ' ' LYS . . . . . . . . . . . . . 47.9 mtmt -58.43 -45.57 88.21 Favored 'General case' 0 N--CA 1.502 2.13 0 O-C-N 121.45 -0.781 . . . . 0.0 110.731 -179.87 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 1.1 mp0 -71.86 -27.94 63.21 Favored 'General case' 0 N--CA 1.499 2.005 0 O-C-N 121.551 -0.718 . . . . 0.0 110.522 -179.855 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 41' ' ' LEU . . . . . 0.594 ' HG ' HD13 ' A' ' 57' ' ' LEU . 6.9 tp -72.58 -53.48 11.82 Favored 'General case' 0 N--CA 1.497 1.894 0 O-C-N 121.208 -0.932 . . . . 0.0 110.452 179.72 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 42' ' ' GLY . . . . . . . . . . . . . . . -56.44 -35.89 67.98 Favored Glycine 0 N--CA 1.496 2.666 0 N-CA-C 110.4 -1.08 . . . . 0.0 110.4 -179.406 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 43' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -56.56 -37.16 70.17 Favored 'General case' 0 N--CA 1.5 2.052 0 O-C-N 121.345 -1.091 . . . . 0.0 109.907 179.218 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 44' ' ' VAL . . . . . . . . . . . . . 88.6 t -85.18 -31.8 7.06 Favored 'Isoleucine or valine' 0 N--CA 1.497 1.917 0 O-C-N 121.483 -0.76 . . . . 0.0 109.761 178.837 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 45' ' ' MET . . . . . 0.543 ' HE1' HD13 ' B' ' 148' ' ' ILE . 0.0 OUTLIER -58.52 -53.33 59.5 Favored 'General case' 0 N--CA 1.5 2.034 0 O-C-N 121.398 -0.814 . . . . 0.0 109.96 179.496 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' A' A ' 46' ' ' ARG . . . . . 0.492 ' HA ' ' HB2' ' A' ' 51' ' ' ASN . 1.9 ppt_? -64.25 -28.72 69.93 Favored 'General case' 0 N--CA 1.499 2.011 0 O-C-N 121.377 -0.827 . . . . 0.0 109.938 179.125 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 47' ' ' MET . . . . . . . . . . . . . 13.9 ttp -66.95 -36.22 81.72 Favored 'General case' 0 N--CA 1.495 1.824 0 O-C-N 121.455 -0.778 . . . . 0.0 109.501 178.856 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 48' ' ' LEU . . . . . . . . . . . . . 28.5 mt -75.28 -40.35 58.77 Favored 'General case' 0 N--CA 1.498 1.959 0 O-C-N 121.516 -0.74 . . . . 0.0 110.0 179.151 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 49' ' ' GLY . . . . . . . . . . . . . . . 139.02 -50.81 0.78 Allowed Glycine 0 N--CA 1.495 2.575 0 N-CA-C 109.96 -1.256 . . . . 0.0 109.96 -179.773 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 50' ' ' GLN . . . . . . . . . . . . . 0.6 OUTLIER -84.89 99.69 11.11 Favored 'General case' 0 N--CA 1.498 1.939 0 O-C-N 121.331 -1.1 . . . . 0.0 110.739 -179.662 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 51' ' ' ASN . . . . . 0.492 ' HB2' ' HA ' ' A' ' 46' ' ' ARG . 14.2 t30 -129.69 101.08 18.84 Favored Pre-proline 0 N--CA 1.496 1.856 0 O-C-N 121.473 -0.767 . . . . 0.0 109.992 179.723 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 52' ' ' PRO . . . . . . . . . . . . . 46.1 Cg_endo -73.56 -92.3 0.01 OUTLIER 'Trans proline' 0 C--N 1.314 -1.252 0 O-C-N 123.821 1.432 . . . . 0.0 111.23 -179.569 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 53' ' ' THR . . . . . 0.665 HG22 ' HD2' ' A' ' 54' ' ' PRO . 0.1 OUTLIER -139.54 151.1 65.77 Favored Pre-proline 0 N--CA 1.502 2.164 0 O-C-N 120.918 -1.114 . . . . 0.0 110.432 -179.375 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' A' A ' 54' ' ' PRO . . . . . 0.665 ' HD2' HG22 ' A' ' 53' ' ' THR . 41.8 Cg_endo -69.21 -40.31 6.37 Favored 'Trans proline' 0 N--CA 1.489 1.247 0 O-C-N 123.841 1.443 . . . . 0.0 110.667 179.807 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 55' ' ' GLU . . . . . . . . . . . . . 3.6 mp0 -66.48 -31.14 71.69 Favored 'General case' 0 N--CA 1.496 1.832 0 O-C-N 121.449 -0.782 . . . . 0.0 109.869 179.375 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 16.0 tt0 -63.7 -34.62 78.28 Favored 'General case' 0 N--CA 1.496 1.838 0 O-C-N 121.528 -0.733 . . . . 0.0 110.231 179.291 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 57' ' ' LEU . . . . . 0.594 HD13 ' HG ' ' A' ' 41' ' ' LEU . 56.7 mt -67.25 -25.63 66.17 Favored 'General case' 0 N--CA 1.496 1.853 0 O-C-N 121.186 -0.946 . . . . 0.0 110.273 179.491 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 58' ' ' GLN . . . . . 0.566 ' O ' HG22 ' A' ' 61' ' ' ILE . 0.0 OUTLIER -64.31 -29.77 70.84 Favored 'General case' 0 N--CA 1.498 1.958 0 O-C-N 121.064 -1.022 . . . . 0.0 108.969 178.793 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' A' A ' 59' ' ' GLU . . . . . 0.504 ' N ' ' HG3' ' A' ' 58' ' ' GLN . 17.8 mm-40 -81.28 -32.22 33.29 Favored 'General case' 0 N--CA 1.492 1.632 0 N-CA-C 107.89 -1.152 . . . . 0.0 107.89 177.415 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 60' ' ' MET . . . . . 0.48 ' HE3' HD23 ' A' ' 57' ' ' LEU . 0.3 OUTLIER -68.86 -44.4 73.41 Favored 'General case' 0 N--CA 1.495 1.793 0 O-C-N 121.91 -0.494 . . . . 0.0 109.953 178.799 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' A' A ' 61' ' ' ILE . . . . . 0.566 HG22 ' O ' ' A' ' 58' ' ' GLN . 12.6 tt -62.71 -31.34 51.84 Favored 'Isoleucine or valine' 0 N--CA 1.497 1.915 0 O-C-N 121.493 -0.754 . . . . 0.0 110.201 179.631 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 62' ' ' ASP . . . . . 0.573 ' HA ' ' HB3' ' A' ' 65' ' ' ASP . 17.6 t70 -64.41 -35.47 81.01 Favored 'General case' 0 N--CA 1.499 1.987 0 O-C-N 121.459 -0.776 . . . . 0.0 110.838 179.675 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 63' ' ' GLU . . . . . . . . . . . . . 5.1 tt0 -51.31 -38.51 53.34 Favored 'General case' 0 N--CA 1.503 2.225 0 O-C-N 121.399 -0.813 . . . . 0.0 110.291 179.571 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 64' ' ' VAL . . . . . . . . . . . . . 65.0 t -100.3 -24.67 4.06 Favored 'Isoleucine or valine' 0 N--CA 1.497 1.883 0 O-C-N 121.516 -0.74 . . . . 0.0 109.966 179.015 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 65' ' ' ASP . . . . . 0.573 ' HB3' ' HA ' ' A' ' 62' ' ' ASP . 18.4 t70 -79.57 -93.03 0.04 OUTLIER 'General case' 0 N--CA 1.494 1.728 0 O-C-N 121.529 -0.732 . . . . 0.0 110.58 -179.595 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 66' ' ' GLU . . . . . . . . . . . . . 0.5 OUTLIER 47.05 32.31 1.89 Allowed 'General case' 0 N--CA 1.501 2.12 0 O-C-N 121.389 -0.819 . . . . 0.0 111.073 -179.592 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 67' ' ' ASP . . . . . . . . . . . . . 4.9 p-10 -118.31 1.63 11.85 Favored 'General case' 0 N--CA 1.498 1.926 0 O-C-N 121.135 -0.978 . . . . 0.0 111.695 -179.559 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 68' ' ' GLY . . . . . . . . . . . . . . . 106.13 -41.33 2.2 Favored Glycine 0 N--CA 1.495 2.605 0 N-CA-C 109.908 -1.277 . . . . 0.0 109.908 179.949 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 69' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -60.9 -51.24 70.11 Favored 'General case' 0 N--CA 1.501 2.095 0 O-C-N 121.482 -1.01 . . . . 0.0 110.778 -179.732 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 70' ' ' GLY . . . . . . . . . . . . . . . 100.06 -28.04 17.54 Favored Glycine 0 N--CA 1.498 2.783 0 C-N-CA 120.152 -1.023 . . . . 0.0 110.959 179.535 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 71' ' ' THR . . . . . . . . . . . . . 11.7 t -104.89 159.89 15.44 Favored 'General case' 0 N--CA 1.5 2.025 0 O-C-N 120.997 -1.296 . . . . 0.0 111.389 -179.533 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 72' ' ' VAL . . . . . 0.541 HG23 HG13 ' A' ' 61' ' ' ILE . 2.5 t -94.35 118.44 40.35 Favored 'Isoleucine or valine' 0 N--CA 1.497 1.884 0 O-C-N 121.751 -0.593 . . . . 0.0 110.239 179.922 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 73' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -91.8 -166.76 1.63 Allowed 'General case' 0 N--CA 1.495 1.809 0 O-C-N 121.165 -0.96 . . . . 0.0 110.012 179.519 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 74' ' ' PHE . . . . . . . . . . . . . 77.3 t80 -61.57 -45.23 95.03 Favored 'General case' 0 N--CA 1.499 2.02 0 O-C-N 121.17 -0.956 . . . . 0.0 110.558 179.827 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 75' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -62.88 -46.2 88.96 Favored 'General case' 0 N--CA 1.499 1.989 0 O-C-N 121.432 -0.793 . . . . 0.0 110.536 179.819 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 76' ' ' GLU . . . . . . . . . . . . . 27.3 mt-10 -63.98 -36.97 85.72 Favored 'General case' 0 N--CA 1.501 2.084 0 O-C-N 121.441 -0.787 . . . . 0.0 109.807 179.35 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 77' ' ' PHE . . . . . . . . . . . . . 5.9 t80 -55.67 -43.43 76.35 Favored 'General case' 0 N--CA 1.494 1.772 0 O-C-N 121.759 -0.588 . . . . 0.0 109.818 179.266 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 78' ' ' LEU . . . . . 0.774 ' HB3' HG13 ' A' ' 9' ' ' VAL . 35.0 mt -70.41 -45.05 66.71 Favored 'General case' 0 N--CA 1.497 1.881 0 O-C-N 121.467 -0.771 . . . . 0.0 110.491 179.553 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 79' ' ' VAL . . . . . . . . . . . . . 24.1 t -58.59 -34.13 50.45 Favored 'Isoleucine or valine' 0 N--CA 1.502 2.138 0 O-C-N 121.335 -0.853 . . . . 0.0 109.202 178.968 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 80' ' ' MET . . . . . 0.43 ' CE ' ' HAI' ' A' ' 91' ' ' SXK . 0.8 OUTLIER -73.77 -42.27 61.28 Favored 'General case' 0 N--CA 1.493 1.693 0 O-C-N 121.526 -0.734 . . . . 0.0 109.238 178.489 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' A' A ' 81' ' ' MET . . . . . 0.516 ' HG3' ' CB ' ' B' ' 150' ' ' ALA . 0.0 OUTLIER -55.11 -51.25 67.0 Favored 'General case' 0 N--CA 1.499 2.014 0 O-C-N 121.76 -0.588 . . . . 0.0 110.559 179.576 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' A' A ' 82' ' ' VAL . . . . . 0.439 HG21 ' CG2' ' A' ' 9' ' ' VAL . 33.7 m -65.99 -29.07 45.68 Favored 'Isoleucine or valine' 0 N--CA 1.502 2.156 0 O-C-N 121.453 -0.779 . . . . 0.0 110.671 179.931 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 83' ' ' ARG . . . . . . . . . . . . . 2.1 mtt180 -64.95 -43.0 94.15 Favored 'General case' 0 N--CA 1.496 1.827 0 O-C-N 121.255 -0.903 . . . . 0.0 109.395 179.237 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 84' ' ' CYS . . . . . . . . . . . . . 0.0 OUTLIER -72.05 -42.63 66.05 Favored 'General case' 0 N--CA 1.495 1.777 0 O-C-N 121.549 -0.719 . . . . 0.0 110.123 179.17 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 85' ' ' MET . . . . . . . . . . . . . 70.7 mtm -74.01 -6.82 49.72 Favored 'General case' 0 N--CA 1.499 2.019 0 O-C-N 121.473 -0.767 . . . . 0.0 111.225 179.834 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 86' ' ' LYS . . . . . . . . . . . . . 47.9 mmtm 58.69 65.61 1.21 Allowed 'General case' 0 N--CA 1.501 2.079 0 O-C-N 121.377 -0.827 . . . . 0.0 110.84 -179.978 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 87' ' ' ASP . . . . . 0.447 ' O ' ' CB ' ' A' ' 88' ' ' ASP . 5.0 m-20 -93.74 -166.2 1.46 Allowed 'General case' 0 N--CA 1.496 1.836 0 O-C-N 121.558 -0.714 . . . . 0.0 110.104 179.595 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 88' ' ' ASP . . . . . 0.447 ' CB ' ' O ' ' A' ' 87' ' ' ASP . 0.4 OUTLIER 72.34 -60.99 0.51 Allowed 'General case' 0 N--CA 1.506 2.344 0 O-C-N 121.653 -0.654 . . . . 0.0 110.995 179.959 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' A' A ' 89' ' ' SER . . . . . . . . . . . . . 0.6 OUTLIER . . . . . 0 N--CA 1.497 1.896 0 CA-C-O 118.205 -0.902 . . . . 0.0 110.428 -179.962 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' B' B ' 144' ' ' ARG . . . . . . . . . . . . . 0.6 OUTLIER . . . . . 0 N--CA 1.497 1.882 0 CA-C-O 120.901 0.382 . . . . 0.0 110.122 . . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' B' B ' 145' ' ' ARG . . . . . 0.445 ' O ' HG13 ' B' ' 146' ' ' VAL . 0.7 OUTLIER -112.42 -63.22 1.46 Allowed 'General case' 0 N--CA 1.495 1.808 0 O-C-N 121.386 -0.821 . . . . 0.0 109.489 179.357 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' B' B ' 146' ' ' VAL . . . . . 0.655 ' HB ' ' HAF' ' A' ' 91' ' ' SXK . 0.0 OUTLIER -155.91 -81.64 0.0 OUTLIER 'Isoleucine or valine' 0 N--CA 1.502 2.156 0 O-C-N 121.628 -0.67 . . . . 0.0 109.355 179.225 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' B' B ' 147' ' ' ARG . . . . . . . . . . . . . 28.8 mtt-85 43.13 50.57 5.59 Favored 'General case' 0 N--CA 1.504 2.246 0 O-C-N 121.55 -0.719 . . . . 0.0 112.183 178.864 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' B' B ' 148' ' ' ILE . . . . . 0.543 HD13 ' HE1' ' A' ' 45' ' ' MET . 1.1 mp -81.81 124.26 38.86 Favored 'Isoleucine or valine' 0 N--CA 1.497 1.911 0 O-C-N 121.011 -1.056 . . . . 0.0 109.766 179.371 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' B' B ' 149' ' ' SER . . . . . . . . . . . . . 6.8 t -88.31 171.43 10.17 Favored 'General case' 0 N--CA 1.496 1.874 0 O-C-N 121.43 -0.794 . . . . 0.0 111.246 -179.417 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' B' B ' 150' ' ' ALA . . . . . 0.516 ' CB ' ' HG3' ' A' ' 81' ' ' MET . . . -61.54 -51.67 67.64 Favored 'General case' 0 N--CA 1.497 1.901 0 O-C-N 121.73 -0.606 . . . . 0.0 110.509 179.732 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' B' B ' 151' ' ' ASP . . . . . . . . . . . . . 6.8 p-10 -61.57 -31.92 71.98 Favored 'General case' 0 N--CA 1.499 2.018 0 O-C-N 121.627 -0.671 . . . . 0.0 110.717 179.685 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' B' B ' 152' ' ' ALA . . . . . . . . . . . . . . . -70.16 -46.52 64.5 Favored 'General case' 0 N--CA 1.497 1.902 0 O-C-N 121.21 -0.931 . . . . 0.0 110.545 179.987 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' B' B ' 153' ' ' MET . . . . . 0.404 ' SD ' HG21 ' B' ' 148' ' ' ILE . 1.5 tpt -75.2 -37.65 61.08 Favored 'General case' 0 N--CA 1.498 1.947 0 O-C-N 121.287 -0.883 . . . . 0.0 110.848 -179.99 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' B' B ' 154' ' ' MET . . . . . . . . . . . . . 2.7 ttp -70.6 -50.54 36.05 Favored 'General case' 0 N--CA 1.498 1.938 0 O-C-N 121.302 -0.874 . . . . 0.0 110.918 -179.652 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' B' B ' 155' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -64.39 -35.77 81.98 Favored 'General case' 0 N--CA 1.5 2.052 0 O-C-N 121.273 -0.892 . . . . 0.0 110.801 -179.752 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' B' B ' 156' ' ' ALA . . . . . 0.694 ' HA ' ' HB3' ' B' ' 160' ' ' ALA . . . -59.31 -46.91 87.3 Favored 'General case' 0 N--CA 1.498 1.933 0 O-C-N 121.303 -0.873 . . . . 0.0 110.112 179.604 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' B' B ' 157' ' ' LEU . . . . . 0.542 HD21 ' HB ' ' A' ' 26' ' ' ILE . 14.8 tp -61.22 -53.79 52.38 Favored 'General case' 0 N--CA 1.496 1.859 0 O-C-N 121.586 -0.696 . . . . 0.0 110.4 179.653 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' B' B ' 158' ' ' LEU . . . . . . . . . . . . . 1.6 mt -104.54 94.27 5.23 Favored 'General case' 0 N--CA 1.495 1.79 0 O-C-N 121.451 -0.781 . . . . 0.0 109.792 179.624 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' B' B ' 159' ' ' GLY . . . . . . . . . . . . . . . 137.99 -58.11 0.63 Allowed Glycine 0 N--CA 1.494 2.567 0 N-CA-C 109.422 -1.471 . . . . 0.0 109.422 -179.631 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' B' B ' 160' ' ' ALA . . . . . 0.694 ' HB3' ' HA ' ' B' ' 156' ' ' ALA . . . -88.35 -16.27 33.44 Favored 'General case' 0 N--CA 1.498 1.969 0 O-C-N 121.471 -1.017 . . . . 0.0 110.892 179.841 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' B' B ' 161' ' ' ARG . . . . . . . . . . . . . 2.8 mmp_? -125.19 -65.39 1.02 Allowed 'General case' 0 N--CA 1.497 1.922 0 O-C-N 121.15 -0.969 . . . . 0.0 110.71 -179.86 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' B' B ' 162' ' ' ALA . . . . . . . . . . . . . . . -115.57 164.57 14.12 Favored 'General case' 0 N--CA 1.497 1.884 0 O-C-N 121.329 -0.857 . . . . 0.0 110.374 179.994 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' B' B ' 163' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.495 1.777 0 CA-C-O 118.2 -0.905 . . . . 0.0 110.018 179.953 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 90' ' ' ' CA' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 012 nuclear nobuild full ' A' A ' 91' ' ' SXK . . . . . 0.655 ' HAF' ' HB ' ' B' ' 146' ' ' VAL . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.496 1.84 0 CA-C-O 120.932 0.396 . . . . 0.0 110.352 . . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 2' ' ' ASP . . . . . . . . . . . . . 15.0 t70 -107.79 -63.4 1.32 Allowed 'General case' 0 N--CA 1.495 1.788 0 O-C-N 121.448 -0.783 . . . . 0.0 110.624 -179.916 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 3' ' ' ASP . . . . . 0.594 ' HB3' ' CB ' ' A' ' 6' ' ' LYS . 3.8 t0 -152.6 140.72 20.34 Favored 'General case' 0 N--CA 1.494 1.752 0 O-C-N 121.283 -0.886 . . . . 0.0 111.45 -178.942 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 4' ' ' ILE . . . . . . . . . . . . . 7.8 mt -94.56 -37.3 7.8 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.72 0 N-CA-C 108.975 -0.75 . . . . 0.0 108.975 178.479 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 5' ' ' TYR . . . . . 0.411 ' HB3' HG13 ' A' ' 82' ' ' VAL . 47.8 m-85 -73.56 -30.61 63.16 Favored 'General case' 0 N--CA 1.496 1.853 0 O-C-N 121.644 -0.66 . . . . 0.0 109.92 179.124 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 6' ' ' LYS . . . . . 0.594 ' CB ' ' HB3' ' A' ' 3' ' ' ASP . 0.3 OUTLIER -56.67 -34.24 67.18 Favored 'General case' 0 N--CA 1.498 1.939 0 O-C-N 121.613 -0.679 . . . . 0.0 109.855 179.041 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' A' A ' 7' ' ' ALA . . . . . . . . . . . . . . . -61.76 -43.05 99.61 Favored 'General case' 0 N--CA 1.496 1.859 0 O-C-N 121.519 -0.738 . . . . 0.0 109.965 179.187 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 8' ' ' ALA . . . . . . . . . . . . . . . -60.66 -34.01 73.67 Favored 'General case' 0 N--CA 1.501 2.081 0 O-C-N 121.438 -0.789 . . . . 0.0 110.829 179.521 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 9' ' ' VAL . . . . . 0.641 HG13 ' HB3' ' A' ' 78' ' ' LEU . 72.9 t -58.73 -43.84 88.73 Favored 'Isoleucine or valine' 0 N--CA 1.501 2.09 0 O-C-N 121.437 -0.79 . . . . 0.0 111.064 -179.92 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 10' ' ' GLU . . . . . . . . . . . . . 12.0 mm-40 -89.76 -1.9 58.11 Favored 'General case' 0 N--CA 1.496 1.842 0 O-C-N 121.257 -0.902 . . . . 0.0 111.166 -179.949 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 11' ' ' GLN . . . . . . . . . . . . . 4.1 mt-30 -99.63 -22.76 15.29 Favored 'General case' 0 N--CA 1.496 1.839 0 O-C-N 121.086 -1.009 . . . . 0.0 110.978 179.78 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 12' ' ' LEU . . . . . 0.556 ' C ' HD12 ' A' ' 12' ' ' LEU . 4.6 pp -67.2 171.9 5.28 Favored 'General case' 0 N--CA 1.505 2.287 0 O-C-N 121.069 -1.019 . . . . 0.0 110.998 -179.811 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 13' ' ' THR . . . . . . . . . . . . . 76.4 p -92.84 159.97 15.14 Favored 'General case' 0 N--CA 1.501 2.092 0 O-C-N 121.332 -0.855 . . . . 0.0 110.854 -179.572 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 14' ' ' GLU . . . . . . . . . . . . . 0.8 OUTLIER -56.77 -28.76 61.78 Favored 'General case' 0 N--CA 1.493 1.716 0 O-C-N 121.643 -0.661 . . . . 0.0 110.653 -179.967 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 1.3 mp0 -60.6 -41.33 94.53 Favored 'General case' 0 N--CA 1.498 1.973 0 O-C-N 121.439 -0.788 . . . . 0.0 110.167 179.419 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 16' ' ' GLN . . . . . 0.471 ' HG2' ' HB2' ' A' ' 12' ' ' LEU . 0.0 OUTLIER -80.24 -33.59 37.85 Favored 'General case' 0 N--CA 1.491 1.591 0 O-C-N 121.423 -0.798 . . . . 0.0 110.087 179.539 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' A' A ' 17' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -70.78 -40.11 72.79 Favored 'General case' 0 N--CA 1.498 1.961 0 O-C-N 121.552 -0.718 . . . . 0.0 110.054 179.305 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 18' ' ' ASN . . . . . . . . . . . . . 3.9 t30 -61.24 -34.6 75.41 Favored 'General case' 0 N--CA 1.497 1.878 0 O-C-N 121.513 -0.742 . . . . 0.0 109.995 179.331 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -62.98 -49.2 75.62 Favored 'General case' 0 N--CA 1.498 1.966 0 O-C-N 121.497 -0.752 . . . . 0.0 109.809 179.295 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 20' ' ' PHE . . . . . . . . . . . . . 12.9 m-85 -64.55 -34.64 78.71 Favored 'General case' 0 N--CA 1.5 2.055 0 O-C-N 121.419 -0.8 . . . . 0.0 110.005 179.098 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 21' ' ' LYS . . . . . . . . . . . . . 1.6 tptp -55.23 -47.35 75.48 Favored 'General case' 0 N--CA 1.498 1.956 0 O-C-N 121.566 -0.709 . . . . 0.0 110.201 179.591 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 22' ' ' ALA . . . . . . . . . . . . . . . -56.07 -44.87 79.33 Favored 'General case' 0 N--CA 1.499 1.996 0 O-C-N 121.598 -0.689 . . . . 0.0 110.082 179.575 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 23' ' ' ALA . . . . . 0.449 ' HA ' HD12 ' A' ' 26' ' ' ILE . . . -66.99 -35.89 80.95 Favored 'General case' 0 N--CA 1.497 1.887 0 O-C-N 121.353 -0.842 . . . . 0.0 109.66 178.726 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 24' ' ' PHE . . . . . 0.422 ' HE1' HD12 ' A' ' 36' ' ' ILE . 76.9 t80 -65.69 -37.85 87.62 Favored 'General case' 0 N--CA 1.497 1.917 0 O-C-N 121.582 -0.699 . . . . 0.0 110.223 179.309 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 25' ' ' ASP . . . . . . . . . . . . . 51.5 m-20 -56.18 -39.72 72.82 Favored 'General case' 0 N--CA 1.501 2.083 0 O-C-N 121.549 -0.719 . . . . 0.0 110.733 179.903 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 26' ' ' ILE . . . . . 0.752 ' HA ' HD12 ' A' ' 29' ' ' LEU . 6.7 mt -71.02 -31.68 45.87 Favored 'Isoleucine or valine' 0 N--CA 1.499 1.986 0 O-C-N 121.174 -0.954 . . . . 0.0 109.846 179.379 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 27' ' ' PHE . . . . . 0.59 ' HB3' HD11 ' A' ' 36' ' ' ILE . 0.2 OUTLIER -71.09 -39.68 71.97 Favored 'General case' 0 N--CA 1.496 1.846 0 O-C-N 121.359 -0.838 . . . . 0.0 110.291 179.522 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' A' A ' 28' ' ' VAL . . . . . 0.465 HG12 HG13 ' A' ' 36' ' ' ILE . 23.5 m -87.99 9.07 2.27 Favored 'Isoleucine or valine' 0 N--CA 1.501 2.086 0 O-C-N 121.365 -0.834 . . . . 0.0 111.281 179.862 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 29' ' ' LEU . . . . . 0.752 HD12 ' HA ' ' A' ' 26' ' ' ILE . 0.7 OUTLIER -61.08 105.82 0.53 Allowed 'General case' 0 N--CA 1.497 1.907 0 O-C-N 121.022 -1.049 . . . . 0.0 110.058 -179.936 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' A' A ' 30' ' ' GLY . . . . . . . . . . . . . . . 96.09 16.62 37.58 Favored Glycine 0 N--CA 1.495 2.623 0 N-CA-C 110.366 -1.094 . . . . 0.0 110.366 -179.577 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 31' ' ' ALA . . . . . . . . . . . . . . . -125.17 87.8 2.77 Favored 'General case' 0 N--CA 1.493 1.719 0 O-C-N 121.024 -1.28 . . . . 0.0 109.959 179.768 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 32' ' ' GLU . . . . . . . . . . . . . 4.0 mt-10 53.46 -91.69 0.03 OUTLIER 'General case' 0 N--CA 1.502 2.153 0 O-C-N 122.001 -0.437 . . . . 0.0 111.19 -179.899 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 7.5 p-10 -143.36 -40.51 0.31 Allowed 'General case' 0 N--CA 1.498 1.96 0 O-C-N 121.132 -0.98 . . . . 0.0 111.277 -179.679 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 34' ' ' GLY . . . . . . . . . . . . . . . -164.26 56.24 0.27 Allowed Glycine 0 N--CA 1.497 2.728 0 N-CA-C 110.104 -1.198 . . . . 0.0 110.104 -179.585 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 35' ' ' CYS . . . . . . . . . . . . . 25.8 p -132.92 149.52 52.24 Favored 'General case' 0 N--CA 1.499 1.99 0 O-C-N 121.456 -1.026 . . . . 0.0 110.359 179.659 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 36' ' ' ILE . . . . . 0.59 HD11 ' HB3' ' A' ' 27' ' ' PHE . 31.0 mt -123.85 130.35 73.97 Favored 'Isoleucine or valine' 0 N--CA 1.497 1.888 0 O-C-N 121.369 -0.832 . . . . 0.0 110.618 -179.826 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 37' ' ' SER . . . . . . . . . . . . . 1.7 t -122.51 -176.49 3.39 Favored 'General case' 0 N--CA 1.496 1.871 0 O-C-N 121.64 -0.662 . . . . 0.0 109.877 179.307 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 38' ' ' THR . . . . . 0.557 ' HB ' ' HA ' ' A' ' 54' ' ' PRO . 54.7 p -65.12 -36.45 84.31 Favored 'General case' 0 N--CA 1.503 2.216 0 O-C-N 121.329 -0.857 . . . . 0.0 110.617 179.891 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 39' ' ' LYS . . . . . . . . . . . . . 7.1 mttm -66.73 -44.47 81.46 Favored 'General case' 0 N--CA 1.498 1.95 0 O-C-N 121.39 -0.818 . . . . 0.0 110.476 179.761 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 1.2 mp0 -71.81 -23.3 61.53 Favored 'General case' 0 N--CA 1.497 1.916 0 O-C-N 121.494 -0.754 . . . . 0.0 110.935 -179.864 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 41' ' ' LEU . . . . . 0.809 HD21 HD22 ' A' ' 57' ' ' LEU . 5.4 tp -63.2 -47.51 82.26 Favored 'General case' 0 N--CA 1.498 1.944 0 O-C-N 121.079 -1.013 . . . . 0.0 110.157 179.774 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 42' ' ' GLY . . . . . 0.495 ' HA2' ' HB2' ' A' ' 45' ' ' MET . . . -55.94 -28.81 54.06 Favored Glycine 0 N--CA 1.495 2.614 0 N-CA-C 110.478 -1.049 . . . . 0.0 110.478 -179.951 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 43' ' ' LYS . . . . . . . . . . . . . 13.5 ttmt -50.99 -47.89 61.42 Favored 'General case' 0 N--CA 1.501 2.079 0 O-C-N 121.374 -1.074 . . . . 0.0 109.984 179.039 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 44' ' ' VAL . . . . . 0.415 HG22 HD21 ' B' ' 157' ' ' LEU . 38.1 t -80.5 -29.14 11.93 Favored 'Isoleucine or valine' 0 N--CA 1.498 1.954 0 O-C-N 121.557 -0.714 . . . . 0.0 110.03 179.053 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 45' ' ' MET . . . . . 0.539 ' HE2' HD11 ' A' ' 41' ' ' LEU . 5.1 mmt -57.09 -40.63 77.34 Favored 'General case' 0 N--CA 1.501 2.093 0 O-C-N 121.345 -0.847 . . . . 0.0 110.268 179.654 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 46' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -59.32 -40.61 86.84 Favored 'General case' 0 N--CA 1.501 2.109 0 O-C-N 121.411 -0.805 . . . . 0.0 110.224 179.383 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 47' ' ' MET . . . . . . . . . . . . . 0.2 OUTLIER -59.76 -43.09 94.48 Favored 'General case' 0 N--CA 1.499 1.981 0 O-C-N 121.493 -0.755 . . . . 0.0 110.185 179.552 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 48' ' ' LEU . . . . . . . . . . . . . 83.9 mt -78.21 -37.49 45.33 Favored 'General case' 0 N--CA 1.498 1.931 0 O-C-N 121.443 -0.785 . . . . 0.0 109.875 179.153 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 49' ' ' GLY . . . . . . . . . . . . . . . 115.92 50.56 0.43 Allowed Glycine 0 N--CA 1.495 2.629 0 N-CA-C 109.582 -1.407 . . . . 0.0 109.582 179.792 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 50' ' ' GLN . . . . . . . . . . . . . 25.1 mt-30 -132.6 145.59 51.22 Favored 'General case' 0 N--CA 1.497 1.923 0 O-C-N 121.408 -1.054 . . . . 0.0 110.111 -179.829 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 51' ' ' ASN . . . . . . . . . . . . . 1.2 t30 -132.36 62.56 63.86 Favored Pre-proline 0 N--CA 1.497 1.919 0 O-C-N 121.273 -0.892 . . . . 0.0 110.959 -179.887 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 52' ' ' PRO . . . . . 0.714 ' HG2' HD11 ' A' ' 57' ' ' LEU . 51.3 Cg_endo -78.16 157.43 30.06 Favored 'Trans proline' 0 C--N 1.314 -1.255 0 O-C-N 123.656 1.345 . . . . 0.0 110.624 179.569 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 53' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -85.14 153.82 59.92 Favored Pre-proline 0 N--CA 1.499 1.98 0 O-C-N 121.235 -0.916 . . . . 0.0 110.191 179.728 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 54' ' ' PRO . . . . . 0.557 ' HA ' ' HB ' ' A' ' 38' ' ' THR . 39.9 Cg_endo -66.15 -47.44 3.43 Favored 'Trans proline' 0 C--N 1.313 -1.303 0 O-C-N 123.686 1.361 . . . . 0.0 110.623 -179.693 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 55' ' ' GLU . . . . . . . . . . . . . 1.3 tt0 -61.45 -30.49 70.62 Favored 'General case' 0 N--CA 1.498 1.95 0 O-C-N 121.307 -0.87 . . . . 0.0 109.834 178.917 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 1.7 tm-20 -73.6 -45.8 50.96 Favored 'General case' 0 N--CA 1.495 1.781 0 O-C-N 121.461 -0.774 . . . . 0.0 110.029 179.252 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 57' ' ' LEU . . . . . 0.809 HD22 HD21 ' A' ' 41' ' ' LEU . 15.6 mt -69.63 -18.16 63.57 Favored 'General case' 0 N--CA 1.497 1.898 0 O-C-N 121.246 -0.908 . . . . 0.0 110.813 179.736 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 58' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -52.68 -51.23 61.16 Favored 'General case' 0 N--CA 1.497 1.921 0 O-C-N 121.084 -1.01 . . . . 0.0 110.538 179.723 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 59' ' ' GLU . . . . . . . . . . . . . 6.8 mm-40 -56.86 -32.23 65.61 Favored 'General case' 0 N--CA 1.499 1.987 0 O-C-N 121.603 -0.686 . . . . 0.0 110.138 179.386 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 60' ' ' MET . . . . . . . . . . . . . 11.5 tpp -59.14 -38.56 79.97 Favored 'General case' 0 N--CA 1.497 1.894 0 O-C-N 121.386 -0.821 . . . . 0.0 109.685 178.863 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 61' ' ' ILE . . . . . 0.449 HG12 ' CG2' ' A' ' 72' ' ' VAL . 15.9 mt -70.73 -41.65 77.59 Favored 'Isoleucine or valine' 0 N--CA 1.497 1.885 0 O-C-N 121.433 -0.792 . . . . 0.0 109.353 178.862 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 62' ' ' ASP . . . . . 0.53 ' HA ' ' HB3' ' A' ' 65' ' ' ASP . 17.8 m-20 -54.84 -32.37 60.51 Favored 'General case' 0 N--CA 1.5 2.036 0 O-C-N 121.596 -0.69 . . . . 0.0 110.719 179.522 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 63' ' ' GLU . . . . . . . . . . . . . 1.4 tm-20 -50.27 -43.35 53.28 Favored 'General case' 0 N--CA 1.5 2.072 0 O-C-N 121.641 -0.662 . . . . 0.0 110.878 179.914 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 64' ' ' VAL . . . . . . . . . . . . . 27.2 m -113.08 0.2 9.08 Favored 'Isoleucine or valine' 0 N--CA 1.501 2.092 0 O-C-N 121.265 -0.897 . . . . 0.0 111.219 179.631 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 65' ' ' ASP . . . . . 0.53 ' HB3' ' HA ' ' A' ' 62' ' ' ASP . 19.7 t70 -86.32 -95.18 0.08 Allowed 'General case' 0 N--CA 1.498 1.949 0 O-C-N 121.211 -0.931 . . . . 0.0 110.37 179.927 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 66' ' ' GLU . . . . . . . . . . . . . 2.3 tp10 50.89 35.21 11.86 Favored 'General case' 0 N--CA 1.502 2.161 0 O-C-N 121.214 -0.929 . . . . 0.0 111.253 -179.759 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 67' ' ' ASP . . . . . . . . . . . . . 3.8 p-10 -117.2 -5.45 11.35 Favored 'General case' 0 N--CA 1.501 2.084 0 O-C-N 121.1 -1.0 . . . . 0.0 111.673 -179.946 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 68' ' ' GLY . . . . . . . . . . . . . . . 109.66 -26.46 14.37 Favored Glycine 0 N--CA 1.496 2.64 0 N-CA-C 110.239 -1.145 . . . . 0.0 110.239 179.822 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 69' ' ' SER . . . . . . . . . . . . . 0.5 OUTLIER -79.68 -41.22 27.29 Favored 'General case' 0 N--CA 1.498 1.955 0 O-C-N 121.227 -1.161 . . . . 0.0 110.731 -179.769 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 70' ' ' GLY . . . . . . . . . . . . . . . 74.0 26.57 68.51 Favored Glycine 0 N--CA 1.497 2.756 0 N-CA-C 109.643 -1.383 . . . . 0.0 109.643 -179.578 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 71' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -140.11 148.29 41.49 Favored 'General case' 0 N--CA 1.497 1.879 0 O-C-N 121.527 -0.984 . . . . 0.0 109.193 179.931 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 72' ' ' VAL . . . . . 0.542 ' HB ' ' HB ' ' A' ' 36' ' ' ILE . 59.4 t -75.34 114.78 15.83 Favored 'Isoleucine or valine' 0 N--CA 1.498 1.957 0 O-C-N 121.367 -0.833 . . . . 0.0 110.539 -179.553 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 73' ' ' ASP . . . . . . . . . . . . . 4.6 m-20 -86.23 -166.32 1.51 Allowed 'General case' 0 N--CA 1.498 1.973 0 O-C-N 121.331 -0.856 . . . . 0.0 109.242 179.263 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 74' ' ' PHE . . . . . . . . . . . . . 53.4 t80 -74.25 -58.38 3.33 Favored 'General case' 0 N--CA 1.498 1.964 0 O-C-N 120.841 -1.162 . . . . 0.0 109.714 179.328 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 75' ' ' ASP . . . . . 0.804 ' HA ' HD12 ' A' ' 78' ' ' LEU . 0.4 OUTLIER -63.84 -33.82 76.54 Favored 'General case' 0 N--CA 1.496 1.864 0 O-C-N 121.452 -0.78 . . . . 0.0 110.162 179.552 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' A' A ' 76' ' ' GLU . . . . . . . . . . . . . 6.1 tt0 -62.16 -38.67 89.93 Favored 'General case' 0 N--CA 1.497 1.893 0 O-C-N 121.23 -0.918 . . . . 0.0 108.884 178.507 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 77' ' ' PHE . . . . . . . . . . . . . 65.2 t80 -62.72 -38.63 91.22 Favored 'General case' 0 N--CA 1.494 1.753 0 O-C-N 121.69 -0.631 . . . . 0.0 109.355 178.347 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 78' ' ' LEU . . . . . 0.804 HD12 ' HA ' ' A' ' 75' ' ' ASP . 14.3 mt -60.86 -36.59 79.54 Favored 'General case' 0 N--CA 1.498 1.967 0 O-C-N 121.475 -0.765 . . . . 0.0 110.049 178.899 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 79' ' ' VAL . . . . . 0.564 HG22 HG21 ' A' ' 9' ' ' VAL . 45.0 t -62.67 -43.56 98.7 Favored 'Isoleucine or valine' 0 N--CA 1.501 2.099 0 O-C-N 121.43 -0.794 . . . . 0.0 109.067 179.205 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 80' ' ' MET . . . . . . . . . . . . . 13.6 ttm -65.58 -36.11 82.79 Favored 'General case' 0 N--CA 1.494 1.753 0 O-C-N 121.542 -0.724 . . . . 0.0 109.355 178.593 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 81' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -58.43 -53.11 61.98 Favored 'General case' 0 N--CA 1.497 1.899 0 O-C-N 121.531 -0.731 . . . . 0.0 110.115 179.403 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 82' ' ' VAL . . . . . 0.523 HG23 ' HE3' ' A' ' 85' ' ' MET . 14.2 p -69.88 -26.51 30.37 Favored 'Isoleucine or valine' 0 N--CA 1.499 2.002 0 O-C-N 121.242 -0.911 . . . . 0.0 110.289 179.213 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 83' ' ' ARG . . . . . 0.519 ' HD2' HG12 ' A' ' 79' ' ' VAL . 27.2 mtt-85 -69.41 -45.18 69.82 Favored 'General case' 0 N--CA 1.498 1.967 0 O-C-N 121.282 -0.886 . . . . 0.0 110.111 179.387 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 84' ' ' CYS . . . . . 0.495 ' HB3' ' HA ' ' B' ' 149' ' ' SER . 86.3 m -98.69 27.08 5.09 Favored 'General case' 0 N--CA 1.498 1.928 0 O-C-N 121.392 -0.818 . . . . 0.0 110.584 179.593 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 85' ' ' MET . . . . . 0.523 ' HE3' HG23 ' A' ' 82' ' ' VAL . 0.0 OUTLIER -76.75 -25.69 53.74 Favored 'General case' 0 N--CA 1.498 1.939 0 O-C-N 121.252 -0.905 . . . . 0.0 110.59 179.646 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' A' A ' 86' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER 59.72 37.48 22.18 Favored 'General case' 0 N--CA 1.502 2.144 0 O-C-N 121.583 -0.698 . . . . 0.0 111.038 179.778 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 87' ' ' ASP . . . . . . . . . . . . . 17.9 t70 -89.97 139.47 30.57 Favored 'General case' 0 N--CA 1.496 1.863 0 O-C-N 121.296 -0.878 . . . . 0.0 110.149 179.677 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 88' ' ' ASP . . . . . . . . . . . . . 11.4 m-20 -109.7 74.23 0.88 Allowed 'General case' 0 N--CA 1.497 1.908 0 O-C-N 121.408 -0.807 . . . . 0.0 110.489 -179.55 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 89' ' ' SER . . . . . . . . . . . . . 28.0 m . . . . . 0 N--CA 1.498 1.951 0 O-C-N 121.171 -0.956 . . . . 0.0 110.337 179.663 . . . . . . . . 0 0 . 1 . 013 nuclear nobuild full ' B' B ' 144' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.497 1.885 0 CA-C-O 120.946 0.403 . . . . 0.0 110.228 . . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' B' B ' 145' ' ' ARG . . . . . 0.443 ' NH2' ' HA ' ' B' ' 145' ' ' ARG . 0.2 OUTLIER -142.16 -61.78 0.45 Allowed 'General case' 0 N--CA 1.497 1.878 0 O-C-N 121.404 -0.81 . . . . 0.0 110.623 -179.798 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' B' B ' 146' ' ' VAL . . . . . . . . . . . . . 4.8 t 52.6 44.45 0.37 Allowed 'Isoleucine or valine' 0 N--CA 1.503 2.21 0 CA-C-O 121.378 0.609 . . . . 0.0 110.799 179.922 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' B' B ' 147' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -130.2 121.07 25.52 Favored 'General case' 0 N--CA 1.495 1.81 0 O-C-N 121.184 -0.947 . . . . 0.0 109.977 179.664 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' B' B ' 148' ' ' ILE . . . . . . . . . . . . . 0.9 OUTLIER -133.36 138.59 50.9 Favored 'Isoleucine or valine' 0 N--CA 1.496 1.871 0 O-C-N 121.271 -0.893 . . . . 0.0 110.772 -179.342 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' B' B ' 149' ' ' SER . . . . . 0.495 ' HA ' ' HB3' ' A' ' 84' ' ' CYS . 86.3 p -105.9 169.3 8.56 Favored 'General case' 0 N--CA 1.496 1.86 0 O-C-N 121.581 -0.699 . . . . 0.0 110.096 179.434 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' B' B ' 150' ' ' ALA . . . . . . . . . . . . . . . -74.65 -42.3 58.77 Favored 'General case' 0 N--CA 1.497 1.907 0 O-C-N 121.302 -0.874 . . . . 0.0 110.871 -179.731 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' B' B ' 151' ' ' ASP . . . . . . . . . . . . . 31.2 t70 -61.39 -52.62 63.86 Favored 'General case' 0 N--CA 1.498 1.97 0 O-C-N 121.462 -0.773 . . . . 0.0 110.882 -179.732 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' B' B ' 152' ' ' ALA . . . . . . . . . . . . . . . -52.33 -45.22 65.56 Favored 'General case' 0 N--CA 1.504 2.232 0 O-C-N 121.3 -0.875 . . . . 0.0 111.047 -179.918 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' B' B ' 153' ' ' MET . . . . . . . . . . . . . 1.3 ttt -73.16 -44.05 60.59 Favored 'General case' 0 N--CA 1.499 1.985 0 O-C-N 121.281 -0.887 . . . . 0.0 110.655 179.984 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' B' B ' 154' ' ' MET . . . . . 0.575 ' HG3' HD12 ' B' ' 158' ' ' LEU . 0.0 OUTLIER -59.4 -37.97 79.36 Favored 'General case' 0 N--CA 1.501 2.113 0 O-C-N 121.467 -0.771 . . . . 0.0 110.457 179.792 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' B' B ' 155' ' ' GLN . . . . . . . . . . . . . 47.5 mt-30 -67.11 -38.4 85.57 Favored 'General case' 0 N--CA 1.499 1.998 0 O-C-N 121.539 -0.726 . . . . 0.0 110.908 179.859 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' B' B ' 156' ' ' ALA . . . . . . . . . . . . . . . -79.03 -34.39 43.94 Favored 'General case' 0 N--CA 1.498 1.951 0 O-C-N 121.321 -0.862 . . . . 0.0 110.971 -179.713 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' B' B ' 157' ' ' LEU . . . . . 0.452 HD22 ' HB ' ' A' ' 26' ' ' ILE . 17.6 mt -75.27 -42.03 55.88 Favored 'General case' 0 N--CA 1.499 1.978 0 O-C-N 121.244 -0.91 . . . . 0.0 111.211 -179.497 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' B' B ' 158' ' ' LEU . . . . . 0.575 HD12 ' HG3' ' B' ' 154' ' ' MET . 95.9 mt -93.24 165.9 12.58 Favored 'General case' 0 N--CA 1.499 2.005 0 O-C-N 121.137 -0.977 . . . . 0.0 110.941 -179.366 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' B' B ' 159' ' ' GLY . . . . . . . . . . . . . . . 100.79 -58.61 0.69 Allowed Glycine 0 N--CA 1.496 2.645 0 N-CA-C 109.749 -1.341 . . . . 0.0 109.749 179.894 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' B' B ' 160' ' ' ALA . . . . . . . . . . . . . . . -110.69 -48.84 3.1 Favored 'General case' 0 N--CA 1.498 1.965 0 O-C-N 121.473 -1.016 . . . . 0.0 110.875 -179.694 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' B' B ' 161' ' ' ARG . . . . . 0.569 ' HD3' HG12 ' A' ' 26' ' ' ILE . 0.0 OUTLIER -70.5 -42.9 70.71 Favored 'General case' 0 N--CA 1.5 2.042 0 O-C-N 121.24 -0.913 . . . . 0.0 110.474 -179.953 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' B' B ' 162' ' ' ALA . . . . . 0.738 ' HB3' HD11 ' A' ' 26' ' ' ILE . . . -144.07 -174.64 4.33 Favored 'General case' 0 N--CA 1.498 1.957 0 O-C-N 121.453 -0.779 . . . . 0.0 110.433 -179.936 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' B' B ' 163' ' ' LYS . . . . . 0.405 ' OXT' HD22 ' B' ' 158' ' ' LEU . 6.6 mtmt . . . . . 0 N--CA 1.498 1.951 0 CA-C-O 117.833 -1.08 . . . . 0.0 110.092 179.517 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 90' ' ' ' CA' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 013 nuclear nobuild full ' A' A ' 91' ' ' SXK . . . . . 0.536 ' CAK' HD13 ' A' ' 41' ' ' LEU . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.496 1.87 0 CA-C-O 121.269 0.557 . . . . 0.0 109.928 . . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 2' ' ' ASP . . . . . . . . . . . . . 8.0 m-20 -134.52 -152.08 0.46 Allowed 'General case' 0 N--CA 1.494 1.77 0 O-C-N 121.396 -0.815 . . . . 0.0 109.942 -179.45 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 3' ' ' ASP . . . . . 0.436 ' HB3' ' HE3' ' A' ' 6' ' ' LYS . 30.3 m-20 55.08 31.98 17.34 Favored 'General case' 0 N--CA 1.503 2.205 0 O-C-N 121.562 -0.711 . . . . 0.0 111.436 179.379 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 4' ' ' ILE . . . . . . . . . . . . . 4.9 mt -68.61 -54.35 21.7 Favored 'Isoleucine or valine' 0 N--CA 1.499 1.988 0 O-C-N 121.229 -0.919 . . . . 0.0 110.589 -179.797 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 5' ' ' TYR . . . . . . . . . . . . . 1.6 m-85 -63.93 -29.78 70.92 Favored 'General case' 0 N--CA 1.502 2.142 0 O-C-N 121.26 -0.9 . . . . 0.0 110.703 179.691 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 6' ' ' LYS . . . . . 0.436 ' HE3' ' HB3' ' A' ' 3' ' ' ASP . 27.7 ttpt -65.11 -36.86 85.63 Favored 'General case' 0 N--CA 1.497 1.907 0 O-C-N 121.24 -0.913 . . . . 0.0 110.057 179.182 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 7' ' ' ALA . . . . . . . . . . . . . . . -58.13 -38.66 76.96 Favored 'General case' 0 N--CA 1.497 1.882 0 O-C-N 121.6 -0.688 . . . . 0.0 110.13 179.505 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 8' ' ' ALA . . . . . . . . . . . . . . . -66.42 -44.03 84.07 Favored 'General case' 0 N--CA 1.497 1.906 0 O-C-N 121.507 -0.746 . . . . 0.0 110.182 179.454 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 9' ' ' VAL . . . . . . . . . . . . . 19.6 t -64.89 -44.01 96.25 Favored 'Isoleucine or valine' 0 N--CA 1.5 2.051 0 O-C-N 121.352 -0.843 . . . . 0.0 110.015 179.362 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 10' ' ' GLU . . . . . . . . . . . . . 31.1 mm-40 -74.09 -19.66 60.52 Favored 'General case' 0 N--CA 1.496 1.849 0 O-C-N 121.346 -0.846 . . . . 0.0 110.356 179.42 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 11' ' ' GLN . . . . . . . . . . . . . 0.2 OUTLIER -58.98 -49.38 78.12 Favored 'General case' 0 N--CA 1.498 1.947 0 O-C-N 121.412 -0.805 . . . . 0.0 109.906 179.425 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 12' ' ' LEU . . . . . 0.711 HD11 ' HG3' ' A' ' 17' ' ' LYS . 0.9 OUTLIER -72.18 134.45 45.69 Favored 'General case' 0 N--CA 1.495 1.812 0 O-C-N 121.314 -0.866 . . . . 0.0 109.003 178.953 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' A' A ' 13' ' ' THR . . . . . 0.477 HG23 ' HB2' ' A' ' 15' ' ' GLU . 13.3 t -60.76 166.16 3.5 Favored 'General case' 0 N--CA 1.501 2.116 0 O-C-N 121.277 -0.889 . . . . 0.0 112.12 -178.009 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 14' ' ' GLU . . . . . 0.558 ' HA ' ' HD3' ' A' ' 17' ' ' LYS . 4.5 tp10 -61.51 -26.21 67.77 Favored 'General case' 0 N--CA 1.493 1.695 0 CA-C-N 116.213 -0.449 . . . . 0.0 110.921 -179.538 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 15' ' ' GLU . . . . . 0.477 ' HB2' HG23 ' A' ' 13' ' ' THR . 1.4 mp0 -57.54 -44.06 84.86 Favored 'General case' 0 N--CA 1.498 1.973 0 O-C-N 121.279 -0.888 . . . . 0.0 109.068 179.049 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 16' ' ' GLN . . . . . 0.494 ' HB2' HD12 ' A' ' 12' ' ' LEU . 44.1 mt-30 -68.82 -38.46 79.88 Favored 'General case' 0 N--CA 1.497 1.889 0 CA-C-O 121.743 0.782 . . . . 0.0 109.033 178.168 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 17' ' ' LYS . . . . . 0.711 ' HG3' HD11 ' A' ' 12' ' ' LEU . 0.0 OUTLIER -61.84 -29.54 70.24 Favored 'General case' 0 N--CA 1.497 1.898 0 N-CA-C 109.608 -0.516 . . . . 0.0 109.608 178.734 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' A' A ' 18' ' ' ASN . . . . . . . . . . . . . 4.6 t-20 -59.45 -43.34 93.19 Favored 'General case' 0 N--CA 1.499 1.976 0 O-C-N 121.592 -0.693 . . . . 0.0 110.154 179.357 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 19' ' ' GLU . . . . . 0.596 ' HB3' ' HE2' ' B' ' 154' ' ' MET . 1.2 mp0 -56.82 -41.86 78.56 Favored 'General case' 0 N--CA 1.497 1.911 0 O-C-N 121.381 -0.825 . . . . 0.0 109.499 179.138 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 20' ' ' PHE . . . . . . . . . . . . . 14.9 m-85 -70.19 -37.4 75.11 Favored 'General case' 0 N--CA 1.494 1.757 0 O-C-N 121.445 -0.784 . . . . 0.0 109.32 178.413 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 21' ' ' LYS . . . . . 0.553 ' HG3' ' N ' ' A' ' 22' ' ' ALA . 0.0 OUTLIER -63.82 -31.7 72.97 Favored 'General case' 0 N--CA 1.495 1.806 0 O-C-N 121.489 -0.757 . . . . 0.0 109.188 178.677 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' A' A ' 22' ' ' ALA . . . . . 0.553 ' N ' ' HG3' ' A' ' 21' ' ' LYS . . . -69.13 -43.58 74.1 Favored 'General case' 0 N--CA 1.495 1.778 0 O-C-N 121.402 -0.811 . . . . 0.0 109.007 178.154 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 23' ' ' ALA . . . . . . . . . . . . . . . -68.84 -43.45 75.45 Favored 'General case' 0 N--CA 1.497 1.885 0 O-C-N 121.558 -0.714 . . . . 0.0 109.369 178.672 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 24' ' ' PHE . . . . . . . . . . . . . 20.1 t80 -60.53 -37.63 81.82 Favored 'General case' 0 N--CA 1.497 1.876 0 O-C-N 121.64 -0.662 . . . . 0.0 109.851 179.027 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 25' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -54.1 -45.59 71.86 Favored 'General case' 0 N--CA 1.5 2.038 0 O-C-N 121.675 -0.641 . . . . 0.0 110.769 179.547 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 26' ' ' ILE . . . . . 0.498 HG22 ' NH1' ' B' ' 161' ' ' ARG . 2.3 mt -87.07 -9.84 11.07 Favored 'Isoleucine or valine' 0 N--CA 1.499 2.01 0 O-C-N 121.304 -0.872 . . . . 0.0 110.485 179.844 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 27' ' ' PHE . . . . . 0.56 ' CE1' HD22 ' A' ' 41' ' ' LEU . 0.1 OUTLIER -73.83 -32.24 63.59 Favored 'General case' 0 N--CA 1.496 1.857 0 O-C-N 121.145 -0.972 . . . . 0.0 109.994 179.386 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' A' A ' 28' ' ' VAL . . . . . . . . . . . . . 15.7 m -100.23 48.56 0.12 Allowed 'Isoleucine or valine' 0 N--CA 1.499 1.989 0 O-C-N 121.52 -0.738 . . . . 0.0 110.246 179.55 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 29' ' ' LEU . . . . . . . . . . . . . 7.0 mt -67.1 -48.51 67.94 Favored 'General case' 0 N--CA 1.5 2.069 0 O-C-N 121.287 -0.883 . . . . 0.0 109.911 179.653 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 30' ' ' GLY . . . . . . . . . . . . . . . -109.24 28.63 10.69 Favored Glycine 0 N--CA 1.495 2.578 0 N-CA-C 109.392 -1.483 . . . . 0.0 109.392 179.117 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 31' ' ' ALA . . . . . . . . . . . . . . . -103.65 90.79 3.77 Favored 'General case' 0 N--CA 1.493 1.723 0 O-C-N 121.308 -1.113 . . . . 0.0 110.053 179.953 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 32' ' ' GLU . . . . . . . . . . . . . 3.3 mp0 -81.86 3.33 26.53 Favored 'General case' 0 N--CA 1.498 1.958 0 O-C-N 121.313 -0.867 . . . . 0.0 111.013 -179.991 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 5.9 p-10 -78.74 -25.95 44.6 Favored 'General case' 0 N--CA 1.497 1.888 0 O-C-N 121.217 -0.927 . . . . 0.0 110.862 179.585 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 34' ' ' GLY . . . . . . . . . . . . . . . 124.83 -22.77 6.37 Favored Glycine 0 N--CA 1.498 2.789 0 C-N-CA 120.058 -1.067 . . . . 0.0 110.804 179.493 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 35' ' ' CYS . . . . . 0.49 ' HB3' ' HA ' ' A' ' 73' ' ' ASP . 0.1 OUTLIER -140.92 -168.59 2.63 Favored 'General case' 0 N--CA 1.498 1.931 0 O-C-N 121.028 -1.278 . . . . 0.0 110.426 -179.706 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' A' A ' 36' ' ' ILE . . . . . 0.573 ' O ' HG22 ' A' ' 71' ' ' THR . 38.2 mt -75.87 122.49 29.98 Favored 'Isoleucine or valine' 0 N--CA 1.497 1.922 0 O-C-N 121.115 -0.99 . . . . 0.0 110.537 -179.478 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 37' ' ' SER . . . . . . . . . . . . . 41.6 t -92.5 159.84 15.33 Favored 'General case' 0 N--CA 1.495 1.787 0 O-C-N 121.58 -0.7 . . . . 0.0 110.041 179.516 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 38' ' ' THR . . . . . 0.567 HG21 ' HA ' ' A' ' 58' ' ' GLN . 11.4 p -63.2 -37.21 86.32 Favored 'General case' 0 N--CA 1.501 2.106 0 O-C-N 121.337 -0.852 . . . . 0.0 110.556 179.954 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 39' ' ' LYS . . . . . . . . . . . . . 2.4 tttp -59.35 -42.79 92.35 Favored 'General case' 0 N--CA 1.498 1.969 0 O-C-N 121.357 -0.839 . . . . 0.0 109.903 179.322 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 1.6 mm-40 -69.1 -42.88 75.52 Favored 'General case' 0 N--CA 1.497 1.913 0 O-C-N 121.525 -0.735 . . . . 0.0 109.92 179.28 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 41' ' ' LEU . . . . . 0.813 HD21 ' HAK' ' A' ' 91' ' ' SXK . 0.1 OUTLIER -60.34 -63.94 1.13 Allowed 'General case' 0 N--CA 1.499 1.997 0 O-C-N 121.655 -0.653 . . . . 0.0 110.23 179.647 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' A' A ' 42' ' ' GLY . . . . . . . . . . . . . . . -48.02 -42.11 22.72 Favored Glycine 0 N--CA 1.502 3.098 0 N-CA-C 110.098 -1.201 . . . . 0.0 110.098 179.655 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 43' ' ' LYS . . . . . . . . . . . . . 66.3 tttt -62.93 -38.05 89.49 Favored 'General case' 0 N--CA 1.501 2.103 0 O-C-N 121.301 -1.117 . . . . 0.0 110.356 179.184 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 44' ' ' VAL . . . . . . . . . . . . . 5.3 t -66.91 -26.62 37.33 Favored 'Isoleucine or valine' 0 N--CA 1.502 2.127 0 O-C-N 121.469 -0.769 . . . . 0.0 110.752 179.589 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 45' ' ' MET . . . . . 0.451 ' HE1' HG12 ' B' ' 148' ' ' ILE . 4.9 mmt -58.79 -29.52 66.9 Favored 'General case' 0 N--CA 1.503 2.222 0 O-C-N 121.192 -0.942 . . . . 0.0 111.455 -179.82 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 46' ' ' ARG . . . . . . . . . . . . . 18.0 ttp180 -56.01 -38.24 70.24 Favored 'General case' 0 N--CA 1.503 2.181 0 O-C-N 121.212 -0.93 . . . . 0.0 110.931 -179.91 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 47' ' ' MET . . . . . . . . . . . . . 14.5 ttp -89.13 4.76 47.41 Favored 'General case' 0 N--CA 1.501 2.087 0 O-C-N 121.27 -0.894 . . . . 0.0 111.148 179.716 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 48' ' ' LEU . . . . . . . . . . . . . 11.9 tp -117.14 -53.73 2.45 Favored 'General case' 0 N--CA 1.494 1.768 0 O-C-N 120.978 -1.076 . . . . 0.0 110.33 -179.824 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 49' ' ' GLY . . . . . 0.461 ' O ' ' HB2' ' A' ' 50' ' ' GLN . . . 170.51 119.4 0.5 Allowed Glycine 0 N--CA 1.493 2.466 0 N-CA-C 109.69 -1.364 . . . . 0.0 109.69 -179.976 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 50' ' ' GLN . . . . . 0.461 ' HB2' ' O ' ' A' ' 49' ' ' GLY . 64.3 mt-30 60.29 -177.7 0.1 Allowed 'General case' 0 N--CA 1.505 2.292 0 O-C-N 121.913 -0.757 . . . . 0.0 111.251 -179.97 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 51' ' ' ASN . . . . . . . . . . . . . 8.7 t-20 -159.35 105.37 1.51 Allowed Pre-proline 0 N--CA 1.496 1.858 0 O-C-N 121.231 -0.918 . . . . 0.0 110.274 -179.769 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 52' ' ' PRO . . . . . 0.71 ' HG2' HD11 ' A' ' 57' ' ' LEU . 52.6 Cg_endo -78.57 165.8 24.63 Favored 'Trans proline' 0 C--N 1.314 -1.252 0 O-C-N 123.819 1.431 . . . . 0.0 110.287 179.98 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 53' ' ' THR . . . . . 0.554 ' HB ' ' HD2' ' A' ' 54' ' ' PRO . 41.5 p -73.76 166.78 41.2 Favored Pre-proline 0 N--CA 1.5 2.042 0 O-C-N 121.103 -0.998 . . . . 0.0 110.448 179.938 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 54' ' ' PRO . . . . . 0.554 ' HD2' ' HB ' ' A' ' 53' ' ' THR . 39.6 Cg_endo -65.52 -40.87 16.8 Favored 'Trans proline' 0 N--CA 1.493 1.452 0 O-C-N 123.707 1.372 . . . . 0.0 111.051 -179.78 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 55' ' ' GLU . . . . . . . . . . . . . 27.3 mm-40 -69.43 -30.3 68.2 Favored 'General case' 0 N--CA 1.496 1.846 0 O-C-N 121.393 -0.817 . . . . 0.0 110.075 179.41 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 1.4 tt0 -54.86 -50.45 68.65 Favored 'General case' 0 N--CA 1.498 1.957 0 O-C-N 121.455 -0.778 . . . . 0.0 110.248 179.643 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 57' ' ' LEU . . . . . 0.71 HD11 ' HG2' ' A' ' 52' ' ' PRO . 1.2 mt -77.58 -22.66 50.6 Favored 'General case' 0 N--CA 1.495 1.796 0 O-C-N 121.36 -0.838 . . . . 0.0 110.825 179.754 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 58' ' ' GLN . . . . . 0.567 ' HA ' HG21 ' A' ' 38' ' ' THR . 0.0 OUTLIER -60.61 -34.62 74.5 Favored 'General case' 0 N--CA 1.499 2.008 0 O-C-N 120.978 -1.076 . . . . 0.0 109.297 179.289 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' A' A ' 59' ' ' GLU . . . . . 0.552 ' N ' ' HG3' ' A' ' 58' ' ' GLN . 12.9 mm-40 -79.77 -33.76 40.36 Favored 'General case' 0 N--CA 1.493 1.695 0 O-C-N 121.289 -0.882 . . . . 0.0 108.697 177.91 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 60' ' ' MET . . . . . . . . . . . . . 16.3 ttm -67.91 -41.42 82.69 Favored 'General case' 0 N--CA 1.495 1.808 0 O-C-N 121.714 -0.616 . . . . 0.0 109.836 178.681 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 61' ' ' ILE . . . . . 0.673 HG13 HG23 ' A' ' 72' ' ' VAL . 3.2 tt -68.04 -36.96 77.39 Favored 'Isoleucine or valine' 0 N--CA 1.495 1.824 0 O-C-N 121.561 -0.712 . . . . 0.0 109.839 179.53 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 62' ' ' ASP . . . . . 0.44 ' HA ' ' HB2' ' A' ' 65' ' ' ASP . 0.4 OUTLIER -68.68 -32.34 72.1 Favored 'General case' 0 N--CA 1.498 1.934 0 O-C-N 121.374 -0.829 . . . . 0.0 110.233 179.009 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' A' A ' 63' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER -59.88 -44.27 94.3 Favored 'General case' 0 N--CA 1.498 1.962 0 O-C-N 121.363 -0.836 . . . . 0.0 110.16 179.534 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 64' ' ' VAL . . . . . 0.567 HG11 ' SD ' ' A' ' 80' ' ' MET . 11.9 p -103.86 24.32 1.83 Allowed 'Isoleucine or valine' 0 N--CA 1.496 1.846 0 O-C-N 121.432 -0.793 . . . . 0.0 110.768 179.839 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 65' ' ' ASP . . . . . 0.44 ' HB2' ' HA ' ' A' ' 62' ' ' ASP . 2.7 t70 -84.41 153.62 23.3 Favored 'General case' 0 N--CA 1.495 1.803 0 O-C-N 120.971 -1.081 . . . . 0.0 110.256 179.756 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 66' ' ' GLU . . . . . . . . . . . . . 32.4 mt-10 -121.11 11.15 10.86 Favored 'General case' 0 N--CA 1.495 1.787 0 O-C-N 121.423 -0.798 . . . . 0.0 111.828 -179.263 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 67' ' ' ASP . . . . . . . . . . . . . 1.1 p30 -146.84 0.51 0.75 Allowed 'General case' 0 N--CA 1.502 2.16 0 O-C-N 120.753 -1.217 . . . . 0.0 113.205 -179.692 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 68' ' ' GLY . . . . . . . . . . . . . . . 89.02 -24.63 12.29 Favored Glycine 0 N--CA 1.497 2.702 0 O-C-N 120.576 -1.328 . . . . 0.0 111.1 179.14 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 69' ' ' SER . . . . . . . . . . . . . 4.2 p -54.45 -29.75 50.66 Favored 'General case' 0 N--CA 1.503 2.181 0 O-C-N 121.107 -1.231 . . . . 0.0 110.403 179.943 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 70' ' ' GLY . . . . . . . . . . . . . . . 71.32 41.89 58.16 Favored Glycine 0 N--CA 1.497 2.712 0 N-CA-C 109.419 -1.472 . . . . 0.0 109.419 -179.761 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 71' ' ' THR . . . . . 0.573 HG22 ' O ' ' A' ' 36' ' ' ILE . 0.2 OUTLIER -142.67 139.04 31.04 Favored 'General case' 0 N--CA 1.498 1.932 0 O-C-N 121.513 -0.992 . . . . 0.0 109.017 179.85 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' A' A ' 72' ' ' VAL . . . . . 0.673 HG23 HG13 ' A' ' 61' ' ' ILE . 38.5 t -75.41 111.44 11.71 Favored 'Isoleucine or valine' 0 N--CA 1.499 1.991 0 O-C-N 121.337 -0.852 . . . . 0.0 111.178 -178.899 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 73' ' ' ASP . . . . . 0.49 ' HA ' ' HB3' ' A' ' 35' ' ' CYS . 8.6 m-20 -87.53 -173.01 4.15 Favored 'General case' 0 N--CA 1.494 1.728 0 O-C-N 121.711 -0.618 . . . . 0.0 109.405 178.941 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 74' ' ' PHE . . . . . . . . . . . . . 87.2 t80 -61.95 -48.47 80.26 Favored 'General case' 0 N--CA 1.5 2.054 0 O-C-N 121.071 -1.018 . . . . 0.0 110.237 179.804 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 75' ' ' ASP . . . . . . . . . . . . . 0.1 OUTLIER -69.36 -45.11 70.15 Favored 'General case' 0 N--CA 1.496 1.852 0 O-C-N 121.457 -0.777 . . . . 0.0 110.355 179.786 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 76' ' ' GLU . . . . . . . . . . . . . 3.2 mt-10 -59.6 -34.73 73.12 Favored 'General case' 0 N--CA 1.499 1.998 0 O-C-N 121.433 -0.792 . . . . 0.0 110.073 179.38 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 77' ' ' PHE . . . . . . . . . . . . . 48.2 t80 -62.25 -43.96 97.63 Favored 'General case' 0 N--CA 1.496 1.86 0 O-C-N 121.48 -0.763 . . . . 0.0 109.644 178.866 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 78' ' ' LEU . . . . . . . . . . . . . 67.5 mt -66.39 -40.94 89.96 Favored 'General case' 0 N--CA 1.499 1.986 0 O-C-N 121.516 -0.74 . . . . 0.0 109.742 179.11 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 79' ' ' VAL . . . . . . . . . . . . . 5.2 t -62.98 -35.0 69.58 Favored 'Isoleucine or valine' 0 N--CA 1.501 2.082 0 O-C-N 121.502 -0.749 . . . . 0.0 110.11 179.355 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 80' ' ' MET . . . . . 0.567 ' SD ' HG11 ' A' ' 64' ' ' VAL . 0.0 OUTLIER -73.58 -31.85 63.82 Favored 'General case' 0 N--CA 1.497 1.891 0 O-C-N 121.308 -0.87 . . . . 0.0 110.341 179.647 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' A' A ' 81' ' ' MET . . . . . . . . . . . . . 12.0 mmt -63.54 -50.5 69.32 Favored 'General case' 0 N--CA 1.498 1.965 0 O-C-N 121.419 -0.801 . . . . 0.0 110.465 179.857 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 82' ' ' VAL . . . . . . . . . . . . . 10.9 p -66.87 -29.14 45.33 Favored 'Isoleucine or valine' 0 N--CA 1.498 1.953 0 O-C-N 121.368 -0.833 . . . . 0.0 110.29 179.606 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 83' ' ' ARG . . . . . . . . . . . . . 3.0 mtt85 -56.92 -41.16 77.68 Favored 'General case' 0 N--CA 1.501 2.103 0 O-C-N 121.307 -0.87 . . . . 0.0 109.777 178.99 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 84' ' ' CYS . . . . . . . . . . . . . 84.4 m -85.45 -33.9 21.78 Favored 'General case' 0 N--CA 1.497 1.893 0 O-C-N 121.477 -0.764 . . . . 0.0 109.584 178.857 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 85' ' ' MET . . . . . . . . . . . . . 36.2 ttp -88.7 83.95 6.72 Favored 'General case' 0 N--CA 1.496 1.864 0 O-C-N 121.46 -0.775 . . . . 0.0 109.88 179.403 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 86' ' ' LYS . . . . . . . . . . . . . 1.6 mttt -110.28 137.1 48.46 Favored 'General case' 0 N--CA 1.499 1.994 0 O-C-N 121.23 -0.919 . . . . 0.0 110.89 -179.695 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 87' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -109.88 55.27 0.64 Allowed 'General case' 0 N--CA 1.497 1.888 0 O-C-N 121.51 -0.744 . . . . 0.0 109.786 179.125 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 88' ' ' ASP . . . . . . . . . . . . . 2.2 m-20 -78.63 125.67 29.68 Favored 'General case' 0 N--CA 1.498 1.957 0 O-C-N 121.217 -0.927 . . . . 0.0 110.647 -179.45 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 89' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER . . . . . 0 N--CA 1.498 1.932 0 CA-C-O 118.126 -0.94 . . . . 0.0 110.272 179.858 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' B' B ' 144' ' ' ARG . . . . . . . . . . . . . 17.9 ptt180 . . . . . 0 N--CA 1.498 1.941 0 CA-C-O 121.193 0.521 . . . . 0.0 110.527 . . . . . . . . . 0 0 . 1 . 014 nuclear nobuild full ' B' B ' 145' ' ' ARG . . . . . . . . . . . . . 27.4 mtt85 51.01 50.88 18.23 Favored 'General case' 0 N--CA 1.504 2.245 0 O-C-N 121.364 -0.835 . . . . 0.0 110.698 -179.917 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' B' B ' 146' ' ' VAL . . . . . 0.515 HG13 ' CD1' ' B' ' 148' ' ' ILE . 9.9 p -114.98 149.43 17.2 Favored 'Isoleucine or valine' 0 N--CA 1.498 1.954 0 O-C-N 121.194 -0.941 . . . . 0.0 110.607 -179.698 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' B' B ' 147' ' ' ARG . . . . . 0.436 ' C ' HD12 ' B' ' 148' ' ' ILE . 3.9 mtm180 -111.88 119.61 39.15 Favored 'General case' 0 N--CA 1.498 1.961 0 O-C-N 121.242 -0.911 . . . . 0.0 110.917 -179.675 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' B' B ' 148' ' ' ILE . . . . . 0.515 ' CD1' HG13 ' B' ' 146' ' ' VAL . 2.2 mp -116.83 -43.45 3.26 Favored 'Isoleucine or valine' 0 N--CA 1.498 1.968 0 O-C-N 121.521 -0.737 . . . . 0.0 110.131 179.571 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' B' B ' 149' ' ' SER . . . . . . . . . . . . . 8.8 t 59.69 -160.21 0.29 Allowed 'General case' 0 N--CA 1.502 2.159 0 O-C-N 121.519 -0.738 . . . . 0.0 110.766 179.899 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' B' B ' 150' ' ' ALA . . . . . . . . . . . . . . . -111.36 -43.64 3.67 Favored 'General case' 0 N--CA 1.496 1.84 0 O-C-N 121.259 -0.9 . . . . 0.0 110.403 -179.974 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' B' B ' 151' ' ' ASP . . . . . . . . . . . . . 8.0 p-10 -58.09 -42.87 86.57 Favored 'General case' 0 N--CA 1.499 1.993 0 O-C-N 121.541 -0.725 . . . . 0.0 111.287 -179.771 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' B' B ' 152' ' ' ALA . . . . . 0.446 ' HB3' ' O ' ' B' ' 148' ' ' ILE . . . -58.49 -50.02 75.25 Favored 'General case' 0 N--CA 1.499 2.009 0 O-C-N 121.149 -0.969 . . . . 0.0 110.239 179.8 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' B' B ' 153' ' ' MET . . . . . . . . . . . . . 1.5 ttt -68.33 -36.58 79.49 Favored 'General case' 0 N--CA 1.497 1.905 0 O-C-N 121.431 -0.793 . . . . 0.0 109.908 179.233 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' B' B ' 154' ' ' MET . . . . . 0.596 ' HE2' ' HB3' ' A' ' 19' ' ' GLU . 4.1 mtt -61.5 -47.83 83.83 Favored 'General case' 0 N--CA 1.497 1.912 0 O-C-N 121.501 -0.75 . . . . 0.0 110.063 179.523 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' B' B ' 155' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -63.33 -28.51 70.06 Favored 'General case' 0 N--CA 1.499 1.99 0 O-C-N 121.462 -0.774 . . . . 0.0 110.962 179.739 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' B' B ' 156' ' ' ALA . . . . . 0.514 ' O ' ' HB3' ' B' ' 160' ' ' ALA . . . -89.66 -22.23 22.37 Favored 'General case' 0 N--CA 1.501 2.078 0 O-C-N 121.236 -0.915 . . . . 0.0 111.724 -179.439 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' B' B ' 157' ' ' LEU . . . . . . . . . . . . . 9.3 mt -99.12 -43.56 6.6 Favored 'General case' 0 N--CA 1.499 2.012 0 O-C-N 120.893 -1.129 . . . . 0.0 111.203 -179.486 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' B' B ' 158' ' ' LEU . . . . . . . . . . . . . 5.9 mp -76.35 107.19 8.43 Favored 'General case' 0 N--CA 1.499 1.999 0 O-C-N 121.201 -0.937 . . . . 0.0 110.49 -179.66 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' B' B ' 159' ' ' GLY . . . . . . . . . . . . . . . 90.13 -60.14 3.43 Favored Glycine 0 N--CA 1.495 2.629 0 N-CA-C 109.856 -1.298 . . . . 0.0 109.856 179.918 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' B' B ' 160' ' ' ALA . . . . . 0.514 ' HB3' ' O ' ' B' ' 156' ' ' ALA . . . -55.47 -54.16 47.25 Favored 'General case' 0 N--CA 1.499 1.993 0 O-C-N 121.747 -0.855 . . . . 0.0 110.972 -179.697 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' B' B ' 161' ' ' ARG . . . . . 0.498 ' NH1' HG22 ' A' ' 26' ' ' ILE . 7.0 ttt-85 -108.8 50.98 0.76 Allowed 'General case' 0 N--CA 1.497 1.876 0 O-C-N 121.232 -0.917 . . . . 0.0 110.066 179.485 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' B' B ' 162' ' ' ALA . . . . . . . . . . . . . . . -132.08 62.8 1.63 Allowed 'General case' 0 N--CA 1.495 1.817 0 O-C-N 121.335 -0.853 . . . . 0.0 110.341 -179.831 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' B' B ' 163' ' ' LYS . . . . . . . . . . . . . 0.5 OUTLIER . . . . . 0 N--CA 1.496 1.871 0 O-C-N 121.265 -0.897 . . . . 0.0 110.648 -179.795 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 90' ' ' ' CA' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 014 nuclear nobuild full ' A' A ' 91' ' ' SXK . . . . . 0.813 ' HAK' HD21 ' A' ' 41' ' ' LEU . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 3.0 ptt? . . . . . 0 N--CA 1.499 1.978 0 CA-C-O 121.009 0.433 . . . . 0.0 110.408 . . . . . . . . . 0 0 . 1 . 015 nuclear nobuild full ' A' A ' 2' ' ' ASP . . . . . . . . . . . . . 1.2 t70 -100.82 63.36 1.04 Allowed 'General case' 0 N--CA 1.495 1.781 0 O-C-N 121.352 -0.843 . . . . 0.0 110.501 -179.919 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 3' ' ' ASP . . . . . . . . . . . . . 2.0 m-20 -98.09 51.32 1.03 Allowed 'General case' 0 N--CA 1.495 1.803 0 O-C-N 121.238 -0.914 . . . . 0.0 109.955 179.642 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 4' ' ' ILE . . . . . . . . . . . . . 2.7 mp -88.65 -49.11 14.48 Favored 'Isoleucine or valine' 0 N--CA 1.497 1.919 0 O-C-N 121.349 -0.844 . . . . 0.0 110.417 -179.777 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 5' ' ' TYR . . . . . . . . . . . . . 12.2 m-85 -62.3 -40.56 96.69 Favored 'General case' 0 N--CA 1.499 2.013 0 O-C-N 121.303 -0.873 . . . . 0.0 110.306 179.842 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 9.7 ttmt -69.95 -37.59 75.88 Favored 'General case' 0 N--CA 1.496 1.846 0 O-C-N 121.4 -0.813 . . . . 0.0 110.061 179.326 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 7' ' ' ALA . . . . . . . . . . . . . . . -51.81 -49.57 62.52 Favored 'General case' 0 N--CA 1.5 2.049 0 O-C-N 121.577 -0.702 . . . . 0.0 110.258 179.632 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 8' ' ' ALA . . . . . . . . . . . . . . . -61.0 -42.89 99.3 Favored 'General case' 0 N--CA 1.497 1.92 0 O-C-N 121.501 -0.749 . . . . 0.0 109.977 179.23 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 9' ' ' VAL . . . . . 0.408 ' HA ' HD12 ' A' ' 12' ' ' LEU . 38.3 t -60.07 -38.19 75.89 Favored 'Isoleucine or valine' 0 N--CA 1.501 2.123 0 O-C-N 121.48 -0.763 . . . . 0.0 110.135 179.414 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 10' ' ' GLU . . . . . . . . . . . . . 36.8 mt-10 -81.57 -31.66 32.51 Favored 'General case' 0 N--CA 1.497 1.877 0 O-C-N 121.51 -0.744 . . . . 0.0 110.192 179.633 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 11' ' ' GLN . . . . . 0.463 ' NE2' ' HB3' ' A' ' 89' ' ' SER . 41.0 mt-30 -63.04 -32.03 73.3 Favored 'General case' 0 N--CA 1.5 2.063 0 O-C-N 121.588 -0.695 . . . . 0.0 111.027 179.923 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 12' ' ' LEU . . . . . 0.408 HD12 ' HA ' ' A' ' 9' ' ' VAL . 30.5 mt -54.54 139.49 37.8 Favored 'General case' 0 N--CA 1.501 2.112 0 O-C-N 121.292 -0.88 . . . . 0.0 110.397 179.85 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 13' ' ' THR . . . . . . . . . . . . . 72.1 p -77.55 165.01 24.86 Favored 'General case' 0 N--CA 1.499 1.979 0 O-C-N 121.216 -0.927 . . . . 0.0 110.025 179.643 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 14' ' ' GLU . . . . . 0.503 ' HA ' ' HD3' ' A' ' 17' ' ' LYS . 0.5 OUTLIER -55.22 -27.51 46.62 Favored 'General case' 0 N--CA 1.493 1.697 0 O-C-N 121.507 -0.746 . . . . 0.0 110.788 -179.6 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 1.5 mp0 -61.31 -47.49 85.69 Favored 'General case' 0 N--CA 1.496 1.848 0 O-C-N 121.351 -0.843 . . . . 0.0 109.329 178.828 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 16' ' ' GLN . . . . . . . . . . . . . 1.2 mt-30 -67.02 -41.65 86.26 Favored 'General case' 0 N--CA 1.498 1.953 0 CA-C-O 121.581 0.705 . . . . 0.0 109.614 178.784 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 17' ' ' LYS . . . . . 0.503 ' HD3' ' HA ' ' A' ' 14' ' ' GLU . 0.2 OUTLIER -59.42 -45.14 92.37 Favored 'General case' 0 N--CA 1.499 1.999 0 CA-C-O 121.119 0.485 . . . . 0.0 109.786 179.202 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' A' A ' 18' ' ' ASN . . . . . . . . . . . . . 0.8 OUTLIER -69.35 -41.08 77.08 Favored 'General case' 0 N--CA 1.496 1.863 0 O-C-N 121.593 -0.692 . . . . 0.0 109.945 179.316 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 0.3 OUTLIER -60.39 -45.49 93.37 Favored 'General case' 0 N--CA 1.5 2.036 0 O-C-N 121.416 -0.802 . . . . 0.0 109.694 179.083 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 20' ' ' PHE . . . . . 0.456 ' CE1' ' HG2' ' A' ' 81' ' ' MET . 8.4 m-85 -64.73 -35.29 80.59 Favored 'General case' 0 N--CA 1.497 1.882 0 O-C-N 121.531 -0.731 . . . . 0.0 109.77 178.94 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 21' ' ' LYS . . . . . 0.467 ' HG3' ' N ' ' A' ' 22' ' ' ALA . 0.0 OUTLIER -60.82 -39.89 90.69 Favored 'General case' 0 N--CA 1.497 1.885 0 O-C-N 121.439 -0.788 . . . . 0.0 109.6 179.173 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' A' A ' 22' ' ' ALA . . . . . 0.467 ' N ' ' HG3' ' A' ' 21' ' ' LYS . . . -62.99 -46.84 85.78 Favored 'General case' 0 N--CA 1.498 1.943 0 O-C-N 121.386 -0.821 . . . . 0.0 109.816 179.136 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 23' ' ' ALA . . . . . . . . . . . . . . . -66.81 -39.3 87.66 Favored 'General case' 0 N--CA 1.497 1.891 0 O-C-N 121.497 -0.752 . . . . 0.0 110.145 179.259 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 24' ' ' PHE . . . . . 0.447 ' CZ ' HG11 ' A' ' 28' ' ' VAL . 73.1 t80 -68.41 -39.83 81.49 Favored 'General case' 0 N--CA 1.498 1.941 0 O-C-N 121.516 -0.74 . . . . 0.0 110.297 179.607 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 25' ' ' ASP . . . . . . . . . . . . . 0.9 OUTLIER -54.24 -43.51 70.95 Favored 'General case' 0 N--CA 1.498 1.974 0 O-C-N 121.5 -0.75 . . . . 0.0 110.047 179.733 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 26' ' ' ILE . . . . . 0.718 ' HA ' HD23 ' A' ' 29' ' ' LEU . 12.9 mt -74.57 -28.07 21.75 Favored 'Isoleucine or valine' 0 N--CA 1.498 1.929 0 O-C-N 121.424 -0.797 . . . . 0.0 109.478 178.564 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 27' ' ' PHE . . . . . . . . . . . . . 0.2 OUTLIER -73.36 -10.54 59.85 Favored 'General case' 0 N--CA 1.498 1.953 0 O-C-N 121.285 -0.884 . . . . 0.0 111.239 179.452 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 28' ' ' VAL . . . . . 0.691 HG12 HG13 ' A' ' 36' ' ' ILE . 21.2 m -125.26 3.17 4.57 Favored 'Isoleucine or valine' 0 N--CA 1.501 2.103 0 O-C-N 121.036 -1.04 . . . . 0.0 111.25 179.841 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 29' ' ' LEU . . . . . 0.718 HD23 ' HA ' ' A' ' 26' ' ' ILE . 2.1 pp -65.64 -32.49 74.09 Favored 'General case' 0 N--CA 1.5 2.033 0 O-C-N 120.913 -1.117 . . . . 0.0 110.154 179.666 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 30' ' ' GLY . . . . . . . . . . . . . . . -114.58 28.05 8.44 Favored Glycine 0 N--CA 1.495 2.628 0 N-CA-C 109.283 -1.527 . . . . 0.0 109.283 178.939 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 31' ' ' ALA . . . . . 0.539 ' HB3' ' HA ' ' A' ' 28' ' ' VAL . . . -124.17 -127.73 0.25 Allowed 'General case' 0 N--CA 1.493 1.725 0 O-C-N 121.516 -0.99 . . . . 0.0 109.668 -179.994 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 32' ' ' GLU . . . . . . . . . . . . . 2.8 mp0 -96.94 -176.09 3.46 Favored 'General case' 0 N--CA 1.497 1.887 0 O-C-N 121.011 -1.056 . . . . 0.0 109.82 179.499 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 3.8 m-20 -68.44 83.33 0.26 Allowed 'General case' 0 N--CA 1.5 2.045 0 O-C-N 121.33 -0.856 . . . . 0.0 110.449 -179.946 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 34' ' ' GLY . . . . . . . . . . . . . . . 73.49 35.16 56.26 Favored Glycine 0 N--CA 1.495 2.608 0 N-CA-C 109.649 -1.38 . . . . 0.0 109.649 -179.448 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 35' ' ' CYS . . . . . . . . . . . . . 1.1 m -146.9 160.22 42.59 Favored 'General case' 0 N--CA 1.497 1.895 0 O-C-N 121.374 -1.074 . . . . 0.0 110.777 -179.692 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 36' ' ' ILE . . . . . 0.691 HG13 HG12 ' A' ' 28' ' ' VAL . 4.1 mt -129.12 126.12 63.72 Favored 'Isoleucine or valine' 0 N--CA 1.498 1.954 0 O-C-N 121.506 -0.746 . . . . 0.0 110.33 -179.983 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 37' ' ' SER . . . . . 0.559 ' C ' HG23 ' A' ' 38' ' ' THR . 1.1 t -125.1 66.33 1.12 Allowed 'General case' 0 N--CA 1.496 1.867 0 O-C-N 121.406 -0.809 . . . . 0.0 110.265 179.755 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 38' ' ' THR . . . . . 0.559 HG23 ' C ' ' A' ' 37' ' ' SER . 1.2 p 66.25 -43.59 0.4 Allowed 'General case' 0 N--CA 1.518 2.958 0 N-CA-C 112.866 0.691 . . . . 0.0 112.866 179.69 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 39' ' ' LYS . . . . . . . . . . . . . 3.7 ttpp -46.59 -64.84 0.66 Allowed 'General case' 0 N--CA 1.505 2.31 0 O-C-N 121.045 -1.035 . . . . 0.0 111.826 -178.941 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 40' ' ' GLU . . . . . 0.427 ' HB2' ' HB2' ' A' ' 31' ' ' ALA . 0.4 OUTLIER -71.44 -32.0 67.84 Favored 'General case' 0 N--CA 1.5 2.033 0 O-C-N 121.076 -1.015 . . . . 0.0 110.245 179.916 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' A' A ' 41' ' ' LEU . . . . . 0.499 ' O ' HD12 ' A' ' 41' ' ' LEU . 4.8 tp -59.08 -50.95 72.13 Favored 'General case' 0 N--CA 1.497 1.919 0 O-C-N 121.5 -0.75 . . . . 0.0 110.377 179.737 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 42' ' ' GLY . . . . . . . . . . . . . . . -59.93 -38.06 93.56 Favored Glycine 0 N--CA 1.493 2.475 0 N-CA-C 110.033 -1.227 . . . . 0.0 110.033 -179.922 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 43' ' ' LYS . . . . . . . . . . . . . 1.9 ttpt -54.23 -44.32 71.61 Favored 'General case' 0 N--CA 1.5 2.036 0 O-C-N 121.439 -1.036 . . . . 0.0 109.832 179.251 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 44' ' ' VAL . . . . . . . . . . . . . 92.7 t -76.31 -39.46 34.58 Favored 'Isoleucine or valine' 0 N--CA 1.496 1.851 0 O-C-N 121.521 -0.737 . . . . 0.0 109.788 179.153 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 45' ' ' MET . . . . . 0.49 ' HE1' HG13 ' B' ' 148' ' ' ILE . 8.7 mmt -61.3 -36.74 80.91 Favored 'General case' 0 N--CA 1.501 2.089 0 O-C-N 121.393 -0.817 . . . . 0.0 109.944 179.222 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 46' ' ' ARG . . . . . . . . . . . . . 0.9 OUTLIER -64.02 -34.44 78.01 Favored 'General case' 0 N--CA 1.5 2.037 0 O-C-N 121.487 -0.758 . . . . 0.0 109.949 179.122 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 47' ' ' MET . . . . . . . . . . . . . 3.1 ttp -77.48 -35.16 53.95 Favored 'General case' 0 N--CA 1.496 1.852 0 O-C-N 121.484 -0.76 . . . . 0.0 109.777 179.401 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 48' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -136.04 89.89 2.53 Favored 'General case' 0 N--CA 1.495 1.794 0 O-C-N 121.407 -0.808 . . . . 0.0 109.57 179.295 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 49' ' ' GLY . . . . . 0.456 ' C ' ' HG3' ' A' ' 50' ' ' GLN . . . 147.36 -114.63 0.72 Allowed Glycine 0 N--CA 1.497 2.701 0 N-CA-C 109.617 -1.393 . . . . 0.0 109.617 -179.503 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 50' ' ' GLN . . . . . 0.456 ' HG3' ' C ' ' A' ' 49' ' ' GLY . 0.0 OUTLIER -149.21 -52.93 0.16 Allowed 'General case' 0 N--CA 1.502 2.163 0 O-C-N 121.575 -0.956 . . . . 0.0 109.818 179.914 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' A' A ' 51' ' ' ASN . . . . . . . . . . . . . 45.3 t30 54.72 78.75 0.37 Allowed Pre-proline 0 N--CA 1.502 2.134 0 O-C-N 121.8 -0.562 . . . . 0.0 112.11 179.317 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 52' ' ' PRO . . . . . . . . . . . . . 44.8 Cg_endo -78.64 -61.55 0.03 OUTLIER 'Trans proline' 0 C--N 1.315 -1.224 0 O-C-N 123.601 1.316 . . . . 0.0 110.0 178.573 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 53' ' ' THR . . . . . . . . . . . . . 3.3 p -134.67 162.29 58.58 Favored Pre-proline 0 N--CA 1.492 1.639 0 O-C-N 121.297 -0.877 . . . . 0.0 109.623 179.611 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 54' ' ' PRO . . . . . . . . . . . . . 43.4 Cg_endo -68.42 -31.06 28.59 Favored 'Trans proline' 0 N--CA 1.491 1.381 0 O-C-N 123.498 1.262 . . . . 0.0 110.515 179.555 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 55' ' ' GLU . . . . . . . . . . . . . 28.9 mp0 -67.39 -29.4 68.9 Favored 'General case' 0 N--CA 1.496 1.853 0 O-C-N 121.548 -0.72 . . . . 0.0 110.227 179.381 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -60.57 -32.74 71.82 Favored 'General case' 0 N--CA 1.499 2.015 0 O-C-N 121.519 -0.738 . . . . 0.0 111.45 -179.754 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 57' ' ' LEU . . . . . 0.46 ' HB3' ' CD2' ' A' ' 41' ' ' LEU . 9.0 mt -89.17 -12.65 40.36 Favored 'General case' 0 N--CA 1.496 1.85 0 O-C-N 121.043 -1.036 . . . . 0.0 111.413 -179.408 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 58' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -66.3 -47.95 71.94 Favored 'General case' 0 N--CA 1.492 1.662 0 O-C-N 120.912 -1.118 . . . . 0.0 108.69 179.234 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 59' ' ' GLU . . . . . . . . . . . . . 8.5 pt-20 -61.15 -31.38 71.1 Favored 'General case' 0 N--CA 1.495 1.819 0 O-C-N 121.548 -0.72 . . . . 0.0 109.601 178.69 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 60' ' ' MET . . . . . 0.427 ' HB2' ' O ' ' A' ' 57' ' ' LEU . 1.9 mmm -61.08 -42.14 97.95 Favored 'General case' 0 N--CA 1.497 1.878 0 O-C-N 121.5 -0.75 . . . . 0.0 109.663 178.811 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 61' ' ' ILE . . . . . 0.848 HG23 HG23 ' A' ' 72' ' ' VAL . 10.9 mt -72.75 -45.42 57.01 Favored 'Isoleucine or valine' 0 N--CA 1.497 1.89 0 O-C-N 121.355 -0.841 . . . . 0.0 109.658 178.982 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 62' ' ' ASP . . . . . . . . . . . . . 10.4 m-20 -54.11 -35.09 61.77 Favored 'General case' 0 N--CA 1.499 1.989 0 O-C-N 121.675 -0.641 . . . . 0.0 111.064 -179.735 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 63' ' ' GLU . . . . . . . . . . . . . 3.5 tm-20 -58.47 -39.93 81.3 Favored 'General case' 0 N--CA 1.501 2.089 0 O-C-N 121.217 -0.927 . . . . 0.0 110.068 179.459 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 64' ' ' VAL . . . . . 0.512 HG12 ' NH2' ' A' ' 83' ' ' ARG . 23.1 m -107.23 23.81 3.04 Favored 'Isoleucine or valine' 0 N--CA 1.497 1.913 0 O-C-N 121.404 -0.81 . . . . 0.0 110.709 179.5 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 65' ' ' ASP . . . . . . . . . . . . . 11.3 t0 -98.2 97.15 8.6 Favored 'General case' 0 N--CA 1.495 1.806 0 O-C-N 121.104 -0.998 . . . . 0.0 110.074 179.648 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 66' ' ' GLU . . . . . . . . . . . . . 3.3 mp0 -91.88 28.67 1.75 Allowed 'General case' 0 N--CA 1.495 1.803 0 O-C-N 121.416 -0.802 . . . . 0.0 109.264 178.818 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 67' ' ' ASP . . . . . . . . . . . . . 1.0 OUTLIER -107.61 -29.58 9.09 Favored 'General case' 0 N--CA 1.492 1.65 0 O-C-N 121.593 -0.692 . . . . 0.0 110.361 -179.477 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 68' ' ' GLY . . . . . . . . . . . . . . . 80.08 19.39 69.91 Favored Glycine 0 N--CA 1.492 2.398 0 N-CA-C 108.215 -1.954 . . . . 0.0 108.215 -177.548 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 69' ' ' SER . . . . . . . . . . . . . 59.9 p -109.81 -44.9 3.73 Favored 'General case' 0 N--CA 1.493 1.704 0 O-C-N 121.609 -0.936 . . . . 0.0 110.393 -179.592 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 70' ' ' GLY . . . . . 0.417 ' O ' HG21 ' A' ' 61' ' ' ILE . . . 118.06 -40.21 2.38 Favored Glycine 0 N--CA 1.499 2.89 0 C-N-CA 119.927 -1.13 . . . . 0.0 110.881 179.518 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 71' ' ' THR . . . . . . . . . . . . . 4.7 m -76.45 144.21 40.05 Favored 'General case' 0 N--CA 1.505 2.276 0 O-C-N 121.002 -1.293 . . . . 0.0 110.342 -179.686 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 72' ' ' VAL . . . . . 0.848 HG23 HG23 ' A' ' 61' ' ' ILE . 0.7 OUTLIER -98.69 136.93 27.76 Favored 'Isoleucine or valine' 0 N--CA 1.497 1.888 0 O-C-N 121.496 -0.753 . . . . 0.0 110.373 179.919 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' A' A ' 73' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER -113.81 -165.37 1.0 Allowed 'General case' 0 N--CA 1.496 1.874 0 O-C-N 121.371 -0.831 . . . . 0.0 110.05 179.814 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 74' ' ' PHE . . . . . . . . . . . . . 23.6 t80 -64.37 -44.85 90.09 Favored 'General case' 0 N--CA 1.499 1.984 0 O-C-N 121.174 -0.953 . . . . 0.0 110.475 179.893 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 75' ' ' ASP . . . . . . . . . . . . . 30.2 t70 -57.72 -51.9 67.64 Favored 'General case' 0 N--CA 1.497 1.909 0 O-C-N 121.412 -0.805 . . . . 0.0 109.881 179.447 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 76' ' ' GLU . . . . . 0.627 ' HB3' HG22 ' A' ' 72' ' ' VAL . 35.0 mt-10 -60.49 -37.09 79.95 Favored 'General case' 0 N--CA 1.499 1.989 0 O-C-N 121.576 -0.702 . . . . 0.0 109.771 178.9 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 77' ' ' PHE . . . . . 0.522 ' HA ' ' CE ' ' A' ' 80' ' ' MET . 2.4 t80 -57.63 -36.64 72.08 Favored 'General case' 0 N--CA 1.496 1.849 0 O-C-N 121.691 -0.63 . . . . 0.0 110.279 179.362 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 78' ' ' LEU . . . . . . . . . . . . . 12.5 mt -75.29 -37.12 61.04 Favored 'General case' 0 N--CA 1.496 1.84 0 O-C-N 121.512 -0.742 . . . . 0.0 110.943 -179.945 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 79' ' ' VAL . . . . . . . . . . . . . 66.1 t -62.11 -49.26 84.81 Favored 'Isoleucine or valine' 0 N--CA 1.503 2.196 0 O-C-N 121.23 -0.919 . . . . 0.0 111.21 -179.504 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 80' ' ' MET . . . . . 0.522 ' CE ' ' HA ' ' A' ' 77' ' ' PHE . 16.2 ptt? -69.67 -24.27 63.58 Favored 'General case' 0 N--CA 1.502 2.147 0 O-C-N 120.872 -1.143 . . . . 0.0 110.727 -179.806 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 81' ' ' MET . . . . . 0.456 ' HG2' ' CE1' ' A' ' 20' ' ' PHE . 24.9 tpp -73.89 -50.46 20.12 Favored 'General case' 0 N--CA 1.494 1.757 0 O-C-N 121.098 -1.002 . . . . 0.0 109.825 179.2 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 82' ' ' VAL . . . . . . . . . . . . . 30.1 m -62.25 -26.08 39.33 Favored 'Isoleucine or valine' 0 N--CA 1.503 2.19 0 O-C-N 121.174 -0.954 . . . . 0.0 109.846 178.905 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 83' ' ' ARG . . . . . 0.512 ' NH2' HG12 ' A' ' 64' ' ' VAL . 19.6 mtt180 -66.1 -52.32 49.72 Favored 'General case' 0 N--CA 1.496 1.858 0 O-C-N 121.283 -0.886 . . . . 0.0 108.936 178.601 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 84' ' ' CYS . . . . . . . . . . . . . 37.7 t -64.74 -23.36 67.22 Favored 'General case' 0 N--CA 1.499 2.009 0 O-C-N 121.648 -0.658 . . . . 0.0 110.397 178.964 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 85' ' ' MET . . . . . 0.462 ' O ' ' HB2' ' A' ' 86' ' ' LYS . 9.5 mtt -66.37 -16.98 64.5 Favored 'General case' 0 N--CA 1.499 1.991 0 O-C-N 121.301 -0.874 . . . . 0.0 110.647 179.257 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 86' ' ' LYS . . . . . 0.462 ' HB2' ' O ' ' A' ' 85' ' ' MET . 18.3 mtmm 67.44 -72.82 0.09 Allowed 'General case' 0 N--CA 1.505 2.277 0 O-C-N 121.849 -0.532 . . . . 0.0 110.837 -179.991 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 87' ' ' ASP . . . . . . . . . . . . . 4.8 t70 -123.27 126.53 47.09 Favored 'General case' 0 N--CA 1.495 1.776 0 O-C-N 121.114 -0.991 . . . . 0.0 110.599 179.959 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 88' ' ' ASP . . . . . . . . . . . . . 12.9 t70 -157.19 152.51 26.33 Favored 'General case' 0 N--CA 1.496 1.85 0 O-C-N 121.436 -0.79 . . . . 0.0 110.288 179.884 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 89' ' ' SER . . . . . 0.463 ' HB3' ' NE2' ' A' ' 11' ' ' GLN . 16.5 m . . . . . 0 N--CA 1.503 2.178 0 CA-C-O 118.016 -0.993 . . . . 0.0 110.822 179.933 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' B' B ' 144' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.496 1.839 0 CA-C-O 121.157 0.503 . . . . 0.0 110.487 . . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' B' B ' 145' ' ' ARG . . . . . . . . . . . . . 0.3 OUTLIER -137.53 119.83 15.76 Favored 'General case' 0 N--CA 1.495 1.792 0 O-C-N 121.467 -0.771 . . . . 0.0 110.096 179.875 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' B' B ' 146' ' ' VAL . . . . . . . . . . . . . 3.3 p -92.26 164.76 2.03 Favored 'Isoleucine or valine' 0 N--CA 1.498 1.936 0 O-C-N 121.44 -0.788 . . . . 0.0 110.667 -179.937 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' B' B ' 147' ' ' ARG . . . . . . . . . . . . . 3.2 mpt_? -120.02 -53.72 2.15 Favored 'General case' 0 N--CA 1.498 1.963 0 O-C-N 121.493 -0.755 . . . . 0.0 110.375 -179.777 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' B' B ' 148' ' ' ILE . . . . . 0.49 HG13 ' HE1' ' A' ' 45' ' ' MET . 30.1 mm 60.01 81.28 0.06 OUTLIER 'Isoleucine or valine' 0 N--CA 1.502 2.134 0 CA-C-O 121.386 0.613 . . . . 0.0 110.646 -179.926 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' B' B ' 149' ' ' SER . . . . . . . . . . . . . 30.1 t -78.86 137.47 37.69 Favored 'General case' 0 N--CA 1.499 1.994 0 O-C-N 121.248 -0.907 . . . . 0.0 110.477 179.691 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' B' B ' 150' ' ' ALA . . . . . . . . . . . . . . . -58.24 -41.86 85.08 Favored 'General case' 0 N--CA 1.499 2.002 0 O-C-N 121.556 -0.715 . . . . 0.0 110.582 179.765 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' B' B ' 151' ' ' ASP . . . . . . . . . . . . . 20.7 t70 -67.16 -47.14 71.89 Favored 'General case' 0 N--CA 1.497 1.909 0 O-C-N 121.317 -0.864 . . . . 0.0 110.308 179.677 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' B' B ' 152' ' ' ALA . . . . . . . . . . . . . . . -60.01 -47.36 86.17 Favored 'General case' 0 N--CA 1.499 1.978 0 O-C-N 121.511 -0.743 . . . . 0.0 110.731 -179.94 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' B' B ' 153' ' ' MET . . . . . . . . . . . . . 0.1 OUTLIER -64.74 -40.05 94.65 Favored 'General case' 0 N--CA 1.498 1.932 0 O-C-N 121.328 -0.858 . . . . 0.0 110.239 179.769 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' B' B ' 154' ' ' MET . . . . . . . . . . . . . 3.1 tpp -63.18 -47.69 81.55 Favored 'General case' 0 N--CA 1.499 1.976 0 O-C-N 121.434 -0.791 . . . . 0.0 110.16 179.501 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' B' B ' 155' ' ' GLN . . . . . . . . . . . . . 0.8 OUTLIER -68.7 -36.95 79.14 Favored 'General case' 0 N--CA 1.5 2.032 0 O-C-N 121.388 -0.82 . . . . 0.0 110.494 179.573 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' B' B ' 156' ' ' ALA . . . . . . . . . . . . . . . -69.65 -29.79 67.34 Favored 'General case' 0 N--CA 1.499 2.005 0 O-C-N 121.306 -0.871 . . . . 0.0 110.934 179.881 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' B' B ' 157' ' ' LEU . . . . . 0.542 HD21 ' HB ' ' A' ' 26' ' ' ILE . 4.8 tp -84.9 -33.99 22.65 Favored 'General case' 0 N--CA 1.497 1.877 0 O-C-N 121.319 -0.863 . . . . 0.0 110.501 179.981 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' B' B ' 158' ' ' LEU . . . . . . . . . . . . . 4.2 mm? -95.53 47.19 1.11 Allowed 'General case' 0 N--CA 1.496 1.862 0 O-C-N 121.297 -0.877 . . . . 0.0 110.308 -179.748 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' B' B ' 159' ' ' GLY . . . . . . . . . . . . . . . 155.75 -149.48 20.56 Favored Glycine 0 N--CA 1.495 2.574 0 N-CA-C 109.674 -1.371 . . . . 0.0 109.674 179.866 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' B' B ' 160' ' ' ALA . . . . . . . . . . . . . . . 50.43 -98.21 0.06 Allowed 'General case' 0 N--CA 1.5 2.073 0 O-C-N 121.823 -0.81 . . . . 0.0 110.706 -179.888 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' B' B ' 161' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -154.35 53.48 0.68 Allowed 'General case' 0 N--CA 1.495 1.818 0 O-C-N 121.017 -1.052 . . . . 0.0 110.187 179.587 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' B' B ' 162' ' ' ALA . . . . . . . . . . . . . . . -99.89 -58.84 1.83 Allowed 'General case' 0 N--CA 1.494 1.734 0 O-C-N 121.245 -0.909 . . . . 0.0 109.514 179.394 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' B' B ' 163' ' ' LYS . . . . . 0.45 ' HA ' ' CE ' ' B' ' 163' ' ' LYS . 0.0 OUTLIER . . . . . 0 N--CA 1.494 1.737 0 CA-C-O 118.205 -0.902 . . . . 0.0 110.227 179.374 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 90' ' ' ' CA' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 015 nuclear nobuild full ' A' A ' 91' ' ' SXK . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 016 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 6.1 ptt? . . . . . 0 N--CA 1.5 2.041 0 CA-C-O 121.429 0.633 . . . . 0.0 110.248 . . . . . . . . . 0 0 . 1 . 016 nuclear nobuild full ' A' A ' 2' ' ' ASP . . . . . . . . . . . . . 0.0 OUTLIER -150.11 -68.63 0.2 Allowed 'General case' 0 N--CA 1.497 1.875 0 O-C-N 121.36 -0.838 . . . . 0.0 109.637 -179.717 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 3' ' ' ASP . . . . . . . . . . . . . 10.3 m-20 46.95 58.79 4.45 Favored 'General case' 0 N--CA 1.502 2.164 0 O-C-N 121.734 -0.604 . . . . 0.0 111.576 178.547 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 4' ' ' ILE . . . . . . . . . . . . . 9.5 mt -72.89 -48.82 43.35 Favored 'Isoleucine or valine' 0 N--CA 1.499 1.977 0 O-C-N 121.046 -1.034 . . . . 0.0 109.945 179.981 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 5' ' ' TYR . . . . . 0.413 ' HB3' ' CG2' ' A' ' 79' ' ' VAL . 0.9 OUTLIER -66.92 -39.54 87.4 Favored 'General case' 0 N--CA 1.496 1.831 0 O-C-N 121.369 -0.832 . . . . 0.0 109.563 179.125 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild full ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 0.4 OUTLIER -68.07 -32.73 73.27 Favored 'General case' 0 N--CA 1.495 1.818 0 O-C-N 121.562 -0.712 . . . . 0.0 109.81 178.946 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 7' ' ' ALA . . . . . . . . . . . . . . . -63.4 -34.65 78.2 Favored 'General case' 0 N--CA 1.499 1.975 0 O-C-N 121.233 -0.917 . . . . 0.0 109.483 178.728 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 8' ' ' ALA . . . . . 0.502 ' HB1' ' HA ' ' A' ' 88' ' ' ASP . . . -66.02 -28.05 68.58 Favored 'General case' 0 N--CA 1.495 1.808 0 O-C-N 121.496 -0.753 . . . . 0.0 110.229 178.892 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 9' ' ' VAL . . . . . 0.434 HG13 ' HB3' ' A' ' 78' ' ' LEU . 68.6 t -64.52 -32.75 59.09 Favored 'Isoleucine or valine' 0 N--CA 1.5 2.069 0 O-C-N 121.318 -0.864 . . . . 0.0 110.338 179.475 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 10' ' ' GLU . . . . . . . . . . . . . 15.4 mt-10 -65.58 -25.45 67.41 Favored 'General case' 0 N--CA 1.499 2.01 0 O-C-N 121.301 -0.874 . . . . 0.0 110.665 179.871 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 11' ' ' GLN . . . . . . . . . . . . . 0.3 OUTLIER -65.45 -24.47 67.18 Favored 'General case' 0 N--CA 1.5 2.065 0 O-C-N 121.407 -0.808 . . . . 0.0 110.991 179.635 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 12' ' ' LEU . . . . . . . . . . . . . 10.2 mt -61.47 135.83 57.81 Favored 'General case' 0 N--CA 1.499 2.023 0 O-C-N 121.256 -0.902 . . . . 0.0 110.45 -179.935 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 13' ' ' THR . . . . . . . . . . . . . 27.9 p -77.97 165.02 24.57 Favored 'General case' 0 N--CA 1.498 1.966 0 O-C-N 121.275 -0.891 . . . . 0.0 110.357 179.623 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 14' ' ' GLU . . . . . . . . . . . . . 0.6 OUTLIER -56.52 -31.49 64.17 Favored 'General case' 0 N--CA 1.494 1.739 0 O-C-N 121.678 -0.639 . . . . 0.0 110.407 -179.879 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 1.4 mp0 -62.07 -52.79 62.47 Favored 'General case' 0 N--CA 1.498 1.933 0 O-C-N 121.467 -0.771 . . . . 0.0 109.761 179.306 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 16' ' ' GLN . . . . . 0.433 ' HA ' ' HB3' ' A' ' 19' ' ' GLU . 38.9 mt-30 -65.02 -33.18 75.44 Favored 'General case' 0 N--CA 1.497 1.888 0 O-C-N 121.627 -0.671 . . . . 0.0 110.111 179.448 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 17' ' ' LYS . . . . . . . . . . . . . 15.4 mttp -63.56 -49.0 75.15 Favored 'General case' 0 N--CA 1.497 1.904 0 N-CA-C 109.47 -0.567 . . . . 0.0 109.47 179.009 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 18' ' ' ASN . . . . . 0.554 ' HA ' ' HG2' ' A' ' 21' ' ' LYS . 41.7 t30 -71.47 -32.21 68.02 Favored 'General case' 0 N--CA 1.497 1.894 0 O-C-N 121.537 -0.727 . . . . 0.0 109.225 178.398 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 19' ' ' GLU . . . . . 0.433 ' HB3' ' HA ' ' A' ' 16' ' ' GLN . 2.4 tt0 -66.73 -41.78 87.33 Favored 'General case' 0 N--CA 1.496 1.848 0 O-C-N 121.539 -0.726 . . . . 0.0 109.425 178.925 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 20' ' ' PHE . . . . . . . . . . . . . 3.0 m-85 -70.68 -34.72 72.3 Favored 'General case' 0 N--CA 1.497 1.877 0 O-C-N 121.497 -0.752 . . . . 0.0 110.301 179.477 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 21' ' ' LYS . . . . . 0.592 ' HG3' ' N ' ' A' ' 22' ' ' ALA . 0.0 OUTLIER -64.47 -28.03 69.39 Favored 'General case' 0 N--CA 1.497 1.921 0 O-C-N 121.33 -0.856 . . . . 0.0 110.158 179.524 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild full ' A' A ' 22' ' ' ALA . . . . . 0.592 ' N ' ' HG3' ' A' ' 21' ' ' LYS . . . -65.44 -44.49 87.13 Favored 'General case' 0 N--CA 1.498 1.963 0 O-C-N 121.143 -0.973 . . . . 0.0 108.96 178.401 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 23' ' ' ALA . . . . . 0.485 ' HB2' HD11 ' B' ' 158' ' ' LEU . . . -71.71 -40.44 69.48 Favored 'General case' 0 N--CA 1.493 1.7 0 N-CA-C 109.086 -0.709 . . . . 0.0 109.086 178.33 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 24' ' ' PHE . . . . . . . . . . . . . 65.2 t80 -59.37 -43.63 92.83 Favored 'General case' 0 N--CA 1.499 1.999 0 O-C-N 121.65 -0.656 . . . . 0.0 110.511 179.448 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 25' ' ' ASP . . . . . . . . . . . . . 16.3 m-20 -61.15 -45.51 94.34 Favored 'General case' 0 N--CA 1.499 2.004 0 O-C-N 121.4 -0.813 . . . . 0.0 110.67 179.997 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 26' ' ' ILE . . . . . . . . . . . . . 54.4 mt -73.56 -21.25 18.46 Favored 'Isoleucine or valine' 0 N--CA 1.501 2.081 0 O-C-N 121.419 -0.801 . . . . 0.0 110.96 179.971 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 27' ' ' PHE . . . . . 0.65 ' CE1' HG21 ' A' ' 44' ' ' VAL . 0.2 OUTLIER -70.29 -11.24 60.77 Favored 'General case' 0 N--CA 1.502 2.15 0 O-C-N 120.991 -1.068 . . . . 0.0 111.878 -179.691 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild full ' A' A ' 28' ' ' VAL . . . . . . . . . . . . . 6.8 m -127.63 -46.83 1.2 Allowed 'Isoleucine or valine' 0 N--CA 1.499 1.984 0 O-C-N 120.949 -1.094 . . . . 0.0 111.049 179.859 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 29' ' ' LEU . . . . . . . . . . . . . 12.7 mt 47.78 39.53 10.63 Favored 'General case' 0 N--CA 1.504 2.238 0 O-C-N 121.364 -0.835 . . . . 0.0 110.629 -179.7 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 30' ' ' GLY . . . . . . . . . . . . . . . 85.13 39.96 8.24 Favored Glycine 0 N--CA 1.494 2.535 0 N-CA-C 109.588 -1.405 . . . . 0.0 109.588 -179.322 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 31' ' ' ALA . . . . . . . . . . . . . . . -56.39 -64.47 0.86 Allowed 'General case' 0 N--CA 1.501 2.107 0 O-C-N 121.535 -0.979 . . . . 0.0 110.456 -179.881 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 32' ' ' GLU . . . . . . . . . . . . . 1.1 mt-10 -129.47 -52.23 1.17 Allowed 'General case' 0 N--CA 1.495 1.813 0 O-C-N 121.618 -0.677 . . . . 0.0 109.495 179.559 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 0.0 OUTLIER -145.95 -54.83 0.28 Allowed 'General case' 0 N--CA 1.496 1.838 0 O-C-N 121.614 -0.678 . . . . 0.0 109.661 179.662 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 34' ' ' GLY . . . . . . . . . . . . . . . -179.93 38.86 0.07 OUTLIER Glycine 0 N--CA 1.495 2.603 0 N-CA-C 109.682 -1.367 . . . . 0.0 109.682 179.497 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 35' ' ' CYS . . . . . . . . . . . . . 68.1 m -149.26 163.61 37.18 Favored 'General case' 0 N--CA 1.497 1.875 0 O-C-N 121.333 -1.098 . . . . 0.0 110.514 -179.617 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 36' ' ' ILE . . . . . . . . . . . . . 55.7 mt -97.16 135.31 31.8 Favored 'Isoleucine or valine' 0 N--CA 1.498 1.931 0 O-C-N 121.374 -0.829 . . . . 0.0 109.869 179.502 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 37' ' ' SER . . . . . . . . . . . . . 7.5 p -115.12 -177.77 3.21 Favored 'General case' 0 N--CA 1.496 1.857 0 O-C-N 121.288 -0.883 . . . . 0.0 110.442 179.821 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 38' ' ' THR . . . . . . . . . . . . . 42.9 p -65.38 -37.45 87.03 Favored 'General case' 0 N--CA 1.502 2.125 0 O-C-N 121.498 -0.752 . . . . 0.0 110.463 179.754 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 39' ' ' LYS . . . . . . . . . . . . . 2.6 mtmp? -63.0 -36.95 85.28 Favored 'General case' 0 N--CA 1.501 2.082 0 O-C-N 121.521 -0.737 . . . . 0.0 110.055 179.598 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 40' ' ' GLU . . . . . 0.424 ' HA ' ' HD2' ' A' ' 43' ' ' LYS . 1.1 mp0 -76.45 -26.82 55.84 Favored 'General case' 0 N--CA 1.496 1.845 0 O-C-N 121.545 -0.722 . . . . 0.0 110.664 -179.902 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 41' ' ' LEU . . . . . 0.653 HD13 ' CAK' ' A' ' 91' ' ' SXK . 4.9 tp -69.56 -49.94 49.49 Favored 'General case' 0 N--CA 1.498 1.972 0 O-C-N 121.1 -1.0 . . . . 0.0 110.135 179.591 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 42' ' ' GLY . . . . . 0.555 ' HA2' ' HB2' ' A' ' 45' ' ' MET . . . -55.02 -32.53 56.63 Favored Glycine 0 N--CA 1.497 2.734 0 N-CA-C 110.798 -0.921 . . . . 0.0 110.798 -179.423 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 43' ' ' LYS . . . . . 0.424 ' HD2' ' HA ' ' A' ' 40' ' ' GLU . 5.4 mttt -54.27 -47.96 71.73 Favored 'General case' 0 N--CA 1.501 2.081 0 O-C-N 121.419 -1.047 . . . . 0.0 110.378 179.822 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 44' ' ' VAL . . . . . 0.65 HG21 ' CE1' ' A' ' 27' ' ' PHE . 61.9 t -82.26 -28.26 9.13 Favored 'Isoleucine or valine' 0 N--CA 1.5 2.04 0 O-C-N 121.287 -0.883 . . . . 0.0 110.064 179.367 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 45' ' ' MET . . . . . 0.555 ' HB2' ' HA2' ' A' ' 42' ' ' GLY . 0.5 OUTLIER -56.95 -31.05 64.59 Favored 'General case' 0 N--CA 1.502 2.156 0 O-C-N 121.308 -0.87 . . . . 0.0 110.991 179.612 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild full ' A' A ' 46' ' ' ARG . . . . . 0.592 ' HA ' ' HG3' ' A' ' 50' ' ' GLN . 7.0 mmm180 -53.5 -27.47 25.67 Favored 'General case' 0 N--CA 1.505 2.296 0 O-C-N 121.35 -0.844 . . . . 0.0 111.729 -179.586 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 47' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -81.6 -39.73 24.07 Favored 'General case' 0 N--CA 1.496 1.871 0 O-C-N 121.101 -0.999 . . . . 0.0 110.812 -179.825 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 48' ' ' LEU . . . . . 0.611 ' O ' HD11 ' B' ' 148' ' ' ILE . 1.1 mt -153.31 104.8 2.81 Favored 'General case' 0 N--CA 1.491 1.613 0 O-C-N 121.264 -0.897 . . . . 0.0 110.17 -179.83 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 49' ' ' GLY . . . . . 0.559 ' HA3' HD11 ' B' ' 148' ' ' ILE . . . 124.48 -67.13 0.52 Allowed Glycine 0 N--CA 1.498 2.833 0 N-CA-C 109.677 -1.369 . . . . 0.0 109.677 -179.996 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 50' ' ' GLN . . . . . 0.592 ' HG3' ' HA ' ' A' ' 46' ' ' ARG . 0.5 OUTLIER 66.53 131.56 0.02 OUTLIER 'General case' 0 N--CA 1.504 2.244 0 CA-C-O 121.582 0.706 . . . . 0.0 111.186 179.935 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild full ' A' A ' 51' ' ' ASN . . . . . 0.613 ' CB ' HD11 ' A' ' 57' ' ' LEU . 14.6 p-10 -97.82 114.82 65.52 Favored Pre-proline 0 N--CA 1.493 1.719 0 O-C-N 121.279 -0.888 . . . . 0.0 109.653 179.367 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 52' ' ' PRO . . . . . . . . . . . . . 43.0 Cg_endo -69.29 -39.16 7.78 Favored 'Trans proline' 0 C--N 1.313 -1.334 0 O-C-N 123.613 1.323 . . . . 0.0 111.084 -179.419 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 53' ' ' THR . . . . . 0.851 HG22 ' HD2' ' A' ' 54' ' ' PRO . 0.2 OUTLIER -126.37 152.88 74.61 Favored Pre-proline 0 N--CA 1.497 1.92 0 O-C-N 121.406 -0.808 . . . . 0.0 109.956 -179.962 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild full ' A' A ' 54' ' ' PRO . . . . . 0.851 ' HD2' HG22 ' A' ' 53' ' ' THR . 42.6 Cg_endo -70.82 -44.85 1.18 Allowed 'Trans proline' 0 C--N 1.314 -1.262 0 O-C-N 123.793 1.417 . . . . 0.0 110.392 179.761 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 55' ' ' GLU . . . . . . . . . . . . . 0.9 OUTLIER -68.98 -19.85 64.16 Favored 'General case' 0 N--CA 1.497 1.881 0 O-C-N 121.441 -0.787 . . . . 0.0 110.33 179.151 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 0.6 OUTLIER -56.99 -41.61 78.73 Favored 'General case' 0 N--CA 1.498 1.939 0 O-C-N 121.361 -0.837 . . . . 0.0 110.269 179.592 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 57' ' ' LEU . . . . . 0.621 ' HB3' HD23 ' A' ' 41' ' ' LEU . 19.7 mt -78.49 -23.54 46.33 Favored 'General case' 0 N--CA 1.495 1.816 0 O-C-N 121.444 -0.785 . . . . 0.0 110.183 179.51 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 58' ' ' GLN . . . . . 0.578 ' O ' HG22 ' A' ' 61' ' ' ILE . 0.0 OUTLIER -59.41 -31.82 69.61 Favored 'General case' 0 N--CA 1.497 1.914 0 O-C-N 121.193 -0.942 . . . . 0.0 109.165 179.13 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild full ' A' A ' 59' ' ' GLU . . . . . 0.544 ' N ' ' HG3' ' A' ' 58' ' ' GLN . 0.8 OUTLIER -72.62 -41.71 65.26 Favored 'General case' 0 N--CA 1.491 1.603 0 N-CA-C 108.508 -0.923 . . . . 0.0 108.508 177.85 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild full ' A' A ' 60' ' ' MET . . . . . . . . . . . . . 2.3 mtp -60.57 -38.56 84.98 Favored 'General case' 0 N--CA 1.495 1.806 0 O-C-N 121.77 -0.581 . . . . 0.0 109.853 178.513 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 61' ' ' ILE . . . . . 0.595 HG13 HG23 ' A' ' 72' ' ' VAL . 3.5 tt -73.17 -33.13 41.01 Favored 'Isoleucine or valine' 0 N--CA 1.497 1.921 0 O-C-N 121.397 -0.814 . . . . 0.0 110.492 179.659 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 62' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -74.9 -29.86 61.11 Favored 'General case' 0 N--CA 1.498 1.941 0 O-C-N 121.334 -0.854 . . . . 0.0 110.501 179.552 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 63' ' ' GLU . . . . . . . . . . . . . 26.7 mt-10 -61.14 -26.23 67.55 Favored 'General case' 0 N--CA 1.502 2.155 0 O-C-N 121.381 -0.824 . . . . 0.0 110.939 179.72 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 64' ' ' VAL . . . . . 0.514 HG11 ' HG3' ' A' ' 80' ' ' MET . 14.0 m -112.35 -12.55 11.61 Favored 'Isoleucine or valine' 0 N--CA 1.501 2.078 0 O-C-N 121.42 -0.8 . . . . 0.0 111.195 -179.665 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 65' ' ' ASP . . . . . 0.416 ' HA ' ' CD ' ' A' ' 76' ' ' GLU . 22.3 t70 -60.17 150.69 29.09 Favored 'General case' 0 N--CA 1.498 1.946 0 O-C-N 121.362 -0.836 . . . . 0.0 110.701 -179.8 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 66' ' ' GLU . . . . . . . . . . . . . 2.1 tt0 -140.07 18.12 2.45 Favored 'General case' 0 N--CA 1.494 1.772 0 O-C-N 121.45 -0.782 . . . . 0.0 111.522 -179.482 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 67' ' ' ASP . . . . . . . . . . . . . 5.9 p30 -140.17 1.22 1.8 Allowed 'General case' 0 N--CA 1.503 2.178 0 O-C-N 120.776 -1.202 . . . . 0.0 112.546 -179.787 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 68' ' ' GLY . . . . . . . . . . . . . . . 86.04 -16.04 45.12 Favored Glycine 0 N--CA 1.496 2.644 0 O-C-N 120.649 -1.282 . . . . 0.0 110.657 179.956 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 69' ' ' SER . . . . . . . . . . . . . 1.1 p -66.96 -27.29 67.33 Favored 'General case' 0 N--CA 1.498 1.934 0 O-C-N 121.013 -1.287 . . . . 0.0 110.224 179.693 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 70' ' ' GLY . . . . . . . . . . . . . . . 87.17 -57.73 4.56 Favored Glycine 0 N--CA 1.499 2.834 0 N-CA-C 110.289 -1.124 . . . . 0.0 110.289 179.441 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 71' ' ' THR . . . . . . . . . . . . . 1.0 OUTLIER -47.99 137.94 9.63 Favored 'General case' 0 N--CA 1.506 2.339 0 O-C-N 121.585 -0.95 . . . . 0.0 110.506 -179.7 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 72' ' ' VAL . . . . . 0.595 HG23 HG13 ' A' ' 61' ' ' ILE . 0.9 OUTLIER -75.91 125.55 35.7 Favored 'Isoleucine or valine' 0 N--CA 1.499 2.0 0 CA-C-O 121.7 0.762 . . . . 0.0 111.631 -178.787 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild full ' A' A ' 73' ' ' ASP . . . . . 0.401 ' H ' ' HB2' ' A' ' 76' ' ' GLU . 1.0 OUTLIER -97.1 -170.55 2.05 Favored 'General case' 0 N--CA 1.495 1.797 0 N-CA-C 109.172 -0.677 . . . . 0.0 109.172 178.724 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild full ' A' A ' 74' ' ' PHE . . . . . . . . . . . . . 28.3 t80 -67.0 -47.72 70.64 Favored 'General case' 0 N--CA 1.499 2.024 0 O-C-N 120.826 -1.171 . . . . 0.0 110.263 179.64 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 75' ' ' ASP . . . . . . . . . . . . . 10.6 t70 -63.64 -44.5 93.68 Favored 'General case' 0 N--CA 1.498 1.967 0 O-C-N 121.412 -0.805 . . . . 0.0 110.146 179.406 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 76' ' ' GLU . . . . . 0.591 ' O ' HG12 ' A' ' 79' ' ' VAL . 95.5 mt-10 -65.77 -35.12 79.82 Favored 'General case' 0 N--CA 1.498 1.929 0 O-C-N 121.464 -0.772 . . . . 0.0 110.277 179.843 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 77' ' ' PHE . . . . . . . . . . . . . 71.2 t80 -67.19 -38.55 85.57 Favored 'General case' 0 N--CA 1.494 1.755 0 O-C-N 121.112 -0.993 . . . . 0.0 109.496 178.978 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 78' ' ' LEU . . . . . 0.434 ' HB3' HG13 ' A' ' 9' ' ' VAL . 41.3 mt -66.29 -43.82 85.27 Favored 'General case' 0 N--CA 1.498 1.955 0 O-C-N 121.542 -0.724 . . . . 0.0 110.38 179.46 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 79' ' ' VAL . . . . . 0.591 HG12 ' O ' ' A' ' 76' ' ' GLU . 7.6 p -69.34 -15.64 19.78 Favored 'Isoleucine or valine' 0 N--CA 1.502 2.165 0 O-C-N 121.185 -0.947 . . . . 0.0 110.314 179.119 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 80' ' ' MET . . . . . 0.514 ' HG3' HG11 ' A' ' 64' ' ' VAL . 15.8 ttp -76.73 -37.43 56.01 Favored 'General case' 0 N--CA 1.493 1.71 0 O-C-N 121.116 -0.99 . . . . 0.0 109.383 178.849 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 81' ' ' MET . . . . . . . . . . . . . 3.8 mmm -69.23 -45.44 69.77 Favored 'General case' 0 N--CA 1.499 2.008 0 O-C-N 121.473 -0.767 . . . . 0.0 110.343 179.696 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 82' ' ' VAL . . . . . 0.455 ' HA ' ' HB2' ' A' ' 85' ' ' MET . 35.6 m -59.51 -28.72 40.66 Favored 'Isoleucine or valine' 0 N--CA 1.505 2.316 0 O-C-N 121.388 -0.82 . . . . 0.0 110.844 -179.985 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 83' ' ' ARG . . . . . 0.493 ' HD2' HG12 ' A' ' 64' ' ' VAL . 4.0 mtp-105 -57.86 -37.07 73.24 Favored 'General case' 0 N--CA 1.502 2.132 0 O-C-N 121.131 -0.981 . . . . 0.0 109.61 178.817 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 84' ' ' CYS . . . . . . . . . . . . . 9.9 t -83.25 -28.54 29.11 Favored 'General case' 0 N--CA 1.495 1.783 0 O-C-N 121.625 -0.672 . . . . 0.0 109.833 178.868 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 85' ' ' MET . . . . . 0.455 ' HB2' ' HA ' ' A' ' 82' ' ' VAL . 66.9 mtm -83.56 53.82 2.65 Favored 'General case' 0 N--CA 1.497 1.887 0 O-C-N 121.431 -0.793 . . . . 0.0 110.876 179.887 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 86' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER 54.57 51.17 14.48 Favored 'General case' 0 N--CA 1.502 2.129 0 O-C-N 121.59 -0.694 . . . . 0.0 111.748 179.223 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 87' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER 61.02 -80.51 0.02 OUTLIER 'General case' 0 N--CA 1.505 2.286 0 O-C-N 121.724 -0.61 . . . . 0.0 111.479 179.213 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 88' ' ' ASP . . . . . 0.502 ' HA ' ' HB1' ' A' ' 8' ' ' ALA . 1.9 t70 -97.91 155.76 16.92 Favored 'General case' 0 N--CA 1.495 1.8 0 O-C-N 120.989 -1.069 . . . . 0.0 110.682 -179.784 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 89' ' ' SER . . . . . . . . . . . . . 0.6 OUTLIER . . . . . 0 N--CA 1.497 1.887 0 CA-C-O 118.251 -0.88 . . . . 0.0 110.198 179.767 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' B' B ' 144' ' ' ARG . . . . . . . . . . . . . 2.5 ttp180 . . . . . 0 N--CA 1.496 1.855 0 CA-C-O 121.084 0.469 . . . . 0.0 110.259 . . . . . . . . . 0 0 . 1 . 016 nuclear nobuild full ' B' B ' 145' ' ' ARG . . . . . . . . . . . . . 2.7 ptm180 -82.44 -176.81 6.42 Favored 'General case' 0 N--CA 1.498 1.958 0 O-C-N 121.346 -0.846 . . . . 0.0 110.412 179.751 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' B' B ' 146' ' ' VAL . . . . . . . . . . . . . 22.4 m -110.61 149.72 13.38 Favored 'Isoleucine or valine' 0 N--CA 1.499 1.998 0 O-C-N 121.345 -0.847 . . . . 0.0 110.625 179.984 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' B' B ' 147' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -129.75 110.77 12.02 Favored 'General case' 0 N--CA 1.498 1.953 0 O-C-N 121.579 -0.701 . . . . 0.0 109.843 179.83 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' B' B ' 148' ' ' ILE . . . . . 0.611 HD11 ' O ' ' A' ' 48' ' ' LEU . 1.4 tp -103.44 -4.95 9.4 Favored 'Isoleucine or valine' 0 N--CA 1.498 1.937 0 O-C-N 121.403 -0.81 . . . . 0.0 111.755 -179.134 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' B' B ' 149' ' ' SER . . . . . . . . . . . . . 20.1 t 59.63 93.68 0.04 OUTLIER 'General case' 0 N--CA 1.505 2.324 0 O-C-N 121.423 -0.798 . . . . 0.0 110.934 179.939 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' B' B ' 150' ' ' ALA . . . . . . . . . . . . . . . -57.57 -42.71 83.65 Favored 'General case' 0 N--CA 1.5 2.045 0 O-C-N 121.5 -0.75 . . . . 0.0 110.93 179.952 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' B' B ' 151' ' ' ASP . . . . . . . . . . . . . 5.4 m-20 -62.73 -49.81 73.58 Favored 'General case' 0 N--CA 1.5 2.041 0 O-C-N 121.4 -0.812 . . . . 0.0 110.644 -179.973 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' B' B ' 152' ' ' ALA . . . . . . . . . . . . . . . -63.35 -44.93 93.44 Favored 'General case' 0 N--CA 1.497 1.918 0 O-C-N 121.379 -0.826 . . . . 0.0 110.149 179.631 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' B' B ' 153' ' ' MET . . . . . . . . . . . . . 0.2 OUTLIER -63.62 -44.66 93.29 Favored 'General case' 0 N--CA 1.497 1.877 0 O-C-N 121.512 -0.743 . . . . 0.0 109.991 179.361 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' B' B ' 154' ' ' MET . . . . . 0.585 ' HG2' HD12 ' B' ' 158' ' ' LEU . 3.8 ttm -60.25 -44.26 95.42 Favored 'General case' 0 N--CA 1.497 1.916 0 O-C-N 121.419 -0.801 . . . . 0.0 110.014 179.308 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' B' B ' 155' ' ' GLN . . . . . . . . . . . . . 1.0 OUTLIER -62.5 -33.14 74.29 Favored 'General case' 0 N--CA 1.498 1.975 0 O-C-N 121.511 -0.743 . . . . 0.0 110.221 179.299 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' B' B ' 156' ' ' ALA . . . . . 0.579 ' O ' ' HB3' ' B' ' 160' ' ' ALA . . . -71.78 -26.68 62.52 Favored 'General case' 0 N--CA 1.497 1.889 0 O-C-N 121.523 -0.736 . . . . 0.0 110.723 179.511 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' B' B ' 157' ' ' LEU . . . . . 0.439 ' O ' ' HB3' ' B' ' 162' ' ' ALA . 13.9 mt -92.87 -41.97 9.77 Favored 'General case' 0 N--CA 1.495 1.82 0 O-C-N 121.273 -0.892 . . . . 0.0 111.326 -179.338 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' B' B ' 158' ' ' LEU . . . . . 0.585 HD12 ' HG2' ' B' ' 154' ' ' MET . 66.0 mt -97.36 2.21 50.29 Favored 'General case' 0 N--CA 1.5 2.06 0 O-C-N 121.198 -0.939 . . . . 0.0 111.597 -179.393 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' B' B ' 159' ' ' GLY . . . . . . . . . . . . . . . -139.59 42.34 1.24 Allowed Glycine 0 N--CA 1.496 2.689 0 N-CA-C 110.02 -1.232 . . . . 0.0 110.02 -179.973 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' B' B ' 160' ' ' ALA . . . . . 0.579 ' HB3' ' O ' ' B' ' 156' ' ' ALA . . . -165.4 -60.74 0.03 OUTLIER 'General case' 0 N--CA 1.496 1.857 0 O-C-N 121.41 -1.053 . . . . 0.0 110.081 179.841 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' B' B ' 161' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -106.38 -23.87 12.4 Favored 'General case' 0 N--CA 1.498 1.937 0 O-C-N 121.604 -0.685 . . . . 0.0 111.105 179.878 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' B' B ' 162' ' ' ALA . . . . . 0.439 ' HB3' ' O ' ' B' ' 157' ' ' LEU . . . -140.9 -172.14 3.4 Favored 'General case' 0 N--CA 1.496 1.83 0 O-C-N 121.126 -0.983 . . . . 0.0 110.008 179.7 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' B' B ' 163' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.497 1.921 0 O-C-N 121.361 -0.837 . . . . 0.0 110.654 179.898 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 90' ' ' ' CA' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 016 nuclear nobuild full ' A' A ' 91' ' ' SXK . . . . . 0.653 ' CAK' HD13 ' A' ' 41' ' ' LEU . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 0.1 OUTLIER . . . . . 0 N--CA 1.496 1.872 0 CA-C-O 121.045 0.45 . . . . 0.0 109.875 . . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 2' ' ' ASP . . . . . . . . . . . . . 0.7 OUTLIER -163.45 -113.55 0.01 OUTLIER 'General case' 0 N--CA 1.495 1.825 0 O-C-N 121.45 -0.781 . . . . 0.0 110.443 -179.265 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 3' ' ' ASP . . . . . . . . . . . . . 1.3 m-20 -95.27 27.92 3.09 Favored 'General case' 0 N--CA 1.499 2.0 0 O-C-N 120.809 -1.182 . . . . 0.0 110.904 -179.94 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 4' ' ' ILE . . . . . . . . . . . . . 15.4 mt -62.3 -53.37 48.3 Favored 'Isoleucine or valine' 0 N--CA 1.501 2.095 0 O-C-N 121.176 -0.952 . . . . 0.0 110.51 -179.865 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 5' ' ' TYR . . . . . 0.568 ' CE1' ' HG2' ' A' ' 83' ' ' ARG . 6.3 m-85 -70.86 -34.76 71.97 Favored 'General case' 0 N--CA 1.498 1.932 0 O-C-N 121.351 -0.843 . . . . 0.0 110.686 -179.987 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -68.57 -30.41 69.18 Favored 'General case' 0 N--CA 1.498 1.969 0 O-C-N 121.251 -0.906 . . . . 0.0 110.53 179.614 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 7' ' ' ALA . . . . . . . . . . . . . . . -55.12 -36.27 65.55 Favored 'General case' 0 N--CA 1.5 2.033 0 O-C-N 121.236 -0.915 . . . . 0.0 109.784 179.146 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 8' ' ' ALA . . . . . 0.63 ' HB1' ' HB ' ' A' ' 82' ' ' VAL . . . -65.24 -35.3 80.62 Favored 'General case' 0 N--CA 1.496 1.842 0 O-C-N 121.586 -0.697 . . . . 0.0 109.778 178.768 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 9' ' ' VAL . . . . . 0.458 ' HA ' HG11 ' A' ' 82' ' ' VAL . 43.7 t -62.62 -32.96 57.23 Favored 'Isoleucine or valine' 0 N--CA 1.502 2.128 0 O-C-N 121.456 -0.777 . . . . 0.0 109.523 178.827 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 10' ' ' GLU . . . . . . . . . . . . . 9.3 mt-10 -88.57 -5.84 57.93 Favored 'General case' 0 N--CA 1.498 1.943 0 O-C-N 121.408 -0.808 . . . . 0.0 110.732 179.273 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 11' ' ' GLN . . . . . . . . . . . . . 1.4 mt-30 -87.97 -29.6 20.66 Favored 'General case' 0 N--CA 1.496 1.865 0 O-C-N 121.105 -0.997 . . . . 0.0 111.063 -179.809 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 12' ' ' LEU . . . . . 0.408 ' HB2' ' CB ' ' A' ' 16' ' ' GLN . 3.7 pp -66.98 153.11 44.43 Favored 'General case' 0 N--CA 1.5 2.065 0 O-C-N 121.104 -0.997 . . . . 0.0 110.739 -179.71 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 13' ' ' THR . . . . . . . . . . . . . 22.2 p -99.48 -177.55 3.62 Favored 'General case' 0 N--CA 1.501 2.105 0 O-C-N 121.416 -0.803 . . . . 0.0 111.368 -179.147 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 14' ' ' GLU . . . . . 0.44 ' O ' ' HB2' ' A' ' 18' ' ' ASN . 12.8 tp10 -53.86 -39.32 65.56 Favored 'General case' 0 N--CA 1.492 1.669 0 O-C-N 121.912 -0.492 . . . . 0.0 110.697 -179.683 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 1.5 mp0 -54.53 -36.95 64.82 Favored 'General case' 0 N--CA 1.5 2.055 0 O-C-N 121.463 -0.773 . . . . 0.0 110.783 179.766 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 16' ' ' GLN . . . . . 0.408 ' CB ' ' HB2' ' A' ' 12' ' ' LEU . 0.8 OUTLIER -72.18 -63.84 1.06 Allowed 'General case' 0 N--CA 1.497 1.897 0 O-C-N 121.292 -0.88 . . . . 0.0 111.146 -179.716 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild full ' A' A ' 17' ' ' LYS . . . . . 0.427 ' HG3' ' O ' ' A' ' 14' ' ' GLU . 5.3 ptmt -54.81 -32.54 60.47 Favored 'General case' 0 N--CA 1.503 2.194 0 O-C-N 121.839 -0.538 . . . . 0.0 111.347 -179.456 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 18' ' ' ASN . . . . . 0.44 ' HB2' ' O ' ' A' ' 14' ' ' GLU . 7.6 t-20 -70.02 -49.45 51.19 Favored 'General case' 0 N--CA 1.494 1.775 0 O-C-N 121.269 -0.894 . . . . 0.0 110.308 179.999 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 0.3 OUTLIER -62.91 -43.48 98.69 Favored 'General case' 0 N--CA 1.497 1.922 0 O-C-N 121.3 -0.875 . . . . 0.0 109.545 179.187 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 20' ' ' PHE . . . . . . . . . . . . . 12.7 m-85 -59.41 -33.79 71.66 Favored 'General case' 0 N--CA 1.497 1.918 0 O-C-N 121.447 -0.783 . . . . 0.0 109.769 178.941 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 21' ' ' LYS . . . . . 0.505 ' HG3' ' N ' ' A' ' 22' ' ' ALA . 0.0 OUTLIER -65.65 -41.78 92.16 Favored 'General case' 0 N--CA 1.496 1.832 0 O-C-N 121.538 -0.726 . . . . 0.0 109.233 178.629 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild full ' A' A ' 22' ' ' ALA . . . . . 0.658 ' O ' HD12 ' A' ' 26' ' ' ILE . . . -69.69 -45.45 68.27 Favored 'General case' 0 N--CA 1.496 1.828 0 O-C-N 121.286 -0.884 . . . . 0.0 109.589 179.181 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 23' ' ' ALA . . . . . . . . . . . . . . . -63.35 -49.73 72.74 Favored 'General case' 0 N--CA 1.497 1.897 0 O-C-N 121.648 -0.658 . . . . 0.0 110.455 179.412 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 24' ' ' PHE . . . . . 0.425 ' CD2' HD12 ' A' ' 36' ' ' ILE . 27.4 t80 -55.92 -43.55 77.45 Favored 'General case' 0 N--CA 1.5 2.069 0 O-C-N 121.507 -0.746 . . . . 0.0 110.47 179.724 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 25' ' ' ASP . . . . . . . . . . . . . 20.2 t70 -62.79 -52.14 64.36 Favored 'General case' 0 N--CA 1.496 1.841 0 O-C-N 121.625 -0.672 . . . . 0.0 110.387 179.815 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 26' ' ' ILE . . . . . 0.658 HD12 ' O ' ' A' ' 22' ' ' ALA . 1.9 mt -64.55 -28.29 44.52 Favored 'Isoleucine or valine' 0 N--CA 1.498 1.963 0 O-C-N 121.334 -0.854 . . . . 0.0 110.495 179.584 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 27' ' ' PHE . . . . . 0.482 ' CZ ' HG21 ' A' ' 44' ' ' VAL . 0.1 OUTLIER -63.9 -42.86 97.32 Favored 'General case' 0 N--CA 1.498 1.947 0 O-C-N 121.194 -0.942 . . . . 0.0 110.511 179.68 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild full ' A' A ' 28' ' ' VAL . . . . . . . . . . . . . 19.5 m -91.38 -35.7 7.32 Favored 'Isoleucine or valine' 0 N--CA 1.499 2.004 0 O-C-N 121.317 -0.864 . . . . 0.0 110.772 -179.975 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 29' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER 57.24 -87.64 0.02 OUTLIER 'General case' 0 N--CA 1.501 2.082 0 O-C-N 121.672 -0.643 . . . . 0.0 110.631 -179.63 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 30' ' ' GLY . . . . . . . . . . . . . . . -89.73 -16.99 55.68 Favored Glycine 0 N--CA 1.496 2.656 0 N-CA-C 110.14 -1.184 . . . . 0.0 110.14 179.421 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 31' ' ' ALA . . . . . . . . . . . . . . . -92.16 46.53 1.27 Allowed 'General case' 0 N--CA 1.499 1.984 0 O-C-N 121.095 -1.238 . . . . 0.0 110.322 179.747 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 32' ' ' GLU . . . . . . . . . . . . . 3.1 tt0 -63.56 -43.85 95.85 Favored 'General case' 0 N--CA 1.499 2.016 0 O-C-N 121.228 -0.92 . . . . 0.0 110.68 -179.824 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 19.9 t70 -70.26 -42.36 72.26 Favored 'General case' 0 N--CA 1.496 1.855 0 O-C-N 121.476 -0.765 . . . . 0.0 110.414 179.818 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 34' ' ' GLY . . . . . 0.442 ' O ' ' HB2' ' A' ' 35' ' ' CYS . . . -72.51 -14.83 77.43 Favored Glycine 0 N--CA 1.497 2.709 0 N-CA-C 110.674 -0.97 . . . . 0.0 110.674 179.867 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 35' ' ' CYS . . . . . 0.442 ' HB2' ' O ' ' A' ' 34' ' ' GLY . 12.7 m 60.45 -171.06 0.14 Allowed 'General case' 0 N--CA 1.502 2.139 0 O-C-N 121.467 -1.019 . . . . 0.0 111.08 -179.867 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 36' ' ' ILE . . . . . 0.425 HD12 ' CD2' ' A' ' 24' ' ' PHE . 65.2 mt -79.36 123.26 36.05 Favored 'Isoleucine or valine' 0 N--CA 1.499 2.009 0 O-C-N 121.191 -0.943 . . . . 0.0 111.059 -179.175 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 37' ' ' SER . . . . . 0.42 ' HB2' HG23 ' A' ' 71' ' ' THR . 18.3 t -125.08 -178.84 4.32 Favored 'General case' 0 N--CA 1.494 1.762 0 O-C-N 121.632 -0.667 . . . . 0.0 109.613 178.948 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 38' ' ' THR . . . . . . . . . . . . . 3.2 p -61.55 -36.34 80.34 Favored 'General case' 0 N--CA 1.501 2.117 0 O-C-N 121.324 -0.86 . . . . 0.0 110.597 179.709 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 39' ' ' LYS . . . . . . . . . . . . . 4.1 tptt -68.3 -34.28 75.86 Favored 'General case' 0 N--CA 1.498 1.951 0 O-C-N 121.529 -0.732 . . . . 0.0 110.804 179.843 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 40' ' ' GLU . . . . . 0.575 ' HA ' ' HD2' ' A' ' 43' ' ' LYS . 25.7 mm-40 -83.58 -24.14 31.65 Favored 'General case' 0 N--CA 1.499 1.978 0 O-C-N 121.299 -0.876 . . . . 0.0 111.083 -179.643 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 41' ' ' LEU . . . . . 0.754 HD12 HD22 ' A' ' 57' ' ' LEU . 3.4 tm? -70.22 -64.66 0.85 Allowed 'General case' 0 N--CA 1.499 1.99 0 O-C-N 121.135 -0.978 . . . . 0.0 109.711 179.519 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 42' ' ' GLY . . . . . . . . . . . . . . . -47.59 -31.85 7.44 Favored Glycine 0 N--CA 1.501 3.025 0 N-CA-C 110.621 -0.992 . . . . 0.0 110.621 179.836 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 43' ' ' LYS . . . . . 0.575 ' HD2' ' HA ' ' A' ' 40' ' ' GLU . 11.1 mttp -49.22 -49.29 43.73 Favored 'General case' 0 N--CA 1.503 2.187 0 O-C-N 121.572 -0.958 . . . . 0.0 110.91 179.602 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 44' ' ' VAL . . . . . 0.606 HG22 ' O ' ' A' ' 41' ' ' LEU . 33.6 m -81.76 -22.02 10.16 Favored 'Isoleucine or valine' 0 N--CA 1.503 2.204 0 O-C-N 121.322 -0.862 . . . . 0.0 111.204 -179.878 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 45' ' ' MET . . . . . 0.605 ' HE1' HG12 ' B' ' 148' ' ' ILE . 19.6 mmt -59.27 -38.74 80.87 Favored 'General case' 0 N--CA 1.502 2.13 0 O-C-N 121.121 -0.987 . . . . 0.0 110.258 179.672 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 46' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -57.7 -41.91 82.65 Favored 'General case' 0 N--CA 1.498 1.939 0 O-C-N 121.572 -0.705 . . . . 0.0 110.454 179.704 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 47' ' ' MET . . . . . . . . . . . . . 29.9 ttp -68.23 -36.05 78.88 Favored 'General case' 0 N--CA 1.498 1.937 0 O-C-N 121.494 -0.754 . . . . 0.0 110.562 179.693 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 48' ' ' LEU . . . . . . . . . . . . . 6.2 tp -75.02 -44.74 46.29 Favored 'General case' 0 N--CA 1.492 1.669 0 O-C-N 121.357 -0.839 . . . . 0.0 110.298 179.951 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 49' ' ' GLY . . . . . . . . . . . . . . . -155.28 -76.77 0.02 OUTLIER Glycine 0 N--CA 1.495 2.613 0 N-CA-C 110.024 -1.23 . . . . 0.0 110.024 179.918 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 50' ' ' GLN . . . . . . . . . . . . . 36.9 mt-30 -137.54 171.63 14.17 Favored 'General case' 0 N--CA 1.499 1.975 0 O-C-N 121.409 -1.053 . . . . 0.0 110.584 -179.833 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 51' ' ' ASN . . . . . . . . . . . . . 1.3 t30 -106.66 105.74 55.76 Favored Pre-proline 0 N--CA 1.499 1.993 0 O-C-N 121.225 -0.922 . . . . 0.0 111.266 -179.556 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 52' ' ' PRO . . . . . 0.598 ' HG2' HD11 ' A' ' 57' ' ' LEU . 46.8 Cg_endo -77.34 166.23 26.44 Favored 'Trans proline' 0 C--N 1.315 -1.225 0 O-C-N 123.668 1.352 . . . . 0.0 110.242 178.799 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 53' ' ' THR . . . . . . . . . . . . . 65.4 p -79.16 159.23 73.38 Favored Pre-proline 0 N--CA 1.5 2.044 0 O-C-N 121.198 -0.939 . . . . 0.0 110.833 -179.527 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 54' ' ' PRO . . . . . . . . . . . . . 41.6 Cg_endo -67.18 -38.7 15.0 Favored 'Trans proline' 0 N--CA 1.49 1.287 0 O-C-N 123.818 1.43 . . . . 0.0 110.817 179.793 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 55' ' ' GLU . . . . . 0.414 ' O ' ' HB2' ' A' ' 58' ' ' GLN . 0.1 OUTLIER -58.88 -39.61 81.91 Favored 'General case' 0 N--CA 1.498 1.933 0 O-C-N 121.394 -0.816 . . . . 0.0 110.107 179.505 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild full ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 5.8 mt-10 -66.58 -37.94 86.0 Favored 'General case' 0 N--CA 1.497 1.876 0 O-C-N 121.38 -0.825 . . . . 0.0 110.302 179.307 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 57' ' ' LEU . . . . . 0.754 HD22 HD12 ' A' ' 41' ' ' LEU . 9.0 mt -81.51 -9.79 59.62 Favored 'General case' 0 N--CA 1.499 1.993 0 O-C-N 121.332 -0.855 . . . . 0.0 111.25 179.958 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 58' ' ' GLN . . . . . 0.414 ' HB2' ' O ' ' A' ' 55' ' ' GLU . 9.7 mm100 -57.36 -52.1 66.7 Favored 'General case' 0 N--CA 1.5 2.062 0 O-C-N 120.997 -1.064 . . . . 0.0 110.113 -179.892 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 59' ' ' GLU . . . . . . . . . . . . . 10.9 tp10 -53.07 -40.11 63.79 Favored 'General case' 0 N--CA 1.498 1.936 0 O-C-N 121.623 -0.673 . . . . 0.0 110.362 179.461 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 60' ' ' MET . . . . . 0.495 ' HE2' HD23 ' A' ' 57' ' ' LEU . 0.4 OUTLIER -53.37 -34.44 57.64 Favored 'General case' 0 N--CA 1.501 2.082 0 O-C-N 121.415 -0.803 . . . . 0.0 110.376 179.389 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild full ' A' A ' 61' ' ' ILE . . . . . 0.574 HG12 HG23 ' A' ' 72' ' ' VAL . 15.1 mt -91.97 -44.27 14.19 Favored 'Isoleucine or valine' 0 N--CA 1.497 1.921 0 O-C-N 121.407 -0.808 . . . . 0.0 110.124 179.196 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 62' ' ' ASP . . . . . . . . . . . . . 71.8 m-20 -57.12 -33.17 67.07 Favored 'General case' 0 N--CA 1.5 2.026 0 O-C-N 121.465 -0.772 . . . . 0.0 111.04 -179.607 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 63' ' ' GLU . . . . . . . . . . . . . 1.9 tt0 -66.91 -26.85 67.06 Favored 'General case' 0 N--CA 1.5 2.044 0 O-C-N 121.186 -0.946 . . . . 0.0 111.035 179.809 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 64' ' ' VAL . . . . . 0.537 HG21 ' SD ' ' A' ' 80' ' ' MET . 24.5 m -117.14 9.96 7.22 Favored 'Isoleucine or valine' 0 N--CA 1.503 2.178 0 O-C-N 121.148 -0.97 . . . . 0.0 111.481 -179.882 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 65' ' ' ASP . . . . . . . . . . . . . 19.0 t70 -80.3 138.23 36.72 Favored 'General case' 0 N--CA 1.498 1.935 0 O-C-N 120.897 -1.127 . . . . 0.0 110.154 179.897 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 66' ' ' GLU . . . . . . . . . . . . . 21.2 mt-10 -128.77 24.07 5.74 Favored 'General case' 0 N--CA 1.497 1.914 0 O-C-N 121.376 -0.827 . . . . 0.0 111.642 -179.132 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 67' ' ' ASP . . . . . . . . . . . . . 42.6 p-10 -141.22 -0.3 1.45 Allowed 'General case' 0 N--CA 1.501 2.109 0 O-C-N 120.767 -1.208 . . . . 0.0 112.865 -179.91 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 68' ' ' GLY . . . . . . . . . . . . . . . 86.97 -21.27 20.68 Favored Glycine 0 N--CA 1.496 2.698 0 O-C-N 120.705 -1.247 . . . . 0.0 110.687 179.653 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 69' ' ' SER . . . . . . . . . . . . . 1.7 p -59.52 -27.99 66.68 Favored 'General case' 0 N--CA 1.499 1.987 0 O-C-N 121.253 -1.145 . . . . 0.0 110.482 179.83 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 70' ' ' GLY . . . . . . . . . . . . . . . 71.44 30.21 67.12 Favored Glycine 0 N--CA 1.498 2.817 0 N-CA-C 110.195 -1.162 . . . . 0.0 110.195 -179.981 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 71' ' ' THR . . . . . 0.42 HG23 ' HB2' ' A' ' 37' ' ' SER . 5.3 m -134.54 142.93 47.14 Favored 'General case' 0 N--CA 1.499 1.999 0 O-C-N 121.407 -1.055 . . . . 0.0 108.929 179.489 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 72' ' ' VAL . . . . . 0.574 HG23 HG12 ' A' ' 61' ' ' ILE . 17.0 t -75.92 113.49 14.91 Favored 'Isoleucine or valine' 0 N--CA 1.498 1.944 0 O-C-N 121.192 -0.943 . . . . 0.0 111.198 -179.002 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 73' ' ' ASP . . . . . . . . . . . . . 17.0 m-20 -88.48 -178.69 5.91 Favored 'General case' 0 N--CA 1.494 1.772 0 N-CA-C 108.7 -0.852 . . . . 0.0 108.7 178.409 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 74' ' ' PHE . . . . . . . . . . . . . 49.1 t80 -63.91 -42.18 97.47 Favored 'General case' 0 N--CA 1.499 2.015 0 O-C-N 120.905 -1.122 . . . . 0.0 109.828 179.266 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 75' ' ' ASP . . . . . . . . . . . . . 1.0 OUTLIER -66.54 -47.13 73.83 Favored 'General case' 0 N--CA 1.496 1.862 0 O-C-N 121.511 -0.743 . . . . 0.0 110.228 179.435 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 76' ' ' GLU . . . . . . . . . . . . . 72.4 mt-10 -63.95 -38.01 89.53 Favored 'General case' 0 N--CA 1.499 1.986 0 O-C-N 121.453 -0.779 . . . . 0.0 109.755 179.238 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 77' ' ' PHE . . . . . . . . . . . . . 75.7 t80 -57.11 -40.6 77.39 Favored 'General case' 0 N--CA 1.495 1.785 0 O-C-N 121.673 -0.642 . . . . 0.0 109.628 179.118 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 78' ' ' LEU . . . . . . . . . . . . . 43.2 mt -63.15 -43.68 97.64 Favored 'General case' 0 N--CA 1.498 1.945 0 O-C-N 121.396 -0.815 . . . . 0.0 109.476 178.802 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 79' ' ' VAL . . . . . . . . . . . . . 73.2 t -61.27 -39.53 82.93 Favored 'Isoleucine or valine' 0 N--CA 1.501 2.101 0 O-C-N 121.616 -0.677 . . . . 0.0 109.473 178.948 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 80' ' ' MET . . . . . 0.537 ' SD ' HG21 ' A' ' 64' ' ' VAL . 11.8 ttp -67.16 -35.19 79.16 Favored 'General case' 0 N--CA 1.496 1.866 0 O-C-N 121.486 -0.759 . . . . 0.0 110.096 179.168 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 81' ' ' MET . . . . . . . . . . . . . 11.3 mmt -70.49 -51.78 26.64 Favored 'General case' 0 N--CA 1.497 1.892 0 O-C-N 121.486 -0.758 . . . . 0.0 110.767 -179.915 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 82' ' ' VAL . . . . . 0.63 ' HB ' ' HB1' ' A' ' 8' ' ' ALA . 34.2 m -62.61 -24.53 35.65 Favored 'Isoleucine or valine' 0 N--CA 1.501 2.1 0 O-C-N 121.141 -0.975 . . . . 0.0 110.655 -179.982 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 83' ' ' ARG . . . . . 0.568 ' HG2' ' CE1' ' A' ' 5' ' ' TYR . 11.3 mtt180 -62.45 -31.48 72.2 Favored 'General case' 0 N--CA 1.499 1.99 0 O-C-N 121.232 -0.917 . . . . 0.0 110.206 179.145 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 84' ' ' CYS . . . . . . . . . . . . . 3.3 t -86.58 -30.88 21.52 Favored 'General case' 0 N--CA 1.494 1.765 0 O-C-N 121.479 -0.763 . . . . 0.0 109.474 178.651 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 85' ' ' MET . . . . . . . . . . . . . 30.9 mtm -74.52 -32.15 62.4 Favored 'General case' 0 N--CA 1.499 2.001 0 O-C-N 121.486 -0.759 . . . . 0.0 111.247 -179.96 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 86' ' ' LYS . . . . . 0.475 ' O ' ' HB3' ' A' ' 87' ' ' ASP . 0.1 OUTLIER -62.89 -25.69 68.43 Favored 'General case' 0 N--CA 1.502 2.169 0 O-C-N 121.219 -0.925 . . . . 0.0 111.185 -179.562 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild full ' A' A ' 87' ' ' ASP . . . . . 0.475 ' HB3' ' O ' ' A' ' 86' ' ' LYS . 31.6 t70 64.53 -69.53 0.09 Allowed 'General case' 0 N--CA 1.505 2.275 0 O-C-N 121.854 -0.529 . . . . 0.0 111.623 179.657 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 88' ' ' ASP . . . . . 0.46 ' CB ' ' O ' ' A' ' 87' ' ' ASP . 1.7 t70 75.13 -63.65 0.41 Allowed 'General case' 0 N--CA 1.505 2.304 0 O-C-N 121.76 -0.588 . . . . 0.0 110.629 -179.46 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 89' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER . . . . . 0 N--CA 1.497 1.914 0 CA-C-O 117.902 -1.047 . . . . 0.0 110.447 179.929 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' B' B ' 144' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.496 1.861 0 CA-C-O 121.089 0.471 . . . . 0.0 110.472 . . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' B' B ' 145' ' ' ARG . . . . . . . . . . . . . 1.1 ttp180 -146.46 142.16 27.84 Favored 'General case' 0 N--CA 1.494 1.759 0 O-C-N 121.412 -0.805 . . . . 0.0 110.311 -179.867 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' B' B ' 146' ' ' VAL . . . . . . . . . . . . . 14.5 p -120.59 138.37 51.31 Favored 'Isoleucine or valine' 0 N--CA 1.496 1.828 0 O-C-N 121.481 -0.762 . . . . 0.0 110.434 -179.852 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' B' B ' 147' ' ' ARG . . . . . 0.539 ' C ' HD12 ' B' ' 148' ' ' ILE . 0.0 OUTLIER -133.57 143.12 48.49 Favored 'General case' 0 N--CA 1.495 1.787 0 O-C-N 121.42 -0.8 . . . . 0.0 110.651 -179.739 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild full ' B' B ' 148' ' ' ILE . . . . . 0.605 HG12 ' HE1' ' A' ' 45' ' ' MET . 1.2 mp -123.92 138.66 52.86 Favored 'Isoleucine or valine' 0 N--CA 1.495 1.794 0 O-C-N 121.597 -0.689 . . . . 0.0 109.774 -179.957 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' B' B ' 149' ' ' SER . . . . . . . . . . . . . 45.5 t -104.38 167.43 9.75 Favored 'General case' 0 N--CA 1.493 1.692 0 O-C-N 121.614 -0.679 . . . . 0.0 110.227 179.762 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' B' B ' 150' ' ' ALA . . . . . . . . . . . . . . . -55.67 -38.37 69.52 Favored 'General case' 0 N--CA 1.497 1.906 0 O-C-N 121.678 -0.638 . . . . 0.0 110.591 179.836 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' B' B ' 151' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -65.35 -46.28 80.83 Favored 'General case' 0 N--CA 1.497 1.908 0 O-C-N 121.329 -0.857 . . . . 0.0 110.445 179.695 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' B' B ' 152' ' ' ALA . . . . . . . . . . . . . . . -51.0 -48.32 61.42 Favored 'General case' 0 N--CA 1.501 2.081 0 O-C-N 121.486 -0.759 . . . . 0.0 110.644 179.943 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' B' B ' 153' ' ' MET . . . . . . . . . . . . . 11.6 mmt -63.17 -42.9 99.49 Favored 'General case' 0 N--CA 1.498 1.973 0 O-C-N 121.357 -0.839 . . . . 0.0 110.099 179.468 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' B' B ' 154' ' ' MET . . . . . . . . . . . . . 13.2 mtt -64.55 -37.04 86.17 Favored 'General case' 0 N--CA 1.498 1.959 0 O-C-N 121.493 -0.755 . . . . 0.0 110.499 179.586 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' B' B ' 155' ' ' GLN . . . . . . . . . . . . . 0.3 OUTLIER -58.02 -33.98 69.55 Favored 'General case' 0 N--CA 1.502 2.166 0 O-C-N 121.419 -0.801 . . . . 0.0 111.533 -179.67 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' B' B ' 156' ' ' ALA . . . . . . . . . . . . . . . -100.8 -44.23 5.85 Favored 'General case' 0 N--CA 1.501 2.094 0 O-C-N 121.159 -0.963 . . . . 0.0 111.162 -179.598 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' B' B ' 157' ' ' LEU . . . . . . . . . . . . . 10.0 mt -75.78 -37.88 58.79 Favored 'General case' 0 N--CA 1.501 2.101 0 O-C-N 121.27 -0.894 . . . . 0.0 111.018 -179.493 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' B' B ' 158' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -113.54 32.82 5.53 Favored 'General case' 0 N--CA 1.498 1.929 0 O-C-N 121.257 -0.902 . . . . 0.0 110.375 179.877 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' B' B ' 159' ' ' GLY . . . . . 0.402 ' O ' ' HB3' ' B' ' 160' ' ' ALA . . . -168.77 -175.72 38.43 Favored Glycine 0 N--CA 1.495 2.587 0 N-CA-C 110.181 -1.168 . . . . 0.0 110.181 -179.806 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' B' B ' 160' ' ' ALA . . . . . 0.402 ' HB3' ' O ' ' B' ' 159' ' ' GLY . . . 59.54 -86.22 0.02 OUTLIER 'General case' 0 N--CA 1.503 2.196 0 O-C-N 121.864 -0.786 . . . . 0.0 110.967 -179.962 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' B' B ' 161' ' ' ARG . . . . . . . . . . . . . 2.5 tpm_? -100.57 -45.22 5.59 Favored 'General case' 0 N--CA 1.497 1.907 0 O-C-N 121.134 -0.979 . . . . 0.0 110.132 179.672 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' B' B ' 162' ' ' ALA . . . . . . . . . . . . . . . -96.49 179.36 5.04 Favored 'General case' 0 N--CA 1.494 1.738 0 O-C-N 121.632 -0.667 . . . . 0.0 109.992 179.816 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' B' B ' 163' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER . . . . . 0 N--CA 1.496 1.871 0 CA-C-O 117.798 -1.096 . . . . 0.0 110.876 -179.642 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 90' ' ' ' CA' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 017 nuclear nobuild full ' A' A ' 91' ' ' SXK . . . . . 0.434 ' HAK' HD23 ' A' ' 41' ' ' LEU . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.497 1.899 0 N-CA-C 109.913 -0.403 . . . . 0.0 109.913 . . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 2' ' ' ASP . . . . . . . . . . . . . 14.2 t70 -129.74 142.75 50.65 Favored 'General case' 0 N--CA 1.494 1.744 0 O-C-N 121.312 -0.867 . . . . 0.0 110.837 -179.786 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 3' ' ' ASP . . . . . 0.504 ' HA ' ' HD2' ' A' ' 6' ' ' LYS . 1.1 m-20 -121.86 6.18 9.89 Favored 'General case' 0 N--CA 1.495 1.807 0 O-C-N 121.65 -0.656 . . . . 0.0 110.717 179.361 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 4' ' ' ILE . . . . . . . . . . . . . 2.7 mp -90.38 -40.55 12.89 Favored 'Isoleucine or valine' 0 N--CA 1.496 1.86 0 O-C-N 121.18 -0.95 . . . . 0.0 110.02 179.769 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 5' ' ' TYR . . . . . . . . . . . . . 5.8 m-85 -57.63 -30.01 65.03 Favored 'General case' 0 N--CA 1.5 2.048 0 O-C-N 121.306 -0.872 . . . . 0.0 110.082 179.384 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 6' ' ' LYS . . . . . 0.547 ' O ' HG12 ' A' ' 9' ' ' VAL . 14.8 mttt -61.15 -43.53 98.74 Favored 'General case' 0 N--CA 1.499 1.997 0 O-C-N 121.385 -0.822 . . . . 0.0 109.716 178.986 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 7' ' ' ALA . . . . . . . . . . . . . . . -55.32 -32.67 62.66 Favored 'General case' 0 N--CA 1.499 2.007 0 O-C-N 121.342 -0.849 . . . . 0.0 110.238 179.099 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 8' ' ' ALA . . . . . . . . . . . . . . . -71.32 -37.52 71.75 Favored 'General case' 0 N--CA 1.499 1.985 0 O-C-N 121.433 -0.792 . . . . 0.0 110.424 179.39 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 9' ' ' VAL . . . . . 0.576 ' HA ' HD11 ' A' ' 12' ' ' LEU . 0.3 OUTLIER -77.4 -23.1 14.37 Favored 'Isoleucine or valine' 0 N--CA 1.499 2.008 0 O-C-N 121.503 -0.748 . . . . 0.0 111.169 -179.66 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild full ' A' A ' 10' ' ' GLU . . . . . . . . . . . . . 28.1 mt-10 -92.89 -26.26 17.7 Favored 'General case' 0 N--CA 1.495 1.811 0 O-C-N 121.238 -0.914 . . . . 0.0 111.918 -179.233 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 11' ' ' GLN . . . . . . . . . . . . . 2.8 mt-30 -119.35 64.06 0.79 Allowed 'General case' 0 N--CA 1.499 2.009 0 O-C-N 120.825 -1.172 . . . . 0.0 112.239 -178.825 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 12' ' ' LEU . . . . . 0.576 HD11 ' HA ' ' A' ' 9' ' ' VAL . 0.5 OUTLIER -90.36 164.15 14.44 Favored 'General case' 0 N--CA 1.501 2.11 0 O-C-N 120.933 -1.105 . . . . 0.0 109.796 178.422 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild full ' A' A ' 13' ' ' THR . . . . . . . . . . . . . 39.4 p -79.47 162.46 25.43 Favored 'General case' 0 N--CA 1.499 1.999 0 O-C-N 121.005 -1.06 . . . . 0.0 109.379 178.658 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 14' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER -55.92 -33.21 64.47 Favored 'General case' 0 N--CA 1.493 1.693 0 O-C-N 121.389 -0.819 . . . . 0.0 110.709 -179.349 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 1.8 mp0 -73.71 -55.81 5.79 Favored 'General case' 0 N--CA 1.498 1.961 0 O-C-N 121.29 -0.881 . . . . 0.0 109.935 179.349 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 16' ' ' GLN . . . . . . . . . . . . . 2.1 mp0 -57.03 -53.59 56.33 Favored 'General case' 0 N--CA 1.503 2.177 0 O-C-N 121.425 -0.797 . . . . 0.0 110.891 -179.827 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 17' ' ' LYS . . . . . 0.507 ' HD3' ' HB2' ' A' ' 12' ' ' LEU . 2.6 ttpm? -57.65 -42.73 84.07 Favored 'General case' 0 N--CA 1.499 2.021 0 CA-C-N 116.228 -0.442 . . . . 0.0 110.96 -179.95 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 18' ' ' ASN . . . . . . . . . . . . . 14.7 t30 -70.62 -42.51 70.81 Favored 'General case' 0 N--CA 1.497 1.921 0 O-C-N 121.288 -0.882 . . . . 0.0 110.66 -179.993 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -56.96 -47.55 80.45 Favored 'General case' 0 N--CA 1.499 2.018 0 O-C-N 121.369 -0.832 . . . . 0.0 110.608 -179.657 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 20' ' ' PHE . . . . . . . . . . . . . 23.3 m-85 -64.7 -37.82 88.88 Favored 'General case' 0 N--CA 1.501 2.095 0 O-C-N 121.051 -1.03 . . . . 0.0 109.863 179.363 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 21' ' ' LYS . . . . . . . . . . . . . 17.3 tptp -62.7 -41.74 99.28 Favored 'General case' 0 N--CA 1.499 1.993 0 O-C-N 121.525 -0.734 . . . . 0.0 109.908 179.228 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 22' ' ' ALA . . . . . . . . . . . . . . . -77.73 -42.62 33.66 Favored 'General case' 0 N--CA 1.496 1.863 0 O-C-N 121.488 -0.757 . . . . 0.0 110.084 179.506 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 23' ' ' ALA . . . . . . . . . . . . . . . -62.71 -42.86 99.86 Favored 'General case' 0 N--CA 1.497 1.903 0 O-C-N 121.463 -0.773 . . . . 0.0 110.461 179.717 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 24' ' ' PHE . . . . . 0.453 ' CE1' HG13 ' A' ' 36' ' ' ILE . 79.7 t80 -62.96 -42.82 99.93 Favored 'General case' 0 N--CA 1.496 1.865 0 O-C-N 121.393 -0.817 . . . . 0.0 110.476 179.854 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 25' ' ' ASP . . . . . . . . . . . . . 0.7 OUTLIER -58.14 -45.38 87.48 Favored 'General case' 0 N--CA 1.499 2.02 0 O-C-N 121.44 -0.787 . . . . 0.0 110.253 179.784 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 26' ' ' ILE . . . . . . . . . . . . . 21.1 mt -68.19 -28.39 40.68 Favored 'Isoleucine or valine' 0 N--CA 1.497 1.912 0 O-C-N 121.42 -0.8 . . . . 0.0 109.611 178.956 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 27' ' ' PHE . . . . . 0.424 ' CE2' HD13 ' B' ' 157' ' ' LEU . 0.1 OUTLIER -73.11 -42.56 62.81 Favored 'General case' 0 N--CA 1.498 1.95 0 O-C-N 121.405 -0.809 . . . . 0.0 111.108 179.871 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild full ' A' A ' 28' ' ' VAL . . . . . 0.429 ' CG1' HG13 ' A' ' 36' ' ' ILE . 18.7 m -92.26 38.33 0.09 OUTLIER 'Isoleucine or valine' 0 N--CA 1.506 2.337 0 O-C-N 121.238 -0.914 . . . . 0.0 111.503 -179.471 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 29' ' ' LEU . . . . . . . . . . . . . 4.7 mt -69.3 -36.75 77.34 Favored 'General case' 0 N--CA 1.498 1.932 0 O-C-N 120.954 -1.091 . . . . 0.0 109.878 179.042 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 30' ' ' GLY . . . . . . . . . . . . . . . -102.67 38.32 3.26 Favored Glycine 0 N--CA 1.494 2.514 0 N-CA-C 109.372 -1.491 . . . . 0.0 109.372 179.018 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 31' ' ' ALA . . . . . . . . . . . . . . . -129.58 -171.82 2.6 Favored 'General case' 0 N--CA 1.496 1.853 0 O-C-N 121.575 -0.956 . . . . 0.0 110.371 -179.992 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 32' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER -136.47 153.93 50.9 Favored 'General case' 0 N--CA 1.492 1.65 0 O-C-N 121.284 -0.885 . . . . 0.0 109.736 179.888 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER 62.81 14.81 7.66 Favored 'General case' 0 N--CA 1.502 2.163 0 O-C-N 121.598 -0.689 . . . . 0.0 111.772 -179.727 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 34' ' ' GLY . . . . . . . . . . . . . . . 60.81 57.17 20.2 Favored Glycine 0 N--CA 1.496 2.668 0 N-CA-C 110.308 -1.117 . . . . 0.0 110.308 179.36 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 35' ' ' CYS . . . . . . . . . . . . . 3.3 t -135.25 127.89 30.86 Favored 'General case' 0 N--CA 1.497 1.906 0 O-C-N 121.475 -1.015 . . . . 0.0 110.093 179.7 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 36' ' ' ILE . . . . . 0.453 HG13 ' CE1' ' A' ' 24' ' ' PHE . 14.8 mt -76.51 132.37 33.11 Favored 'Isoleucine or valine' 0 N--CA 1.5 2.048 0 O-C-N 121.235 -0.916 . . . . 0.0 110.367 -179.775 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 37' ' ' SER . . . . . . . . . . . . . 22.9 t -117.14 173.36 6.71 Favored 'General case' 0 N--CA 1.496 1.848 0 O-C-N 121.601 -0.687 . . . . 0.0 109.804 179.126 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 38' ' ' THR . . . . . 0.503 ' HB ' ' O ' ' A' ' 54' ' ' PRO . 23.3 p -61.04 -45.8 93.31 Favored 'General case' 0 N--CA 1.502 2.153 0 O-C-N 121.215 -0.928 . . . . 0.0 110.613 -180.0 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 39' ' ' LYS . . . . . . . . . . . . . 9.6 tmtt? -59.64 -35.18 73.89 Favored 'General case' 0 N--CA 1.499 1.976 0 O-C-N 121.596 -0.69 . . . . 0.0 110.557 179.728 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 40' ' ' GLU . . . . . 0.401 ' O ' ' HB3' ' A' ' 43' ' ' LYS . 9.3 mm-40 -69.58 -36.68 76.48 Favored 'General case' 0 N--CA 1.497 1.899 0 O-C-N 121.363 -0.836 . . . . 0.0 110.579 -179.968 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 41' ' ' LEU . . . . . 0.566 HD23 ' HB3' ' A' ' 57' ' ' LEU . 6.8 tp -67.59 -45.16 76.32 Favored 'General case' 0 N--CA 1.497 1.922 0 O-C-N 121.028 -1.045 . . . . 0.0 109.053 178.748 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 42' ' ' GLY . . . . . . . . . . . . . . . -57.73 -34.3 70.21 Favored Glycine 0 N--CA 1.491 2.316 0 N-CA-C 110.073 -1.211 . . . . 0.0 110.073 179.862 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 43' ' ' LYS . . . . . 0.401 ' HB3' ' O ' ' A' ' 40' ' ' GLU . 15.2 ttpt -54.0 -37.96 64.57 Favored 'General case' 0 N--CA 1.501 2.11 0 O-C-N 121.472 -1.017 . . . . 0.0 109.773 179.057 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 44' ' ' VAL . . . . . . . . . . . . . 98.0 t -84.55 -41.24 15.92 Favored 'Isoleucine or valine' 0 N--CA 1.499 2.017 0 O-C-N 121.395 -0.816 . . . . 0.0 109.699 179.097 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 45' ' ' MET . . . . . . . . . . . . . 2.6 mtt -64.31 -22.67 67.03 Favored 'General case' 0 N--CA 1.502 2.149 0 O-C-N 121.485 -0.759 . . . . 0.0 110.992 179.564 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 46' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -49.6 -40.96 40.75 Favored 'General case' 0 N--CA 1.501 2.079 0 O-C-N 121.364 -0.835 . . . . 0.0 111.555 -179.642 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 47' ' ' MET . . . . . . . . . . . . . 2.7 ptt? -94.39 4.23 54.13 Favored 'General case' 0 N--CA 1.5 2.037 0 O-C-N 121.26 -0.9 . . . . 0.0 111.741 -179.646 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 48' ' ' LEU . . . . . . . . . . . . . 43.0 tp -132.84 -64.07 0.76 Allowed 'General case' 0 N--CA 1.493 1.723 0 O-C-N 120.803 -1.185 . . . . 0.0 111.045 -179.466 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 49' ' ' GLY . . . . . 0.463 ' O ' ' HB2' ' A' ' 50' ' ' GLN . . . -96.96 19.24 55.58 Favored Glycine 0 N--CA 1.498 2.772 0 C-N-CA 120.405 -0.903 . . . . 0.0 111.115 -179.464 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 50' ' ' GLN . . . . . 0.463 ' HB2' ' O ' ' A' ' 49' ' ' GLY . 36.1 mt-30 65.19 -68.4 0.11 Allowed 'General case' 0 N--CA 1.507 2.407 0 CA-C-N 118.254 1.027 . . . . 0.0 111.469 179.661 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 51' ' ' ASN . . . . . . . . . . . . . 0.9 OUTLIER 63.49 94.28 0.05 OUTLIER Pre-proline 0 N--CA 1.504 2.227 0 O-C-N 121.492 -0.755 . . . . 0.0 110.956 -179.759 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 52' ' ' PRO . . . . . . . . . . . . . 49.2 Cg_endo -75.41 -42.96 0.4 Allowed 'Trans proline' 0 N--CA 1.49 1.274 0 O-C-N 123.747 1.393 . . . . 0.0 111.212 179.819 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 53' ' ' THR . . . . . 0.603 HG23 ' HB2' ' A' ' 56' ' ' GLU . 0.0 OUTLIER -143.54 153.94 59.23 Favored Pre-proline 0 N--CA 1.501 2.086 0 O-C-N 121.198 -0.939 . . . . 0.0 110.622 -179.875 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild full ' A' A ' 54' ' ' PRO . . . . . 0.503 ' O ' ' HB ' ' A' ' 38' ' ' THR . 44.2 Cg_endo -69.9 -42.08 3.56 Favored 'Trans proline' 0 C--N 1.312 -1.382 0 O-C-N 124.111 1.585 . . . . 0.0 110.774 179.431 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 55' ' ' GLU . . . . . . . . . . . . . 3.0 mp0 -55.04 -28.6 53.43 Favored 'General case' 0 N--CA 1.504 2.24 0 O-C-N 121.312 -0.867 . . . . 0.0 111.045 179.997 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 56' ' ' GLU . . . . . 0.603 ' HB2' HG23 ' A' ' 53' ' ' THR . 22.5 tt0 -65.74 -29.96 70.55 Favored 'General case' 0 N--CA 1.496 1.836 0 O-C-N 121.317 -0.865 . . . . 0.0 111.206 179.91 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 57' ' ' LEU . . . . . 0.67 HD22 ' N ' ' A' ' 57' ' ' LEU . 3.1 mm? -84.51 -12.95 53.26 Favored 'General case' 0 N--CA 1.5 2.035 0 O-C-N 120.949 -1.095 . . . . 0.0 111.58 -179.459 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 58' ' ' GLN . . . . . 0.673 ' HA ' HG22 ' A' ' 61' ' ' ILE . 0.0 OUTLIER -57.2 -30.57 64.67 Favored 'General case' 0 N--CA 1.502 2.132 0 O-C-N 121.126 -0.984 . . . . 0.0 109.525 179.545 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild full ' A' A ' 59' ' ' GLU . . . . . . . . . . . . . 0.7 OUTLIER -61.9 -37.46 84.69 Favored 'General case' 0 N--CA 1.498 1.966 0 O-C-N 121.058 -1.027 . . . . 0.0 109.013 178.214 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 60' ' ' MET . . . . . . . . . . . . . 0.7 OUTLIER -72.55 -40.54 66.63 Favored 'General case' 0 N--CA 1.495 1.786 0 O-C-N 121.798 -0.564 . . . . 0.0 110.509 179.49 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 61' ' ' ILE . . . . . 0.673 HG22 ' HA ' ' A' ' 58' ' ' GLN . 15.2 tt -76.23 -38.32 33.63 Favored 'Isoleucine or valine' 0 N--CA 1.498 1.954 0 O-C-N 121.245 -0.909 . . . . 0.0 111.019 -179.75 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 62' ' ' ASP . . . . . . . . . . . . . 0.7 OUTLIER -66.84 -35.23 79.58 Favored 'General case' 0 N--CA 1.499 2.023 0 O-C-N 121.148 -0.97 . . . . 0.0 110.433 179.928 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 63' ' ' GLU . . . . . . . . . . . . . 1.2 tt0 -56.84 -34.27 67.59 Favored 'General case' 0 N--CA 1.499 1.982 0 O-C-N 121.535 -0.728 . . . . 0.0 110.452 179.412 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 64' ' ' VAL . . . . . 0.54 HG11 ' HB2' ' A' ' 80' ' ' MET . 27.5 t -101.63 -20.64 5.47 Favored 'Isoleucine or valine' 0 N--CA 1.496 1.872 0 O-C-N 121.311 -0.868 . . . . 0.0 110.651 179.632 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 65' ' ' ASP . . . . . . . . . . . . . 30.0 t70 -58.55 -70.93 0.13 Allowed 'General case' 0 N--CA 1.5 2.071 0 O-C-N 121.359 -0.838 . . . . 0.0 110.778 -179.641 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 66' ' ' GLU . . . . . . . . . . . . . 15.8 mm-40 49.18 30.61 3.12 Favored 'General case' 0 N--CA 1.504 2.23 0 O-C-N 121.489 -0.757 . . . . 0.0 110.293 -179.209 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 67' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -105.05 -29.15 10.61 Favored 'General case' 0 N--CA 1.492 1.633 0 O-C-N 121.604 -0.685 . . . . 0.0 110.549 -179.45 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 68' ' ' GLY . . . . . . . . . . . . . . . 110.92 -11.68 29.56 Favored Glycine 0 N--CA 1.495 2.569 0 N-CA-C 109.406 -1.477 . . . . 0.0 109.406 -178.729 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 69' ' ' SER . . . . . . . . . . . . . 89.7 p -102.32 -42.89 5.85 Favored 'General case' 0 N--CA 1.495 1.818 0 O-C-N 121.468 -1.019 . . . . 0.0 111.015 -179.847 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 70' ' ' GLY . . . . . . . . . . . . . . . 95.31 38.14 4.88 Favored Glycine 0 N--CA 1.496 2.657 0 N-CA-C 108.417 -1.873 . . . . 0.0 108.417 -178.954 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 71' ' ' THR . . . . . . . . . . . . . 8.1 p -142.6 134.31 26.77 Favored 'General case' 0 N--CA 1.492 1.648 0 O-C-N 121.763 -0.845 . . . . 0.0 109.954 -179.086 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 72' ' ' VAL . . . . . . . . . . . . . 2.9 t -103.05 113.56 40.16 Favored 'Isoleucine or valine' 0 N--CA 1.494 1.733 0 O-C-N 121.386 -0.821 . . . . 0.0 110.59 -179.859 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 73' ' ' ASP . . . . . . . . . . . . . 1.6 p-10 -87.15 -159.32 0.5 Allowed 'General case' 0 N--CA 1.496 1.83 0 O-C-N 121.493 -0.754 . . . . 0.0 110.042 179.581 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 74' ' ' PHE . . . . . . . . . . . . . 46.7 t80 -61.67 -51.87 66.64 Favored 'General case' 0 N--CA 1.496 1.866 0 O-C-N 121.303 -0.873 . . . . 0.0 110.323 179.812 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 75' ' ' ASP . . . . . 0.418 ' HA ' HD23 ' A' ' 78' ' ' LEU . 0.3 OUTLIER -61.61 -47.31 86.01 Favored 'General case' 0 N--CA 1.496 1.87 0 O-C-N 121.518 -0.738 . . . . 0.0 110.675 -179.935 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild full ' A' A ' 76' ' ' GLU . . . . . . . . . . . . . 14.2 mt-10 -63.58 -33.53 75.81 Favored 'General case' 0 N--CA 1.499 2.004 0 O-C-N 121.327 -0.858 . . . . 0.0 110.433 179.586 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 77' ' ' PHE . . . . . . . . . . . . . 33.6 t80 -76.68 -46.2 26.59 Favored 'General case' 0 N--CA 1.497 1.886 0 O-C-N 121.173 -0.954 . . . . 0.0 110.033 179.358 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 78' ' ' LEU . . . . . 0.568 HD11 HD11 ' A' ' 12' ' ' LEU . 0.1 OUTLIER -66.44 -36.14 82.05 Favored 'General case' 0 N--CA 1.498 1.946 0 O-C-N 121.429 -0.794 . . . . 0.0 110.429 -179.791 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild full ' A' A ' 79' ' ' VAL . . . . . 0.488 ' N ' ' HG ' ' A' ' 78' ' ' LEU . 4.3 p -71.78 -33.91 49.97 Favored 'Isoleucine or valine' 0 N--CA 1.499 2.015 0 O-C-N 120.951 -1.093 . . . . 0.0 109.206 178.684 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 80' ' ' MET . . . . . 0.54 ' HB2' HG11 ' A' ' 64' ' ' VAL . 56.2 ttp -61.24 -33.53 73.67 Favored 'General case' 0 N--CA 1.496 1.829 0 O-C-N 121.545 -0.722 . . . . 0.0 109.198 178.415 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 81' ' ' MET . . . . . . . . . . . . . 9.1 mmt -62.96 -42.85 99.95 Favored 'General case' 0 N--CA 1.494 1.763 0 O-C-N 121.667 -0.646 . . . . 0.0 109.544 178.881 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 82' ' ' VAL . . . . . . . . . . . . . 71.9 t -60.69 -38.85 79.76 Favored 'Isoleucine or valine' 0 N--CA 1.5 2.06 0 O-C-N 121.478 -0.764 . . . . 0.0 109.363 178.832 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 83' ' ' ARG . . . . . . . . . . . . . 20.1 mtp180 -62.79 -37.06 85.18 Favored 'General case' 0 N--CA 1.498 1.965 0 O-C-N 121.372 -0.83 . . . . 0.0 109.383 178.62 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 84' ' ' CYS . . . . . 0.618 ' SG ' ' HAF' ' A' ' 91' ' ' SXK . 66.7 m -78.86 -24.88 44.04 Favored 'General case' 0 N--CA 1.496 1.863 0 O-C-N 121.577 -0.702 . . . . 0.0 110.311 179.226 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 85' ' ' MET . . . . . . . . . . . . . 2.5 mtp -80.0 51.82 1.41 Allowed 'General case' 0 N--CA 1.499 2.012 0 O-C-N 121.28 -0.888 . . . . 0.0 109.7 179.156 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 86' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -165.51 128.53 2.16 Favored 'General case' 0 N--CA 1.493 1.716 0 O-C-N 121.282 -0.886 . . . . 0.0 109.924 -179.482 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 87' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -112.93 -61.81 1.68 Allowed 'General case' 0 N--CA 1.495 1.807 0 O-C-N 121.446 -0.784 . . . . 0.0 111.022 -179.505 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 88' ' ' ASP . . . . . . . . . . . . . 21.5 t70 -94.35 -63.14 1.22 Allowed 'General case' 0 N--CA 1.499 1.978 0 O-C-N 121.195 -0.94 . . . . 0.0 110.623 -179.805 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 89' ' ' SER . . . . . . . . . . . . . 7.7 t . . . . . 0 N--CA 1.495 1.814 0 CA-C-O 117.805 -1.093 . . . . 0.0 110.251 179.948 . . . . . . . . 0 0 . 1 . 018 nuclear nobuild full ' B' B ' 144' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER . . . . . 0 N--CA 1.499 1.997 0 CA-C-O 121.272 0.558 . . . . 0.0 110.401 . . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' B' B ' 145' ' ' ARG . . . . . . . . . . . . . 4.1 tpt85 -158.76 -58.52 0.07 Allowed 'General case' 0 N--CA 1.498 1.929 0 O-C-N 121.241 -0.912 . . . . 0.0 111.173 -179.901 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' B' B ' 146' ' ' VAL . . . . . 0.739 HG21 HD12 ' B' ' 148' ' ' ILE . 28.3 m -77.61 -13.79 14.16 Favored 'Isoleucine or valine' 0 N--CA 1.505 2.316 0 O-C-N 121.263 -0.898 . . . . 0.0 112.234 -178.821 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' B' B ' 147' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER 56.69 40.35 29.26 Favored 'General case' 0 N--CA 1.504 2.231 0 O-C-N 121.149 -0.969 . . . . 0.0 111.039 -179.872 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' B' B ' 148' ' ' ILE . . . . . 0.739 HD12 HG21 ' B' ' 146' ' ' VAL . 0.4 OUTLIER -77.85 135.94 25.23 Favored 'Isoleucine or valine' 0 N--CA 1.501 2.075 0 O-C-N 121.278 -0.889 . . . . 0.0 110.039 179.801 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild full ' B' B ' 149' ' ' SER . . . . . 0.404 ' HA ' ' HB3' ' A' ' 84' ' ' CYS . 40.8 t -107.1 172.57 6.75 Favored 'General case' 0 N--CA 1.5 2.042 0 O-C-N 121.204 -0.935 . . . . 0.0 111.163 -179.255 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' B' B ' 150' ' ' ALA . . . . . . . . . . . . . . . -55.75 -50.58 70.0 Favored 'General case' 0 N--CA 1.499 2.019 0 O-C-N 121.72 -0.612 . . . . 0.0 111.084 -179.792 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' B' B ' 151' ' ' ASP . . . . . . . . . . . . . 4.7 p-10 -56.97 -37.28 71.39 Favored 'General case' 0 N--CA 1.501 2.083 0 O-C-N 121.392 -0.817 . . . . 0.0 110.696 179.893 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' B' B ' 152' ' ' ALA . . . . . . . . . . . . . . . -70.44 -45.29 66.12 Favored 'General case' 0 N--CA 1.495 1.803 0 O-C-N 121.321 -0.862 . . . . 0.0 109.636 179.304 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' B' B ' 153' ' ' MET . . . . . 0.6 ' HG3' ' HAJ' ' A' ' 91' ' ' SXK . 1.1 mmt -62.74 -40.95 98.83 Favored 'General case' 0 N--CA 1.496 1.86 0 O-C-N 121.613 -0.68 . . . . 0.0 110.137 179.364 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' B' B ' 154' ' ' MET . . . . . . . . . . . . . 9.9 mmt -61.86 -47.94 82.77 Favored 'General case' 0 N--CA 1.499 1.993 0 O-C-N 121.358 -0.839 . . . . 0.0 109.956 179.458 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' B' B ' 155' ' ' GLN . . . . . . . . . . . . . 13.9 mt-30 -68.72 -29.69 68.16 Favored 'General case' 0 N--CA 1.498 1.973 0 O-C-N 121.338 -0.851 . . . . 0.0 110.505 179.334 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' B' B ' 156' ' ' ALA . . . . . 0.497 ' O ' ' HB3' ' B' ' 160' ' ' ALA . . . -80.39 -20.32 44.28 Favored 'General case' 0 N--CA 1.498 1.973 0 O-C-N 121.243 -0.911 . . . . 0.0 111.082 179.867 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' B' B ' 157' ' ' LEU . . . . . 0.424 HD13 ' CE2' ' A' ' 27' ' ' PHE . 13.6 tp -96.59 -49.18 5.22 Favored 'General case' 0 N--CA 1.497 1.907 0 O-C-N 121.041 -1.037 . . . . 0.0 111.017 -179.685 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' B' B ' 158' ' ' LEU . . . . . 0.438 ' HA ' ' HB2' ' B' ' 162' ' ' ALA . 19.0 mt -96.64 -29.56 13.76 Favored 'General case' 0 N--CA 1.5 2.069 0 O-C-N 121.15 -0.969 . . . . 0.0 111.587 -179.24 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' B' B ' 159' ' ' GLY . . . . . . . . . . . . . . . -84.91 -31.82 22.62 Favored Glycine 0 N--CA 1.498 2.829 0 O-C-N 121.153 -0.967 . . . . 0.0 110.886 -179.24 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' B' B ' 160' ' ' ALA . . . . . 0.497 ' HB3' ' O ' ' B' ' 156' ' ' ALA . . . -83.32 78.79 9.57 Favored 'General case' 0 N--CA 1.497 1.921 0 O-C-N 121.139 -1.212 . . . . 0.0 111.214 -179.167 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' B' B ' 161' ' ' ARG . . . . . . . . . . . . . 0.3 OUTLIER 46.48 74.2 0.15 Allowed 'General case' 0 N--CA 1.504 2.238 0 O-C-N 121.582 -0.699 . . . . 0.0 111.544 179.338 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' B' B ' 162' ' ' ALA . . . . . 0.438 ' HB2' ' HA ' ' B' ' 158' ' ' LEU . . . -89.66 133.45 34.64 Favored 'General case' 0 N--CA 1.496 1.83 0 O-C-N 121.139 -0.976 . . . . 0.0 109.726 179.126 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' B' B ' 163' ' ' LYS . . . . . 0.414 ' HB3' ' O ' ' B' ' 162' ' ' ALA . 0.0 OUTLIER . . . . . 0 N--CA 1.505 2.295 0 CA-C-O 118.776 -0.63 . . . . 0.0 110.598 -179.603 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 90' ' ' ' CA' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 018 nuclear nobuild full ' A' A ' 91' ' ' SXK . . . . . 0.618 ' HAF' ' SG ' ' A' ' 84' ' ' CYS . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 1.7 tpp . . . . . 0 N--CA 1.498 1.938 0 CA-C-O 120.858 0.361 . . . . 0.0 110.244 . . . . . . . . . 0 0 . 1 . 019 nuclear nobuild full ' A' A ' 2' ' ' ASP . . . . . . . . . . . . . 4.4 t70 -97.61 62.06 1.65 Allowed 'General case' 0 N--CA 1.495 1.805 0 O-C-N 121.333 -0.855 . . . . 0.0 109.787 179.584 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 3' ' ' ASP . . . . . . . . . . . . . 8.0 m-20 -90.0 -34.99 15.78 Favored 'General case' 0 N--CA 1.495 1.788 0 O-C-N 121.36 -0.837 . . . . 0.0 110.632 -179.453 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 4' ' ' ILE . . . . . . . . . . . . . 72.3 mt -57.88 -49.5 80.88 Favored 'Isoleucine or valine' 0 N--CA 1.502 2.17 0 O-C-N 121.347 -0.845 . . . . 0.0 110.371 179.842 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 5' ' ' TYR . . . . . . . . . . . . . 44.1 m-85 -66.26 -42.22 88.81 Favored 'General case' 0 N--CA 1.501 2.122 0 O-C-N 121.244 -0.91 . . . . 0.0 110.525 179.931 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 6' ' ' LYS . . . . . 0.483 ' HB3' ' HE3' ' A' ' 6' ' ' LYS . 15.9 mtpp -65.3 -32.18 73.7 Favored 'General case' 0 N--CA 1.493 1.683 0 O-C-N 121.332 -0.855 . . . . 0.0 110.415 179.99 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 7' ' ' ALA . . . . . . . . . . . . . . . -51.65 -42.91 62.42 Favored 'General case' 0 N--CA 1.498 1.954 0 O-C-N 121.253 -0.904 . . . . 0.0 109.306 178.803 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 8' ' ' ALA . . . . . 0.472 ' HB3' HG21 ' A' ' 82' ' ' VAL . . . -70.23 -42.24 72.5 Favored 'General case' 0 N--CA 1.495 1.812 0 O-C-N 121.503 -0.748 . . . . 0.0 109.158 178.218 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 9' ' ' VAL . . . . . 0.768 HG13 ' HB3' ' A' ' 78' ' ' LEU . 69.7 t -61.52 -40.53 86.79 Favored 'Isoleucine or valine' 0 N--CA 1.5 2.034 0 O-C-N 121.704 -0.623 . . . . 0.0 110.103 179.15 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 10' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER -69.16 -28.83 66.77 Favored 'General case' 0 N--CA 1.497 1.912 0 O-C-N 121.512 -0.743 . . . . 0.0 110.587 179.7 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 11' ' ' GLN . . . . . . . . . . . . . 0.1 OUTLIER -92.42 41.61 1.08 Allowed 'General case' 0 N--CA 1.496 1.836 0 O-C-N 121.279 -0.888 . . . . 0.0 110.946 -179.754 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 12' ' ' LEU . . . . . 0.557 HD12 ' HA ' ' A' ' 9' ' ' VAL . 10.7 mt -106.8 123.82 48.71 Favored 'General case' 0 N--CA 1.497 1.904 0 O-C-N 121.134 -0.979 . . . . 0.0 110.177 179.516 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 13' ' ' THR . . . . . . . . . . . . . 0.3 OUTLIER -79.69 164.49 23.7 Favored 'General case' 0 N--CA 1.498 1.927 0 O-C-N 121.193 -0.942 . . . . 0.0 110.07 179.621 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 14' ' ' GLU . . . . . . . . . . . . . 0.2 OUTLIER -52.54 -30.75 32.2 Favored 'General case' 0 N--CA 1.497 1.879 0 O-C-N 121.625 -0.672 . . . . 0.0 111.196 -179.281 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 1.5 mp0 -59.65 -51.23 70.71 Favored 'General case' 0 N--CA 1.497 1.892 0 O-C-N 121.449 -0.782 . . . . 0.0 109.838 179.483 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 16' ' ' GLN . . . . . . . . . . . . . 3.0 mp0 -79.99 -26.79 39.77 Favored 'General case' 0 N--CA 1.5 2.03 0 O-C-N 121.452 -0.78 . . . . 0.0 110.12 179.148 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 17' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -69.15 -42.57 75.76 Favored 'General case' 0 N--CA 1.496 1.867 0 O-C-N 121.628 -0.67 . . . . 0.0 110.097 179.707 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 18' ' ' ASN . . . . . 0.508 ' HA ' ' HG2' ' A' ' 21' ' ' LYS . 12.2 t30 -56.9 -39.69 74.89 Favored 'General case' 0 N--CA 1.499 2.002 0 O-C-N 121.6 -0.688 . . . . 0.0 110.761 179.923 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 4.4 mt-10 -54.88 -48.51 72.9 Favored 'General case' 0 N--CA 1.499 2.011 0 O-C-N 121.33 -0.856 . . . . 0.0 109.987 179.553 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 20' ' ' PHE . . . . . . . . . . . . . 43.9 m-85 -77.65 -33.58 53.41 Favored 'General case' 0 N--CA 1.497 1.919 0 O-C-N 121.436 -0.79 . . . . 0.0 110.282 179.516 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 21' ' ' LYS . . . . . 0.514 ' HG3' ' N ' ' A' ' 22' ' ' ALA . 0.0 OUTLIER -64.21 -34.31 77.79 Favored 'General case' 0 N--CA 1.496 1.858 0 O-C-N 121.183 -0.948 . . . . 0.0 109.508 179.02 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild full ' A' A ' 22' ' ' ALA . . . . . 0.514 ' N ' ' HG3' ' A' ' 21' ' ' LYS . . . -76.02 -41.52 50.74 Favored 'General case' 0 N--CA 1.496 1.873 0 O-C-N 121.556 -0.715 . . . . 0.0 109.153 178.434 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 23' ' ' ALA . . . . . 0.492 ' O ' ' HB2' ' A' ' 27' ' ' PHE . . . -73.3 -7.27 50.83 Favored 'General case' 0 N--CA 1.494 1.732 0 O-C-N 121.679 -0.638 . . . . 0.0 110.75 178.975 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 24' ' ' PHE . . . . . . . . . . . . . 38.5 t80 -107.92 -49.32 3.23 Favored 'General case' 0 N--CA 1.495 1.793 0 O-C-N 121.181 -0.949 . . . . 0.0 110.795 -179.574 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 25' ' ' ASP . . . . . . . . . . . . . 0.1 OUTLIER -61.38 -41.84 97.75 Favored 'General case' 0 N--CA 1.5 2.065 0 O-C-N 121.307 -0.871 . . . . 0.0 110.891 -179.389 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 26' ' ' ILE . . . . . . . . . . . . . 37.4 mt -76.62 -27.05 16.83 Favored 'Isoleucine or valine' 0 N--CA 1.499 1.977 0 O-C-N 121.152 -0.968 . . . . 0.0 109.798 179.037 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 27' ' ' PHE . . . . . 0.567 ' HA ' HD21 ' B' ' 157' ' ' LEU . 1.7 t80 -59.08 -50.6 73.45 Favored 'General case' 0 N--CA 1.497 1.894 0 O-C-N 121.638 -0.664 . . . . 0.0 110.421 179.484 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 28' ' ' VAL . . . . . . . . . . . . . 18.6 m -91.04 -35.4 7.12 Favored 'Isoleucine or valine' 0 N--CA 1.497 1.906 0 O-C-N 121.555 -0.716 . . . . 0.0 111.254 -179.288 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 29' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER 46.48 43.66 12.31 Favored 'General case' 0 N--CA 1.497 1.919 0 O-C-N 121.45 -0.781 . . . . 0.0 110.218 -179.654 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 30' ' ' GLY . . . . . . . . . . . . . . . 106.06 -62.04 0.33 Allowed Glycine 0 N--CA 1.494 2.503 0 N-CA-C 108.794 -1.722 . . . . 0.0 108.794 -178.768 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 31' ' ' ALA . . . . . . . . . . . . . . . 47.88 56.64 6.95 Favored 'General case' 0 N--CA 1.501 2.121 0 O-C-N 121.81 -0.817 . . . . 0.0 111.13 179.531 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 32' ' ' GLU . . . . . . . . . . . . . 2.8 mm-40 51.33 32.47 8.44 Favored 'General case' 0 N--CA 1.502 2.13 0 O-C-N 121.644 -0.66 . . . . 0.0 110.979 179.938 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 1.2 t70 55.17 53.52 10.02 Favored 'General case' 0 N--CA 1.499 2.017 0 O-C-N 121.49 -0.756 . . . . 0.0 110.696 -179.848 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 34' ' ' GLY . . . . . 0.508 ' O ' HG21 ' A' ' 71' ' ' THR . . . -145.46 31.29 1.68 Allowed Glycine 0 N--CA 1.499 2.839 0 C-N-CA 119.883 -1.151 . . . . 0.0 111.146 -179.762 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 35' ' ' CYS . . . . . . . . . . . . . 96.7 m 48.62 -151.59 0.13 Allowed 'General case' 0 N--CA 1.508 2.456 0 O-C-N 121.373 -1.075 . . . . 0.0 111.302 179.353 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 36' ' ' ILE . . . . . . . . . . . . . 30.5 mt -80.95 105.56 11.0 Favored 'Isoleucine or valine' 0 N--CA 1.5 2.054 0 O-C-N 120.792 -1.193 . . . . 0.0 110.141 -179.893 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 37' ' ' SER . . . . . . . . . . . . . 5.7 t -100.57 175.71 5.58 Favored 'General case' 0 N--CA 1.496 1.835 0 O-C-N 121.429 -0.794 . . . . 0.0 110.098 179.595 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 38' ' ' THR . . . . . 0.407 HG21 ' HG2' ' A' ' 58' ' ' GLN . 33.6 p -61.81 -38.8 89.49 Favored 'General case' 0 N--CA 1.501 2.1 0 O-C-N 121.231 -0.918 . . . . 0.0 110.041 179.553 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 39' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -65.64 -40.29 92.36 Favored 'General case' 0 N--CA 1.499 2.005 0 O-C-N 121.674 -0.641 . . . . 0.0 110.379 179.535 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 2.3 mp0 -65.42 -48.8 71.57 Favored 'General case' 0 N--CA 1.499 2.014 0 O-C-N 121.434 -0.791 . . . . 0.0 110.399 179.896 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 41' ' ' LEU . . . . . 0.587 HD22 ' HAK' ' A' ' 91' ' ' SXK . 7.7 tp -61.69 -47.44 85.31 Favored 'General case' 0 N--CA 1.499 1.983 0 O-C-N 121.481 -0.762 . . . . 0.0 110.323 179.898 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 42' ' ' GLY . . . . . . . . . . . . . . . -58.16 -40.06 93.16 Favored Glycine 0 N--CA 1.493 2.472 0 N-CA-C 110.155 -1.178 . . . . 0.0 110.155 -179.712 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 43' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -56.42 -45.21 80.82 Favored 'General case' 0 N--CA 1.5 2.066 0 O-C-N 121.439 -1.036 . . . . 0.0 109.97 179.426 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 44' ' ' VAL . . . . . 0.447 HG21 ' CE1' ' A' ' 27' ' ' PHE . 72.1 t -67.84 -42.69 86.14 Favored 'Isoleucine or valine' 0 N--CA 1.498 1.94 0 O-C-N 121.42 -0.8 . . . . 0.0 109.557 179.154 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 45' ' ' MET . . . . . 0.53 ' HE1' HD11 ' A' ' 41' ' ' LEU . 0.9 OUTLIER -60.04 -39.27 85.35 Favored 'General case' 0 N--CA 1.499 2.012 0 O-C-N 121.431 -0.793 . . . . 0.0 109.59 178.805 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild full ' A' A ' 46' ' ' ARG . . . . . . . . . . . . . 0.3 OUTLIER -61.49 -37.49 83.87 Favored 'General case' 0 N--CA 1.496 1.832 0 O-C-N 121.65 -0.656 . . . . 0.0 109.706 178.859 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 47' ' ' MET . . . . . . . . . . . . . 18.1 ttp -67.02 -38.65 86.33 Favored 'General case' 0 N--CA 1.496 1.863 0 O-C-N 121.711 -0.618 . . . . 0.0 110.032 179.153 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 48' ' ' LEU . . . . . . . . . . . . . 5.9 tp -68.9 -36.79 78.45 Favored 'General case' 0 N--CA 1.493 1.677 0 O-C-N 121.4 -0.812 . . . . 0.0 110.307 179.691 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 49' ' ' GLY . . . . . . . . . . . . . . . 131.98 -39.61 1.74 Allowed Glycine 0 N--CA 1.494 2.561 0 N-CA-C 110.023 -1.231 . . . . 0.0 110.023 179.925 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 50' ' ' GLN . . . . . . . . . . . . . 7.8 mt-30 -88.16 107.51 18.81 Favored 'General case' 0 N--CA 1.497 1.922 0 O-C-N 121.274 -1.133 . . . . 0.0 110.626 -179.741 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 51' ' ' ASN . . . . . . . . . . . . . 24.4 t-20 -156.79 100.76 1.99 Allowed Pre-proline 0 N--CA 1.499 1.999 0 O-C-N 121.412 -0.805 . . . . 0.0 110.196 179.81 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 52' ' ' PRO . . . . . . . . . . . . . 49.0 Cg_endo -79.53 -89.2 0.0 OUTLIER 'Trans proline' 0 C--N 1.317 -1.131 0 O-C-N 123.839 1.441 . . . . 0.0 111.178 -179.999 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 53' ' ' THR . . . . . . . . . . . . . 4.6 p -127.95 165.83 27.77 Favored Pre-proline 0 N--CA 1.496 1.846 0 O-C-N 120.945 -1.097 . . . . 0.0 110.791 -179.233 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 54' ' ' PRO . . . . . . . . . . . . . 42.7 Cg_endo -68.79 -31.76 24.64 Favored 'Trans proline' 0 N--CA 1.491 1.335 0 O-C-N 123.704 1.371 . . . . 0.0 110.939 179.495 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 55' ' ' GLU . . . . . . . . . . . . . 1.9 mp0 -67.4 -29.45 68.97 Favored 'General case' 0 N--CA 1.499 1.994 0 O-C-N 121.22 -0.925 . . . . 0.0 110.075 179.271 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 4.6 tm-20 -56.82 -35.99 69.44 Favored 'General case' 0 N--CA 1.499 1.979 0 O-C-N 121.53 -0.732 . . . . 0.0 110.663 179.587 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 57' ' ' LEU . . . . . 0.593 ' H ' HD22 ' A' ' 57' ' ' LEU . 0.7 OUTLIER -69.58 -29.26 66.77 Favored 'General case' 0 N--CA 1.499 1.98 0 O-C-N 121.33 -0.856 . . . . 0.0 110.87 179.983 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild full ' A' A ' 58' ' ' GLN . . . . . 0.748 ' O ' HG22 ' A' ' 61' ' ' ILE . 0.0 OUTLIER -56.86 -49.74 74.57 Favored 'General case' 0 N--CA 1.498 1.941 0 O-C-N 121.051 -1.031 . . . . 0.0 109.451 179.642 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild full ' A' A ' 59' ' ' GLU . . . . . . . . . . . . . 0.7 OUTLIER -64.65 -38.1 89.85 Favored 'General case' 0 N--CA 1.495 1.805 0 N-CA-C 108.418 -0.956 . . . . 0.0 108.418 177.971 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 60' ' ' MET . . . . . 0.442 ' HB2' ' HA ' ' A' ' 57' ' ' LEU . 7.5 mmm -58.8 -39.1 80.15 Favored 'General case' 0 N--CA 1.496 1.838 0 O-C-N 121.795 -0.566 . . . . 0.0 110.096 178.772 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 61' ' ' ILE . . . . . 0.748 HG22 ' O ' ' A' ' 58' ' ' GLN . 5.1 tt -76.72 -26.9 16.59 Favored 'Isoleucine or valine' 0 N--CA 1.498 1.943 0 O-C-N 121.435 -0.791 . . . . 0.0 110.575 179.729 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 62' ' ' ASP . . . . . . . . . . . . . 1.8 t70 -62.32 -25.22 67.76 Favored 'General case' 0 N--CA 1.498 1.948 0 O-C-N 121.417 -0.802 . . . . 0.0 110.487 179.683 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 63' ' ' GLU . . . . . . . . . . . . . 16.2 tt0 -47.28 -42.39 20.79 Favored 'General case' 0 N--CA 1.501 2.097 0 O-C-N 121.613 -0.68 . . . . 0.0 110.961 179.459 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 64' ' ' VAL . . . . . 0.563 HG11 ' HB2' ' A' ' 80' ' ' MET . 27.5 m -127.45 30.14 1.81 Allowed 'Isoleucine or valine' 0 N--CA 1.498 1.96 0 O-C-N 121.342 -0.849 . . . . 0.0 110.85 179.929 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 65' ' ' ASP . . . . . . . . . . . . . 19.3 t70 -119.9 -97.82 0.46 Allowed 'General case' 0 N--CA 1.495 1.78 0 O-C-N 121.173 -0.955 . . . . 0.0 110.062 179.589 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 66' ' ' GLU . . . . . . . . . . . . . 1.4 mm-40 47.24 35.34 3.66 Favored 'General case' 0 N--CA 1.502 2.126 0 O-C-N 121.354 -0.841 . . . . 0.0 110.967 -179.903 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 67' ' ' ASP . . . . . . . . . . . . . 4.4 p-10 -114.09 7.45 16.71 Favored 'General case' 0 N--CA 1.497 1.884 0 O-C-N 121.213 -0.93 . . . . 0.0 111.367 -179.691 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 68' ' ' GLY . . . . . . . . . . . . . . . 98.34 -27.1 21.0 Favored Glycine 0 N--CA 1.497 2.759 0 N-CA-C 110.45 -1.06 . . . . 0.0 110.45 179.888 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 69' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -80.34 -42.36 23.08 Favored 'General case' 0 N--CA 1.498 1.951 0 O-C-N 121.22 -1.165 . . . . 0.0 111.01 -179.612 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 70' ' ' GLY . . . . . . . . . . . . . . . 81.13 6.77 89.16 Favored Glycine 0 N--CA 1.499 2.854 0 C-N-CA 120.205 -0.997 . . . . 0.0 110.871 179.959 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 71' ' ' THR . . . . . 0.508 HG21 ' O ' ' A' ' 34' ' ' GLY . 2.7 m -124.33 140.53 52.87 Favored 'General case' 0 N--CA 1.498 1.955 0 O-C-N 121.09 -1.241 . . . . 0.0 109.842 179.697 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 72' ' ' VAL . . . . . 0.658 HG23 HG12 ' A' ' 61' ' ' ILE . 3.0 t -92.35 123.63 44.52 Favored 'Isoleucine or valine' 0 N--CA 1.495 1.791 0 O-C-N 121.426 -0.796 . . . . 0.0 110.723 -179.633 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 73' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER -97.28 -163.5 1.05 Allowed 'General case' 0 N--CA 1.494 1.736 0 O-C-N 121.525 -0.735 . . . . 0.0 109.671 179.28 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 74' ' ' PHE . . . . . 0.412 ' CE2' HD11 ' A' ' 78' ' ' LEU . 11.1 t80 -64.97 -45.49 85.47 Favored 'General case' 0 N--CA 1.499 2.023 0 O-C-N 121.067 -1.02 . . . . 0.0 110.475 179.771 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 75' ' ' ASP . . . . . . . . . . . . . 16.3 t70 -59.85 -50.76 72.54 Favored 'General case' 0 N--CA 1.498 1.974 0 O-C-N 121.358 -0.839 . . . . 0.0 109.978 179.389 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 76' ' ' GLU . . . . . . . . . . . . . 43.5 mt-10 -62.18 -40.7 96.91 Favored 'General case' 0 N--CA 1.498 1.943 0 O-C-N 121.515 -0.741 . . . . 0.0 109.553 179.167 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 77' ' ' PHE . . . . . . . . . . . . . 71.8 t80 -60.83 -44.19 97.27 Favored 'General case' 0 N--CA 1.496 1.872 0 O-C-N 121.617 -0.677 . . . . 0.0 109.703 178.712 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 78' ' ' LEU . . . . . 0.768 ' HB3' HG13 ' A' ' 9' ' ' VAL . 52.6 mt -65.98 -43.62 87.29 Favored 'General case' 0 N--CA 1.5 2.046 0 O-C-N 121.567 -0.708 . . . . 0.0 110.087 179.389 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 79' ' ' VAL . . . . . 0.642 ' O ' HG12 ' A' ' 82' ' ' VAL . 45.2 t -60.2 -44.68 95.94 Favored 'Isoleucine or valine' 0 N--CA 1.497 1.891 0 O-C-N 121.61 -0.681 . . . . 0.0 109.393 179.374 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 80' ' ' MET . . . . . 0.563 ' HB2' HG11 ' A' ' 64' ' ' VAL . 2.3 ttp -62.78 -39.77 95.26 Favored 'General case' 0 N--CA 1.495 1.812 0 O-C-N 121.517 -0.74 . . . . 0.0 110.013 178.923 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 81' ' ' MET . . . . . . . . . . . . . 11.2 mmt -62.33 -44.29 96.84 Favored 'General case' 0 N--CA 1.498 1.948 0 O-C-N 121.57 -0.706 . . . . 0.0 110.743 179.946 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 82' ' ' VAL . . . . . 0.642 HG12 ' O ' ' A' ' 79' ' ' VAL . 2.4 p -70.21 -26.57 29.69 Favored 'Isoleucine or valine' 0 N--CA 1.5 2.05 0 O-C-N 121.169 -0.957 . . . . 0.0 110.292 179.514 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 83' ' ' ARG . . . . . 0.618 ' HD2' HG12 ' A' ' 79' ' ' VAL . 4.0 mtp180 -74.6 -33.68 62.68 Favored 'General case' 0 N--CA 1.495 1.795 0 O-C-N 121.222 -0.924 . . . . 0.0 109.444 178.742 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 84' ' ' CYS . . . . . 0.768 ' HA ' ' HB2' ' A' ' 88' ' ' ASP . 0.1 OUTLIER -71.59 -11.52 60.89 Favored 'General case' 0 N--CA 1.496 1.869 0 O-C-N 121.703 -0.623 . . . . 0.0 110.921 179.323 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild full ' A' A ' 85' ' ' MET . . . . . . . . . . . . . 12.2 tpp -58.19 -22.02 49.96 Favored 'General case' 0 N--CA 1.5 2.029 0 O-C-N 121.315 -0.865 . . . . 0.0 111.563 -179.953 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 86' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -90.95 43.53 1.15 Allowed 'General case' 0 N--CA 1.5 2.039 0 O-C-N 120.994 -1.066 . . . . 0.0 110.7 179.962 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 87' ' ' ASP . . . . . . . . . . . . . 1.1 t70 55.35 30.8 15.5 Favored 'General case' 0 N--CA 1.501 2.096 0 O-C-N 121.407 -0.808 . . . . 0.0 111.652 179.607 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 88' ' ' ASP . . . . . 0.768 ' HB2' ' HA ' ' A' ' 84' ' ' CYS . 0.9 OUTLIER -67.63 -39.06 84.69 Favored 'General case' 0 N--CA 1.498 1.949 0 O-C-N 120.911 -1.118 . . . . 0.0 109.923 179.339 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild full ' A' A ' 89' ' ' SER . . . . . 0.483 ' HA ' ' HD3' ' B' ' 147' ' ' ARG . 0.2 OUTLIER . . . . . 0 N--CA 1.496 1.834 0 CA-C-O 118.363 -0.827 . . . . 0.0 110.538 179.434 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' B' B ' 144' ' ' ARG . . . . . . . . . . . . . 6.2 mpt_? . . . . . 0 N--CA 1.497 1.878 0 CA-C-O 120.867 0.365 . . . . 0.0 110.151 . . . . . . . . . 0 0 . 1 . 019 nuclear nobuild full ' B' B ' 145' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER 60.64 -158.89 0.32 Allowed 'General case' 0 N--CA 1.502 2.151 0 O-C-N 121.67 -0.644 . . . . 0.0 110.683 -179.848 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' B' B ' 146' ' ' VAL . . . . . 0.732 HG12 HG12 ' B' ' 148' ' ' ILE . 91.6 t -114.94 -77.08 0.45 Allowed 'Isoleucine or valine' 0 N--CA 1.498 1.965 0 O-C-N 121.088 -1.008 . . . . 0.0 110.472 -179.571 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' B' B ' 147' ' ' ARG . . . . . 0.483 ' HD3' ' HA ' ' A' ' 89' ' ' SER . 0.0 OUTLIER 54.57 83.07 0.08 Allowed 'General case' 0 N--CA 1.505 2.278 0 O-C-N 121.519 -0.738 . . . . 0.0 110.824 -179.927 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild full ' B' B ' 148' ' ' ILE . . . . . 0.732 HG12 HG12 ' B' ' 146' ' ' VAL . 36.7 mm -111.91 110.21 31.38 Favored 'Isoleucine or valine' 0 N--CA 1.495 1.823 0 O-C-N 121.294 -0.879 . . . . 0.0 110.426 -179.879 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' B' B ' 149' ' ' SER . . . . . . . . . . . . . 89.0 p -96.99 158.9 15.2 Favored 'General case' 0 N--CA 1.496 1.839 0 O-C-N 121.383 -0.823 . . . . 0.0 110.391 179.696 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' B' B ' 150' ' ' ALA . . . . . . . . . . . . . . . -58.85 -50.09 75.28 Favored 'General case' 0 N--CA 1.498 1.974 0 O-C-N 121.482 -0.761 . . . . 0.0 111.104 -179.652 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' B' B ' 151' ' ' ASP . . . . . . . . . . . . . 7.2 p-10 -60.62 -35.75 76.92 Favored 'General case' 0 N--CA 1.502 2.137 0 O-C-N 121.371 -0.83 . . . . 0.0 111.252 -179.804 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' B' B ' 152' ' ' ALA . . . . . . . . . . . . . . . -74.36 -38.82 63.1 Favored 'General case' 0 N--CA 1.496 1.825 0 O-C-N 121.131 -0.981 . . . . 0.0 110.252 179.645 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' B' B ' 153' ' ' MET . . . . . . . . . . . . . 0.4 OUTLIER -64.66 -47.97 76.49 Favored 'General case' 0 N--CA 1.498 1.962 0 O-C-N 121.41 -0.806 . . . . 0.0 110.608 179.973 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' B' B ' 154' ' ' MET . . . . . 0.427 ' HG3' ' N ' ' B' ' 155' ' ' GLN . 17.2 ptp -63.84 -30.25 71.36 Favored 'General case' 0 N--CA 1.5 2.04 0 O-C-N 121.167 -0.958 . . . . 0.0 110.298 179.57 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' B' B ' 155' ' ' GLN . . . . . 0.427 ' N ' ' HG3' ' B' ' 154' ' ' MET . 0.2 OUTLIER -65.54 -35.79 81.88 Favored 'General case' 0 N--CA 1.498 1.961 0 O-C-N 121.327 -0.858 . . . . 0.0 110.201 179.074 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild full ' B' B ' 156' ' ' ALA . . . . . . . . . . . . . . . -87.28 -43.77 11.92 Favored 'General case' 0 N--CA 1.495 1.799 0 O-C-N 121.431 -0.793 . . . . 0.0 110.143 179.719 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' B' B ' 157' ' ' LEU . . . . . 0.567 HD21 ' HA ' ' A' ' 27' ' ' PHE . 0.9 OUTLIER -64.67 -48.65 73.96 Favored 'General case' 0 N--CA 1.498 1.972 0 O-C-N 121.614 -0.679 . . . . 0.0 110.481 179.969 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild full ' B' B ' 158' ' ' LEU . . . . . . . . . . . . . 6.3 mt -101.28 27.16 6.4 Favored 'General case' 0 N--CA 1.498 1.947 0 O-C-N 121.161 -0.962 . . . . 0.0 110.856 -179.988 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' B' B ' 159' ' ' GLY . . . . . . . . . . . . . . . -122.75 -49.14 0.24 Allowed Glycine 0 N--CA 1.497 2.748 0 N-CA-C 109.205 -1.558 . . . . 0.0 109.205 179.293 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' B' B ' 160' ' ' ALA . . . . . . . . . . . . . . . -85.18 -43.23 14.01 Favored 'General case' 0 N--CA 1.497 1.88 0 O-C-N 121.418 -1.048 . . . . 0.0 109.808 179.258 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' B' B ' 161' ' ' ARG . . . . . . . . . . . . . 0.9 OUTLIER -78.31 -54.12 6.55 Favored 'General case' 0 N--CA 1.497 1.889 0 O-C-N 121.289 -0.882 . . . . 0.0 109.631 179.349 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' B' B ' 162' ' ' ALA . . . . . . . . . . . . . . . -97.87 133.29 42.56 Favored 'General case' 0 N--CA 1.494 1.762 0 O-C-N 121.402 -0.811 . . . . 0.0 109.62 179.242 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' B' B ' 163' ' ' LYS . . . . . 0.4 ' HA ' ' HE2' ' B' ' 163' ' ' LYS . 0.0 OUTLIER . . . . . 0 N--CA 1.495 1.812 0 CA-C-O 117.763 -1.113 . . . . 0.0 110.725 -179.921 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 90' ' ' ' CA' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 019 nuclear nobuild full ' A' A ' 91' ' ' SXK . . . . . 0.587 ' HAK' HD22 ' A' ' 41' ' ' LEU . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 9.9 tpt . . . . . 0 N--CA 1.496 1.849 0 CA-C-O 120.987 0.422 . . . . 0.0 110.279 . . . . . . . . . 0 0 . 1 . 020 nuclear nobuild full ' A' A ' 2' ' ' ASP . . . . . . . . . . . . . 1.6 p30 -157.71 168.31 27.59 Favored 'General case' 0 N--CA 1.498 1.969 0 O-C-N 121.463 -0.773 . . . . 0.0 110.574 -179.743 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 3' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER -111.52 95.61 5.61 Favored 'General case' 0 N--CA 1.498 1.946 0 O-C-N 121.315 -0.866 . . . . 0.0 110.798 -179.823 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 4' ' ' ILE . . . . . . . . . . . . . 1.8 pp -82.27 -28.75 9.17 Favored 'Isoleucine or valine' 0 N--CA 1.499 2.009 0 O-C-N 121.272 -0.892 . . . . 0.0 110.626 179.674 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 5' ' ' TYR . . . . . 0.423 ' CE1' ' HG2' ' A' ' 83' ' ' ARG . 16.5 m-85 -72.07 -42.55 66.08 Favored 'General case' 0 N--CA 1.496 1.872 0 O-C-N 121.252 -0.905 . . . . 0.0 109.767 179.407 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -66.5 -44.13 83.44 Favored 'General case' 0 N--CA 1.495 1.791 0 O-C-N 121.541 -0.724 . . . . 0.0 109.771 179.121 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 7' ' ' ALA . . . . . . . . . . . . . . . -52.42 -41.26 63.06 Favored 'General case' 0 N--CA 1.498 1.973 0 O-C-N 121.464 -0.773 . . . . 0.0 109.936 179.12 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 8' ' ' ALA . . . . . . . . . . . . . . . -60.12 -33.07 71.63 Favored 'General case' 0 N--CA 1.498 1.948 0 O-C-N 121.515 -0.741 . . . . 0.0 110.633 179.203 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 9' ' ' VAL . . . . . 0.503 ' HA ' HD23 ' A' ' 12' ' ' LEU . 84.5 t -84.61 -37.46 12.64 Favored 'Isoleucine or valine' 0 N--CA 1.498 1.958 0 O-C-N 121.459 -0.776 . . . . 0.0 110.566 179.996 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 10' ' ' GLU . . . . . . . . . . . . . 0.5 OUTLIER -67.98 -26.31 65.86 Favored 'General case' 0 N--CA 1.499 2.022 0 O-C-N 121.431 -0.793 . . . . 0.0 112.447 -178.73 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 11' ' ' GLN . . . . . . . . . . . . . 0.8 OUTLIER -134.13 65.82 1.56 Allowed 'General case' 0 N--CA 1.498 1.974 0 O-C-N 120.638 -1.289 . . . . 0.0 112.18 -179.346 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 12' ' ' LEU . . . . . 0.566 ' C ' HD12 ' A' ' 12' ' ' LEU . 4.4 pp -110.41 160.17 16.82 Favored 'General case' 0 N--CA 1.499 2.01 0 O-C-N 121.236 -0.915 . . . . 0.0 109.317 177.854 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 13' ' ' THR . . . . . . . . . . . . . 60.5 p -73.91 157.05 36.97 Favored 'General case' 0 N--CA 1.505 2.276 0 O-C-N 121.084 -1.01 . . . . 0.0 111.456 -178.627 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 14' ' ' GLU . . . . . . . . . . . . . 3.0 tp10 -53.18 -34.82 58.59 Favored 'General case' 0 N--CA 1.495 1.801 0 O-C-N 121.828 -0.545 . . . . 0.0 110.338 179.848 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 1.2 mp0 -63.29 -43.88 96.64 Favored 'General case' 0 N--CA 1.496 1.829 0 O-C-N 121.601 -0.687 . . . . 0.0 109.59 179.389 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 16' ' ' GLN . . . . . 0.505 ' HB3' HD13 ' A' ' 12' ' ' LEU . 0.1 OUTLIER -58.52 -37.88 76.56 Favored 'General case' 0 N--CA 1.498 1.931 0 CA-C-O 121.587 0.708 . . . . 0.0 110.144 179.269 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild full ' A' A ' 17' ' ' LYS . . . . . 0.527 ' HB2' HD11 ' A' ' 12' ' ' LEU . 1.3 ttpt -77.8 -33.72 52.41 Favored 'General case' 0 N--CA 1.493 1.709 0 O-C-N 121.5 -0.75 . . . . 0.0 109.986 179.173 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 18' ' ' ASN . . . . . . . . . . . . . 52.5 m-20 -68.42 -46.31 70.25 Favored 'General case' 0 N--CA 1.498 1.973 0 O-C-N 121.417 -0.802 . . . . 0.0 110.847 179.92 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 12.6 pt-20 -60.61 -35.84 77.12 Favored 'General case' 0 N--CA 1.502 2.131 0 O-C-N 121.173 -0.954 . . . . 0.0 110.121 179.856 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 20' ' ' PHE . . . . . . . . . . . . . 18.4 m-30 -77.12 -32.18 56.28 Favored 'General case' 0 N--CA 1.496 1.847 0 O-C-N 121.317 -0.864 . . . . 0.0 109.927 178.923 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 21' ' ' LYS . . . . . . . . . . . . . 2.9 tptp -60.97 -46.95 88.67 Favored 'General case' 0 N--CA 1.498 1.956 0 O-C-N 121.484 -0.76 . . . . 0.0 109.649 178.961 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 22' ' ' ALA . . . . . 0.497 ' O ' HD12 ' A' ' 26' ' ' ILE . . . -61.73 -50.23 73.24 Favored 'General case' 0 N--CA 1.499 1.989 0 O-C-N 121.395 -0.816 . . . . 0.0 109.869 179.324 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 23' ' ' ALA . . . . . . . . . . . . . . . -59.04 -40.44 85.05 Favored 'General case' 0 N--CA 1.498 1.929 0 O-C-N 121.557 -0.715 . . . . 0.0 109.647 178.94 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 24' ' ' PHE . . . . . 0.53 ' O ' HG13 ' A' ' 28' ' ' VAL . 73.9 t80 -64.55 -43.8 92.78 Favored 'General case' 0 N--CA 1.498 1.946 0 O-C-N 121.788 -0.57 . . . . 0.0 109.89 179.212 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 25' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER -56.6 -45.47 81.42 Favored 'General case' 0 N--CA 1.499 2.013 0 O-C-N 121.475 -0.766 . . . . 0.0 110.496 179.573 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 26' ' ' ILE . . . . . 0.543 ' HB ' HD12 ' B' ' 157' ' ' LEU . 6.6 mt -70.56 -31.75 47.41 Favored 'Isoleucine or valine' 0 N--CA 1.498 1.966 0 O-C-N 121.168 -0.957 . . . . 0.0 109.518 179.143 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 27' ' ' PHE . . . . . 0.585 ' CZ ' HG11 ' A' ' 44' ' ' VAL . 0.2 OUTLIER -74.46 -22.5 59.08 Favored 'General case' 0 N--CA 1.496 1.845 0 O-C-N 121.102 -0.999 . . . . 0.0 110.774 179.186 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild full ' A' A ' 28' ' ' VAL . . . . . 0.692 HG12 HG13 ' A' ' 36' ' ' ILE . 10.6 m -107.36 10.6 9.13 Favored 'Isoleucine or valine' 0 N--CA 1.501 2.076 0 O-C-N 121.153 -0.967 . . . . 0.0 111.902 -179.354 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 29' ' ' LEU . . . . . 0.622 ' O ' HD12 ' A' ' 29' ' ' LEU . 4.6 pp -57.13 136.85 56.4 Favored 'General case' 0 N--CA 1.504 2.242 0 O-C-N 120.77 -1.206 . . . . 0.0 109.398 179.379 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 30' ' ' GLY . . . . . . . . . . . . . . . 90.39 -49.6 3.22 Favored Glycine 0 N--CA 1.495 2.628 0 N-CA-C 108.093 -2.003 . . . . 0.0 108.093 -177.838 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 31' ' ' ALA . . . . . . . . . . . . . . . -88.42 67.48 8.61 Favored 'General case' 0 N--CA 1.491 1.616 0 O-C-N 121.617 -0.931 . . . . 0.0 108.727 178.481 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 32' ' ' GLU . . . . . . . . . . . . . 1.3 mp0 -61.71 -10.87 9.69 Favored 'General case' 0 N--CA 1.501 2.122 0 O-C-N 121.565 -0.71 . . . . 0.0 112.146 -178.898 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 15.7 t70 -52.8 -35.39 56.76 Favored 'General case' 0 N--CA 1.501 2.09 0 O-C-N 121.148 -0.97 . . . . 0.0 110.516 179.484 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 34' ' ' GLY . . . . . . . . . . . . . . . 107.53 34.16 2.94 Favored Glycine 0 N--CA 1.497 2.746 0 N-CA-C 110.267 -1.133 . . . . 0.0 110.267 179.521 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 35' ' ' CYS . . . . . . . . . . . . . 28.3 p -144.36 156.8 44.4 Favored 'General case' 0 N--CA 1.495 1.79 0 O-C-N 121.275 -1.132 . . . . 0.0 110.203 179.697 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 36' ' ' ILE . . . . . 0.692 HG13 HG12 ' A' ' 28' ' ' VAL . 17.9 mt -121.42 118.59 56.46 Favored 'Isoleucine or valine' 0 N--CA 1.494 1.752 0 O-C-N 121.383 -0.823 . . . . 0.0 109.987 -179.965 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 37' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -101.07 163.19 12.4 Favored 'General case' 0 N--CA 1.493 1.72 0 O-C-N 121.558 -0.714 . . . . 0.0 109.637 179.167 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 38' ' ' THR . . . . . 0.832 HG21 ' HA ' ' A' ' 58' ' ' GLN . 77.7 p -64.27 -32.76 74.47 Favored 'General case' 0 N--CA 1.5 2.045 0 O-C-N 121.31 -0.869 . . . . 0.0 110.595 -179.829 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 39' ' ' LYS . . . . . 0.473 ' HA ' ' HB3' ' A' ' 54' ' ' PRO . 11.6 mttp -60.88 -34.33 74.46 Favored 'General case' 0 N--CA 1.496 1.864 0 O-C-N 121.518 -0.739 . . . . 0.0 109.465 178.777 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 1.2 mp0 -83.42 -30.55 27.23 Favored 'General case' 0 N--CA 1.497 1.921 0 O-C-N 121.485 -0.76 . . . . 0.0 109.604 178.471 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 41' ' ' LEU . . . . . 0.487 HD13 ' CAK' ' A' ' 91' ' ' SXK . 6.4 tp -62.46 -39.83 94.67 Favored 'General case' 0 N--CA 1.497 1.877 0 O-C-N 121.412 -0.805 . . . . 0.0 110.412 179.574 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 42' ' ' GLY . . . . . 0.507 ' HA2' ' HB2' ' A' ' 45' ' ' MET . . . -53.92 -36.18 55.17 Favored Glycine 0 N--CA 1.495 2.616 0 N-CA-C 110.831 -0.908 . . . . 0.0 110.831 -179.049 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 43' ' ' LYS . . . . . . . . . . . . . 1.6 mtmt -55.21 -34.13 63.65 Favored 'General case' 0 N--CA 1.502 2.145 0 O-C-N 121.381 -1.07 . . . . 0.0 110.561 179.711 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 44' ' ' VAL . . . . . 0.585 HG11 ' CZ ' ' A' ' 27' ' ' PHE . 42.1 t -93.07 -36.72 7.74 Favored 'Isoleucine or valine' 0 N--CA 1.498 1.936 0 O-C-N 121.334 -0.854 . . . . 0.0 109.6 178.921 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 45' ' ' MET . . . . . 0.507 ' HB2' ' HA2' ' A' ' 42' ' ' GLY . 0.3 OUTLIER -58.29 -38.08 76.3 Favored 'General case' 0 N--CA 1.5 2.036 0 O-C-N 121.47 -0.769 . . . . 0.0 110.777 179.646 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild full ' A' A ' 46' ' ' ARG . . . . . 0.47 ' HA ' ' C ' ' A' ' 50' ' ' GLN . 16.6 ptt180 -63.44 -23.68 67.5 Favored 'General case' 0 N--CA 1.499 2.012 0 O-C-N 121.304 -0.872 . . . . 0.0 110.911 179.97 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 47' ' ' MET . . . . . . . . . . . . . 7.1 ttp -82.14 1.18 37.41 Favored 'General case' 0 N--CA 1.495 1.798 0 O-C-N 121.397 -0.815 . . . . 0.0 110.731 179.389 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 48' ' ' LEU . . . . . . . . . . . . . 45.1 mt -131.16 -50.7 1.02 Allowed 'General case' 0 N--CA 1.496 1.83 0 O-C-N 121.078 -1.014 . . . . 0.0 111.052 -179.82 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 49' ' ' GLY . . . . . 0.508 ' O ' ' HB2' ' A' ' 50' ' ' GLN . . . -125.52 38.04 2.37 Favored Glycine 0 N--CA 1.498 2.772 0 C-N-CA 119.866 -1.159 . . . . 0.0 110.987 -179.14 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 50' ' ' GLN . . . . . 0.508 ' HB2' ' O ' ' A' ' 49' ' ' GLY . 10.9 mt-30 67.12 -50.06 0.48 Allowed 'General case' 0 N--CA 1.512 2.636 0 CA-C-N 117.913 0.857 . . . . 0.0 112.498 179.122 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 51' ' ' ASN . . . . . 0.555 ' OD1' HD11 ' A' ' 57' ' ' LEU . 8.3 t30 64.94 101.24 0.04 OUTLIER Pre-proline 0 N--CA 1.504 2.258 0 O-C-N 121.414 -0.804 . . . . 0.0 110.542 -179.185 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 52' ' ' PRO . . . . . . . . . . . . . 44.3 Cg_endo -74.64 -52.87 0.11 Allowed 'Trans proline' 0 C--N 1.312 -1.352 0 O-C-N 123.938 1.494 . . . . 0.0 111.464 -179.642 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 53' ' ' THR . . . . . 0.703 HG23 ' HB2' ' A' ' 56' ' ' GLU . 0.0 OUTLIER -149.31 153.04 36.96 Favored Pre-proline 0 N--CA 1.5 2.048 0 O-C-N 121.131 -0.981 . . . . 0.0 111.073 -179.63 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild full ' A' A ' 54' ' ' PRO . . . . . 0.473 ' HB3' ' HA ' ' A' ' 39' ' ' LYS . 46.4 Cg_endo -71.75 -36.28 6.55 Favored 'Trans proline' 0 C--N 1.313 -1.331 0 O-C-N 124.205 1.634 . . . . 0.0 110.69 179.563 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 55' ' ' GLU . . . . . 0.458 ' O ' ' HB3' ' A' ' 58' ' ' GLN . 0.7 OUTLIER -65.11 -27.78 68.98 Favored 'General case' 0 N--CA 1.5 2.063 0 O-C-N 121.338 -0.851 . . . . 0.0 110.959 179.931 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild full ' A' A ' 56' ' ' GLU . . . . . 0.703 ' HB2' HG23 ' A' ' 53' ' ' THR . 24.0 tt0 -66.8 -30.12 70.24 Favored 'General case' 0 N--CA 1.498 1.93 0 O-C-N 121.119 -0.988 . . . . 0.0 110.275 179.28 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 57' ' ' LEU . . . . . 0.555 HD11 ' OD1' ' A' ' 51' ' ' ASN . 29.7 mt -80.31 -9.54 59.74 Favored 'General case' 0 N--CA 1.496 1.843 0 O-C-N 121.253 -0.904 . . . . 0.0 111.414 -179.889 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 58' ' ' GLN . . . . . 0.832 ' HA ' HG21 ' A' ' 38' ' ' THR . 0.0 OUTLIER -56.74 -42.11 78.69 Favored 'General case' 0 N--CA 1.5 2.052 0 O-C-N 121.032 -1.042 . . . . 0.0 110.142 -179.819 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild full ' A' A ' 59' ' ' GLU . . . . . . . . . . . . . 7.8 tt0 -59.2 -35.94 74.49 Favored 'General case' 0 N--CA 1.498 1.963 0 O-C-N 121.37 -0.831 . . . . 0.0 110.035 179.175 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 60' ' ' MET . . . . . . . . . . . . . 2.5 tpp -59.18 -46.2 89.04 Favored 'General case' 0 N--CA 1.498 1.95 0 O-C-N 121.584 -0.698 . . . . 0.0 109.989 179.304 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 61' ' ' ILE . . . . . 0.469 HG23 HG23 ' A' ' 72' ' ' VAL . 1.9 mt -72.65 -41.1 62.81 Favored 'Isoleucine or valine' 0 N--CA 1.497 1.884 0 O-C-N 121.352 -0.843 . . . . 0.0 109.716 179.276 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 62' ' ' ASP . . . . . . . . . . . . . 75.1 m-20 -53.62 -31.11 45.83 Favored 'General case' 0 N--CA 1.501 2.098 0 O-C-N 121.476 -0.765 . . . . 0.0 110.956 179.566 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 63' ' ' GLU . . . . . . . . . . . . . 0.3 OUTLIER -68.27 -25.54 65.22 Favored 'General case' 0 N--CA 1.5 2.028 0 O-C-N 121.359 -0.838 . . . . 0.0 111.254 179.958 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 64' ' ' VAL . . . . . 0.463 HG22 ' NH1' ' A' ' 83' ' ' ARG . 20.1 t -121.76 6.34 5.89 Favored 'Isoleucine or valine' 0 N--CA 1.501 2.098 0 O-C-N 121.162 -0.962 . . . . 0.0 111.436 -179.328 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 65' ' ' ASP . . . . . . . . . . . . . 5.6 t70 -98.35 73.94 2.16 Favored 'General case' 0 N--CA 1.496 1.833 0 O-C-N 120.706 -1.246 . . . . 0.0 110.459 179.87 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 66' ' ' GLU . . . . . . . . . . . . . 4.6 mp0 -88.56 55.91 3.58 Favored 'General case' 0 N--CA 1.496 1.832 0 O-C-N 121.239 -0.913 . . . . 0.0 108.978 179.23 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 67' ' ' ASP . . . . . . . . . . . . . 2.1 t70 -126.58 -59.33 1.29 Allowed 'General case' 0 N--CA 1.493 1.71 0 O-C-N 121.6 -0.688 . . . . 0.0 110.944 -178.759 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 68' ' ' GLY . . . . . . . . . . . . . . . 143.09 -40.18 1.26 Allowed Glycine 0 N--CA 1.494 2.518 0 N-CA-C 109.715 -1.354 . . . . 0.0 109.715 -179.434 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 69' ' ' SER . . . . . . . . . . . . . 59.6 p -63.89 -29.0 70.22 Favored 'General case' 0 N--CA 1.5 2.031 0 O-C-N 121.404 -1.057 . . . . 0.0 111.206 -179.9 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 70' ' ' GLY . . . . . . . . . . . . . . . 86.72 -12.91 60.14 Favored Glycine 0 N--CA 1.497 2.717 0 C-N-CA 119.875 -1.155 . . . . 0.0 110.569 -179.806 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 71' ' ' THR . . . . . . . . . . . . . 3.5 m -101.09 138.0 38.71 Favored 'General case' 0 N--CA 1.497 1.91 0 O-C-N 121.028 -1.278 . . . . 0.0 109.681 179.694 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 72' ' ' VAL . . . . . 0.469 HG23 HG23 ' A' ' 61' ' ' ILE . 8.1 t -82.36 125.63 39.88 Favored 'Isoleucine or valine' 0 N--CA 1.496 1.861 0 O-C-N 121.704 -0.622 . . . . 0.0 110.793 -179.634 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 73' ' ' ASP . . . . . . . . . . . . . 0.8 OUTLIER -99.75 -163.17 1.01 Allowed 'General case' 0 N--CA 1.494 1.757 0 O-C-N 121.41 -0.806 . . . . 0.0 109.564 179.206 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 74' ' ' PHE . . . . . 0.754 ' CE2' HD11 ' A' ' 78' ' ' LEU . 65.4 t80 -63.16 -45.78 90.23 Favored 'General case' 0 N--CA 1.5 2.039 0 O-C-N 121.161 -0.962 . . . . 0.0 110.361 179.827 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 75' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -62.22 -51.72 66.65 Favored 'General case' 0 N--CA 1.499 1.979 0 O-C-N 121.373 -0.83 . . . . 0.0 110.616 179.897 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 76' ' ' GLU . . . . . . . . . . . . . 55.5 mt-10 -64.88 -23.22 67.17 Favored 'General case' 0 N--CA 1.501 2.076 0 O-C-N 121.326 -0.859 . . . . 0.0 110.085 179.449 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 77' ' ' PHE . . . . . . . . . . . . . 88.4 t80 -79.34 -35.31 41.22 Favored 'General case' 0 N--CA 1.496 1.868 0 O-C-N 121.3 -0.875 . . . . 0.0 109.677 178.872 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 78' ' ' LEU . . . . . 0.754 HD11 ' CE2' ' A' ' 74' ' ' PHE . 65.5 mt -62.41 -50.42 71.58 Favored 'General case' 0 N--CA 1.498 1.944 0 O-C-N 121.412 -0.805 . . . . 0.0 109.984 179.454 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 79' ' ' VAL . . . . . . . . . . . . . 7.4 p -62.74 -31.91 53.86 Favored 'Isoleucine or valine' 0 N--CA 1.5 2.065 0 O-C-N 121.369 -0.832 . . . . 0.0 109.797 179.066 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 80' ' ' MET . . . . . . . . . . . . . 5.2 ttp -65.71 -38.94 90.58 Favored 'General case' 0 N--CA 1.496 1.839 0 O-C-N 121.255 -0.903 . . . . 0.0 109.47 178.633 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 81' ' ' MET . . . . . . . . . . . . . 7.6 mmt -62.08 -41.62 98.36 Favored 'General case' 0 N--CA 1.497 1.881 0 O-C-N 121.501 -0.749 . . . . 0.0 110.036 179.261 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 82' ' ' VAL . . . . . . . . . . . . . 30.6 t -61.41 -35.85 69.21 Favored 'Isoleucine or valine' 0 N--CA 1.5 2.04 0 O-C-N 121.245 -0.909 . . . . 0.0 109.21 178.79 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 83' ' ' ARG . . . . . 0.463 ' NH1' HG22 ' A' ' 64' ' ' VAL . 8.5 mtt180 -68.18 -26.1 65.57 Favored 'General case' 0 N--CA 1.498 1.938 0 O-C-N 121.422 -0.799 . . . . 0.0 109.761 178.496 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 84' ' ' CYS . . . . . 0.515 ' HB3' ' HA ' ' B' ' 149' ' ' SER . 73.2 m -85.25 11.6 9.69 Favored 'General case' 0 N--CA 1.499 2.009 0 O-C-N 121.364 -0.835 . . . . 0.0 111.097 179.468 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 85' ' ' MET . . . . . . . . . . . . . 2.6 tpp -88.82 8.08 30.86 Favored 'General case' 0 N--CA 1.499 2.008 0 O-C-N 121.043 -1.036 . . . . 0.0 111.071 179.782 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 86' ' ' LYS . . . . . . . . . . . . . 1.0 OUTLIER 70.4 -65.73 0.31 Allowed 'General case' 0 N--CA 1.504 2.272 0 O-C-N 121.558 -0.714 . . . . 0.0 111.72 179.708 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 87' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER -137.6 -159.41 0.95 Allowed 'General case' 0 N--CA 1.5 2.037 0 O-C-N 121.032 -1.043 . . . . 0.0 111.031 -179.348 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 88' ' ' ASP . . . . . . . . . . . . . 8.7 t70 70.32 -69.41 0.18 Allowed 'General case' 0 N--CA 1.504 2.267 0 O-C-N 121.976 -0.453 . . . . 0.0 111.387 179.993 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 89' ' ' SER . . . . . . . . . . . . . 25.4 p . . . . . 0 N--CA 1.499 1.986 0 O-C-N 121.196 -0.94 . . . . 0.0 111.154 -179.75 . . . . . . . . 0 0 . 1 . 020 nuclear nobuild full ' B' B ' 144' ' ' ARG . . . . . 0.474 ' O ' ' HB3' ' B' ' 145' ' ' ARG . 2.3 tpt85 . . . . . 0 N--CA 1.499 1.991 0 CA-C-O 120.69 0.281 . . . . 0.0 110.4 . . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' B' B ' 145' ' ' ARG . . . . . 0.474 ' HB3' ' O ' ' B' ' 144' ' ' ARG . 3.0 ttt-85 70.09 150.26 0.09 Allowed 'General case' 0 N--CA 1.504 2.262 0 CA-C-O 121.412 0.625 . . . . 0.0 110.686 -179.688 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' B' B ' 146' ' ' VAL . . . . . 1.081 HG12 HD13 ' B' ' 148' ' ' ILE . 22.8 t -91.85 -47.94 13.93 Favored 'Isoleucine or valine' 0 N--CA 1.499 1.996 0 O-C-N 121.448 -0.782 . . . . 0.0 109.951 -179.667 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' B' B ' 147' ' ' ARG . . . . . 0.496 ' HB2' ' O ' ' B' ' 146' ' ' VAL . 33.5 mtm-85 64.85 -82.34 0.03 OUTLIER 'General case' 0 N--CA 1.503 2.216 0 O-C-N 121.995 -0.44 . . . . 0.0 112.088 179.249 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' B' B ' 148' ' ' ILE . . . . . 1.081 HD13 HG12 ' B' ' 146' ' ' VAL . 0.9 OUTLIER 56.62 90.71 0.04 OUTLIER 'Isoleucine or valine' 0 N--CA 1.505 2.28 0 CA-C-O 122.23 1.014 . . . . 0.0 109.158 -178.61 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild full ' B' B ' 149' ' ' SER . . . . . 0.515 ' HA ' ' HB3' ' A' ' 84' ' ' CYS . 74.0 p -93.69 164.11 13.27 Favored 'General case' 0 N--CA 1.495 1.789 0 O-C-N 121.1 -1.0 . . . . 0.0 111.068 -178.743 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' B' B ' 150' ' ' ALA . . . . . . . . . . . . . . . -65.49 -49.4 69.18 Favored 'General case' 0 N--CA 1.494 1.772 0 O-C-N 121.704 -0.623 . . . . 0.0 110.766 -179.831 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' B' B ' 151' ' ' ASP . . . . . . . . . . . . . 5.7 p-10 -54.95 -38.84 68.24 Favored 'General case' 0 N--CA 1.502 2.17 0 O-C-N 121.539 -0.726 . . . . 0.0 110.885 179.932 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' B' B ' 152' ' ' ALA . . . . . . . . . . . . . . . -74.64 -44.21 51.56 Favored 'General case' 0 N--CA 1.496 1.851 0 O-C-N 121.296 -0.878 . . . . 0.0 110.43 179.678 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' B' B ' 153' ' ' MET . . . . . . . . . . . . . 2.1 mmt -67.67 -31.73 71.91 Favored 'General case' 0 N--CA 1.498 1.962 0 O-C-N 121.267 -0.896 . . . . 0.0 110.65 179.841 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' B' B ' 154' ' ' MET . . . . . . . . . . . . . 4.4 ttm -57.61 -44.0 85.13 Favored 'General case' 0 N--CA 1.5 2.049 0 O-C-N 121.361 -0.837 . . . . 0.0 110.501 179.876 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' B' B ' 155' ' ' GLN . . . . . . . . . . . . . 1.3 tm0? -66.11 -37.19 85.12 Favored 'General case' 0 N--CA 1.5 2.06 0 O-C-N 121.384 -0.822 . . . . 0.0 110.354 179.631 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' B' B ' 156' ' ' ALA . . . . . . . . . . . . . . . -76.74 -34.29 58.09 Favored 'General case' 0 N--CA 1.499 2.022 0 O-C-N 121.478 -0.764 . . . . 0.0 111.178 -179.753 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' B' B ' 157' ' ' LEU . . . . . 0.543 HD12 ' HB ' ' A' ' 26' ' ' ILE . 3.1 mm? -85.22 -49.68 8.0 Favored 'General case' 0 N--CA 1.5 2.044 0 O-C-N 121.186 -0.946 . . . . 0.0 110.522 -179.565 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' B' B ' 158' ' ' LEU . . . . . . . . . . . . . 3.7 mp -95.88 62.68 2.28 Favored 'General case' 0 N--CA 1.496 1.865 0 O-C-N 121.275 -0.89 . . . . 0.0 110.01 179.967 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' B' B ' 159' ' ' GLY . . . . . . . . . . . . . . . -171.9 -159.79 19.0 Favored Glycine 0 N--CA 1.495 2.589 0 N-CA-C 109.71 -1.356 . . . . 0.0 109.71 -179.988 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' B' B ' 160' ' ' ALA . . . . . . . . . . . . . . . 54.25 -91.35 0.03 OUTLIER 'General case' 0 N--CA 1.503 2.221 0 O-C-N 121.782 -0.834 . . . . 0.0 110.984 -179.903 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' B' B ' 161' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -137.21 31.71 2.64 Favored 'General case' 0 N--CA 1.497 1.89 0 O-C-N 121.052 -1.03 . . . . 0.0 110.553 179.741 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' B' B ' 162' ' ' ALA . . . . . . . . . . . . . . . -155.94 159.35 39.18 Favored 'General case' 0 N--CA 1.497 1.917 0 O-C-N 121.183 -0.948 . . . . 0.0 110.776 -179.846 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' B' B ' 163' ' ' LYS . . . . . . . . . . . . . 0.6 OUTLIER . . . . . 0 N--CA 1.497 1.89 0 CA-C-O 118.238 -0.887 . . . . 0.0 110.394 -179.972 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 90' ' ' ' CA' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 020 nuclear nobuild full ' A' A ' 91' ' ' SXK . . . . . 0.487 ' CAK' HD13 ' A' ' 41' ' ' LEU . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 stop_ save_