data_2kob_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 2kob _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 ' 63' ' ' SER . . . . . 0.594 ' HA ' ' HA ' ' A' ' 103' ' ' SER . 29.4 p . . . . . 0 N--CA 1.449 -0.492 0 CA-C-O 120.908 0.385 . . . . 0.0 110.518 . . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 64' ' ' PHE . . . . . 0.487 ' HB2' HD12 ' A' ' 107' ' ' ILE . 83.2 t80 -62.32 -35.62 79.62 Favored 'General case' 0 C--N 1.327 -0.372 0 N-CA-C 109.852 -0.425 . . . . 0.0 109.852 179.174 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 65' ' ' GLY . . . . . . . . . . . . . . . -60.92 -37.57 94.0 Favored Glycine 0 N--CA 1.449 -0.483 0 CA-C-N 115.904 -0.589 . . . . 0.0 112.329 176.964 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 66' ' ' ASP . . . . . . . . . . . . . 9.4 t70 -59.84 -54.39 46.77 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-O 120.894 0.378 . . . . 0.0 110.603 178.063 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 67' ' ' TRP . . . . . . . . . . . . . 87.5 m95 -72.44 -31.38 65.42 Favored 'General case' 0 C--N 1.325 -0.464 0 CA-C-N 115.941 -0.572 . . . . 0.0 111.94 -176.953 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 68' ' ' ALA . . . . . 0.504 ' O ' HD11 ' A' ' 72' ' ' LEU . . . -64.03 -44.87 91.24 Favored 'General case' 0 C--N 1.327 -0.408 0 CA-C-O 120.872 0.368 . . . . 0.0 110.325 176.336 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 69' ' ' GLU . . . . . . . . . . . . . 15.7 tm-20 -62.47 -38.68 90.77 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 115.981 -0.554 . . . . 0.0 110.05 178.916 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 70' ' ' LYS . . . . . . . . . . . . . 90.0 mttt -68.07 -38.49 82.46 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.244 -0.434 . . . . 0.0 111.055 177.399 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 71' ' ' PHE . . . . . . . . . . . . . 87.8 t80 -64.04 -44.15 93.36 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-O 120.958 0.408 . . . . 0.0 110.355 176.786 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 72' ' ' LEU . . . . . 0.513 ' HG ' ' HG2' ' A' ' 89' ' ' LYS . 3.9 mp -56.6 -51.55 68.24 Favored 'General case' 0 C--N 1.327 -0.387 0 CA-C-N 115.735 -0.666 . . . . 0.0 110.421 175.866 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 73' ' ' LYS . . . . . . . . . . . . . 39.9 ttmt -63.01 -37.8 88.63 Favored 'General case' 0 C--N 1.326 -0.423 0 CA-C-N 115.968 -0.56 . . . . 0.0 110.635 179.229 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 74' ' ' SER . . . . . . . . . . . . . 31.4 t -57.68 -51.87 67.75 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.144 -0.48 . . . . 0.0 110.949 177.819 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 75' ' ' LYS . . . . . 0.532 ' HA ' ' HB2' ' A' ' 78' ' ' ASP . 25.9 mmtm -69.84 -30.21 67.65 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-O 120.862 0.363 . . . . 0.0 111.119 -178.044 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 76' ' ' GLU . . . . . . . . . . . . . 35.5 tt0 -64.68 -38.55 91.37 Favored 'General case' 0 C--N 1.323 -0.561 0 CA-C-N 116.105 -0.498 . . . . 0.0 110.195 175.332 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 77' ' ' ALA . . . . . . . . . . . . . . . -80.15 -23.72 40.91 Favored 'General case' 0 C--N 1.325 -0.461 0 CA-C-N 115.83 -0.623 . . . . 0.0 111.158 176.058 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 78' ' ' ASP . . . . . 0.532 ' HB2' ' HA ' ' A' ' 75' ' ' LYS . 11.2 m-20 -67.6 -33.38 74.87 Favored 'General case' 0 CA--C 1.517 -0.294 0 CA-C-N 116.443 -0.344 . . . . 0.0 110.795 177.43 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 79' ' ' GLY . . . . . . . . . . . . . . . 105.7 41.2 1.89 Allowed Glycine 0 N--CA 1.446 -0.669 0 C-N-CA 120.557 -0.83 . . . . 0.0 112.934 176.208 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 80' ' ' VAL . . . . . . . . . . . . . 30.0 m -87.26 158.25 3.15 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.567 0 N-CA-C 109.674 -0.491 . . . . 0.0 109.674 174.549 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 81' ' ' SER . . . . . . . . . . . . . 61.1 m -61.43 146.16 49.33 Favored 'General case' 0 C--N 1.323 -0.561 0 CA-C-N 116.581 -0.282 . . . . 0.0 110.546 177.636 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 82' ' ' VAL . . . . . . . . . . . . . 60.3 t -57.05 -43.17 80.7 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.378 0 CA-C-N 116.384 -0.371 . . . . 0.0 111.03 -178.345 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 83' ' ' SER . . . . . . . . . . . . . 27.9 m -59.65 -39.11 83.3 Favored 'General case' 0 C--N 1.326 -0.441 0 CA-C-N 116.374 -0.375 . . . . 0.0 110.545 176.889 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 84' ' ' GLN . . . . . . . . . . . . . 6.7 tp-100 -69.15 -44.24 72.69 Favored 'General case' 0 C--N 1.326 -0.423 0 CA-C-N 115.964 -0.562 . . . . 0.0 110.091 179.154 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 85' ' ' LEU . . . . . 0.517 ' O ' ' HG3' ' A' ' 89' ' ' LYS . 2.4 tm? -62.64 -43.76 97.98 Favored 'General case' 0 C--N 1.326 -0.438 0 CA-C-N 115.849 -0.614 . . . . 0.0 109.933 178.953 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 86' ' ' ASN . . . . . . . . . . . . . 77.4 m-20 -64.18 -26.94 68.74 Favored 'General case' 0 C--N 1.332 -0.182 0 CA-C-N 116.116 -0.493 . . . . 0.0 111.259 177.564 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 87' ' ' SER . . . . . . . . . . . . . 60.5 m -64.92 -47.27 78.3 Favored 'General case' 0 C--N 1.33 -0.263 0 N-CA-C 109.896 -0.409 . . . . 0.0 109.896 176.403 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 88' ' ' TYR . . . . . . . . . . . . . 44.2 m-85 -58.7 -45.92 88.46 Favored 'General case' 0 C--O 1.232 0.168 0 CA-C-N 116.252 -0.431 . . . . 0.0 110.215 177.298 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 89' ' ' LYS . . . . . 0.517 ' HG3' ' O ' ' A' ' 85' ' ' LEU . 46.5 mtpt -58.71 -44.05 90.27 Favored 'General case' 0 C--N 1.332 -0.19 0 CA-C-N 115.747 -0.661 . . . . 0.0 110.549 179.85 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 90' ' ' ASN . . . . . . . . . . . . . 8.8 t30 -63.66 -39.41 94.26 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 116.196 -0.456 . . . . 0.0 110.832 -179.532 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 91' ' ' TYR . . . . . . . . . . . . . 18.4 m-85 -60.59 -48.65 80.83 Favored 'General case' 0 C--N 1.331 -0.215 0 CA-C-N 116.615 -0.266 . . . . 0.0 111.054 179.895 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 92' ' ' CYS . . . . . 0.589 ' HA ' ' HB2' ' A' ' 96' ' ' LEU . 24.2 p -76.42 -27.47 56.28 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-O 120.711 0.291 . . . . 0.0 111.748 -176.465 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 93' ' ' ARG . . . . . . . . . . . . . 56.0 ttp180 -81.84 -42.9 18.98 Favored 'General case' 0 C--N 1.327 -0.406 0 CA-C-O 120.772 0.32 . . . . 0.0 111.833 -175.914 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 94' ' ' ASN . . . . . . . . . . . . . 13.5 m120 -95.46 -57.27 2.44 Favored 'General case' 0 C--N 1.325 -0.485 0 CA-C-N 116.305 -0.407 . . . . 0.0 111.909 -173.644 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 95' ' ' HIS . . . . . . . . . . . . . 36.6 m80 -78.59 -48.58 14.88 Favored 'General case' 0 C--N 1.327 -0.4 0 CA-C-O 120.849 0.357 . . . . 0.0 111.249 -174.355 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 96' ' ' LEU . . . . . 0.589 ' HB2' ' HA ' ' A' ' 92' ' ' CYS . 66.3 mt -88.82 21.98 2.85 Favored 'General case' 0 C--N 1.324 -0.536 0 CA-C-N 116.342 -0.39 . . . . 0.0 110.253 -179.504 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 97' ' ' SER . . . . . 0.542 ' N ' ' HD2' ' A' ' 98' ' ' PRO . 4.3 t -55.3 -48.26 96.64 Favored Pre-proline 0 CA--C 1.541 0.607 0 CA-C-N 115.881 -0.599 . . . . 0.0 111.477 -178.822 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 98' ' ' PRO . . . . . 0.542 ' HD2' ' N ' ' A' ' 97' ' ' SER . 17.3 Cg_endo -58.97 -33.0 98.57 Favored 'Trans proline' 0 C--N 1.358 1.054 0 C-N-CA 121.988 1.792 . . . . 0.0 112.264 176.314 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 99' ' ' LEU . . . . . 0.505 HD12 HD11 ' A' ' 115' ' ' ILE . 2.5 mp -78.51 -33.57 47.96 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 116.512 -0.313 . . . . 0.0 111.015 -179.129 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 100' ' ' TYR . . . . . . . . . . . . . 19.1 t80 -59.27 -28.07 66.4 Favored 'General case' 0 C--N 1.327 -0.374 0 CA-C-N 115.972 -0.558 . . . . 0.0 111.295 -176.325 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 101' ' ' MET . . . . . . . . . . . . . 27.0 ptt? -95.23 -0.68 52.82 Favored 'General case' 0 C--N 1.327 -0.374 0 CA-C-N 116.161 -0.472 . . . . 0.0 111.379 -179.329 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 102' ' ' LYS . . . . . 0.538 ' HG3' ' O ' ' A' ' 98' ' ' PRO . 91.5 mttt -101.69 162.6 12.78 Favored 'General case' 0 C--N 1.326 -0.45 0 CA-C-O 121.004 0.431 . . . . 0.0 110.562 -178.838 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 103' ' ' SER . . . . . 0.594 ' HA ' ' HA ' ' A' ' 63' ' ' SER . 39.4 t -91.27 158.72 16.41 Favored 'General case' 0 C--N 1.319 -0.722 0 N-CA-C 108.969 -0.752 . . . . 0.0 108.969 172.68 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 104' ' ' LEU . . . . . . . . . . . . . 93.5 mt -56.83 -35.26 68.6 Favored 'General case' 0 C--N 1.325 -0.465 0 CA-C-O 120.824 0.345 . . . . 0.0 111.269 -177.877 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 105' ' ' SER . . . . . . . . . . . . . 25.5 p -77.41 -16.58 58.76 Favored 'General case' 0 C--N 1.324 -0.513 0 CA-C-O 120.968 0.413 . . . . 0.0 111.144 -178.994 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 106' ' ' GLU . . . . . 0.534 ' OE1' ' HB3' ' A' ' 103' ' ' SER . 1.0 OUTLIER -97.08 2.73 51.64 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.119 -0.491 . . . . 0.0 110.875 -178.945 . . . . . . . . 3 3 . 1 . 001 nuclear orig core ' A' A ' 107' ' ' ILE . . . . . 0.491 HG13 ' O ' ' A' ' 103' ' ' SER . 86.2 mt -96.28 128.92 47.05 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.538 0 CA-C-O 121.101 0.477 . . . . 0.0 110.658 179.749 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 108' ' ' LEU . . . . . 0.674 ' HB2' ' HB2' ' A' ' 111' ' ' ASP . 2.5 mm? -103.48 144.44 28.65 Favored Pre-proline 0 C--N 1.32 -0.682 0 CA-C-N 115.574 -0.739 . . . . 0.0 110.157 -177.937 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 109' ' ' PRO . . . . . . . . . . . . . 32.0 Cg_exo -59.35 -40.73 65.19 Favored 'Trans proline' 0 C--O 1.233 0.26 0 C-N-CA 122.429 2.086 . . . . 0.0 112.035 177.365 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 110' ' ' ALA . . . . . . . . . . . . . . . -75.92 -19.83 58.48 Favored 'General case' 0 C--N 1.332 -0.188 0 CA-C-N 116.295 -0.412 . . . . 0.0 110.794 179.247 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 111' ' ' ASP . . . . . 0.674 ' HB2' ' HB2' ' A' ' 108' ' ' LEU . 33.8 t70 -71.06 -40.83 71.42 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-O 121.299 0.571 . . . . 0.0 109.753 178.769 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 112' ' ' ILE . . . . . 0.498 HG12 HD23 ' A' ' 99' ' ' LEU . 47.9 mt -66.12 -39.34 84.14 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.41 0 CA-C-N 115.71 -0.677 . . . . 0.0 109.759 174.859 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 113' ' ' GLN . . . . . . . . . . . . . 29.6 tp60 -60.83 -31.11 70.54 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 115.388 -0.824 . . . . 0.0 110.095 176.611 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 114' ' ' SER . . . . . . . . . . . . . 22.9 t -67.82 -40.64 83.78 Favored 'General case' 0 C--N 1.33 -0.246 0 CA-C-N 115.866 -0.606 . . . . 0.0 110.29 178.35 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 115' ' ' ILE . . . . . 0.505 HD11 HD12 ' A' ' 99' ' ' LEU . 74.8 mt -59.5 -39.12 78.47 Favored 'Isoleucine or valine' 0 C--O 1.233 0.231 0 CA-C-O 121.012 0.434 . . . . 0.0 110.565 177.105 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 116' ' ' ILE . . . . . . . . . . . . . 47.6 mm -66.44 -31.81 55.24 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.455 0 CA-C-N 115.866 -0.606 . . . . 0.0 110.594 178.143 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 117' ' ' ASN . . . . . . . . . . . . . 8.2 t30 -70.09 -38.08 75.57 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-O 121.069 0.462 . . . . 0.0 110.7 178.269 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 118' ' ' GLU . . . . . . . . . . . . . 39.4 mm-40 -80.14 -30.27 38.97 Favored 'General case' 0 C--N 1.325 -0.494 0 CA-C-N 116.092 -0.503 . . . . 0.0 111.219 -177.677 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 119' ' ' THR . . . . . . . . . . . . . 51.4 m -79.67 110.87 15.42 Favored 'General case' 0 C--N 1.322 -0.591 0 CA-C-O 121.271 0.558 . . . . 0.0 109.851 176.117 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 120' ' ' LYS . . . . . . . . . . . . . 47.4 mttp -111.28 76.83 1.0 Allowed 'General case' 0 C--N 1.317 -0.806 0 CA-C-O 121.46 0.648 . . . . 0.0 110.268 -177.182 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 121' ' ' LEU . . . . . . . . . . . . . 97.9 mt -129.3 -174.88 3.4 Favored 'General case' 0 C--N 1.323 -0.576 0 CA-C-N 114.996 -1.002 . . . . 0.0 109.86 -178.666 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 122' ' ' ALA . . . . . . . . . . . . . . . -62.35 158.2 18.04 Favored 'General case' 0 C--N 1.327 -0.388 0 CA-C-O 120.997 0.427 . . . . 0.0 111.925 -179.001 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 123' ' ' LYS . . . . . . . . . . . . . 93.7 mttt -54.29 -49.6 69.27 Favored 'General case' 0 N--CA 1.464 0.252 0 CA-C-N 115.62 -0.718 . . . . 0.0 111.418 -177.823 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 124' ' ' ASN . . . . . . . . . . . . . 27.8 t-20 -55.13 -40.8 70.96 Favored 'General case' 0 C--N 1.331 -0.234 0 CA-C-N 115.607 -0.724 . . . . 0.0 111.265 -179.038 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 125' ' ' THR . . . . . 0.495 ' O ' HG13 ' A' ' 129' ' ' ILE . 6.5 m -69.13 -44.26 72.71 Favored 'General case' 0 C--N 1.327 -0.393 0 CA-C-N 116.075 -0.512 . . . . 0.0 110.717 -178.447 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 126' ' ' LEU . . . . . . . . . . . . . 87.2 mt -60.26 -45.42 93.36 Favored 'General case' 0 C--O 1.234 0.278 0 CA-C-N 116.26 -0.427 . . . . 0.0 110.907 -179.184 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 127' ' ' LYS . . . . . 0.758 ' HG2' HG13 ' A' ' 156' ' ' ILE . 96.5 mttt -68.28 -36.81 79.95 Favored 'General case' 0 C--N 1.326 -0.44 0 CA-C-N 116.062 -0.517 . . . . 0.0 110.707 179.725 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 128' ' ' ALA . . . . . . . . . . . . . . . -60.34 -41.32 93.35 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.419 -0.355 . . . . 0.0 110.912 179.196 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 129' ' ' ILE . . . . . 0.495 HG13 ' O ' ' A' ' 125' ' ' THR . 80.2 mt -59.87 -49.88 82.21 Favored 'Isoleucine or valine' 0 C--O 1.235 0.301 0 CA-C-N 116.15 -0.477 . . . . 0.0 110.239 177.485 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 130' ' ' ARG . . . . . 0.577 ' NH1' ' HA ' ' A' ' 152' ' ' ASP . 23.3 ttp85 -63.67 -46.11 87.06 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 115.845 -0.616 . . . . 0.0 110.606 -179.216 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 131' ' ' ASN . . . . . . . . . . . . . 92.5 m-20 -58.57 -40.17 82.35 Favored 'General case' 0 N--CA 1.464 0.242 0 CA-C-N 116.302 -0.408 . . . . 0.0 111.086 179.818 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 132' ' ' THR . . . . . 0.425 ' O ' HG13 ' A' ' 136' ' ' ILE . 53.8 m -61.8 -46.61 88.79 Favored 'General case' 0 C--N 1.33 -0.248 0 CA-C-O 120.813 0.34 . . . . 0.0 110.42 177.214 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 133' ' ' ALA . . . . . . . . . . . . . . . -61.15 -44.4 97.38 Favored 'General case' 0 C--N 1.331 -0.233 0 CA-C-N 116.012 -0.54 . . . . 0.0 110.64 178.938 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 134' ' ' SER . . . . . 0.478 ' O ' ' HG3' ' A' ' 138' ' ' ARG . 74.3 m -54.45 -45.9 73.2 Favored 'General case' 0 C--N 1.331 -0.227 0 CA-C-N 116.236 -0.438 . . . . 0.0 111.197 178.665 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 135' ' ' GLN . . . . . . . . . . . . . 75.2 mt-30 -64.9 -38.55 91.35 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-O 120.603 0.24 . . . . 0.0 110.969 -178.855 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 136' ' ' ILE . . . . . 0.425 HG13 ' O ' ' A' ' 132' ' ' THR . 72.4 mt -63.91 -47.01 92.51 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.269 0 CA-C-N 116.485 -0.325 . . . . 0.0 110.704 177.813 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 137' ' ' PHE . . . . . 0.54 ' O ' HG13 ' A' ' 141' ' ' ILE . 46.6 m-85 -63.03 -36.83 84.87 Favored 'General case' 0 C--N 1.331 -0.214 0 CA-C-N 116.303 -0.408 . . . . 0.0 111.004 178.2 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 138' ' ' ARG . . . . . 0.492 ' O ' ' HG3' ' A' ' 142' ' ' GLU . 91.4 mtt180 -61.5 -41.89 97.96 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.742 -0.208 . . . . 0.0 110.819 178.472 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 139' ' ' LEU . . . . . . . . . . . . . 58.2 tp -59.4 -43.02 93.03 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-O 121.147 0.498 . . . . 0.0 110.125 175.213 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 140' ' ' ALA . . . . . . . . . . . . . . . -62.22 -43.64 98.37 Favored 'General case' 0 C--N 1.324 -0.505 0 CA-C-N 115.885 -0.598 . . . . 0.0 110.527 177.201 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 141' ' ' ILE . . . . . 0.54 HG13 ' O ' ' A' ' 137' ' ' PHE . 75.0 mt -61.61 -34.0 59.88 Favored 'Isoleucine or valine' 0 CA--C 1.531 0.238 0 CA-C-N 116.466 -0.334 . . . . 0.0 111.26 176.225 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 142' ' ' GLU . . . . . 0.492 ' HG3' ' O ' ' A' ' 138' ' ' ARG . 43.6 mt-10 -60.37 -41.31 93.48 Favored 'General case' 0 C--N 1.332 -0.17 0 CA-C-O 120.874 0.369 . . . . 0.0 110.692 177.907 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 143' ' ' ASN . . . . . 0.442 ' N ' HD21 ' A' ' 143' ' ' ASN . 0.9 OUTLIER -88.75 -1.58 58.15 Favored 'General case' 0 C--N 1.327 -0.403 0 CA-C-O 121.015 0.436 . . . . 0.0 110.189 176.754 . . . . . . . . 3 3 . 1 . 001 nuclear orig core ' A' A ' 144' ' ' ARG . . . . . . . . . . . . . 69.2 mtt180 65.02 27.78 12.54 Favored 'General case' 0 N--CA 1.462 0.155 0 CA-C-N 115.228 -0.897 . . . . 0.0 111.668 177.515 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 145' ' ' ALA . . . . . . . . . . . . . . . -66.62 -43.89 83.51 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 115.685 -0.689 . . . . 0.0 109.508 174.859 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 146' ' ' ILE . . . . . . . . . . . . . 20.5 tt -120.75 151.73 23.72 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.477 0 N-CA-C 108.586 -0.894 . . . . 0.0 108.586 172.632 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 147' ' ' ASP . . . . . . . . . . . . . 39.0 t70 -96.66 -5.86 37.92 Favored 'General case' 0 C--N 1.322 -0.617 0 N-CA-C 112.326 0.491 . . . . 0.0 112.326 -169.723 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 148' ' ' PHE . . . . . . . . . . . . . 47.6 p90 -154.63 171.19 19.89 Favored 'General case' 0 C--N 1.323 -0.558 0 O-C-N 122.18 -0.325 . . . . 0.0 110.783 -173.934 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 149' ' ' ASN . . . . . . . . . . . . . 42.9 t-20 -118.51 95.39 48.73 Favored Pre-proline 0 C--N 1.327 -0.393 0 CA-C-N 116.292 -0.413 . . . . 0.0 110.299 -179.011 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 150' ' ' PRO . . . . . . . . . . . . . 39.2 Cg_endo -66.61 -22.33 51.02 Favored 'Trans proline' 0 C--N 1.341 0.178 0 C-N-CA 122.817 2.345 . . . . 0.0 112.166 -178.433 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 151' ' ' ALA . . . . . . . . . . . . . . . -70.52 -28.91 65.31 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.227 -0.442 . . . . 0.0 110.564 -179.51 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 152' ' ' ASP . . . . . 0.577 ' HA ' ' NH1' ' A' ' 130' ' ' ARG . 85.6 m-20 -80.01 -10.84 59.8 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-O 121.2 0.524 . . . . 0.0 110.621 179.226 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 153' ' ' TYR . . . . . . . . . . . . . 60.3 t80 -88.9 -16.98 30.55 Favored 'General case' 0 C--N 1.321 -0.661 0 CA-C-N 115.572 -0.74 . . . . 0.0 109.216 174.566 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 154' ' ' VAL . . . . . . . . . . . . . 90.5 t -73.61 130.8 35.67 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.291 0 CA-C-N 115.656 -0.702 . . . . 0.0 109.997 177.535 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 155' ' ' ARG . . . . . . . . . . . . . 71.4 ttt180 -110.7 142.49 42.55 Favored 'General case' 0 C--N 1.318 -0.766 0 N-CA-C 109.523 -0.547 . . . . 0.0 109.523 178.81 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 156' ' ' ILE . . . . . 0.758 HG13 ' HG2' ' A' ' 127' ' ' LYS . 42.3 mm -87.86 116.0 64.81 Favored Pre-proline 0 C--N 1.32 -0.694 0 N-CA-C 109.476 -0.564 . . . . 0.0 109.476 -179.664 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 157' ' ' PRO . . . . . 0.408 ' HD3' ' HA ' ' A' ' 156' ' ' ILE . 24.0 Cg_exo . . . . . 0 N--CA 1.463 -0.269 0 C-N-CA 122.48 2.12 . . . . 0.0 112.144 -176.561 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 63' ' ' SER . . . . . . . . . . . . . 22.9 t . . . . . 0 N--CA 1.447 -0.609 0 N-CA-C 109.001 -0.741 . . . . 0.0 109.001 . . . . . . . . . 0 0 . 1 . 002 nuclear orig core ' A' A ' 64' ' ' PHE . . . . . 0.42 ' HB2' HD13 ' A' ' 107' ' ' ILE . 73.8 t80 -66.18 -32.53 74.03 Favored 'General case' 0 C--N 1.328 -0.332 0 N-CA-C 109.149 -0.686 . . . . 0.0 109.149 177.386 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 65' ' ' GLY . . . . . . . . . . . . . . . -59.76 -40.21 96.32 Favored Glycine 0 N--CA 1.448 -0.508 0 CA-C-N 115.775 -0.648 . . . . 0.0 111.666 175.427 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 66' ' ' ASP . . . . . 0.42 ' O ' ' HB2' ' A' ' 70' ' ' LYS . 9.1 m-20 -61.96 -45.06 95.3 Favored 'General case' 0 CA--C 1.519 -0.239 0 CA-C-O 120.83 0.347 . . . . 0.0 110.628 178.682 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 67' ' ' TRP . . . . . 0.482 ' HA ' ' HB2' ' A' ' 70' ' ' LYS . 90.2 m95 -78.13 -31.92 50.14 Favored 'General case' 0 C--N 1.327 -0.383 0 CA-C-N 116.275 -0.42 . . . . 0.0 111.861 -176.856 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 68' ' ' ALA . . . . . 0.548 ' HB3' ' HB3' ' A' ' 92' ' ' CYS . . . -63.08 -44.2 96.42 Favored 'General case' 0 C--N 1.325 -0.474 0 N-CA-C 109.687 -0.486 . . . . 0.0 109.687 174.955 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 69' ' ' GLU . . . . . . . . . . . . . 3.7 tp10 -68.56 -38.12 80.49 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 115.639 -0.71 . . . . 0.0 109.885 174.9 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 70' ' ' LYS . . . . . 0.482 ' HB2' ' HA ' ' A' ' 67' ' ' TRP . 1.7 tppt? -57.51 -45.52 84.85 Favored 'General case' 0 C--N 1.331 -0.201 0 CA-C-N 115.86 -0.609 . . . . 0.0 110.343 179.303 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 71' ' ' PHE . . . . . . . . . . . . . 70.1 t80 -62.5 -44.45 96.34 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 115.834 -0.621 . . . . 0.0 110.593 179.651 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 72' ' ' LEU . . . . . 0.518 HD23 ' HA ' ' A' ' 89' ' ' LYS . 8.5 mp -60.33 -48.86 79.92 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.076 -0.511 . . . . 0.0 110.56 177.226 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 73' ' ' LYS . . . . . . . . . . . . . 59.1 mtpt -59.77 -38.52 82.05 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 116.284 -0.416 . . . . 0.0 110.943 178.335 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 74' ' ' SER . . . . . 0.408 ' O ' ' HB2' ' A' ' 78' ' ' ASP . 58.5 m -61.61 -45.03 95.83 Favored 'General case' 0 C--N 1.327 -0.371 0 CA-C-N 116.431 -0.349 . . . . 0.0 110.947 179.36 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 75' ' ' LYS . . . . . . . . . . . . . 72.3 mmtt -71.29 -42.93 68.09 Favored 'General case' 0 C--N 1.327 -0.377 0 CA-C-O 120.757 0.313 . . . . 0.0 111.071 178.774 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 76' ' ' GLU . . . . . . . . . . . . . 9.4 tp10 -57.48 -46.08 84.1 Favored 'General case' 0 C--N 1.327 -0.383 0 CA-C-N 115.825 -0.625 . . . . 0.0 110.513 179.205 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 77' ' ' ALA . . . . . . . . . . . . . . . -79.25 -21.97 45.4 Favored 'General case' 0 C--N 1.327 -0.405 0 CA-C-N 116.022 -0.535 . . . . 0.0 111.497 -178.582 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 78' ' ' ASP . . . . . 0.408 ' HB2' ' O ' ' A' ' 74' ' ' SER . 24.3 t70 -68.8 -54.5 15.49 Favored 'General case' 0 C--N 1.327 -0.378 0 CA-C-O 121.051 0.453 . . . . 0.0 110.28 179.907 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 79' ' ' GLY . . . . . . . . . . . . . . . 137.61 65.22 0.05 OUTLIER Glycine 0 N--CA 1.445 -0.76 0 CA-C-N 115.688 -0.687 . . . . 0.0 112.194 179.482 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 80' ' ' VAL . . . . . . . . . . . . . 35.0 m -119.0 160.01 19.17 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.523 0 N-CA-C 109.882 -0.414 . . . . 0.0 109.882 176.03 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 81' ' ' SER . . . . . . . . . . . . . 8.7 t -72.35 159.56 33.81 Favored 'General case' 0 C--N 1.322 -0.591 0 N-CA-C 110.08 -0.341 . . . . 0.0 110.08 179.693 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 82' ' ' VAL . . . . . . . . . . . . . 48.2 t -59.91 -46.07 94.37 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.322 0 CA-C-O 120.785 0.326 . . . . 0.0 110.699 -177.793 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 83' ' ' SER . . . . . . . . . . . . . 52.7 p -57.09 -40.83 77.72 Favored 'General case' 0 C--N 1.326 -0.414 0 CA-C-N 115.961 -0.563 . . . . 0.0 110.591 178.252 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 84' ' ' GLN . . . . . . . . . . . . . 6.6 tp-100 -65.5 -45.72 82.51 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 115.644 -0.707 . . . . 0.0 110.336 -179.382 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 85' ' ' LEU . . . . . 0.423 HD22 ' O ' ' A' ' 72' ' ' LEU . 1.3 tm? -64.28 -42.36 96.47 Favored 'General case' 0 C--N 1.325 -0.458 0 CA-C-N 116.059 -0.519 . . . . 0.0 109.618 178.767 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 86' ' ' ASN . . . . . . . . . . . . . 5.8 m-20 -66.82 -21.83 66.02 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.259 -0.428 . . . . 0.0 111.426 178.407 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 87' ' ' SER . . . . . . . . . . . . . 50.5 m -67.08 -48.54 67.91 Favored 'General case' 0 C--N 1.326 -0.445 0 N-CA-C 109.466 -0.568 . . . . 0.0 109.466 174.222 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 88' ' ' TYR . . . . . 0.416 ' HA ' ' CD2' ' A' ' 91' ' ' TYR . 47.8 m-85 -66.06 -35.78 81.46 Favored 'General case' 0 C--N 1.334 -0.107 0 CA-C-O 121.324 0.583 . . . . 0.0 109.832 176.689 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 89' ' ' LYS . . . . . 0.518 ' HA ' HD23 ' A' ' 72' ' ' LEU . 34.5 ttmt -60.14 -43.68 95.51 Favored 'General case' 0 C--N 1.325 -0.492 0 CA-C-N 115.208 -0.906 . . . . 0.0 110.389 177.862 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 90' ' ' ASN . . . . . 0.439 ' O ' ' HB2' ' A' ' 94' ' ' ASN . 36.1 t30 -63.46 -33.39 75.46 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 115.929 -0.578 . . . . 0.0 110.749 177.829 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 91' ' ' TYR . . . . . 0.416 ' CD2' ' HA ' ' A' ' 88' ' ' TYR . 23.2 m-85 -69.88 -59.76 2.72 Favored 'General case' 0 C--N 1.324 -0.52 0 CA-C-N 116.462 -0.335 . . . . 0.0 110.36 177.395 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 92' ' ' CYS . . . . . 0.548 ' HB3' ' HB3' ' A' ' 68' ' ' ALA . 82.0 m -66.53 -47.68 72.14 Favored 'General case' 0 C--N 1.326 -0.423 0 N-CA-C 112.778 0.658 . . . . 0.0 112.778 -173.086 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 93' ' ' ARG . . . . . 0.403 HH11 ' HD3' ' A' ' 93' ' ' ARG . 10.4 mmm180 -77.17 -49.12 15.89 Favored 'General case' 0 C--N 1.326 -0.449 0 N-CA-C 111.966 0.358 . . . . 0.0 111.966 -173.669 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 94' ' ' ASN . . . . . 0.439 ' HB2' ' O ' ' A' ' 90' ' ' ASN . 2.6 m-20 -84.8 -50.73 7.32 Favored 'General case' 0 C--N 1.325 -0.496 0 CA-C-N 116.167 -0.47 . . . . 0.0 111.819 -172.209 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 95' ' ' HIS . . . . . . . . . . . . . 78.5 m80 -86.24 -40.93 15.05 Favored 'General case' 0 C--N 1.325 -0.497 0 N-CA-C 112.017 0.377 . . . . 0.0 112.017 -172.391 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 96' ' ' LEU . . . . . 0.524 HD11 ' HA ' ' A' ' 92' ' ' CYS . 96.0 mt -89.17 22.26 2.89 Favored 'General case' 0 C--N 1.323 -0.586 0 CA-C-O 120.956 0.407 . . . . 0.0 110.699 -179.765 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 97' ' ' SER . . . . . 0.472 ' OG ' ' HD3' ' A' ' 98' ' ' PRO . 3.1 p -57.36 -41.49 91.11 Favored Pre-proline 0 CA--C 1.545 0.771 0 N-CA-C 113.188 0.81 . . . . 0.0 113.188 -179.183 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 98' ' ' PRO . . . . . 0.472 ' HD3' ' OG ' ' A' ' 97' ' ' SER . 31.5 Cg_exo -58.46 -35.74 98.32 Favored 'Trans proline' 0 C--N 1.363 1.33 0 C-N-CA 121.631 1.554 . . . . 0.0 112.109 176.965 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 99' ' ' LEU . . . . . . . . . . . . . 49.2 mt -84.63 -30.07 25.22 Favored 'General case' 0 C--N 1.326 -0.45 0 CA-C-N 116.263 -0.426 . . . . 0.0 110.657 -176.85 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 100' ' ' TYR . . . . . . . . . . . . . 17.4 t80 -57.82 -26.69 62.34 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 115.811 -0.631 . . . . 0.0 111.297 -176.495 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 101' ' ' MET . . . . . . . . . . . . . 26.8 ptt? -97.81 1.92 48.81 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.215 -0.448 . . . . 0.0 111.44 -178.115 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 102' ' ' LYS . . . . . . . . . . . . . 95.5 mttt -109.23 149.29 29.62 Favored 'General case' 0 C--N 1.326 -0.435 0 CA-C-O 120.732 0.301 . . . . 0.0 110.527 -178.285 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 103' ' ' SER . . . . . 0.413 ' O ' HG13 ' A' ' 107' ' ' ILE . 62.5 m -70.04 146.95 50.62 Favored 'General case' 0 C--N 1.323 -0.579 0 CA-C-N 116.226 -0.443 . . . . 0.0 110.238 178.867 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 104' ' ' LEU . . . . . . . . . . . . . 26.5 tp -55.28 -33.6 63.36 Favored 'General case' 0 C--N 1.326 -0.419 0 CA-C-N 115.816 -0.629 . . . . 0.0 111.861 -177.272 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 105' ' ' SER . . . . . . . . . . . . . 2.9 p -81.74 -16.59 50.63 Favored 'General case' 0 C--N 1.323 -0.571 0 N-CA-C 112.769 0.655 . . . . 0.0 112.769 -173.756 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 106' ' ' GLU . . . . . . . . . . . . . 20.3 pt-20 -108.21 9.32 28.11 Favored 'General case' 0 C--N 1.329 -0.325 0 C-N-CA 120.798 -0.361 . . . . 0.0 111.884 -172.388 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 107' ' ' ILE . . . . . 0.42 HD13 ' HB2' ' A' ' 64' ' ' PHE . 69.1 mt -88.03 102.68 12.86 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.5 0 CA-C-O 121.152 0.501 . . . . 0.0 110.707 -179.873 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 108' ' ' LEU . . . . . . . . . . . . . 2.5 pt? -75.4 143.25 75.9 Favored Pre-proline 0 C--N 1.324 -0.519 0 CA-C-N 115.86 -0.609 . . . . 0.0 110.391 177.104 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 109' ' ' PRO . . . . . 0.498 ' HG3' ' HB3' ' A' ' 150' ' ' PRO . 32.5 Cg_exo -57.13 -31.41 90.33 Favored 'Trans proline' 0 C--N 1.347 0.479 0 C-N-CA 123.053 2.502 . . . . 0.0 112.347 -177.714 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 110' ' ' ALA . . . . . . . . . . . . . . . -61.55 -35.42 77.73 Favored 'General case' 0 C--N 1.327 -0.375 0 CA-C-N 115.677 -0.692 . . . . 0.0 111.375 -178.859 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 111' ' ' ASP . . . . . . . . . . . . . 26.0 t70 -72.06 -37.89 69.56 Favored 'General case' 0 C--O 1.234 0.289 0 CA-C-O 121.031 0.443 . . . . 0.0 110.338 -176.357 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 112' ' ' ILE . . . . . 0.429 ' HB ' HG21 ' A' ' 154' ' ' VAL . 34.9 mt -66.36 -38.39 81.71 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.363 0 CA-C-N 115.928 -0.578 . . . . 0.0 109.444 175.678 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 113' ' ' GLN . . . . . . . . . . . . . 27.3 tp60 -62.19 -37.46 85.36 Favored 'General case' 0 C--N 1.331 -0.216 0 CA-C-N 115.472 -0.786 . . . . 0.0 110.032 177.002 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 114' ' ' SER . . . . . . . . . . . . . 33.8 m -59.72 -40.67 88.8 Favored 'General case' 0 C--N 1.334 -0.09 0 CA-C-N 116.155 -0.475 . . . . 0.0 110.786 177.031 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 115' ' ' ILE . . . . . . . . . . . . . 69.4 mt -61.75 -47.89 91.19 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.303 0 CA-C-N 116.252 -0.431 . . . . 0.0 110.478 178.934 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 116' ' ' ILE . . . . . . . . . . . . . 38.9 mm -70.68 -18.18 20.89 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.31 0 CA-C-O 121.279 0.562 . . . . 0.0 110.653 -179.365 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 117' ' ' ASN . . . . . . . . . . . . . 1.9 m-20 -77.43 -51.29 11.03 Favored 'General case' 0 C--N 1.326 -0.421 0 CA-C-N 116.006 -0.543 . . . . 0.0 111.253 178.646 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 118' ' ' GLU . . . . . . . . . . . . . 25.3 mt-10 -82.93 -30.23 28.54 Favored 'General case' 0 C--O 1.236 0.346 0 N-CA-C 111.957 0.355 . . . . 0.0 111.957 -175.657 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 119' ' ' THR . . . . . . . . . . . . . 62.0 m -70.26 111.55 5.95 Favored 'General case' 0 C--N 1.325 -0.459 0 N-CA-C 109.474 -0.565 . . . . 0.0 109.474 177.031 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 120' ' ' LYS . . . . . . . . . . . . . 35.2 mtmm -111.91 78.29 1.11 Allowed 'General case' 0 C--N 1.323 -0.585 0 CA-C-O 121.658 0.742 . . . . 0.0 111.027 -176.68 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 121' ' ' LEU . . . . . . . . . . . . . 4.6 mm? -108.79 -174.84 2.61 Favored 'General case' 0 C--N 1.318 -0.796 0 CA-C-N 114.357 -1.292 . . . . 0.0 108.402 172.949 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 122' ' ' ALA . . . . . . . . . . . . . . . -56.04 134.03 52.24 Favored 'General case' 0 C--N 1.324 -0.523 0 N-CA-C 109.643 -0.503 . . . . 0.0 109.643 172.164 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 123' ' ' LYS . . . . . 0.536 ' O ' ' HG3' ' A' ' 127' ' ' LYS . 35.1 mtmm -54.07 -35.53 62.16 Favored 'General case' 0 C--N 1.327 -0.403 0 CA-C-N 116.482 -0.326 . . . . 0.0 111.392 -178.644 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 124' ' ' ASN . . . . . . . . . . . . . 36.7 t30 -57.32 -43.39 83.27 Favored 'General case' 0 C--N 1.327 -0.407 0 CA-C-O 121.115 0.484 . . . . 0.0 110.455 175.961 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 125' ' ' THR . . . . . 0.468 ' O ' HG13 ' A' ' 129' ' ' ILE . 33.4 m -73.32 -34.75 65.85 Favored 'General case' 0 C--N 1.326 -0.432 0 CA-C-N 115.852 -0.613 . . . . 0.0 110.764 179.58 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 126' ' ' LEU . . . . . . . . . . . . . 92.2 mt -60.96 -42.17 97.74 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-O 120.981 0.42 . . . . 0.0 110.348 177.061 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 127' ' ' LYS . . . . . 0.536 ' HG3' ' O ' ' A' ' 123' ' ' LYS . 44.7 mtpt -60.12 -45.9 91.45 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 115.703 -0.68 . . . . 0.0 109.996 175.16 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 128' ' ' ALA . . . . . . . . . . . . . . . -58.04 -45.86 86.27 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 115.719 -0.673 . . . . 0.0 111.355 -179.421 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 129' ' ' ILE . . . . . 0.468 HG13 ' O ' ' A' ' 125' ' ' THR . 71.9 mt -59.02 -48.32 87.05 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.228 0 CA-C-O 121.122 0.487 . . . . 0.0 110.439 178.155 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 130' ' ' ARG . . . . . 0.408 ' HD3' ' O ' ' A' ' 151' ' ' ALA . 1.5 tmm_? -62.81 -49.56 74.47 Favored 'General case' 0 C--N 1.326 -0.431 0 CA-C-N 115.672 -0.694 . . . . 0.0 110.333 -178.851 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 131' ' ' ASN . . . . . . . . . . . . . 95.9 m-20 -62.55 -39.25 93.03 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-N 116.165 -0.47 . . . . 0.0 111.195 -176.945 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 132' ' ' THR . . . . . 0.494 ' O ' HG13 ' A' ' 136' ' ' ILE . 56.5 m -59.5 -42.16 91.53 Favored 'General case' 0 C--N 1.327 -0.407 0 CA-C-O 120.796 0.331 . . . . 0.0 110.188 176.941 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 133' ' ' ALA . . . . . . . . . . . . . . . -65.37 -44.09 88.69 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 116.162 -0.472 . . . . 0.0 111.207 179.613 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 134' ' ' SER . . . . . 0.472 ' HA ' ' HB3' ' A' ' 151' ' ' ALA . 10.9 p -64.88 -30.31 71.3 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-O 120.651 0.262 . . . . 0.0 111.123 179.916 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 135' ' ' GLN . . . . . 0.532 ' HA ' ' HG2' ' A' ' 138' ' ' ARG . 2.1 mp0 -71.79 -34.96 69.84 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.423 -0.353 . . . . 0.0 110.515 175.813 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 136' ' ' ILE . . . . . 0.494 HG13 ' O ' ' A' ' 132' ' ' THR . 77.8 mt -63.11 -47.36 92.87 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.459 0 CA-C-N 116.128 -0.487 . . . . 0.0 110.492 175.737 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 137' ' ' PHE . . . . . 0.42 ' O ' HG13 ' A' ' 141' ' ' ILE . 48.7 m-85 -64.81 -38.36 90.72 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 116.18 -0.464 . . . . 0.0 111.712 -179.911 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 138' ' ' ARG . . . . . 0.532 ' HG2' ' HA ' ' A' ' 135' ' ' GLN . 9.4 ptm180 -73.73 -25.87 60.4 Favored 'General case' 0 C--N 1.329 -0.307 0 C-N-CA 120.622 -0.431 . . . . 0.0 110.377 -179.393 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 139' ' ' LEU . . . . . . . . . . . . . 55.9 tp -67.51 -32.56 73.45 Favored 'General case' 0 C--N 1.332 -0.153 0 CA-C-O 121.58 0.705 . . . . 0.0 109.391 173.712 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 140' ' ' ALA . . . . . 0.434 ' HB1' ' HB1' ' A' ' 145' ' ' ALA . . . -72.55 -38.33 68.01 Favored 'General case' 0 C--N 1.322 -0.61 0 CA-C-N 115.46 -0.791 . . . . 0.0 110.452 175.408 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 141' ' ' ILE . . . . . 0.42 HG13 ' O ' ' A' ' 137' ' ' PHE . 75.5 mt -56.93 -47.69 82.78 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.286 0 CA-C-N 116.118 -0.492 . . . . 0.0 111.455 177.335 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 142' ' ' GLU . . . . . . . . . . . . . 11.3 pt-20 -70.44 -6.71 37.79 Favored 'General case' 0 CA--C 1.533 0.302 0 CA-C-O 120.924 0.393 . . . . 0.0 111.671 -177.401 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 143' ' ' ASN . . . . . . . . . . . . . 45.4 m-80 -110.99 9.46 22.18 Favored 'General case' 0 C--N 1.326 -0.456 0 CA-C-O 120.857 0.36 . . . . 0.0 110.399 174.678 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 144' ' ' ARG . . . . . 0.426 HH11 ' HD2' ' A' ' 144' ' ' ARG . 41.1 mtm105 62.18 23.23 13.7 Favored 'General case' 0 N--CA 1.463 0.21 0 CA-C-N 115.346 -0.843 . . . . 0.0 111.427 177.429 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 145' ' ' ALA . . . . . 0.434 ' HB1' ' HB1' ' A' ' 140' ' ' ALA . . . -77.94 -35.48 50.35 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-O 120.981 0.419 . . . . 0.0 110.285 179.407 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 146' ' ' ILE . . . . . . . . . . . . . 15.6 tt -144.0 152.0 16.08 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.509 0 CA-C-N 115.783 -0.644 . . . . 0.0 109.313 178.093 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 147' ' ' ASP . . . . . . . . . . . . . 33.4 t70 -113.03 14.93 19.71 Favored 'General case' 0 C--N 1.323 -0.573 0 CA-C-O 121.549 0.69 . . . . 0.0 110.495 -176.416 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 148' ' ' PHE . . . . . . . . . . . . . 61.2 t80 -145.13 144.3 30.84 Favored 'General case' 0 C--N 1.321 -0.669 0 CA-C-N 115.643 -0.708 . . . . 0.0 109.576 -174.972 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 149' ' ' ASN . . . . . . . . . . . . . 48.0 t-20 -119.18 88.71 37.94 Favored Pre-proline 0 C--N 1.325 -0.467 0 CA-C-O 120.963 0.411 . . . . 0.0 110.413 179.14 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 150' ' ' PRO . . . . . 0.498 ' HB3' ' HG3' ' A' ' 109' ' ' PRO . 35.8 Cg_exo -59.95 -29.25 88.94 Favored 'Trans proline' 0 C--N 1.342 0.195 0 C-N-CA 122.612 2.208 . . . . 0.0 112.154 -178.549 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 151' ' ' ALA . . . . . 0.472 ' HB3' ' HA ' ' A' ' 134' ' ' SER . . . -70.33 -27.78 64.63 Favored 'General case' 0 N--CA 1.449 -0.483 0 CA-C-N 115.69 -0.687 . . . . 0.0 112.164 -173.218 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 152' ' ' ASP . . . . . . . . . . . . . 0.0 OUTLIER -79.03 -14.37 59.22 Favored 'General case' 0 C--N 1.331 -0.232 0 C-N-CA 119.531 -0.868 . . . . 0.0 109.889 -176.953 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 153' ' ' TYR . . . . . . . . . . . . . 86.3 m-85 -88.46 -1.0 57.81 Favored 'General case' 0 C--N 1.331 -0.227 0 CA-C-N 116.036 -0.529 . . . . 0.0 110.522 176.768 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 154' ' ' VAL . . . . . 0.429 HG21 ' HB ' ' A' ' 112' ' ' ILE . 73.5 t -85.87 126.36 40.56 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.436 0 CA-C-N 115.861 -0.608 . . . . 0.0 109.793 175.788 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 155' ' ' ARG . . . . . . . . . . . . . 38.7 ttt180 -103.63 140.59 37.36 Favored 'General case' 0 C--N 1.323 -0.585 0 CA-C-N 116.222 -0.445 . . . . 0.0 111.127 -173.421 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 156' ' ' ILE . . . . . . . . . . . . . 1.9 mp -88.32 140.7 30.4 Favored Pre-proline 0 C--N 1.328 -0.346 0 CA-C-N 115.656 -0.702 . . . . 0.0 110.135 177.904 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 157' ' ' PRO . . . . . . . . . . . . . 52.0 Cg_exo . . . . . 0 N--CA 1.459 -0.541 0 C-N-CA 122.083 1.855 . . . . 0.0 111.818 173.221 . . . . . . . . 0 0 . 1 . 003 nuclear orig core ' A' A ' 63' ' ' SER . . . . . 0.428 ' HA ' ' HA ' ' A' ' 103' ' ' SER . 32.3 m . . . . . 0 N--CA 1.45 -0.43 0 N-CA-C 110.035 -0.357 . . . . 0.0 110.035 . . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 64' ' ' PHE . . . . . 0.403 ' HB3' ' O ' ' A' ' 99' ' ' LEU . 88.6 t80 -60.72 -44.71 96.29 Favored 'General case' 0 C--N 1.326 -0.438 0 CA-C-N 116.366 -0.379 . . . . 0.0 110.812 -177.888 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 65' ' ' GLY . . . . . . . . . . . . . . . -68.47 -23.83 75.15 Favored Glycine 0 N--CA 1.451 -0.365 0 C-N-CA 120.765 -0.731 . . . . 0.0 112.374 179.622 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 66' ' ' ASP . . . . . . . . . . . . . 29.9 t70 -74.64 -47.65 30.82 Favored 'General case' 0 C--N 1.322 -0.598 0 N-CA-C 109.512 -0.551 . . . . 0.0 109.512 177.221 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 67' ' ' TRP . . . . . 0.474 ' HA ' ' HG3' ' A' ' 70' ' ' LYS . 64.3 m95 -65.29 -31.37 72.47 Favored 'General case' 0 C--N 1.33 -0.243 0 CA-C-N 115.91 -0.586 . . . . 0.0 110.906 175.361 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 68' ' ' ALA . . . . . 0.541 ' O ' ' HG ' ' A' ' 72' ' ' LEU . . . -61.93 -41.69 98.25 Favored 'General case' 0 C--N 1.327 -0.403 0 CA-C-N 116.171 -0.468 . . . . 0.0 110.239 174.935 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 69' ' ' GLU . . . . . . . . . . . . . 76.8 tt0 -63.74 -41.44 98.03 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.106 -0.497 . . . . 0.0 109.884 177.2 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 70' ' ' LYS . . . . . 0.474 ' HG3' ' HA ' ' A' ' 67' ' ' TRP . 14.1 mmmt -55.72 -47.29 77.12 Favored 'General case' 0 C--N 1.333 -0.122 0 CA-C-N 115.696 -0.684 . . . . 0.0 109.695 174.919 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 71' ' ' PHE . . . . . . . . . . . . . 91.9 t80 -63.97 -44.54 92.44 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 115.378 -0.828 . . . . 0.0 111.219 179.421 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 72' ' ' LEU . . . . . 0.541 ' HG ' ' O ' ' A' ' 68' ' ' ALA . 96.4 mt -60.36 -49.11 78.88 Favored 'General case' 0 C--N 1.327 -0.405 0 CA-C-O 120.735 0.303 . . . . 0.0 111.05 -178.914 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 73' ' ' LYS . . . . . . . . . . . . . 55.7 tptt -65.26 -37.56 87.6 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-O 121.032 0.444 . . . . 0.0 110.331 179.607 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 74' ' ' SER . . . . . . . . . . . . . 27.3 t -66.11 -41.7 90.23 Favored 'General case' 0 C--N 1.326 -0.436 0 CA-C-N 116.07 -0.514 . . . . 0.0 110.277 177.994 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 75' ' ' LYS . . . . . 0.41 ' HA ' ' HD2' ' A' ' 75' ' ' LYS . 38.7 tptt -72.13 -30.8 65.41 Favored 'General case' 0 N--CA 1.447 -0.622 0 CA-C-O 121.011 0.434 . . . . 0.0 110.687 -177.927 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 76' ' ' GLU . . . . . . . . . . . . . 37.2 tt0 -58.82 -50.14 75.07 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.202 -0.454 . . . . 0.0 109.811 171.591 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 77' ' ' ALA . . . . . . . . . . . . . . . -69.3 -27.34 65.31 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 115.935 -0.575 . . . . 0.0 110.748 178.348 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 78' ' ' ASP . . . . . . . . . . . . . 24.1 t70 -59.27 -31.15 68.84 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 115.752 -0.658 . . . . 0.0 110.009 175.823 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 79' ' ' GLY . . . . . . . . . . . . . . . 105.17 53.22 0.8 Allowed Glycine 0 N--CA 1.451 -0.319 0 C-N-CA 120.715 -0.755 . . . . 0.0 113.238 172.466 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 80' ' ' VAL . . . . . . . . . . . . . 30.2 m -99.73 161.38 3.26 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.519 0 CA-C-O 120.685 0.279 . . . . 0.0 111.001 178.644 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 81' ' ' SER . . . . . . . . . . . . . 5.5 m -66.09 154.61 39.13 Favored 'General case' 0 C--N 1.325 -0.496 0 CA-C-N 115.767 -0.651 . . . . 0.0 110.379 178.164 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 82' ' ' VAL . . . . . . . . . . . . . 8.7 p -59.78 -40.21 81.93 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.297 0 CA-C-O 120.542 0.21 . . . . 0.0 111.199 -178.433 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 83' ' ' SER . . . . . . . . . . . . . 69.2 m -74.09 -22.29 59.56 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-O 120.662 0.267 . . . . 0.0 110.725 178.59 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 84' ' ' GLN . . . . . . . . . . . . . 50.8 tt0 -71.96 -44.33 63.74 Favored 'General case' 0 N--CA 1.455 -0.189 0 N-CA-C 109.336 -0.616 . . . . 0.0 109.336 178.228 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 85' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -63.4 -36.14 82.75 Favored 'General case' 0 C--N 1.327 -0.409 0 N-CA-C 109.12 -0.696 . . . . 0.0 109.12 175.869 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 86' ' ' ASN . . . . . . . . . . . . . 8.1 m-80 -66.74 -37.52 84.82 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 115.612 -0.722 . . . . 0.0 111.707 178.392 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 87' ' ' SER . . . . . . . . . . . . . 66.6 p -67.1 -29.74 69.57 Favored 'General case' 0 C--N 1.332 -0.189 0 C-N-CA 120.667 -0.413 . . . . 0.0 110.694 178.846 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 88' ' ' TYR . . . . . . . . . . . . . 26.1 m-85 -66.68 -35.63 80.61 Favored 'General case' 0 N--CA 1.454 -0.227 0 N-CA-C 109.755 -0.461 . . . . 0.0 109.755 174.827 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 89' ' ' LYS . . . . . . . . . . . . . 62.9 mttm -63.89 -38.68 91.99 Favored 'General case' 0 CA--C 1.529 0.167 0 CA-C-N 116.063 -0.517 . . . . 0.0 110.113 173.873 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 90' ' ' ASN . . . . . 0.543 ' O ' ' HB3' ' A' ' 94' ' ' ASN . 6.8 m120 -57.88 -35.68 71.33 Favored 'General case' 0 N--CA 1.467 0.389 0 CA-C-N 116.055 -0.521 . . . . 0.0 111.012 177.441 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 91' ' ' TYR . . . . . 0.49 ' CD1' HG12 ' A' ' 129' ' ' ILE . 23.1 m-85 -84.54 -49.14 8.86 Favored 'General case' 0 C--N 1.318 -0.781 0 CA-C-N 116.325 -0.398 . . . . 0.0 111.121 -179.773 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 92' ' ' CYS . . . . . 0.496 ' HA ' ' HB2' ' A' ' 96' ' ' LEU . 50.3 t -70.22 -48.72 55.79 Favored 'General case' 0 C--N 1.323 -0.564 0 N-CA-C 112.236 0.458 . . . . 0.0 112.236 -174.524 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 93' ' ' ARG . . . . . 0.522 ' O ' ' HB3' ' A' ' 97' ' ' SER . 54.7 ttt180 -80.95 -25.13 37.62 Favored 'General case' 0 C--N 1.325 -0.464 0 CA-C-O 120.741 0.305 . . . . 0.0 111.63 -172.669 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 94' ' ' ASN . . . . . 0.543 ' HB3' ' O ' ' A' ' 90' ' ' ASN . 24.0 t-20 -100.18 -61.36 1.38 Allowed 'General case' 0 C--N 1.325 -0.467 0 C-N-CA 120.66 -0.416 . . . . 0.0 111.397 -178.514 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 95' ' ' HIS . . . . . . . . . . . . . 60.5 m80 -85.82 -14.46 45.0 Favored 'General case' 0 C--N 1.326 -0.453 0 N-CA-C 112.494 0.553 . . . . 0.0 112.494 -170.987 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 96' ' ' LEU . . . . . 0.496 ' HB2' ' HA ' ' A' ' 92' ' ' CYS . 93.5 mt -119.61 17.2 12.84 Favored 'General case' 0 C--N 1.321 -0.661 0 CA-C-O 120.796 0.332 . . . . 0.0 110.449 -179.606 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 97' ' ' SER . . . . . 0.523 ' N ' ' HD2' ' A' ' 98' ' ' PRO . 22.2 p -61.88 -42.19 81.13 Favored Pre-proline 0 CA--C 1.543 0.675 0 N-CA-C 113.073 0.768 . . . . 0.0 113.073 -176.251 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 98' ' ' PRO . . . . . 0.523 ' HD2' ' N ' ' A' ' 97' ' ' SER . 36.3 Cg_endo -65.42 -26.09 55.62 Favored 'Trans proline' 0 C--N 1.36 1.137 0 C-N-CA 121.431 1.421 . . . . 0.0 112.037 178.378 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 99' ' ' LEU . . . . . 0.403 ' O ' ' HB3' ' A' ' 64' ' ' PHE . 80.9 mt -89.93 -21.67 22.36 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 115.978 -0.555 . . . . 0.0 110.673 -178.45 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 100' ' ' TYR . . . . . . . . . . . . . 28.1 t80 -55.06 -43.15 73.59 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 115.858 -0.61 . . . . 0.0 110.825 -179.07 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 101' ' ' MET . . . . . . . . . . . . . 23.1 ptt? -94.63 14.12 22.06 Favored 'General case' 0 C--N 1.319 -0.723 0 CA-C-N 115.807 -0.633 . . . . 0.0 111.52 -175.727 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 102' ' ' LYS . . . . . . . . . . . . . 64.6 mttm -108.77 165.99 11.14 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-O 120.962 0.41 . . . . 0.0 110.997 178.092 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 103' ' ' SER . . . . . 0.474 ' O ' ' HG2' ' A' ' 106' ' ' GLU . 3.1 m -79.91 143.06 34.58 Favored 'General case' 0 C--N 1.323 -0.559 0 N-CA-C 108.821 -0.807 . . . . 0.0 108.821 172.138 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 104' ' ' LEU . . . . . . . . . . . . . 1.9 pt? -68.14 -18.92 64.76 Favored 'General case' 0 C--N 1.322 -0.618 0 C-N-CA 120.898 -0.321 . . . . 0.0 111.748 -174.103 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 105' ' ' SER . . . . . . . . . . . . . 16.7 p -87.79 -22.17 24.67 Favored 'General case' 0 C--N 1.327 -0.411 0 N-CA-C 111.813 0.301 . . . . 0.0 111.813 -179.171 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 106' ' ' GLU . . . . . 0.474 ' HG2' ' O ' ' A' ' 103' ' ' SER . 11.5 pt-20 -89.66 -7.63 54.24 Favored 'General case' 0 C--N 1.331 -0.199 0 CA-C-O 120.963 0.411 . . . . 0.0 110.583 -177.633 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 107' ' ' ILE . . . . . 0.467 HG13 ' O ' ' A' ' 103' ' ' SER . 73.4 mt -70.41 135.16 28.73 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.48 0 CA-C-N 115.885 -0.598 . . . . 0.0 110.566 179.826 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 108' ' ' LEU . . . . . 0.414 ' HB2' ' HB2' ' A' ' 111' ' ' ASP . 54.3 mt -97.43 129.52 31.61 Favored Pre-proline 0 C--N 1.325 -0.49 0 CA-C-N 116.175 -0.466 . . . . 0.0 110.776 -176.434 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 109' ' ' PRO . . . . . . . . . . . . . 50.6 Cg_exo -56.95 -38.24 96.45 Favored 'Trans proline' 0 CA--C 1.529 0.274 0 C-N-CA 122.752 2.301 . . . . 0.0 112.032 177.213 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 110' ' ' ALA . . . . . . . . . . . . . . . -70.83 -32.37 69.4 Favored 'General case' 0 C--N 1.332 -0.192 0 CA-C-N 116.204 -0.453 . . . . 0.0 110.776 178.751 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 111' ' ' ASP . . . . . 0.417 ' O ' HG13 ' A' ' 115' ' ' ILE . 36.6 t70 -64.93 -45.72 84.62 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.079 -0.51 . . . . 0.0 109.925 179.038 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 112' ' ' ILE . . . . . . . . . . . . . 36.4 mt -64.25 -39.37 85.29 Favored 'Isoleucine or valine' 0 C--O 1.234 0.277 0 CA-C-N 115.589 -0.732 . . . . 0.0 110.511 176.823 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 113' ' ' GLN . . . . . . . . . . . . . 6.5 tp-100 -58.3 -44.73 88.66 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 115.774 -0.648 . . . . 0.0 110.791 178.232 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 114' ' ' SER . . . . . . . . . . . . . 53.5 m -62.57 -36.0 81.29 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.667 -0.242 . . . . 0.0 110.911 178.097 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 115' ' ' ILE . . . . . 0.417 HG13 ' O ' ' A' ' 111' ' ' ASP . 72.4 mt -64.86 -48.63 83.53 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.193 0 CA-C-O 120.686 0.279 . . . . 0.0 110.384 177.707 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 116' ' ' ILE . . . . . . . . . . . . . 40.8 mm -61.45 -43.42 96.76 Favored 'Isoleucine or valine' 0 N--CA 1.463 0.209 0 CA-C-N 116.265 -0.425 . . . . 0.0 110.53 177.833 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 117' ' ' ASN . . . . . . . . . . . . . 3.0 t-20 -60.17 -37.0 78.84 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 115.689 -0.687 . . . . 0.0 111.203 179.964 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 118' ' ' GLU . . . . . . . . . . . . . 48.4 mt-10 -93.8 0.76 56.44 Favored 'General case' 0 C--N 1.326 -0.417 0 CA-C-N 116.382 -0.372 . . . . 0.0 111.713 -178.513 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 119' ' ' THR . . . . . . . . . . . . . 94.2 m -88.04 110.02 20.29 Favored 'General case' 0 N--CA 1.447 -0.6 0 N-CA-C 108.067 -1.086 . . . . 0.0 108.067 168.876 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 120' ' ' LYS . . . . . . . . . . . . . 66.4 mttm -107.69 64.98 0.63 Allowed 'General case' 0 C--N 1.322 -0.601 0 CA-C-O 121.919 0.866 . . . . 0.0 110.471 -172.401 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 121' ' ' LEU . . . . . . . . . . . . . 87.5 mt -119.5 -174.19 2.68 Favored 'General case' 0 C--N 1.321 -0.634 0 CA-C-N 114.567 -1.197 . . . . 0.0 109.639 -179.526 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 122' ' ' ALA . . . . . . . . . . . . . . . -61.2 149.3 38.04 Favored 'General case' 0 C--N 1.325 -0.476 0 CA-C-N 116.337 -0.392 . . . . 0.0 111.364 -179.832 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 123' ' ' LYS . . . . . . . . . . . . . 55.5 pttt -56.14 -33.01 64.77 Favored 'General case' 0 C--N 1.327 -0.378 0 CA-C-N 115.802 -0.635 . . . . 0.0 111.217 178.473 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 124' ' ' ASN . . . . . . . . . . . . . 95.0 m-20 -62.18 -39.96 94.44 Favored 'General case' 0 C--N 1.331 -0.219 0 CA-C-N 116.069 -0.514 . . . . 0.0 110.472 177.944 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 125' ' ' THR . . . . . 0.552 ' O ' HG13 ' A' ' 129' ' ' ILE . 8.6 m -68.29 -41.41 81.01 Favored 'General case' 0 C--N 1.326 -0.424 0 CA-C-N 116.031 -0.532 . . . . 0.0 110.489 -179.895 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 126' ' ' LEU . . . . . . . . . . . . . 92.6 mt -59.99 -45.54 92.38 Favored 'General case' 0 C--O 1.235 0.324 0 CA-C-N 116.071 -0.513 . . . . 0.0 110.755 179.691 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 127' ' ' LYS . . . . . . . . . . . . . 98.8 mttt -67.29 -34.83 78.22 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.018 -0.537 . . . . 0.0 110.766 178.844 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 128' ' ' ALA . . . . . . . . . . . . . . . -65.82 -43.65 87.95 Favored 'General case' 0 C--N 1.327 -0.391 0 CA-C-N 116.162 -0.472 . . . . 0.0 111.059 -179.273 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 129' ' ' ILE . . . . . 0.552 HG13 ' O ' ' A' ' 125' ' ' THR . 59.1 mt -61.2 -41.82 90.98 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.185 0 CA-C-O 121.154 0.502 . . . . 0.0 109.795 176.998 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 130' ' ' ARG . . . . . 0.593 HH21 HG13 ' A' ' 154' ' ' VAL . 3.2 tpp180 -64.5 -48.1 76.45 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 115.843 -0.617 . . . . 0.0 110.723 179.032 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 131' ' ' ASN . . . . . . . . . . . . . 0.9 OUTLIER -57.83 -52.67 64.51 Favored 'General case' 0 C--N 1.328 -0.345 0 O-C-N 123.341 0.4 . . . . 0.0 110.899 -179.887 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 132' ' ' THR . . . . . 0.478 ' O ' HG13 ' A' ' 136' ' ' ILE . 33.3 m -54.55 -54.06 46.29 Favored 'General case' 0 C--N 1.327 -0.384 0 CA-C-N 116.098 -0.501 . . . . 0.0 110.94 -179.451 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 133' ' ' ALA . . . . . . . . . . . . . . . -62.9 -39.32 94.14 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 116.284 -0.416 . . . . 0.0 111.932 -176.929 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 134' ' ' SER . . . . . . . . . . . . . 79.4 p -65.46 -32.53 74.19 Favored 'General case' 0 C--O 1.233 0.188 0 CA-C-O 120.55 0.214 . . . . 0.0 111.259 -176.514 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 135' ' ' GLN . . . . . 0.474 ' O ' ' HG2' ' A' ' 138' ' ' ARG . 36.1 mt-30 -79.73 -26.11 40.9 Favored 'General case' 0 N--CA 1.453 -0.306 0 C-N-CA 120.946 -0.302 . . . . 0.0 110.808 -179.919 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 136' ' ' ILE . . . . . 0.478 HG13 ' O ' ' A' ' 132' ' ' THR . 73.5 mt -65.34 -46.59 89.94 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.323 0 N-CA-C 109.823 -0.436 . . . . 0.0 109.823 173.791 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 137' ' ' PHE . . . . . 0.42 ' O ' HG13 ' A' ' 141' ' ' ILE . 53.3 m-85 -64.87 -40.5 95.23 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 116.078 -0.51 . . . . 0.0 111.102 177.33 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 138' ' ' ARG . . . . . 0.474 ' HG2' ' O ' ' A' ' 135' ' ' GLN . 0.2 OUTLIER -67.5 -26.07 66.17 Favored 'General case' 0 CA--C 1.53 0.203 0 CA-C-O 120.805 0.336 . . . . 0.0 110.391 -177.751 . . . . . . . . 3 3 . 1 . 003 nuclear orig core ' A' A ' 139' ' ' LEU . . . . . 0.4 ' HA ' ' HG2' ' A' ' 142' ' ' GLU . 62.2 tp -67.65 -34.3 76.67 Favored 'General case' 0 C--N 1.332 -0.195 0 CA-C-O 121.28 0.562 . . . . 0.0 109.561 176.706 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 140' ' ' ALA . . . . . . . . . . . . . . . -74.61 -33.78 62.68 Favored 'General case' 0 C--N 1.325 -0.459 0 CA-C-N 115.907 -0.588 . . . . 0.0 110.081 175.697 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 141' ' ' ILE . . . . . 0.623 ' HA ' ' O ' ' A' ' 146' ' ' ILE . 75.9 mt -62.3 -47.94 90.73 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.28 0 CA-C-N 115.947 -0.569 . . . . 0.0 111.069 176.795 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 142' ' ' GLU . . . . . 0.4 ' HG2' ' HA ' ' A' ' 139' ' ' LEU . 5.3 pt-20 -69.56 -16.55 63.44 Favored 'General case' 0 C--N 1.331 -0.229 0 CA-C-O 120.917 0.389 . . . . 0.0 110.975 -179.52 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 143' ' ' ASN . . . . . . . . . . . . . 18.3 m-80 -98.41 2.9 48.31 Favored 'General case' 0 C--N 1.326 -0.435 0 CA-C-N 116.399 -0.364 . . . . 0.0 110.485 175.68 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 144' ' ' ARG . . . . . 0.416 HH11 ' HD2' ' A' ' 144' ' ' ARG . 25.6 mtm180 63.43 20.55 12.31 Favored 'General case' 0 N--CA 1.464 0.271 0 CA-C-N 115.649 -0.705 . . . . 0.0 112.146 175.663 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 145' ' ' ALA . . . . . . . . . . . . . . . -75.12 -37.58 61.38 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-O 121.367 0.604 . . . . 0.0 109.418 176.421 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 146' ' ' ILE . . . . . 0.623 ' O ' ' HA ' ' A' ' 141' ' ' ILE . 13.7 tt -146.85 137.9 18.17 Favored 'Isoleucine or valine' 0 N--CA 1.449 -0.513 0 CA-C-N 115.254 -0.885 . . . . 0.0 108.823 175.192 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 147' ' ' ASP . . . . . . . . . . . . . 7.9 p-10 -106.04 19.71 20.1 Favored 'General case' 0 C--N 1.321 -0.639 0 CA-C-O 121.19 0.519 . . . . 0.0 110.188 -178.947 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 148' ' ' PHE . . . . . 0.412 ' H ' HG12 ' A' ' 146' ' ' ILE . 70.6 t80 -132.12 123.35 26.96 Favored 'General case' 0 C--N 1.32 -0.689 0 CA-C-N 115.353 -0.84 . . . . 0.0 109.846 -175.058 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 149' ' ' ASN . . . . . 0.518 ' HB2' HD13 ' A' ' 141' ' ' ILE . 31.5 t-20 -107.58 98.12 22.79 Favored Pre-proline 0 C--N 1.325 -0.494 0 N-CA-C 110.058 -0.349 . . . . 0.0 110.058 -179.656 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 150' ' ' PRO . . . . . . . . . . . . . 55.2 Cg_endo -70.44 -13.89 33.41 Favored 'Trans proline' 0 C--N 1.344 0.338 0 C-N-CA 122.765 2.31 . . . . 0.0 112.661 -176.51 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 151' ' ' ALA . . . . . . . . . . . . . . . -71.24 -20.02 62.29 Favored 'General case' 0 C--N 1.326 -0.414 0 CA-C-N 116.206 -0.452 . . . . 0.0 110.987 -179.374 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 152' ' ' ASP . . . . . . . . . . . . . 31.0 t70 -71.99 -21.74 61.53 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-O 121.186 0.517 . . . . 0.0 110.902 -179.82 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 153' ' ' TYR . . . . . . . . . . . . . 99.2 m-85 -92.58 1.73 57.1 Favored 'General case' 0 C--N 1.324 -0.532 0 CA-C-N 115.893 -0.594 . . . . 0.0 110.81 -177.962 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 154' ' ' VAL . . . . . 0.593 HG13 HH21 ' A' ' 130' ' ' ARG . 60.6 t -88.11 106.52 16.56 Favored 'Isoleucine or valine' 0 N--CA 1.448 -0.529 0 N-CA-C 109.529 -0.545 . . . . 0.0 109.529 175.949 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 155' ' ' ARG . . . . . . . . . . . . . 12.0 tpp180 -77.01 121.6 23.75 Favored 'General case' 0 C--N 1.32 -0.675 0 CA-C-N 115.853 -0.612 . . . . 0.0 109.891 -178.982 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 156' ' ' ILE . . . . . . . . . . . . . 48.5 mm -90.0 120.2 69.31 Favored Pre-proline 0 C--N 1.325 -0.499 0 CA-C-N 116.272 -0.422 . . . . 0.0 110.213 179.932 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 157' ' ' PRO . . . . . . . . . . . . . 55.5 Cg_endo . . . . . 0 N--CA 1.461 -0.402 0 C-N-CA 122.349 2.033 . . . . 0.0 111.819 178.372 . . . . . . . . 0 0 . 1 . 004 nuclear orig core ' A' A ' 63' ' ' SER . . . . . . . . . . . . . 36.5 t . . . . . 0 N--CA 1.45 -0.438 0 N-CA-C 109.744 -0.465 . . . . 0.0 109.744 . . . . . . . . . 0 0 . 1 . 004 nuclear orig core ' A' A ' 64' ' ' PHE . . . . . 0.445 ' HB3' ' O ' ' A' ' 99' ' ' LEU . 87.4 t80 -59.07 -38.61 79.85 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-N 116.207 -0.451 . . . . 0.0 110.357 179.753 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 65' ' ' GLY . . . . . . . . . . . . . . . -65.38 -32.32 83.21 Favored Glycine 0 N--CA 1.45 -0.38 0 C-N-CA 120.91 -0.662 . . . . 0.0 112.745 179.99 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 66' ' ' ASP . . . . . . . . . . . . . 20.3 t70 -68.33 -41.45 80.78 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-O 121.043 0.449 . . . . 0.0 110.154 -179.645 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 67' ' ' TRP . . . . . . . . . . . . . 80.4 m95 -74.84 -31.56 61.69 Favored 'General case' 0 C--N 1.327 -0.399 0 CA-C-N 116.027 -0.533 . . . . 0.0 110.979 178.061 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 68' ' ' ALA . . . . . . . . . . . . . . . -62.07 -41.66 98.39 Favored 'General case' 0 C--N 1.33 -0.243 0 N-CA-C 109.874 -0.417 . . . . 0.0 109.874 174.342 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 69' ' ' GLU . . . . . . . . . . . . . 3.3 tm-20 -54.32 -51.09 65.79 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 115.607 -0.724 . . . . 0.0 110.246 175.034 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 70' ' ' LYS . . . . . . . . . . . . . 48.3 mttp -72.81 -25.44 61.14 Favored 'General case' 0 C--N 1.324 -0.531 0 CA-C-N 115.904 -0.589 . . . . 0.0 111.828 -176.688 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 71' ' ' PHE . . . . . . . . . . . . . 69.5 t80 -70.36 -49.38 49.78 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-O 120.876 0.37 . . . . 0.0 110.29 175.337 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 72' ' ' LEU . . . . . 0.434 HD11 ' HA ' ' A' ' 72' ' ' LEU . 4.0 mm? -65.42 -34.71 78.93 Favored 'General case' 0 C--N 1.326 -0.446 0 CA-C-O 120.882 0.373 . . . . 0.0 110.222 177.065 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 73' ' ' LYS . . . . . . . . . . . . . 3.9 tppp? -64.05 -45.9 86.77 Favored 'General case' 0 C--N 1.325 -0.469 0 CA-C-N 115.84 -0.618 . . . . 0.0 110.513 178.43 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 74' ' ' SER . . . . . 0.42 ' O ' ' HB2' ' A' ' 78' ' ' ASP . 13.1 p -70.33 -27.73 64.6 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 116.333 -0.394 . . . . 0.0 111.037 -179.023 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 75' ' ' LYS . . . . . 0.452 ' HD3' ' HA ' ' A' ' 75' ' ' LYS . 67.9 mmtt -74.83 -34.18 62.28 Favored 'General case' 0 C--O 1.236 0.346 0 CA-C-O 120.929 0.395 . . . . 0.0 110.842 174.462 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 76' ' ' GLU . . . . . . . . . . . . . 7.5 tp10 -63.06 -41.54 99.49 Favored 'General case' 0 C--N 1.324 -0.526 0 CA-C-O 121.369 0.604 . . . . 0.0 109.608 173.842 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 77' ' ' ALA . . . . . . . . . . . . . . . -81.18 -10.09 59.69 Favored 'General case' 0 C--N 1.327 -0.404 0 CA-C-N 115.755 -0.657 . . . . 0.0 110.92 177.033 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 78' ' ' ASP . . . . . 0.42 ' HB2' ' O ' ' A' ' 74' ' ' SER . 17.9 t70 -77.23 -49.48 15.0 Favored 'General case' 0 C--N 1.327 -0.4 0 CA-C-N 115.999 -0.546 . . . . 0.0 110.101 178.824 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 79' ' ' GLY . . . . . . . . . . . . . . . 121.43 25.54 2.17 Favored Glycine 0 N--CA 1.449 -0.489 0 C-N-CA 120.573 -0.822 . . . . 0.0 113.052 177.227 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 80' ' ' VAL . . . . . . . . . . . . . 15.9 m -67.67 157.39 6.24 Favored 'Isoleucine or valine' 0 C--O 1.234 0.262 0 CA-C-N 117.088 0.444 . . . . 0.0 110.559 176.734 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 81' ' ' SER . . . . . . . . . . . . . 28.7 t -58.67 138.39 57.02 Favored 'General case' 0 N--CA 1.451 -0.418 0 CA-C-N 115.985 -0.552 . . . . 0.0 109.755 174.812 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 82' ' ' VAL . . . . . . . . . . . . . 14.0 p -58.39 -34.07 49.49 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.583 0 CA-C-O 120.732 0.301 . . . . 0.0 110.786 -179.44 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 83' ' ' SER . . . . . . . . . . . . . 23.3 t -69.38 -43.16 74.09 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-O 121.17 0.509 . . . . 0.0 109.861 177.715 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 84' ' ' GLN . . . . . . . . . . . . . 24.6 tp60 -64.58 -37.62 88.17 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 115.757 -0.656 . . . . 0.0 110.085 178.008 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 85' ' ' LEU . . . . . . . . . . . . . 41.1 tp -66.02 -43.07 88.73 Favored 'General case' 0 C--N 1.327 -0.403 0 CA-C-N 115.646 -0.706 . . . . 0.0 110.564 177.781 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 86' ' ' ASN . . . . . . . . . . . . . 12.3 m-80 -59.6 -38.66 81.86 Favored 'General case' 0 N--CA 1.463 0.189 0 CA-C-N 116.452 -0.34 . . . . 0.0 110.405 176.469 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 87' ' ' SER . . . . . . . . . . . . . 33.1 t -60.62 -48.22 82.75 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 115.903 -0.589 . . . . 0.0 110.4 177.341 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 88' ' ' TYR . . . . . . . . . . . . . 21.8 m-85 -61.58 -45.16 95.32 Favored 'General case' 0 C--O 1.234 0.28 0 CA-C-O 120.786 0.327 . . . . 0.0 110.745 178.311 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 89' ' ' LYS . . . . . . . . . . . . . 97.4 mttt -61.27 -39.33 90.0 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 116.127 -0.488 . . . . 0.0 111.066 179.328 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 90' ' ' ASN . . . . . . . . . . . . . 8.7 t30 -65.26 -41.95 93.73 Favored 'General case' 0 C--N 1.327 -0.37 0 CA-C-O 120.762 0.315 . . . . 0.0 110.578 -179.399 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 91' ' ' TYR . . . . . . . . . . . . . 21.4 m-30 -64.63 -43.22 94.42 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.392 -0.367 . . . . 0.0 111.221 179.93 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 92' ' ' CYS . . . . . 0.519 ' HA ' HD11 ' A' ' 96' ' ' LEU . 58.4 m -76.37 -42.89 43.05 Favored 'General case' 0 C--N 1.323 -0.564 0 CA-C-N 116.5 -0.318 . . . . 0.0 111.844 -175.846 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 93' ' ' ARG . . . . . . . . . . . . . 63.8 ttt180 -79.25 -36.4 39.98 Favored 'General case' 0 C--N 1.326 -0.426 0 CA-C-O 120.669 0.271 . . . . 0.0 111.478 -174.46 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 94' ' ' ASN . . . . . . . . . . . . . 4.1 m-20 -101.03 -49.96 3.95 Favored 'General case' 0 C--N 1.328 -0.337 0 N-CA-C 111.997 0.369 . . . . 0.0 111.997 -174.509 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 95' ' ' HIS . . . . . . . . . . . . . 0.6 OUTLIER -82.25 -32.53 29.63 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-O 120.943 0.402 . . . . 0.0 111.248 -174.0 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 96' ' ' LEU . . . . . 0.555 HD22 ' NH2' ' A' ' 130' ' ' ARG . 93.3 mt -98.68 22.48 9.92 Favored 'General case' 0 C--N 1.324 -0.524 0 CA-C-N 116.115 -0.493 . . . . 0.0 110.741 179.746 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 97' ' ' SER . . . . . 0.543 ' OG ' ' HD3' ' A' ' 98' ' ' PRO . 2.5 p -53.86 -45.1 99.01 Favored Pre-proline 0 CA--C 1.544 0.742 0 N-CA-C 113.29 0.848 . . . . 0.0 113.29 -177.98 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 98' ' ' PRO . . . . . 0.543 ' HD3' ' OG ' ' A' ' 97' ' ' SER . 33.8 Cg_exo -60.3 -43.77 32.59 Favored 'Trans proline' 0 C--N 1.361 1.224 0 C-N-CA 121.593 1.528 . . . . 0.0 111.938 178.454 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 99' ' ' LEU . . . . . 0.445 ' O ' ' HB3' ' A' ' 64' ' ' PHE . 61.1 mt -76.29 -32.45 58.78 Favored 'General case' 0 C--N 1.326 -0.456 0 CA-C-N 115.818 -0.628 . . . . 0.0 110.592 -176.399 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 100' ' ' TYR . . . . . . . . . . . . . 42.8 t80 -57.84 -33.22 68.4 Favored 'General case' 0 C--N 1.326 -0.433 0 CA-C-N 115.73 -0.668 . . . . 0.0 110.801 -179.652 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 101' ' ' MET . . . . . . . . . . . . . 65.8 mtt -102.32 14.29 32.35 Favored 'General case' 0 C--N 1.324 -0.508 0 CA-C-N 116.206 -0.452 . . . . 0.0 110.889 -178.244 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 102' ' ' LYS . . . . . 0.442 ' HG3' ' O ' ' A' ' 98' ' ' PRO . 64.6 mttt -99.05 163.14 12.7 Favored 'General case' 0 C--N 1.326 -0.444 0 CA-C-O 121.24 0.543 . . . . 0.0 111.162 179.104 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 103' ' ' SER . . . . . . . . . . . . . 20.3 m -80.3 137.06 36.54 Favored 'General case' 0 N--CA 1.446 -0.662 0 CA-C-N 115.307 -0.86 . . . . 0.0 109.134 173.533 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 104' ' ' LEU . . . . . 0.557 ' HG ' HD13 ' A' ' 146' ' ' ILE . 50.3 tp -55.07 -43.82 74.25 Favored 'General case' 0 C--N 1.327 -0.409 0 N-CA-C 112.65 0.611 . . . . 0.0 112.65 -171.293 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 105' ' ' SER . . . . . . . . . . . . . 15.5 m -84.01 -9.72 58.44 Favored 'General case' 0 C--N 1.321 -0.665 0 N-CA-C 112.702 0.631 . . . . 0.0 112.702 -171.171 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 106' ' ' GLU . . . . . . . . . . . . . 0.2 OUTLIER -86.95 -22.12 25.8 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-O 120.871 0.367 . . . . 0.0 110.229 -177.082 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 107' ' ' ILE . . . . . . . . . . . . . 62.9 mt -60.66 126.25 18.2 Favored 'Isoleucine or valine' 0 C--O 1.236 0.35 0 CA-C-N 115.747 -0.66 . . . . 0.0 111.491 -174.939 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 108' ' ' LEU . . . . . 0.432 HD11 ' HB1' ' A' ' 110' ' ' ALA . 1.4 pt? -112.25 149.32 40.81 Favored Pre-proline 0 C--N 1.325 -0.488 0 CA-C-N 115.432 -0.804 . . . . 0.0 110.31 -179.541 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 109' ' ' PRO . . . . . . . . . . . . . 50.9 Cg_exo -55.01 -39.77 89.25 Favored 'Trans proline' 0 C--N 1.344 0.324 0 C-N-CA 122.952 2.435 . . . . 0.0 112.906 179.674 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 110' ' ' ALA . . . . . 0.432 ' HB1' HD11 ' A' ' 108' ' ' LEU . . . -58.85 -38.67 79.28 Favored 'General case' 0 N--CA 1.464 0.243 0 N-CA-C 111.779 0.289 . . . . 0.0 111.779 -178.209 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 111' ' ' ASP . . . . . . . . . . . . . 28.2 t70 -66.49 -45.91 78.05 Favored 'General case' 0 C--N 1.327 -0.379 0 CA-C-O 121.246 0.546 . . . . 0.0 110.155 -178.172 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 112' ' ' ILE . . . . . 0.503 HD11 ' HB2' ' A' ' 150' ' ' PRO . 58.4 mt -65.74 -38.6 82.63 Favored 'Isoleucine or valine' 0 C--O 1.239 0.519 0 CA-C-N 115.564 -0.744 . . . . 0.0 110.581 177.486 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 113' ' ' GLN . . . . . . . . . . . . . 27.1 tp60 -61.91 -40.57 95.93 Favored 'General case' 0 C--N 1.327 -0.384 0 CA-C-N 115.266 -0.879 . . . . 0.0 110.348 179.597 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 114' ' ' SER . . . . . . . . . . . . . 19.0 t -60.18 -43.95 95.45 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 116.088 -0.506 . . . . 0.0 110.152 177.687 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 115' ' ' ILE . . . . . . . . . . . . . 69.0 mt -54.88 -39.52 48.93 Favored 'Isoleucine or valine' 0 CA--C 1.53 0.195 0 CA-C-O 120.8 0.333 . . . . 0.0 110.677 178.491 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 116' ' ' ILE . . . . . 0.486 HG12 HH11 ' A' ' 130' ' ' ARG . 23.3 mm -70.02 -40.0 77.99 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.238 0 CA-C-N 116.425 -0.352 . . . . 0.0 111.332 177.905 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 117' ' ' ASN . . . . . . . . . . . . . 6.4 t30 -67.39 -32.82 73.98 Favored 'General case' 0 C--N 1.324 -0.51 0 CA-C-O 120.948 0.404 . . . . 0.0 110.501 -178.772 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 118' ' ' GLU . . . . . . . . . . . . . 36.9 mt-10 -83.7 -30.61 26.63 Favored 'General case' 0 C--N 1.327 -0.391 0 CA-C-N 115.808 -0.633 . . . . 0.0 111.564 -178.848 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 119' ' ' THR . . . . . . . . . . . . . 97.9 m -83.77 121.06 26.79 Favored 'General case' 0 C--N 1.325 -0.467 0 CA-C-O 120.977 0.417 . . . . 0.0 111.399 -177.584 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 120' ' ' LYS . . . . . . . . . . . . . 74.6 mmtt -109.09 86.11 2.22 Favored 'General case' 0 C--N 1.321 -0.666 0 CA-C-O 121.293 0.568 . . . . 0.0 110.868 176.716 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 121' ' ' LEU . . . . . . . . . . . . . 85.8 mt -120.52 -175.2 2.97 Favored 'General case' 0 C--N 1.319 -0.755 0 CA-C-N 115.235 -0.893 . . . . 0.0 108.841 174.727 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 122' ' ' ALA . . . . . . . . . . . . . . . -58.5 139.42 55.69 Favored 'General case' 0 C--N 1.324 -0.529 0 N-CA-C 109.325 -0.62 . . . . 0.0 109.325 173.871 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 123' ' ' LYS . . . . . . . . . . . . . 91.6 mttt -62.33 -33.04 73.93 Favored 'General case' 0 C--N 1.322 -0.618 0 CA-C-O 121.141 0.495 . . . . 0.0 110.832 -174.432 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 124' ' ' ASN . . . . . . . . . . . . . 42.9 m-80 -65.56 -39.07 91.26 Favored 'General case' 0 C--N 1.325 -0.49 0 CA-C-N 115.666 -0.697 . . . . 0.0 110.312 175.09 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 125' ' ' THR . . . . . 0.474 ' O ' HG13 ' A' ' 129' ' ' ILE . 17.3 m -69.75 -37.39 76.42 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 116.001 -0.545 . . . . 0.0 110.691 179.48 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 126' ' ' LEU . . . . . . . . . . . . . 98.2 mt -56.8 -51.45 68.88 Favored 'General case' 0 C--O 1.237 0.442 0 CA-C-N 116.27 -0.423 . . . . 0.0 110.949 179.364 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 127' ' ' LYS . . . . . 0.532 ' HB3' HG23 ' A' ' 156' ' ' ILE . 12.7 ptmm? -71.29 -21.29 62.1 Favored 'General case' 0 C--N 1.327 -0.41 0 CA-C-N 116.269 -0.423 . . . . 0.0 111.254 179.593 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 128' ' ' ALA . . . . . . . . . . . . . . . -69.08 -43.02 75.4 Favored 'General case' 0 C--N 1.331 -0.222 0 CA-C-O 120.859 0.362 . . . . 0.0 110.654 175.353 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 129' ' ' ILE . . . . . 0.474 HG13 ' O ' ' A' ' 125' ' ' THR . 51.9 mt -66.07 -29.45 46.83 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.235 0 CA-C-O 121.177 0.513 . . . . 0.0 110.03 177.779 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 130' ' ' ARG . . . . . 0.844 ' HA ' ' HE ' ' A' ' 130' ' ' ARG . 0.4 OUTLIER -76.09 -43.31 44.06 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.397 -0.365 . . . . 0.0 110.932 175.69 . . . . . . . . 3 3 . 1 . 004 nuclear orig core ' A' A ' 131' ' ' ASN . . . . . 0.566 ' O ' ' HG2' ' A' ' 135' ' ' GLN . 27.2 t-20 -55.86 -51.51 67.29 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-O 120.889 0.376 . . . . 0.0 110.259 177.649 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 132' ' ' THR . . . . . . . . . . . . . 28.5 m -54.81 -48.57 72.61 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 115.569 -0.741 . . . . 0.0 110.966 178.454 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 133' ' ' ALA . . . . . . . . . . . . . . . -63.15 -39.27 94.18 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.122 -0.49 . . . . 0.0 111.04 179.654 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 134' ' ' SER . . . . . . . . . . . . . 11.1 t -63.98 -38.56 91.53 Favored 'General case' 0 C--N 1.327 -0.406 0 CA-C-N 116.372 -0.376 . . . . 0.0 110.429 -179.613 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 135' ' ' GLN . . . . . 0.566 ' HG2' ' O ' ' A' ' 131' ' ' ASN . 78.1 mm-40 -61.04 -37.81 83.92 Favored 'General case' 0 C--N 1.331 -0.229 0 CA-C-O 121.016 0.436 . . . . 0.0 110.198 177.474 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 136' ' ' ILE . . . . . . . . . . . . . 69.9 mt -64.57 -46.62 92.02 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.357 0 CA-C-N 115.71 -0.677 . . . . 0.0 110.683 177.998 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 137' ' ' PHE . . . . . 0.471 ' O ' HG13 ' A' ' 141' ' ' ILE . 53.4 m-85 -61.0 -42.27 98.11 Favored 'General case' 0 N--CA 1.462 0.14 0 CA-C-O 120.908 0.385 . . . . 0.0 110.548 176.192 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 138' ' ' ARG . . . . . 0.515 ' O ' ' HG3' ' A' ' 142' ' ' GLU . 25.9 mtp180 -57.88 -47.11 83.73 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 115.895 -0.593 . . . . 0.0 111.207 177.699 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 139' ' ' LEU . . . . . . . . . . . . . 61.7 tp -56.55 -37.34 70.38 Favored 'General case' 0 C--N 1.327 -0.392 0 CA-C-O 121.28 0.562 . . . . 0.0 110.637 178.67 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 140' ' ' ALA . . . . . 0.504 ' HB1' HD23 ' A' ' 104' ' ' LEU . . . -68.92 -43.09 75.85 Favored 'General case' 0 C--N 1.324 -0.511 0 CA-C-N 115.775 -0.648 . . . . 0.0 110.551 176.955 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 141' ' ' ILE . . . . . 0.471 HG13 ' O ' ' A' ' 137' ' ' PHE . 81.7 mt -60.3 -39.11 79.85 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.254 0 CA-C-N 116.109 -0.496 . . . . 0.0 110.911 177.094 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 142' ' ' GLU . . . . . 0.515 ' HG3' ' O ' ' A' ' 138' ' ' ARG . 42.5 mt-10 -61.5 -32.58 72.61 Favored 'General case' 0 C--N 1.33 -0.243 0 CA-C-N 116.419 -0.355 . . . . 0.0 111.16 179.624 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 143' ' ' ASN . . . . . . . . . . . . . 44.9 m-80 -95.34 6.58 48.63 Favored 'General case' 0 C--N 1.326 -0.42 0 CA-C-N 116.365 -0.38 . . . . 0.0 110.477 178.58 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 144' ' ' ARG . . . . . . . . . . . . . 47.7 mtp85 59.81 30.67 20.23 Favored 'General case' 0 N--CA 1.466 0.333 0 CA-C-N 115.525 -0.761 . . . . 0.0 111.426 179.309 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 145' ' ' ALA . . . . . . . . . . . . . . . -85.5 -9.43 57.43 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 115.897 -0.592 . . . . 0.0 110.237 177.703 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 146' ' ' ILE . . . . . 0.557 HD13 ' HG ' ' A' ' 104' ' ' LEU . 14.8 tt -160.08 150.4 6.0 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.454 0 CA-C-N 115.545 -0.752 . . . . 0.0 109.069 174.992 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 147' ' ' ASP . . . . . . . . . . . . . 21.2 t70 -116.76 19.83 14.28 Favored 'General case' 0 C--N 1.326 -0.447 0 CA-C-O 121.864 0.84 . . . . 0.0 109.469 -177.81 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 148' ' ' PHE . . . . . . . . . . . . . 61.4 t80 -141.93 134.26 27.92 Favored 'General case' 0 C--N 1.321 -0.653 0 CA-C-N 115.321 -0.854 . . . . 0.0 109.985 -171.532 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 149' ' ' ASN . . . . . . . . . . . . . 54.7 t-20 -117.19 95.96 48.25 Favored Pre-proline 0 C--N 1.324 -0.539 0 N-CA-C 109.64 -0.504 . . . . 0.0 109.64 176.816 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 150' ' ' PRO . . . . . 0.503 ' HB2' HD11 ' A' ' 112' ' ' ILE . 23.3 Cg_exo -63.54 -32.26 70.26 Favored 'Trans proline' 0 CA--C 1.528 0.191 0 C-N-CA 122.604 2.202 . . . . 0.0 112.324 -177.692 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 151' ' ' ALA . . . . . . . . . . . . . . . -71.91 -20.09 61.83 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.114 -0.494 . . . . 0.0 111.163 -177.073 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 152' ' ' ASP . . . . . . . . . . . . . 31.9 t70 -68.85 -25.48 64.67 Favored 'General case' 0 C--N 1.326 -0.422 0 CA-C-N 116.196 -0.457 . . . . 0.0 110.854 -179.63 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 153' ' ' TYR . . . . . . . . . . . . . 78.8 m-85 -93.5 -7.29 44.74 Favored 'General case' 0 C--N 1.327 -0.373 0 CA-C-N 115.981 -0.554 . . . . 0.0 111.203 -176.857 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 154' ' ' VAL . . . . . . . . . . . . . 99.3 t -76.33 117.31 20.79 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.42 0 CA-C-O 121.033 0.444 . . . . 0.0 111.346 -175.284 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 155' ' ' ARG . . . . . . . . . . . . . 32.7 ptt85 -80.43 144.05 32.94 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 115.882 -0.599 . . . . 0.0 110.112 177.912 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 156' ' ' ILE . . . . . 0.562 HD11 ' HG3' ' A' ' 130' ' ' ARG . 24.3 mm -115.55 131.89 23.41 Favored Pre-proline 0 C--N 1.323 -0.546 0 CA-C-N 116.133 -0.485 . . . . 0.0 110.653 -179.024 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 157' ' ' PRO . . . . . . . . . . . . . 55.7 Cg_endo . . . . . 0 N--CA 1.459 -0.5 0 C-N-CA 122.186 1.924 . . . . 0.0 111.278 174.068 . . . . . . . . 0 0 . 1 . 005 nuclear orig core ' A' A ' 63' ' ' SER . . . . . . . . . . . . . 93.9 p . . . . . 0 C--O 1.234 0.283 0 CA-C-O 120.733 0.301 . . . . 0.0 110.258 . . . . . . . . . 0 0 . 1 . 005 nuclear orig core ' A' A ' 64' ' ' PHE . . . . . 0.462 ' HB2' HD13 ' A' ' 107' ' ' ILE . 64.0 t80 -64.78 -29.91 70.9 Favored 'General case' 0 C--N 1.327 -0.382 0 N-CA-C 109.634 -0.506 . . . . 0.0 109.634 178.587 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 65' ' ' GLY . . . . . . . . . . . . . . . -61.4 -39.37 97.18 Favored Glycine 0 C--N 1.332 0.342 0 CA-C-N 115.885 -0.598 . . . . 0.0 112.133 176.664 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 66' ' ' ASP . . . . . . . . . . . . . 20.5 m-20 -62.57 -51.68 66.39 Favored 'General case' 0 N--CA 1.463 0.187 0 CA-C-O 121.106 0.479 . . . . 0.0 110.162 178.263 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 67' ' ' TRP . . . . . . . . . . . . . 95.7 m95 -68.78 -29.32 67.66 Favored 'General case' 0 C--N 1.326 -0.451 0 CA-C-N 115.577 -0.738 . . . . 0.0 111.937 -177.777 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 68' ' ' ALA . . . . . 0.63 ' HB3' ' SG ' ' A' ' 92' ' ' CYS . . . -61.23 -48.78 79.9 Favored 'General case' 0 C--N 1.324 -0.517 0 CA-C-O 121.086 0.469 . . . . 0.0 110.282 175.725 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 69' ' ' GLU . . . . . . . . . . . . . 5.1 mm-40 -59.71 -44.14 93.82 Favored 'General case' 0 C--N 1.326 -0.416 0 CA-C-N 115.525 -0.761 . . . . 0.0 111.055 176.218 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 70' ' ' LYS . . . . . . . . . . . . . 57.0 mtpt -66.28 -33.97 76.95 Favored 'General case' 0 C--N 1.327 -0.388 0 CA-C-N 115.936 -0.575 . . . . 0.0 110.825 -179.872 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 71' ' ' PHE . . . . . 0.541 ' CE1' ' HB3' ' A' ' 135' ' ' GLN . 65.9 t80 -66.91 -49.35 65.84 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-O 120.843 0.354 . . . . 0.0 110.657 176.683 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 72' ' ' LEU . . . . . 0.441 ' HG ' ' O ' ' A' ' 68' ' ' ALA . 89.9 mt -59.89 -40.58 89.22 Favored 'General case' 0 C--N 1.324 -0.526 0 CA-C-N 116.238 -0.437 . . . . 0.0 110.681 -179.047 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 73' ' ' LYS . . . . . 0.711 ' HA ' ' HG2' ' A' ' 76' ' ' GLU . 28.1 tttp -78.34 -27.0 46.97 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.412 -0.358 . . . . 0.0 111.549 -175.989 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 74' ' ' SER . . . . . . . . . . . . . 22.1 p -75.89 -26.08 56.67 Favored 'General case' 0 C--N 1.321 -0.64 0 C-N-CA 120.197 -0.601 . . . . 0.0 110.226 176.355 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 75' ' ' LYS . . . . . 0.43 ' HG2' ' O ' ' A' ' 71' ' ' PHE . 28.8 mmmt -77.52 -43.25 32.69 Favored 'General case' 0 C--O 1.234 0.251 0 CA-C-N 116.554 -0.293 . . . . 0.0 110.835 177.368 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 76' ' ' GLU . . . . . 0.711 ' HG2' ' HA ' ' A' ' 73' ' ' LYS . 12.2 pt-20 -62.05 -35.39 78.48 Favored 'General case' 0 N--CA 1.462 0.167 0 CA-C-O 120.84 0.353 . . . . 0.0 110.223 176.709 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 77' ' ' ALA . . . . . . . . . . . . . . . -73.8 -32.7 63.88 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.21 -0.45 . . . . 0.0 110.85 176.987 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 78' ' ' ASP . . . . . . . . . . . . . 19.3 t70 -61.68 -54.77 38.26 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.099 -0.5 . . . . 0.0 110.787 178.47 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 79' ' ' GLY . . . . . . . . . . . . . . . 145.89 50.43 0.03 OUTLIER Glycine 0 N--CA 1.45 -0.427 0 C-N-CA 120.275 -0.964 . . . . 0.0 113.068 177.076 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 80' ' ' VAL . . . . . 0.443 HG21 HD22 ' A' ' 85' ' ' LEU . 31.0 m -106.56 155.48 7.34 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.514 0 O-C-N 122.652 -0.322 . . . . 0.0 110.334 177.055 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 81' ' ' SER . . . . . . . . . . . . . 13.0 m -70.73 150.55 45.8 Favored 'General case' 0 C--N 1.32 -0.682 0 CA-C-N 116.137 -0.483 . . . . 0.0 109.789 175.162 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 82' ' ' VAL . . . . . . . . . . . . . 14.1 p -60.75 -35.61 65.37 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.402 0 CA-C-O 120.597 0.237 . . . . 0.0 110.556 179.274 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 83' ' ' SER . . . . . . . . . . . . . 8.5 m -65.29 -37.49 87.31 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-O 121.081 0.467 . . . . 0.0 110.57 177.419 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 84' ' ' GLN . . . . . . . . . . . . . 6.1 tp-100 -68.42 -40.08 81.35 Favored 'General case' 0 C--N 1.332 -0.179 0 CA-C-N 115.971 -0.559 . . . . 0.0 109.609 177.031 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 85' ' ' LEU . . . . . 0.443 HD22 HG21 ' A' ' 80' ' ' VAL . 0.7 OUTLIER -65.12 -36.73 85.2 Favored 'General case' 0 C--N 1.327 -0.385 0 CA-C-N 115.59 -0.732 . . . . 0.0 109.486 177.35 . . . . . . . . 3 3 . 1 . 005 nuclear orig core ' A' A ' 86' ' ' ASN . . . . . . . . . . . . . 11.6 m120 -57.64 -39.47 77.06 Favored 'General case' 0 CA--C 1.519 -0.221 0 CA-C-N 116.046 -0.524 . . . . 0.0 110.622 175.261 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 87' ' ' SER . . . . . . . . . . . . . 49.0 m -65.23 -46.3 81.17 Favored 'General case' 0 C--N 1.326 -0.42 0 CA-C-N 116.407 -0.36 . . . . 0.0 110.547 178.588 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 88' ' ' TYR . . . . . . . . . . . . . 49.2 m-85 -57.5 -46.45 83.75 Favored 'General case' 0 N--CA 1.463 0.198 0 CA-C-O 121.01 0.433 . . . . 0.0 110.404 175.495 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 89' ' ' LYS . . . . . . . . . . . . . 38.4 ttmt -66.44 -35.6 80.69 Favored 'General case' 0 C--N 1.324 -0.528 0 CA-C-N 115.652 -0.704 . . . . 0.0 110.734 -178.951 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 90' ' ' ASN . . . . . . . . . . . . . 25.9 t-20 -62.29 -47.86 82.46 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-O 120.943 0.401 . . . . 0.0 110.207 178.553 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 91' ' ' TYR . . . . . . . . . . . . . 31.0 m-85 -62.3 -50.94 69.65 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.085 -0.507 . . . . 0.0 110.185 177.361 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 92' ' ' CYS . . . . . 0.63 ' SG ' ' HB3' ' A' ' 68' ' ' ALA . 42.0 t -63.96 -48.56 76.0 Favored 'General case' 0 C--N 1.323 -0.579 0 N-CA-C 112.368 0.507 . . . . 0.0 112.368 -175.262 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 93' ' ' ARG . . . . . . . . . . . . . 72.5 ttt180 -70.93 -38.5 72.91 Favored 'General case' 0 C--N 1.324 -0.504 0 N-CA-C 111.914 0.338 . . . . 0.0 111.914 -173.293 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 94' ' ' ASN . . . . . . . . . . . . . 73.1 m-20 -102.96 -58.12 1.93 Allowed 'General case' 0 C--N 1.324 -0.527 0 C-N-CA 120.912 -0.315 . . . . 0.0 111.718 -172.437 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 95' ' ' HIS . . . . . . . . . . . . . 78.0 m-70 -74.05 -42.7 59.84 Favored 'General case' 0 C--N 1.326 -0.425 0 CA-C-O 120.73 0.3 . . . . 0.0 111.086 -174.572 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 96' ' ' LEU . . . . . 0.541 ' HB2' ' HA ' ' A' ' 92' ' ' CYS . 96.0 mt -93.16 16.88 11.98 Favored 'General case' 0 C--N 1.325 -0.471 0 CA-C-N 116.475 -0.329 . . . . 0.0 110.63 179.414 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 97' ' ' SER . . . . . 0.571 ' N ' ' HD2' ' A' ' 98' ' ' PRO . 18.6 t -54.37 -47.55 97.28 Favored Pre-proline 0 CA--C 1.537 0.476 0 CA-C-N 115.811 -0.632 . . . . 0.0 111.427 178.665 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 98' ' ' PRO . . . . . 0.583 ' O ' ' HG3' ' A' ' 102' ' ' LYS . 10.3 Cg_endo -53.56 -32.38 63.6 Favored 'Trans proline' 0 C--N 1.36 1.143 0 C-N-CA 122.329 2.019 . . . . 0.0 112.758 175.554 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 99' ' ' LEU . . . . . 0.504 HD23 HG12 ' A' ' 112' ' ' ILE . 10.7 mp -81.22 -39.76 24.87 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-O 120.766 0.317 . . . . 0.0 110.865 178.243 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 100' ' ' TYR . . . . . . . . . . . . . 33.4 t80 -54.03 -33.69 57.98 Favored 'General case' 0 C--N 1.331 -0.225 0 CA-C-N 115.642 -0.708 . . . . 0.0 110.531 179.062 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 101' ' ' MET . . . . . . . . . . . . . 65.0 mtt -91.15 6.41 45.16 Favored 'General case' 0 C--N 1.327 -0.401 0 CA-C-N 115.539 -0.755 . . . . 0.0 111.652 -177.586 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 102' ' ' LYS . . . . . 0.583 ' HG3' ' O ' ' A' ' 98' ' ' PRO . 59.3 mttp -108.92 166.52 10.76 Favored 'General case' 0 C--N 1.326 -0.456 0 CA-C-O 121.555 0.693 . . . . 0.0 111.148 178.942 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 103' ' ' SER . . . . . 0.485 ' O ' HG13 ' A' ' 107' ' ' ILE . 28.6 t -96.93 160.38 14.38 Favored 'General case' 0 C--N 1.32 -0.703 0 CA-C-N 115.199 -0.909 . . . . 0.0 109.312 174.218 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 104' ' ' LEU . . . . . 0.5 ' HB3' HD12 ' A' ' 146' ' ' ILE . 84.9 mt -50.21 -59.57 3.81 Favored 'General case' 0 N--CA 1.468 0.469 0 N-CA-C 113.407 0.891 . . . . 0.0 113.407 -171.087 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 105' ' ' SER . . . . . . . . . . . . . 29.4 t -81.02 -0.47 39.85 Favored 'General case' 0 C--N 1.325 -0.483 0 CA-C-O 121.061 0.457 . . . . 0.0 111.046 -174.115 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 106' ' ' GLU . . . . . . . . . . . . . 3.4 mp0 -99.46 -1.8 37.62 Favored 'General case' 0 C--N 1.325 -0.481 0 CA-C-N 116.131 -0.486 . . . . 0.0 110.702 -175.962 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 107' ' ' ILE . . . . . 0.485 HG13 ' O ' ' A' ' 103' ' ' SER . 76.0 mt -87.13 129.0 39.31 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.455 0 CA-C-N 115.889 -0.596 . . . . 0.0 110.596 179.83 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 108' ' ' LEU . . . . . . . . . . . . . 91.9 mt -97.44 136.63 21.25 Favored Pre-proline 0 C--N 1.321 -0.636 0 CA-C-N 116.093 -0.503 . . . . 0.0 110.206 178.311 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 109' ' ' PRO . . . . . . . . . . . . . 32.5 Cg_exo -59.03 -32.94 98.42 Favored 'Trans proline' 0 CA--C 1.528 0.215 0 C-N-CA 122.738 2.292 . . . . 0.0 111.892 177.06 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 110' ' ' ALA . . . . . . . . . . . . . . . -67.04 -30.72 70.87 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 115.77 -0.65 . . . . 0.0 110.988 178.651 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 111' ' ' ASP . . . . . 0.428 ' O ' HG13 ' A' ' 115' ' ' ILE . 32.5 t70 -65.92 -39.61 90.7 Favored 'General case' 0 C--N 1.331 -0.218 0 N-CA-C 109.448 -0.575 . . . . 0.0 109.448 179.975 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 112' ' ' ILE . . . . . 0.504 HG12 HD23 ' A' ' 99' ' ' LEU . 15.6 mt -68.39 -40.95 83.09 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.308 0 CA-C-N 115.358 -0.837 . . . . 0.0 110.238 177.474 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 113' ' ' GLN . . . . . 0.493 ' HA ' HG22 ' A' ' 154' ' ' VAL . 0.0 OUTLIER -63.14 -40.63 98.13 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 115.911 -0.586 . . . . 0.0 109.988 -179.514 . . . . . . . . 3 3 . 1 . 005 nuclear orig core ' A' A ' 114' ' ' SER . . . . . . . . . . . . . 58.2 m -59.59 -41.47 90.36 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 116.358 -0.383 . . . . 0.0 110.862 176.921 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 115' ' ' ILE . . . . . 0.487 HD11 ' HG2' ' A' ' 98' ' ' PRO . 78.1 mt -57.65 -50.38 77.56 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.211 0 CA-C-O 120.81 0.338 . . . . 0.0 110.52 176.547 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 116' ' ' ILE . . . . . 0.4 HG21 ' HB3' ' A' ' 126' ' ' LEU . 49.5 mm -60.56 -43.2 94.0 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.343 0 CA-C-N 115.897 -0.592 . . . . 0.0 111.017 179.784 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 117' ' ' ASN . . . . . . . . . . . . . 55.1 t30 -67.18 -36.55 82.02 Favored 'General case' 0 C--N 1.324 -0.503 0 CA-C-N 115.925 -0.579 . . . . 0.0 111.492 -177.492 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 118' ' ' GLU . . . . . . . . . . . . . 43.2 mt-10 -84.19 -19.89 33.27 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 116.496 -0.32 . . . . 0.0 111.813 -177.43 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 119' ' ' THR . . . . . . . . . . . . . 96.1 m -70.82 126.29 29.18 Favored 'General case' 0 C--N 1.323 -0.563 0 N-CA-C 109.817 -0.438 . . . . 0.0 109.817 176.202 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 120' ' ' LYS . . . . . . . . . . . . . 21.8 mtpp -102.44 35.75 2.35 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-O 120.862 0.363 . . . . 0.0 111.591 -174.659 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 121' ' ' LEU . . . . . . . . . . . . . 3.9 mm? -100.92 -175.92 3.02 Favored 'General case' 0 C--N 1.323 -0.574 0 CA-C-N 116.215 -0.448 . . . . 0.0 109.919 177.105 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 122' ' ' ALA . . . . . 0.411 ' O ' ' HG ' ' A' ' 126' ' ' LEU . . . -69.65 162.68 27.2 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-O 121.072 0.463 . . . . 0.0 111.67 -177.228 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 123' ' ' LYS . . . . . . . . . . . . . 53.2 mtmt -62.84 -34.2 76.82 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 115.764 -0.653 . . . . 0.0 111.073 -179.043 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 124' ' ' ASN . . . . . 0.715 ' HA ' ' HE3' ' A' ' 127' ' ' LYS . 65.2 t30 -64.4 -39.45 93.88 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-O 121.06 0.457 . . . . 0.0 109.911 176.937 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 125' ' ' THR . . . . . 0.433 ' O ' HG13 ' A' ' 129' ' ' ILE . 3.5 m -65.98 -39.0 89.97 Favored 'General case' 0 C--N 1.327 -0.399 0 CA-C-N 115.665 -0.698 . . . . 0.0 110.29 178.6 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 126' ' ' LEU . . . . . 0.411 ' HG ' ' O ' ' A' ' 122' ' ' ALA . 85.0 mt -62.33 -43.16 99.47 Favored 'General case' 0 C--O 1.234 0.26 0 CA-C-N 115.862 -0.608 . . . . 0.0 110.563 177.151 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 127' ' ' LYS . . . . . 0.715 ' HE3' ' HA ' ' A' ' 124' ' ' ASN . 27.0 mtmt -59.92 -41.35 91.54 Favored 'General case' 0 C--N 1.331 -0.237 0 CA-C-N 116.132 -0.486 . . . . 0.0 110.766 177.328 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 128' ' ' ALA . . . . . . . . . . . . . . . -60.99 -34.78 75.32 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.148 -0.478 . . . . 0.0 111.327 -179.308 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 129' ' ' ILE . . . . . 0.433 HG13 ' O ' ' A' ' 125' ' ' THR . 64.6 mt -65.69 -50.55 70.51 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.304 0 CA-C-N 116.519 -0.31 . . . . 0.0 110.397 178.424 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 130' ' ' ARG . . . . . . . . . . . . . 24.5 ttt180 -60.68 -42.85 97.93 Favored 'General case' 0 N--CA 1.462 0.14 0 CA-C-N 116.455 -0.339 . . . . 0.0 110.336 176.23 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 131' ' ' ASN . . . . . . . . . . . . . 7.7 t30 -55.91 -52.31 64.56 Favored 'General case' 0 C--N 1.327 -0.384 0 CA-C-N 115.816 -0.629 . . . . 0.0 110.519 -179.768 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 132' ' ' THR . . . . . 0.568 ' O ' HG13 ' A' ' 136' ' ' ILE . 37.7 m -57.43 -48.88 77.95 Favored 'General case' 0 C--N 1.326 -0.442 0 CA-C-N 115.714 -0.675 . . . . 0.0 110.814 178.898 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 133' ' ' ALA . . . . . . . . . . . . . . . -63.3 -46.99 84.14 Favored 'General case' 0 C--N 1.331 -0.213 0 CA-C-N 116.109 -0.496 . . . . 0.0 111.601 -177.859 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 134' ' ' SER . . . . . . . . . . . . . 9.5 t -62.98 -38.78 92.53 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-O 120.73 0.3 . . . . 0.0 110.519 -177.596 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 135' ' ' GLN . . . . . 0.541 ' HB3' ' CE1' ' A' ' 71' ' ' PHE . 0.8 OUTLIER -61.73 -39.97 93.44 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.255 -0.43 . . . . 0.0 110.967 176.67 . . . . . . . . 3 3 . 1 . 005 nuclear orig core ' A' A ' 136' ' ' ILE . . . . . 0.568 HG13 ' O ' ' A' ' 132' ' ' THR . 66.3 mt -65.7 -48.52 82.11 Favored 'Isoleucine or valine' 0 C--O 1.233 0.213 0 CA-C-N 116.344 -0.389 . . . . 0.0 110.635 178.336 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 137' ' ' PHE . . . . . 0.458 ' O ' HG13 ' A' ' 141' ' ' ILE . 40.6 m-85 -58.19 -43.92 87.81 Favored 'General case' 0 CA--C 1.521 -0.143 0 CA-C-N 116.179 -0.464 . . . . 0.0 110.748 178.321 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 138' ' ' ARG . . . . . 0.59 ' O ' ' HG3' ' A' ' 142' ' ' GLU . 62.3 mtt85 -59.51 -42.3 91.88 Favored 'General case' 0 C--O 1.222 -0.354 0 CA-C-N 116.278 -0.419 . . . . 0.0 111.163 178.673 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 139' ' ' LEU . . . . . . . . . . . . . 57.4 tp -56.95 -41.89 79.1 Favored 'General case' 0 C--N 1.326 -0.456 0 CA-C-O 120.942 0.401 . . . . 0.0 110.398 178.301 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 140' ' ' ALA . . . . . . . . . . . . . . . -66.84 -40.46 87.96 Favored 'General case' 0 C--N 1.327 -0.389 0 CA-C-N 116.144 -0.48 . . . . 0.0 110.475 176.693 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 141' ' ' ILE . . . . . 0.458 HG13 ' O ' ' A' ' 137' ' ' PHE . 80.1 mt -63.3 -40.5 89.28 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.301 0 CA-C-N 116.207 -0.451 . . . . 0.0 110.831 178.428 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 142' ' ' GLU . . . . . 0.59 ' HG3' ' O ' ' A' ' 138' ' ' ARG . 50.2 mt-10 -63.47 -29.99 71.19 Favored 'General case' 0 C--N 1.331 -0.228 0 CA-C-O 120.812 0.339 . . . . 0.0 111.049 179.971 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 143' ' ' ASN . . . . . 0.447 ' N ' HD21 ' A' ' 143' ' ' ASN . 0.9 OUTLIER -92.98 6.18 48.82 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-O 120.95 0.405 . . . . 0.0 110.32 176.927 . . . . . . . . 3 3 . 1 . 005 nuclear orig core ' A' A ' 144' ' ' ARG . . . . . 0.418 ' HD3' ' HA ' ' A' ' 144' ' ' ARG . 3.8 mmt180 59.52 28.33 17.7 Favored 'General case' 0 N--CA 1.464 0.26 0 CA-C-N 115.545 -0.752 . . . . 0.0 112.096 179.087 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 145' ' ' ALA . . . . . . . . . . . . . . . -78.51 -31.25 47.56 Favored 'General case' 0 C--N 1.327 -0.395 0 CA-C-O 121.074 0.464 . . . . 0.0 109.965 176.874 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 146' ' ' ILE . . . . . 0.5 HD12 ' HB3' ' A' ' 104' ' ' LEU . 14.8 tt -141.75 142.48 28.37 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.464 0 CA-C-N 115.641 -0.708 . . . . 0.0 109.165 175.503 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 147' ' ' ASP . . . . . . . . . . . . . 33.1 t70 -108.28 25.66 11.37 Favored 'General case' 0 C--N 1.322 -0.626 0 CA-C-O 121.681 0.753 . . . . 0.0 110.394 -175.999 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 148' ' ' PHE . . . . . . . . . . . . . 80.7 t80 -148.81 141.96 24.98 Favored 'General case' 0 C--N 1.325 -0.498 0 CA-C-N 115.909 -0.587 . . . . 0.0 110.498 -177.393 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 149' ' ' ASN . . . . . . . . . . . . . 47.3 t-20 -116.73 99.61 52.95 Favored Pre-proline 0 C--N 1.326 -0.427 0 N-CA-C 110.111 -0.329 . . . . 0.0 110.111 177.83 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 150' ' ' PRO . . . . . . . . . . . . . 24.1 Cg_exo -64.54 -21.69 65.68 Favored 'Trans proline' 0 C--N 1.342 0.229 0 C-N-CA 122.892 2.395 . . . . 0.0 112.757 -178.593 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 151' ' ' ALA . . . . . 0.453 ' O ' HG12 ' A' ' 154' ' ' VAL . . . -73.62 -14.35 61.16 Favored 'General case' 0 C--N 1.327 -0.39 0 CA-C-O 120.875 0.369 . . . . 0.0 111.322 -176.719 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 152' ' ' ASP . . . . . . . . . . . . . 24.1 t70 -64.87 -27.89 69.17 Favored 'General case' 0 C--N 1.324 -0.54 0 CA-C-O 121.044 0.45 . . . . 0.0 110.395 178.201 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 153' ' ' TYR . . . . . . . . . . . . . 63.2 m-85 -97.26 0.81 48.78 Favored 'General case' 0 C--N 1.328 -0.343 0 N-CA-C 112.787 0.662 . . . . 0.0 112.787 -175.275 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 154' ' ' VAL . . . . . 0.493 HG22 ' HA ' ' A' ' 113' ' ' GLN . 6.3 p -94.21 106.7 18.39 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.384 0 C-N-CA 119.667 -0.813 . . . . 0.0 110.224 177.146 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 155' ' ' ARG . . . . . . . . . . . . . 18.2 ptt180 -93.04 144.55 25.15 Favored 'General case' 0 C--N 1.322 -0.622 0 CA-C-N 115.666 -0.697 . . . . 0.0 111.015 -177.249 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 156' ' ' ILE . . . . . . . . . . . . . 44.4 mm -89.25 116.82 67.34 Favored Pre-proline 0 C--N 1.323 -0.555 0 CA-C-N 115.655 -0.702 . . . . 0.0 109.803 179.616 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 157' ' ' PRO . . . . . . . . . . . . . 13.0 Cg_exo . . . . . 0 N--CA 1.464 -0.264 0 C-N-CA 122.613 2.209 . . . . 0.0 111.867 -179.613 . . . . . . . . 0 0 . 1 . 006 nuclear orig core ' A' A ' 63' ' ' SER . . . . . 0.5 ' HA ' ' HA ' ' A' ' 103' ' ' SER . 10.7 p . . . . . 0 N--CA 1.452 -0.352 0 N-CA-C 110.259 -0.274 . . . . 0.0 110.259 . . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 64' ' ' PHE . . . . . 0.503 ' HB2' HD11 ' A' ' 107' ' ' ILE . 86.6 t80 -60.99 -34.55 74.96 Favored 'General case' 0 C--N 1.33 -0.249 0 N-CA-C 109.933 -0.395 . . . . 0.0 109.933 179.693 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 65' ' ' GLY . . . . . . . . . . . . . . . -58.5 -44.82 95.19 Favored Glycine 0 N--CA 1.447 -0.6 0 CA-C-N 115.901 -0.59 . . . . 0.0 112.256 176.326 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 66' ' ' ASP . . . . . . . . . . . . . 36.9 t70 -65.08 -40.98 95.42 Favored 'General case' 0 C--N 1.327 -0.393 0 CA-C-O 120.819 0.342 . . . . 0.0 110.324 178.273 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 67' ' ' TRP . . . . . 0.411 ' CH2' ' HA ' ' A' ' 140' ' ' ALA . 87.0 m95 -62.36 -42.02 99.07 Favored 'General case' 0 C--N 1.332 -0.18 0 CA-C-N 116.278 -0.419 . . . . 0.0 110.967 177.011 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 68' ' ' ALA . . . . . 0.503 ' O ' ' HG ' ' A' ' 72' ' ' LEU . . . -59.73 -44.69 93.65 Favored 'General case' 0 C--N 1.327 -0.373 0 CA-C-N 116.287 -0.415 . . . . 0.0 110.669 177.8 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 69' ' ' GLU . . . . . . . . . . . . . 80.6 mt-10 -61.57 -42.85 99.44 Favored 'General case' 0 C--N 1.325 -0.461 0 CA-C-N 116.242 -0.436 . . . . 0.0 111.177 178.51 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 70' ' ' LYS . . . . . . . . . . . . . 43.2 mtmt -69.63 -28.64 66.09 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.272 -0.422 . . . . 0.0 110.731 179.639 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 71' ' ' PHE . . . . . . . . . . . . . 87.8 t80 -74.53 -40.12 61.94 Favored 'General case' 0 C--N 1.325 -0.488 0 CA-C-N 116.07 -0.514 . . . . 0.0 110.216 176.371 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 72' ' ' LEU . . . . . 0.503 ' HG ' ' O ' ' A' ' 68' ' ' ALA . 91.1 mt -65.93 -36.48 83.48 Favored 'General case' 0 C--N 1.327 -0.37 0 CA-C-O 120.883 0.373 . . . . 0.0 110.307 176.773 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 73' ' ' LYS . . . . . . . . . . . . . 39.4 ttmt -63.11 -45.8 90.31 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 115.943 -0.571 . . . . 0.0 110.642 178.472 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 74' ' ' SER . . . . . . . . . . . . . 6.4 p -73.75 -39.8 63.97 Favored 'General case' 0 C--N 1.326 -0.456 0 CA-C-N 115.847 -0.615 . . . . 0.0 111.323 -178.023 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 75' ' ' LYS . . . . . 0.476 ' O ' ' HB3' ' A' ' 78' ' ' ASP . 10.8 tptp -69.61 -21.93 63.54 Favored 'General case' 0 N--CA 1.454 -0.268 0 CA-C-O 120.811 0.338 . . . . 0.0 111.074 179.29 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 76' ' ' GLU . . . . . . . . . . . . . 31.1 tt0 -73.15 -43.5 61.44 Favored 'General case' 0 C--N 1.324 -0.532 0 N-CA-C 109.304 -0.628 . . . . 0.0 109.304 174.183 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 77' ' ' ALA . . . . . . . . . . . . . . . -65.65 -27.18 68.19 Favored 'General case' 0 C--N 1.331 -0.213 0 CA-C-N 115.668 -0.696 . . . . 0.0 110.672 175.714 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 78' ' ' ASP . . . . . 0.476 ' HB3' ' O ' ' A' ' 75' ' ' LYS . 18.5 t0 -51.98 -44.1 63.87 Favored 'General case' 0 C--O 1.235 0.295 0 CA-C-N 115.555 -0.748 . . . . 0.0 109.605 173.712 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 79' ' ' GLY . . . . . . . . . . . . . . . 107.31 29.06 4.65 Favored Glycine 0 N--CA 1.448 -0.521 0 CA-C-N 115.44 -0.8 . . . . 0.0 112.141 -179.315 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 80' ' ' VAL . . . . . . . . . . . . . 33.1 m -69.63 150.35 10.34 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.347 0 CA-C-O 120.956 0.407 . . . . 0.0 110.675 179.758 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 81' ' ' SER . . . . . . . . . . . . . 14.0 m -72.92 168.34 19.16 Favored 'General case' 0 C--N 1.324 -0.518 0 CA-C-N 115.849 -0.614 . . . . 0.0 111.016 -179.383 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 82' ' ' VAL . . . . . . . . . . . . . 48.9 t -57.44 -52.37 57.88 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.187 0 CA-C-N 116.259 -0.428 . . . . 0.0 111.425 -176.523 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 83' ' ' SER . . . . . . . . . . . . . 59.8 m -62.42 -27.6 69.21 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-O 120.891 0.377 . . . . 0.0 111.113 -179.095 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 84' ' ' GLN . . . . . . . . . . . . . 51.5 tp60 -69.18 -54.55 14.25 Favored 'General case' 0 C--N 1.327 -0.396 0 CA-C-N 116.152 -0.476 . . . . 0.0 109.812 -179.74 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 85' ' ' LEU . . . . . . . . . . . . . 31.7 tp -69.17 -30.33 68.53 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.22 -0.446 . . . . 0.0 110.216 179.835 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 86' ' ' ASN . . . . . . . . . . . . . 27.2 t-20 -58.03 -44.65 87.45 Favored 'General case' 0 C--O 1.235 0.3 0 CA-C-N 116.094 -0.503 . . . . 0.0 110.195 176.018 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 87' ' ' SER . . . . . . . . . . . . . 8.7 t -66.83 -39.24 87.58 Favored 'General case' 0 N--CA 1.452 -0.327 0 CA-C-N 115.66 -0.7 . . . . 0.0 110.1 178.821 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 88' ' ' TYR . . . . . . . . . . . . . 30.9 m-85 -59.17 -46.32 88.71 Favored 'General case' 0 C--O 1.231 0.101 0 CA-C-N 116.321 -0.399 . . . . 0.0 111.106 177.053 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 89' ' ' LYS . . . . . . . . . . . . . 88.3 mttt -62.82 -44.38 96.3 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.5 -0.318 . . . . 0.0 110.45 179.09 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 90' ' ' ASN . . . . . . . . . . . . . 27.1 t-20 -57.98 -50.35 73.71 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.095 -0.502 . . . . 0.0 110.913 -179.5 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 91' ' ' TYR . . . . . . . . . . . . . 22.3 m-30 -58.68 -52.1 67.11 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.321 -0.4 . . . . 0.0 110.909 -179.492 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 92' ' ' CYS . . . . . 0.45 ' HA ' ' HB2' ' A' ' 96' ' ' LEU . 61.5 m -67.52 -44.9 77.26 Favored 'General case' 0 C--N 1.325 -0.461 0 CA-C-N 116.173 -0.467 . . . . 0.0 112.117 -173.771 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 93' ' ' ARG . . . . . . . . . . . . . 23.9 mmm-85 -81.08 -28.97 35.07 Favored 'General case' 0 C--N 1.329 -0.318 0 N-CA-C 112.194 0.442 . . . . 0.0 112.194 -173.123 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 94' ' ' ASN . . . . . . . . . . . . . 0.9 OUTLIER -105.54 -61.95 1.42 Allowed 'General case' 0 C--N 1.328 -0.366 0 C-N-CA 120.407 -0.517 . . . . 0.0 112.115 -176.409 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 95' ' ' HIS . . . . . . . . . . . . . 38.9 t-80 -75.84 -26.21 56.95 Favored 'General case' 0 C--N 1.326 -0.416 0 CA-C-O 120.826 0.346 . . . . 0.0 111.148 -172.37 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 96' ' ' LEU . . . . . 0.455 HD21 HD12 ' A' ' 99' ' ' LEU . 86.7 mt -108.37 14.95 24.4 Favored 'General case' 0 C--N 1.324 -0.504 0 CA-C-N 116.334 -0.394 . . . . 0.0 110.69 -179.793 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 97' ' ' SER . . . . . 0.58 ' N ' ' HD2' ' A' ' 98' ' ' PRO . 8.1 t -57.76 -46.03 99.77 Favored Pre-proline 0 CA--C 1.541 0.632 0 CA-C-N 116.342 -0.39 . . . . 0.0 111.897 -179.249 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 98' ' ' PRO . . . . . 0.58 ' HD2' ' N ' ' A' ' 97' ' ' SER . 10.2 Cg_endo -55.13 -28.19 59.65 Favored 'Trans proline' 0 C--N 1.357 0.992 0 C-N-CA 122.306 2.004 . . . . 0.0 112.591 175.604 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 99' ' ' LEU . . . . . 0.464 HD13 HG12 ' A' ' 112' ' ' ILE . 72.8 mt -89.29 -30.48 18.44 Favored 'General case' 0 C--N 1.326 -0.413 0 CA-C-N 116.251 -0.431 . . . . 0.0 110.219 -179.895 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 100' ' ' TYR . . . . . . . . . . . . . 16.4 t80 -57.11 -39.84 75.88 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 115.473 -0.785 . . . . 0.0 110.577 -179.519 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 101' ' ' MET . . . . . . . . . . . . . 24.7 ttt -76.47 -23.23 53.83 Favored 'General case' 0 C--O 1.233 0.222 0 CA-C-N 115.764 -0.653 . . . . 0.0 110.751 179.706 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 102' ' ' LYS . . . . . . . . . . . . . 50.0 mttm -75.72 146.46 40.1 Favored 'General case' 0 C--N 1.323 -0.573 0 CA-C-O 121.298 0.57 . . . . 0.0 111.63 -177.945 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 103' ' ' SER . . . . . 0.5 ' HA ' ' HA ' ' A' ' 63' ' ' SER . 7.4 m -76.4 160.73 29.29 Favored 'General case' 0 N--CA 1.445 -0.698 0 N-CA-C 108.109 -1.071 . . . . 0.0 108.109 169.788 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 104' ' ' LEU . . . . . 0.532 ' HG ' HD13 ' A' ' 146' ' ' ILE . 18.0 tp -56.5 -33.48 66.03 Favored 'General case' 0 C--N 1.323 -0.568 0 N-CA-C 111.914 0.339 . . . . 0.0 111.914 -174.007 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 105' ' ' SER . . . . . . . . . . . . . 12.1 p -87.77 -2.11 58.4 Favored 'General case' 0 CA--C 1.536 0.437 0 N-CA-C 112.416 0.524 . . . . 0.0 112.416 -177.698 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 106' ' ' GLU . . . . . 0.412 ' HG3' ' HB2' ' A' ' 103' ' ' SER . 43.3 mt-10 -94.41 -6.11 44.82 Favored 'General case' 0 C--O 1.234 0.268 0 CA-C-O 120.93 0.395 . . . . 0.0 111.17 -178.519 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 107' ' ' ILE . . . . . 0.503 HD11 ' HB2' ' A' ' 64' ' ' PHE . 74.8 mt -95.19 120.13 44.19 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.685 0 CA-C-N 116.147 -0.479 . . . . 0.0 111.456 -173.341 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 108' ' ' LEU . . . . . . . . . . . . . 85.7 mt -101.47 152.47 38.02 Favored Pre-proline 0 C--N 1.323 -0.549 0 CA-C-N 115.726 -0.67 . . . . 0.0 109.618 176.744 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 109' ' ' PRO . . . . . . . . . . . . . 18.4 Cg_endo -61.77 -24.39 77.38 Favored 'Trans proline' 0 C--O 1.233 0.235 0 C-N-CA 122.235 1.957 . . . . 0.0 111.516 176.446 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 110' ' ' ALA . . . . . . . . . . . . . . . -69.42 -38.44 77.9 Favored 'General case' 0 N--CA 1.452 -0.354 0 CA-C-N 115.612 -0.722 . . . . 0.0 111.011 179.761 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 111' ' ' ASP . . . . . 0.42 ' O ' HG13 ' A' ' 115' ' ' ILE . 54.6 m-20 -57.7 -52.94 63.37 Favored 'General case' 0 N--CA 1.464 0.228 0 CA-C-O 121.129 0.49 . . . . 0.0 110.437 -179.508 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 112' ' ' ILE . . . . . 0.464 HG12 HD13 ' A' ' 99' ' ' LEU . 28.4 mt -62.58 -47.39 93.16 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.51 0 CA-C-N 115.388 -0.824 . . . . 0.0 111.015 -177.745 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 113' ' ' GLN . . . . . . . . . . . . . 12.2 tm0? -64.97 -40.11 94.5 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.166 -0.47 . . . . 0.0 110.653 -176.2 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 114' ' ' SER . . . . . . . . . . . . . 27.9 t -57.11 -49.47 75.8 Favored 'General case' 0 C--O 1.237 0.438 0 CA-C-O 120.842 0.354 . . . . 0.0 110.477 179.034 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 115' ' ' ILE . . . . . 0.42 HG13 ' O ' ' A' ' 111' ' ' ASP . 60.9 mt -59.4 -49.34 83.89 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.179 0 CA-C-N 115.943 -0.571 . . . . 0.0 109.969 179.015 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 116' ' ' ILE . . . . . 0.436 HG23 HD12 ' A' ' 156' ' ' ILE . 33.4 mm -56.16 -44.29 78.59 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.227 0 CA-C-N 116.033 -0.531 . . . . 0.0 111.024 178.462 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 117' ' ' ASN . . . . . . . . . . . . . 10.1 t30 -55.62 -40.73 72.51 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 115.826 -0.624 . . . . 0.0 112.207 -177.494 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 118' ' ' GLU . . . . . . . . . . . . . 10.9 pt-20 -92.29 -9.22 42.79 Favored 'General case' 0 C--N 1.325 -0.462 0 N-CA-C 112.308 0.484 . . . . 0.0 112.308 -178.572 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 119' ' ' THR . . . . . . . . . . . . . 84.4 m -76.25 132.73 40.04 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-O 120.731 0.301 . . . . 0.0 110.844 178.91 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 120' ' ' LYS . . . . . 0.449 ' HE3' ' HB2' ' A' ' 120' ' ' LYS . 39.3 mtmt -106.91 89.55 3.04 Favored 'General case' 0 C--N 1.328 -0.364 0 N-CA-C 110.247 -0.279 . . . . 0.0 110.247 179.619 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 121' ' ' LEU . . . . . . . . . . . . . 86.8 mt -135.44 173.23 11.95 Favored 'General case' 0 C--N 1.322 -0.598 0 CA-C-N 116.565 -0.289 . . . . 0.0 110.265 178.27 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 122' ' ' ALA . . . . . . . . . . . . . . . -68.4 157.19 36.3 Favored 'General case' 0 C--N 1.327 -0.384 0 CA-C-N 116.359 -0.382 . . . . 0.0 110.543 178.906 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 123' ' ' LYS . . . . . . . . . . . . . 59.2 pttt -57.56 -36.41 71.63 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.2 -0.454 . . . . 0.0 110.83 -179.556 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 124' ' ' ASN . . . . . . . . . . . . . 52.9 t30 -64.82 -46.25 82.76 Favored 'General case' 0 C--N 1.332 -0.161 0 CA-C-N 116.235 -0.439 . . . . 0.0 110.405 177.591 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 125' ' ' THR . . . . . 0.475 ' O ' HG13 ' A' ' 129' ' ' ILE . 2.3 m -66.39 -45.31 80.46 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 115.573 -0.739 . . . . 0.0 111.187 -176.246 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 126' ' ' LEU . . . . . 0.635 ' HB3' HD13 ' A' ' 156' ' ' ILE . 83.8 mt -61.84 -48.01 82.48 Favored 'General case' 0 C--O 1.234 0.246 0 CA-C-N 116.286 -0.415 . . . . 0.0 111.248 -179.144 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 127' ' ' LYS . . . . . . . . . . . . . 98.1 mttt -63.56 -35.11 79.4 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.378 -0.374 . . . . 0.0 110.782 177.81 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 128' ' ' ALA . . . . . . . . . . . . . . . -62.18 -43.28 99.18 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-N 116.57 -0.286 . . . . 0.0 110.969 179.517 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 129' ' ' ILE . . . . . 0.475 HG13 ' O ' ' A' ' 125' ' ' THR . 68.4 mt -61.28 -47.52 93.13 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.33 0 CA-C-O 120.878 0.37 . . . . 0.0 110.499 178.491 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 130' ' ' ARG . . . . . 0.464 ' HD2' ' HB ' ' A' ' 154' ' ' VAL . 9.7 ttt180 -65.31 -45.89 82.52 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.258 -0.428 . . . . 0.0 111.213 -179.666 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 131' ' ' ASN . . . . . . . . . . . . . 92.9 m-20 -63.94 -33.39 75.61 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-O 120.65 0.262 . . . . 0.0 111.094 -179.755 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 132' ' ' THR . . . . . . . . . . . . . 98.0 m -65.53 -45.35 83.81 Favored 'General case' 0 C--N 1.325 -0.493 0 CA-C-O 120.887 0.375 . . . . 0.0 110.331 174.823 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 133' ' ' ALA . . . . . . . . . . . . . . . -64.4 -43.88 93.04 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 115.923 -0.58 . . . . 0.0 111.111 -179.386 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 134' ' ' SER . . . . . 0.534 ' O ' ' HG3' ' A' ' 138' ' ' ARG . 23.6 p -64.3 -35.51 81.1 Favored 'General case' 0 C--N 1.331 -0.196 0 CA-C-N 116.667 -0.242 . . . . 0.0 110.797 -179.373 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 135' ' ' GLN . . . . . . . . . . . . . 13.1 mm100 -59.63 -42.06 91.88 Favored 'General case' 0 C--N 1.331 -0.236 0 CA-C-O 120.803 0.335 . . . . 0.0 110.794 175.034 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 136' ' ' ILE . . . . . . . . . . . . . 69.3 mt -65.07 -42.98 95.89 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.365 0 CA-C-N 115.938 -0.573 . . . . 0.0 110.508 178.045 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 137' ' ' PHE . . . . . 0.437 ' O ' HG13 ' A' ' 141' ' ' ILE . 35.3 m-85 -66.92 -37.83 85.06 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.213 -0.449 . . . . 0.0 110.927 178.207 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 138' ' ' ARG . . . . . 0.534 ' HG3' ' O ' ' A' ' 134' ' ' SER . 54.1 mtp180 -59.32 -43.33 92.69 Favored 'General case' 0 CA--C 1.517 -0.324 0 N-CA-C 110.022 -0.362 . . . . 0.0 110.022 174.92 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 139' ' ' LEU . . . . . . . . . . . . . 49.9 tp -58.87 -41.18 86.47 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 115.75 -0.659 . . . . 0.0 110.075 178.205 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 140' ' ' ALA . . . . . 0.436 ' HB1' HD22 ' A' ' 104' ' ' LEU . . . -64.99 -41.63 95.23 Favored 'General case' 0 C--N 1.327 -0.391 0 CA-C-N 116.086 -0.506 . . . . 0.0 110.62 177.16 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 141' ' ' ILE . . . . . 0.437 HG13 ' O ' ' A' ' 137' ' ' PHE . 74.7 mt -61.81 -46.11 97.23 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.374 0 CA-C-N 116.14 -0.482 . . . . 0.0 110.902 176.299 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 142' ' ' GLU . . . . . 0.4 ' HG3' ' O ' ' A' ' 138' ' ' ARG . 44.5 mt-10 -60.61 -36.77 79.41 Favored 'General case' 0 N--CA 1.465 0.282 0 CA-C-O 120.79 0.329 . . . . 0.0 111.012 178.548 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 143' ' ' ASN . . . . . . . . . . . . . 40.4 m-80 -88.23 10.44 19.56 Favored 'General case' 0 C--N 1.331 -0.225 0 CA-C-N 116.154 -0.475 . . . . 0.0 110.719 178.934 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 144' ' ' ARG . . . . . . . . . . . . . 61.6 mtt-85 64.23 21.71 12.61 Favored 'General case' 0 N--CA 1.466 0.334 0 CA-C-N 115.621 -0.718 . . . . 0.0 112.389 171.246 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 145' ' ' ALA . . . . . . . . . . . . . . . -85.26 -27.6 25.91 Favored 'General case' 0 C--N 1.323 -0.552 0 CA-C-O 120.806 0.336 . . . . 0.0 111.595 -176.678 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 146' ' ' ILE . . . . . 0.532 HD13 ' HG ' ' A' ' 104' ' ' LEU . 13.8 tt -143.88 149.58 17.72 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.536 0 CA-C-O 120.906 0.384 . . . . 0.0 110.452 -179.79 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 147' ' ' ASP . . . . . . . . . . . . . 0.9 OUTLIER -114.92 25.03 11.24 Favored 'General case' 0 C--N 1.325 -0.46 0 CA-C-O 121.254 0.549 . . . . 0.0 110.249 179.524 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 148' ' ' PHE . . . . . . . . . . . . . 60.1 t80 -144.29 134.01 23.67 Favored 'General case' 0 C--N 1.323 -0.582 0 CA-C-N 115.581 -0.736 . . . . 0.0 109.589 -174.434 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 149' ' ' ASN . . . . . . . . . . . . . 53.6 t-20 -115.19 95.66 43.05 Favored Pre-proline 0 C--N 1.324 -0.525 0 N-CA-C 109.987 -0.375 . . . . 0.0 109.987 178.5 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 150' ' ' PRO . . . . . . . . . . . . . 32.9 Cg_exo -58.62 -33.18 98.01 Favored 'Trans proline' 0 C--N 1.342 0.225 0 C-N-CA 122.937 2.425 . . . . 0.0 112.769 -178.575 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 151' ' ' ALA . . . . . 0.478 ' HA ' HG23 ' A' ' 154' ' ' VAL . . . -73.38 -20.73 60.69 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 116.442 -0.345 . . . . 0.0 111.502 -176.327 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 152' ' ' ASP . . . . . . . . . . . . . 29.9 t70 -70.15 -23.72 63.05 Favored 'General case' 0 C--N 1.325 -0.5 0 CA-C-O 121.123 0.487 . . . . 0.0 110.62 178.942 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 153' ' ' TYR . . . . . . . . . . . . . 77.0 m-85 -96.59 -2.88 43.97 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.114 -0.493 . . . . 0.0 110.763 -178.571 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 154' ' ' VAL . . . . . 0.478 HG23 ' HA ' ' A' ' 151' ' ' ALA . 61.0 t -77.64 117.66 23.15 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.391 0 CA-C-N 116.384 -0.371 . . . . 0.0 110.374 179.19 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 155' ' ' ARG . . . . . . . . . . . . . 51.1 mtp85 -92.12 141.9 28.09 Favored 'General case' 0 C--N 1.318 -0.802 0 CA-C-O 120.972 0.415 . . . . 0.0 110.514 176.32 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 156' ' ' ILE . . . . . 0.635 HD13 ' HB3' ' A' ' 126' ' ' LEU . 2.9 tp -106.97 129.31 24.55 Favored Pre-proline 0 C--N 1.318 -0.789 0 CA-C-N 115.456 -0.793 . . . . 0.0 109.609 -176.889 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 157' ' ' PRO . . . . . . . . . . . . . 86.1 Cg_endo . . . . . 0 N--CA 1.454 -0.8 0 C-N-CA 122.631 2.221 . . . . 0.0 113.08 -179.426 . . . . . . . . 0 0 . 1 . 007 nuclear orig core ' A' A ' 63' ' ' SER . . . . . 0.592 ' HA ' ' HA ' ' A' ' 103' ' ' SER . 47.0 m . . . . . 0 N--CA 1.444 -0.77 0 CA-C-O 120.753 0.311 . . . . 0.0 110.54 . . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 64' ' ' PHE . . . . . 0.49 ' HB3' ' O ' ' A' ' 99' ' ' LEU . 80.6 t80 -58.47 -34.4 70.84 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 115.865 -0.607 . . . . 0.0 111.145 -176.171 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 65' ' ' GLY . . . . . . . . . . . . . . . -61.68 -40.78 99.23 Favored Glycine 0 N--CA 1.453 -0.224 0 C-N-CA 120.898 -0.668 . . . . 0.0 112.636 179.901 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 66' ' ' ASP . . . . . . . . . . . . . 24.7 t70 -61.11 -52.16 66.08 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-O 120.936 0.398 . . . . 0.0 110.163 177.635 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 67' ' ' TRP . . . . . . . . . . . . . 98.7 m95 -65.51 -34.47 78.33 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-N 115.58 -0.737 . . . . 0.0 111.403 -179.204 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 68' ' ' ALA . . . . . 0.58 ' O ' ' HG ' ' A' ' 72' ' ' LEU . . . -61.96 -50.85 70.46 Favored 'General case' 0 C--N 1.327 -0.377 0 CA-C-O 120.665 0.269 . . . . 0.0 110.827 178.598 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 69' ' ' GLU . . . . . . . . . . . . . 33.3 tt0 -69.87 -34.37 73.48 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-O 120.769 0.319 . . . . 0.0 110.213 -179.791 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 70' ' ' LYS . . . . . . . . . . . . . 48.9 tttm -61.72 -42.93 99.6 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-O 121.298 0.57 . . . . 0.0 109.556 176.264 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 71' ' ' PHE . . . . . . . . . . . . . 71.4 t80 -64.31 -45.15 89.17 Favored 'General case' 0 C--N 1.326 -0.423 0 CA-C-N 115.244 -0.889 . . . . 0.0 111.056 176.82 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 72' ' ' LEU . . . . . 0.58 ' HG ' ' O ' ' A' ' 68' ' ' ALA . 89.2 mt -61.44 -42.41 98.72 Favored 'General case' 0 C--N 1.327 -0.396 0 CA-C-O 121.017 0.436 . . . . 0.0 110.38 178.706 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 73' ' ' LYS . . . . . 0.499 ' HD2' ' HA ' ' A' ' 73' ' ' LYS . 18.2 tptt -70.0 -38.22 75.91 Favored 'General case' 0 C--N 1.326 -0.434 0 CA-C-N 115.842 -0.617 . . . . 0.0 111.15 -176.023 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 74' ' ' SER . . . . . . . . . . . . . 8.1 p -70.06 -32.4 70.48 Favored 'General case' 0 C--N 1.327 -0.376 0 C-N-CA 121.077 -0.249 . . . . 0.0 110.877 179.987 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 75' ' ' LYS . . . . . . . . . . . . . 30.8 mmtp -73.09 -37.28 66.81 Favored 'General case' 0 C--O 1.234 0.273 0 CA-C-O 120.775 0.322 . . . . 0.0 110.478 174.634 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 76' ' ' GLU . . . . . . . . . . . . . 42.0 tt0 -61.84 -46.12 90.83 Favored 'General case' 0 C--N 1.327 -0.379 0 CA-C-N 116.053 -0.521 . . . . 0.0 110.251 177.474 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 77' ' ' ALA . . . . . . . . . . . . . . . -70.54 -33.41 71.12 Favored 'General case' 0 C--N 1.325 -0.466 0 CA-C-N 115.816 -0.629 . . . . 0.0 111.072 177.644 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 78' ' ' ASP . . . . . . . . . . . . . 20.1 t70 -57.9 -47.05 83.95 Favored 'General case' 0 CA--C 1.518 -0.286 0 CA-C-N 116.142 -0.481 . . . . 0.0 110.431 177.449 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 79' ' ' GLY . . . . . . . . . . . . . . . 114.98 41.17 0.85 Allowed Glycine 0 N--CA 1.443 -0.835 0 C-N-CA 120.436 -0.887 . . . . 0.0 112.966 176.288 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 80' ' ' VAL . . . . . . . . . . . . . 29.0 m -77.33 157.53 5.29 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.442 0 N-CA-C 110.137 -0.319 . . . . 0.0 110.137 174.649 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 81' ' ' SER . . . . . . . . . . . . . 18.4 m -62.07 150.3 38.7 Favored 'General case' 0 C--N 1.324 -0.534 0 N-CA-C 110.239 -0.282 . . . . 0.0 110.239 177.925 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 82' ' ' VAL . . . . . . . . . . . . . 55.4 t -58.97 -42.82 87.24 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.495 0 CA-C-N 116.356 -0.384 . . . . 0.0 110.453 -177.348 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 83' ' ' SER . . . . . . . . . . . . . 13.4 m -59.44 -39.19 82.76 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 116.311 -0.404 . . . . 0.0 111.131 179.054 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 84' ' ' GLN . . . . . . . . . . . . . 7.7 tp-100 -63.32 -45.03 93.2 Favored 'General case' 0 C--O 1.234 0.274 0 CA-C-O 121.107 0.48 . . . . 0.0 110.298 177.407 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 85' ' ' LEU . . . . . . . . . . . . . 46.8 tp -67.88 -36.18 79.79 Favored 'General case' 0 C--N 1.327 -0.408 0 CA-C-N 115.936 -0.575 . . . . 0.0 110.428 179.455 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 86' ' ' ASN . . . . . . . . . . . . . 11.8 m120 -60.83 -47.2 87.45 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.233 -0.44 . . . . 0.0 110.563 178.215 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 87' ' ' SER . . . . . . . . . . . . . 3.5 p -63.36 -36.32 83.3 Favored 'General case' 0 CA--C 1.531 0.243 0 C-N-CA 121.038 -0.265 . . . . 0.0 111.319 179.396 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 88' ' ' TYR . . . . . . . . . . . . . 6.6 m-85 -59.62 -54.49 45.86 Favored 'General case' 0 C--O 1.233 0.232 0 CA-C-O 121.707 0.765 . . . . 0.0 110.167 174.236 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 89' ' ' LYS . . . . . 0.404 ' HE3' ' HB2' ' A' ' 89' ' ' LYS . 34.6 ttmt -65.59 -32.97 74.84 Favored 'General case' 0 C--N 1.325 -0.467 0 CA-C-N 114.597 -1.183 . . . . 0.0 110.88 -175.741 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 90' ' ' ASN . . . . . . . . . . . . . 27.6 t-20 -64.43 -52.18 59.41 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 116.02 -0.536 . . . . 0.0 111.324 179.708 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 91' ' ' TYR . . . . . . . . . . . . . 22.3 m-85 -61.06 -39.72 90.91 Favored 'General case' 0 C--O 1.234 0.259 0 CA-C-O 121.033 0.444 . . . . 0.0 110.233 179.756 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 92' ' ' CYS . . . . . 0.582 ' HA ' ' HB2' ' A' ' 96' ' ' LEU . 42.7 t -64.63 -49.57 70.56 Favored 'General case' 0 C--N 1.325 -0.474 0 CA-C-N 115.31 -0.859 . . . . 0.0 111.094 -178.09 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 93' ' ' ARG . . . . . . . . . . . . . 28.9 mmt180 -73.09 -6.56 46.47 Favored 'General case' 0 C--N 1.328 -0.35 0 N-CA-C 112.94 0.718 . . . . 0.0 112.94 -175.099 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 94' ' ' ASN . . . . . . . . . . . . . 52.7 m-80 -118.9 -64.66 1.25 Allowed 'General case' 0 C--N 1.327 -0.403 0 C-N-CA 119.537 -0.865 . . . . 0.0 112.721 -179.402 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 95' ' ' HIS . . . . . . . . . . . . . 82.7 m-70 -88.98 -20.49 24.39 Favored 'General case' 0 C--N 1.325 -0.469 0 N-CA-C 112.617 0.599 . . . . 0.0 112.617 -173.838 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 96' ' ' LEU . . . . . 0.582 ' HB2' ' HA ' ' A' ' 92' ' ' CYS . 83.4 mt -99.05 7.14 46.22 Favored 'General case' 0 C--N 1.325 -0.463 0 C-N-CA 120.946 -0.302 . . . . 0.0 111.065 -178.751 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 97' ' ' SER . . . . . 0.541 ' N ' ' HD2' ' A' ' 98' ' ' PRO . 50.2 m -57.63 -49.26 94.78 Favored Pre-proline 0 CA--C 1.537 0.453 0 CA-C-N 116.383 -0.371 . . . . 0.0 111.896 178.907 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 98' ' ' PRO . . . . . 0.541 ' HD2' ' N ' ' A' ' 97' ' ' SER . 9.5 Cg_endo -53.9 -40.07 82.13 Favored 'Trans proline' 0 C--N 1.358 1.037 0 C-N-CA 122.047 1.831 . . . . 0.0 112.458 176.727 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 99' ' ' LEU . . . . . 0.517 HD21 ' HD2' ' A' ' 102' ' ' LYS . 90.6 mt -75.28 -29.53 60.16 Favored 'General case' 0 C--N 1.332 -0.188 0 CA-C-N 116.255 -0.43 . . . . 0.0 111.107 -178.736 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 100' ' ' TYR . . . . . . . . . . . . . 23.4 t80 -55.74 -29.82 60.19 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 115.759 -0.655 . . . . 0.0 111.701 -174.318 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 101' ' ' MET . . . . . . . . . . . . . 65.2 mtt -106.77 10.75 30.72 Favored 'General case' 0 C--N 1.326 -0.44 0 CA-C-O 120.663 0.268 . . . . 0.0 111.571 -178.16 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 102' ' ' LYS . . . . . 0.523 ' HE3' ' OD2' ' A' ' 111' ' ' ASP . 68.3 mttm -97.03 134.41 40.42 Favored 'General case' 0 C--N 1.326 -0.424 0 N-CA-C 110.217 -0.29 . . . . 0.0 110.217 177.628 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 103' ' ' SER . . . . . 0.592 ' HA ' ' HA ' ' A' ' 63' ' ' SER . 68.0 m -73.52 152.28 40.72 Favored 'General case' 0 C--N 1.323 -0.568 0 N-CA-C 109.298 -0.631 . . . . 0.0 109.298 172.823 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 104' ' ' LEU . . . . . 0.407 ' HA ' HD11 ' A' ' 107' ' ' ILE . 82.2 mt -53.51 -35.9 61.16 Favored 'General case' 0 C--N 1.33 -0.276 0 N-CA-C 112.265 0.469 . . . . 0.0 112.265 -174.64 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 105' ' ' SER . . . . . . . . . . . . . 2.7 p -79.55 -6.81 57.79 Favored 'General case' 0 C--N 1.325 -0.474 0 N-CA-C 111.95 0.352 . . . . 0.0 111.95 -177.748 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 106' ' ' GLU . . . . . 0.528 ' OE1' ' HB2' ' A' ' 103' ' ' SER . 1.9 mp0 -112.21 7.21 19.4 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-O 120.746 0.308 . . . . 0.0 110.974 178.704 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 107' ' ' ILE . . . . . 0.504 HG13 ' O ' ' A' ' 103' ' ' SER . 81.8 mt -88.99 117.02 31.54 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.46 0 CA-C-O 121.106 0.479 . . . . 0.0 110.464 179.553 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 108' ' ' LEU . . . . . . . . . . . . . 85.6 mt -95.25 134.34 24.69 Favored Pre-proline 0 C--N 1.322 -0.609 0 CA-C-N 115.877 -0.601 . . . . 0.0 110.273 -179.868 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 109' ' ' PRO . . . . . . . . . . . . . 40.1 Cg_exo -58.79 -34.4 98.98 Favored 'Trans proline' 0 C--N 1.343 0.264 0 C-N-CA 122.643 2.229 . . . . 0.0 111.735 176.771 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 110' ' ' ALA . . . . . . . . . . . . . . . -70.64 -23.4 62.53 Favored 'General case' 0 C--N 1.33 -0.243 0 CA-C-N 115.624 -0.716 . . . . 0.0 111.106 178.702 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 111' ' ' ASP . . . . . 0.523 ' OD2' ' HE3' ' A' ' 102' ' ' LYS . 31.1 t70 -71.86 -42.97 66.25 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-O 121.181 0.515 . . . . 0.0 109.631 -179.932 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 112' ' ' ILE . . . . . 0.439 HD11 ' HB2' ' A' ' 150' ' ' PRO . 37.4 mt -67.89 -39.7 82.21 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.437 0 CA-C-N 115.69 -0.686 . . . . 0.0 110.186 176.689 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 113' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -59.86 -47.19 86.76 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 115.607 -0.724 . . . . 0.0 110.055 179.081 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 114' ' ' SER . . . . . . . . . . . . . 13.1 p -65.91 -27.56 68.28 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 116.261 -0.427 . . . . 0.0 111.148 -179.261 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 115' ' ' ILE . . . . . 0.518 HG13 ' O ' ' A' ' 111' ' ' ASP . 76.7 mt -61.19 -43.33 96.19 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.231 0 CA-C-O 121.198 0.523 . . . . 0.0 110.399 173.515 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 116' ' ' ILE . . . . . . . . . . . . . 50.7 mm -63.18 -33.35 60.42 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.599 0 CA-C-O 121.22 0.534 . . . . 0.0 110.17 177.228 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 117' ' ' ASN . . . . . . . . . . . . . 0.2 OUTLIER -75.56 -29.18 59.27 Favored 'General case' 0 C--N 1.326 -0.429 0 CA-C-N 115.799 -0.637 . . . . 0.0 110.77 -179.151 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 118' ' ' GLU . . . . . 0.477 ' HG3' ' HA ' ' A' ' 115' ' ' ILE . 3.1 pp20? -87.81 -8.99 55.19 Favored 'General case' 0 C--N 1.33 -0.245 0 C-N-CA 120.599 -0.441 . . . . 0.0 110.887 179.587 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 119' ' ' THR . . . . . . . . . . . . . 34.6 m -80.83 117.77 21.77 Favored 'General case' 0 N--CA 1.449 -0.5 0 N-CA-C 109.472 -0.566 . . . . 0.0 109.472 174.307 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 120' ' ' LYS . . . . . . . . . . . . . 67.3 mttm -98.29 32.14 2.57 Favored 'General case' 0 C--N 1.324 -0.534 0 CA-C-O 121.37 0.605 . . . . 0.0 110.77 -175.734 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 121' ' ' LEU . . . . . 0.406 HD22 HG22 ' A' ' 125' ' ' THR . 10.8 mp -100.86 -175.57 2.92 Favored 'General case' 0 C--N 1.322 -0.619 0 CA-C-N 115.642 -0.708 . . . . 0.0 110.266 178.998 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 122' ' ' ALA . . . . . 0.52 ' O ' ' HG ' ' A' ' 126' ' ' LEU . . . -75.03 164.56 26.41 Favored 'General case' 0 C--N 1.325 -0.495 0 CA-C-O 121.142 0.496 . . . . 0.0 111.888 -175.462 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 123' ' ' LYS . . . . . . . . . . . . . 64.6 tttp -59.86 -42.16 93.06 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 115.28 -0.873 . . . . 0.0 111.879 -175.784 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 124' ' ' ASN . . . . . . . . . . . . . 26.8 p-10 -63.29 -34.3 77.39 Favored 'General case' 0 C--N 1.326 -0.436 0 CA-C-O 120.822 0.344 . . . . 0.0 110.988 179.947 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 125' ' ' THR . . . . . 0.406 HG22 HD22 ' A' ' 121' ' ' LEU . 17.2 m -73.1 -38.02 66.51 Favored 'General case' 0 C--N 1.326 -0.428 0 CA-C-O 120.794 0.33 . . . . 0.0 110.358 177.989 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 126' ' ' LEU . . . . . 0.52 ' HG ' ' O ' ' A' ' 122' ' ' ALA . 89.5 mt -58.96 -49.01 79.49 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-O 121.146 0.498 . . . . 0.0 110.686 178.556 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 127' ' ' LYS . . . . . 0.515 ' HA ' ' HB3' ' A' ' 130' ' ' ARG . 16.4 ptmt -74.91 -20.25 59.79 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-N 116.072 -0.513 . . . . 0.0 110.93 -177.089 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 128' ' ' ALA . . . . . . . . . . . . . . . -66.57 -41.76 88.08 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-O 120.757 0.313 . . . . 0.0 110.62 174.822 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 129' ' ' ILE . . . . . . . . . . . . . 46.9 mt -64.86 -40.28 88.53 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.24 0 N-CA-C 109.192 -0.67 . . . . 0.0 109.192 175.057 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 130' ' ' ARG . . . . . 0.515 ' HB3' ' HA ' ' A' ' 127' ' ' LYS . 13.5 tpt85 -55.02 -45.41 75.16 Favored 'General case' 0 CA--C 1.533 0.314 0 CA-C-N 115.13 -0.941 . . . . 0.0 111.092 173.427 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 131' ' ' ASN . . . . . . . . . . . . . 12.9 m-80 -66.84 -47.04 73.2 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.366 -0.379 . . . . 0.0 111.251 178.637 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 132' ' ' THR . . . . . . . . . . . . . 40.3 m -57.9 -53.18 61.1 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.28 -0.418 . . . . 0.0 111.201 -178.786 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 133' ' ' ALA . . . . . . . . . . . . . . . -60.67 -36.25 78.27 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.234 -0.439 . . . . 0.0 111.034 -178.82 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 134' ' ' SER . . . . . 0.522 ' O ' ' HG3' ' A' ' 138' ' ' ARG . 39.0 t -60.31 -50.0 75.38 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.252 -0.431 . . . . 0.0 110.798 179.925 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 135' ' ' GLN . . . . . . . . . . . . . 75.4 mt-30 -59.47 -37.28 77.78 Favored 'General case' 0 C--N 1.331 -0.216 0 CA-C-N 116.384 -0.371 . . . . 0.0 110.832 -177.993 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 136' ' ' ILE . . . . . . . . . . . . . 71.0 mt -64.55 -47.35 89.49 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.386 0 CA-C-N 116.034 -0.53 . . . . 0.0 110.769 178.879 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 137' ' ' PHE . . . . . 0.453 ' O ' HG13 ' A' ' 141' ' ' ILE . 41.7 m-85 -65.98 -35.08 79.6 Favored 'General case' 0 C--N 1.331 -0.224 0 CA-C-N 116.544 -0.298 . . . . 0.0 111.41 179.543 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 138' ' ' ARG . . . . . 0.522 ' HG3' ' O ' ' A' ' 134' ' ' SER . 45.0 mtp-105 -61.9 -38.84 89.87 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-O 120.888 0.375 . . . . 0.0 110.492 178.157 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 139' ' ' LEU . . . . . . . . . . . . . 50.2 tp -60.55 -36.88 79.54 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-N 115.878 -0.601 . . . . 0.0 110.355 178.072 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 140' ' ' ALA . . . . . . . . . . . . . . . -69.6 -37.75 77.03 Favored 'General case' 0 C--N 1.327 -0.37 0 CA-C-N 115.961 -0.563 . . . . 0.0 110.365 177.353 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 141' ' ' ILE . . . . . 0.453 HG13 ' O ' ' A' ' 137' ' ' PHE . 70.2 mt -63.26 -44.46 99.21 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.277 0 CA-C-N 116.061 -0.518 . . . . 0.0 110.403 175.955 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 142' ' ' GLU . . . . . . . . . . . . . 51.8 mt-10 -62.14 -27.99 69.33 Favored 'General case' 0 C--N 1.331 -0.224 0 CA-C-N 116.129 -0.487 . . . . 0.0 111.59 178.632 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 143' ' ' ASN . . . . . 0.514 ' C ' ' HD2' ' A' ' 144' ' ' ARG . 34.9 m-80 -97.26 21.18 10.33 Favored 'General case' 0 C--N 1.324 -0.511 0 CA-C-N 116.143 -0.481 . . . . 0.0 110.783 178.439 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 144' ' ' ARG . . . . . 0.514 ' HD2' ' C ' ' A' ' 143' ' ' ASN . 0.0 OUTLIER 38.48 39.18 0.29 Allowed 'General case' 0 N--CA 1.472 0.648 0 C-N-CA 124.347 1.059 . . . . 0.0 112.496 -177.497 . . . . . . . . 3 3 . 1 . 007 nuclear orig core ' A' A ' 145' ' ' ALA . . . . . . . . . . . . . . . -88.33 -32.88 18.2 Favored 'General case' 0 C--N 1.325 -0.466 0 CA-C-N 115.808 -0.633 . . . . 0.0 109.613 176.983 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 146' ' ' ILE . . . . . 0.423 ' O ' ' HA ' ' A' ' 141' ' ' ILE . 16.6 tt -149.47 133.56 8.69 Favored 'Isoleucine or valine' 0 N--CA 1.449 -0.514 0 CA-C-N 115.283 -0.871 . . . . 0.0 109.439 177.506 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 147' ' ' ASP . . . . . . . . . . . . . 35.2 t70 -102.56 24.18 10.83 Favored 'General case' 0 C--N 1.325 -0.496 0 CA-C-O 122.09 0.948 . . . . 0.0 109.484 179.636 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 148' ' ' PHE . . . . . 0.406 ' H ' HG12 ' A' ' 146' ' ' ILE . 68.7 t80 -132.7 133.26 43.31 Favored 'General case' 0 C--N 1.319 -0.718 0 CA-C-N 114.927 -1.033 . . . . 0.0 109.64 -174.312 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 149' ' ' ASN . . . . . . . . . . . . . 18.5 t-20 -116.16 99.57 52.78 Favored Pre-proline 0 C--N 1.323 -0.571 0 N-CA-C 110.283 -0.266 . . . . 0.0 110.283 -179.84 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 150' ' ' PRO . . . . . 0.439 ' HB2' HD11 ' A' ' 112' ' ' ILE . 22.0 Cg_exo -65.67 -26.08 53.75 Favored 'Trans proline' 0 C--O 1.23 0.124 0 C-N-CA 122.68 2.253 . . . . 0.0 112.283 -178.818 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 151' ' ' ALA . . . . . . . . . . . . . . . -69.92 -20.89 63.33 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 115.995 -0.548 . . . . 0.0 111.333 -177.469 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 152' ' ' ASP . . . . . . . . . . . . . 25.2 t70 -64.15 -29.79 70.89 Favored 'General case' 0 C--O 1.234 0.253 0 CA-C-N 116.122 -0.49 . . . . 0.0 110.863 179.807 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 153' ' ' TYR . . . . . . . . . . . . . 78.7 m-85 -87.73 -5.19 58.78 Favored 'General case' 0 C--N 1.327 -0.383 0 CA-C-N 115.709 -0.678 . . . . 0.0 111.17 -176.175 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 154' ' ' VAL . . . . . . . . . . . . . 66.0 t -79.5 107.42 11.91 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.445 0 CA-C-O 120.929 0.395 . . . . 0.0 110.214 -179.399 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 155' ' ' ARG . . . . . . . . . . . . . 89.4 mtt180 -91.09 133.75 35.08 Favored 'General case' 0 C--N 1.323 -0.585 0 CA-C-N 116.104 -0.498 . . . . 0.0 110.54 -178.432 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 156' ' ' ILE . . . . . . . . . . . . . 50.6 mm -91.94 116.49 66.56 Favored Pre-proline 0 C--N 1.325 -0.495 0 CA-C-N 116.114 -0.494 . . . . 0.0 110.491 -176.951 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 157' ' ' PRO . . . . . . . . . . . . . 31.9 Cg_endo . . . . . 0 C--O 1.235 0.355 0 C-N-CA 122.97 2.447 . . . . 0.0 113.219 -175.86 . . . . . . . . 0 0 . 1 . 008 nuclear orig core ' A' A ' 63' ' ' SER . . . . . . . . . . . . . 72.4 p . . . . . 0 N--CA 1.448 -0.545 0 N-CA-C 109.565 -0.531 . . . . 0.0 109.565 . . . . . . . . . 0 0 . 1 . 008 nuclear orig core ' A' A ' 64' ' ' PHE . . . . . 0.463 ' HB2' HD11 ' A' ' 107' ' ' ILE . 87.1 t80 -60.25 -35.71 76.12 Favored 'General case' 0 C--N 1.329 -0.299 0 N-CA-C 109.896 -0.409 . . . . 0.0 109.896 176.642 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 65' ' ' GLY . . . . . . . . . . . . . . . -62.01 -39.32 97.42 Favored Glycine 0 N--CA 1.452 -0.267 0 C-N-CA 121.13 -0.557 . . . . 0.0 112.106 176.964 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 66' ' ' ASP . . . . . 0.405 ' O ' ' HG3' ' A' ' 70' ' ' LYS . 8.6 m-20 -63.39 -52.08 63.14 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-O 120.908 0.385 . . . . 0.0 110.445 177.958 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 67' ' ' TRP . . . . . . . . . . . . . 95.9 m95 -67.19 -35.3 79.33 Favored 'General case' 0 C--N 1.326 -0.433 0 CA-C-N 115.921 -0.582 . . . . 0.0 111.37 -178.011 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 68' ' ' ALA . . . . . 0.659 ' O ' ' HG ' ' A' ' 72' ' ' LEU . . . -61.07 -51.09 70.62 Favored 'General case' 0 C--N 1.326 -0.449 0 N-CA-C 110.065 -0.346 . . . . 0.0 110.065 175.806 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 69' ' ' GLU . . . . . . . . . . . . . 11.9 tp10 -61.29 -37.86 84.72 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.099 -0.5 . . . . 0.0 110.665 -179.379 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 70' ' ' LYS . . . . . 0.405 ' HG3' ' O ' ' A' ' 66' ' ' ASP . 57.2 mtpt -66.57 -45.8 78.11 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.465 -0.334 . . . . 0.0 110.79 176.956 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 71' ' ' PHE . . . . . . . . . . . . . 89.9 t80 -61.77 -42.29 98.79 Favored 'General case' 0 C--N 1.327 -0.381 0 CA-C-N 116.241 -0.436 . . . . 0.0 110.384 179.215 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 72' ' ' LEU . . . . . 0.659 ' HG ' ' O ' ' A' ' 68' ' ' ALA . 91.7 mt -62.82 -44.23 96.7 Favored 'General case' 0 C--N 1.326 -0.439 0 CA-C-N 115.978 -0.555 . . . . 0.0 110.751 178.335 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 73' ' ' LYS . . . . . . . . . . . . . 22.7 tptp -65.67 -37.16 85.72 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-O 121.137 0.494 . . . . 0.0 110.057 179.794 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 74' ' ' SER . . . . . . . . . . . . . 9.8 t -65.44 -44.57 86.88 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 115.688 -0.687 . . . . 0.0 110.183 177.766 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 75' ' ' LYS . . . . . . . . . . . . . 20.6 mmtt -68.17 -31.55 71.18 Favored 'General case' 0 C--N 1.331 -0.204 0 CA-C-N 116.371 -0.377 . . . . 0.0 110.983 178.796 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 76' ' ' GLU . . . . . . . . . . . . . 38.9 tt0 -57.64 -49.13 77.47 Favored 'General case' 0 C--N 1.324 -0.51 0 CA-C-N 115.92 -0.582 . . . . 0.0 110.097 174.947 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 77' ' ' ALA . . . . . . . . . . . . . . . -74.69 -29.13 61.11 Favored 'General case' 0 C--N 1.327 -0.382 0 CA-C-N 115.705 -0.68 . . . . 0.0 111.34 178.824 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 78' ' ' ASP . . . . . . . . . . . . . 19.8 t70 -55.34 -45.45 76.42 Favored 'General case' 0 N--CA 1.465 0.32 0 CA-C-N 116.098 -0.501 . . . . 0.0 110.564 177.058 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 79' ' ' GLY . . . . . . . . . . . . . . . 128.41 62.46 0.12 Allowed Glycine 0 N--CA 1.446 -0.697 0 C-N-CA 120.679 -0.772 . . . . 0.0 112.308 176.906 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 80' ' ' VAL . . . . . . . . . . . . . 34.4 m -115.66 155.17 17.02 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.589 0 CA-C-O 120.677 0.275 . . . . 0.0 110.562 177.403 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 81' ' ' SER . . . . . . . . . . . . . 31.0 t -65.06 153.75 39.82 Favored 'General case' 0 C--N 1.324 -0.532 0 CA-C-N 115.817 -0.629 . . . . 0.0 110.261 175.818 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 82' ' ' VAL . . . . . . . . . . . . . 10.2 p -60.03 -36.83 69.79 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.318 0 CA-C-O 120.818 0.342 . . . . 0.0 110.325 177.453 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 83' ' ' SER . . . . . . . . . . . . . 34.2 t -69.43 -34.48 74.51 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-O 121.185 0.517 . . . . 0.0 109.973 178.254 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 84' ' ' GLN . . . . . . . . . . . . . 8.0 tp-100 -65.97 -40.63 91.41 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 115.825 -0.625 . . . . 0.0 109.852 178.23 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 85' ' ' LEU . . . . . 0.406 HD12 ' HB3' ' A' ' 72' ' ' LEU . 54.4 tp -70.41 -43.65 69.53 Favored 'General case' 0 C--N 1.326 -0.42 0 CA-C-N 115.987 -0.551 . . . . 0.0 110.831 178.229 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 86' ' ' ASN . . . . . . . . . . . . . 97.3 m-20 -60.45 -44.34 95.96 Favored 'General case' 0 C--N 1.332 -0.16 0 CA-C-N 116.437 -0.347 . . . . 0.0 110.922 179.498 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 87' ' ' SER . . . . . . . . . . . . . 8.4 p -61.58 -38.2 86.66 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.669 -0.241 . . . . 0.0 110.798 -179.735 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 88' ' ' TYR . . . . . 0.4 ' HA ' ' CD2' ' A' ' 91' ' ' TYR . 18.0 m-30 -57.89 -46.05 85.5 Favored 'General case' 0 C--O 1.231 0.1 0 CA-C-O 120.983 0.421 . . . . 0.0 110.32 173.81 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 89' ' ' LYS . . . . . 0.587 ' HA ' ' SG ' ' A' ' 92' ' ' CYS . 60.0 mttm -63.24 -38.1 89.85 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 115.681 -0.69 . . . . 0.0 110.872 179.264 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 90' ' ' ASN . . . . . . . . . . . . . 9.4 m120 -60.02 -32.49 70.94 Favored 'General case' 0 C--N 1.327 -0.401 0 CA-C-O 120.753 0.311 . . . . 0.0 111.085 177.408 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 91' ' ' TYR . . . . . 0.4 ' CD2' ' HA ' ' A' ' 88' ' ' TYR . 21.1 m-85 -70.38 -52.6 21.27 Favored 'General case' 0 C--O 1.235 0.327 0 CA-C-O 120.735 0.302 . . . . 0.0 110.619 178.17 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 92' ' ' CYS . . . . . 0.671 ' HA ' ' HB2' ' A' ' 96' ' ' LEU . 21.2 p -75.79 -39.18 57.4 Favored 'General case' 0 C--N 1.33 -0.253 0 N-CA-C 112.256 0.465 . . . . 0.0 112.256 -172.903 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 93' ' ' ARG . . . . . . . . . . . . . 43.8 ttt-85 -69.87 -47.92 60.72 Favored 'General case' 0 C--N 1.324 -0.51 0 CA-C-O 120.866 0.365 . . . . 0.0 111.502 -176.902 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 94' ' ' ASN . . . . . . . . . . . . . 17.7 m120 -87.54 -57.63 2.88 Favored 'General case' 0 C--N 1.325 -0.469 0 N-CA-C 112.205 0.446 . . . . 0.0 112.205 -173.282 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 95' ' ' HIS . . . . . . . . . . . . . 8.5 m80 -86.46 -40.57 15.19 Favored 'General case' 0 C--N 1.327 -0.389 0 N-CA-C 113.263 0.838 . . . . 0.0 113.263 -173.292 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 96' ' ' LEU . . . . . 0.671 ' HB2' ' HA ' ' A' ' 92' ' ' CYS . 76.6 mt -87.0 21.45 2.3 Favored 'General case' 0 C--N 1.325 -0.459 0 C-N-CA 120.704 -0.398 . . . . 0.0 110.69 -179.276 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 97' ' ' SER . . . . . 0.55 ' OG ' ' HD3' ' A' ' 98' ' ' PRO . 1.8 p -55.65 -45.29 99.9 Favored Pre-proline 0 CA--C 1.54 0.56 0 N-CA-C 113.003 0.742 . . . . 0.0 113.003 -179.006 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 98' ' ' PRO . . . . . 0.55 ' HD3' ' OG ' ' A' ' 97' ' ' SER . 32.2 Cg_exo -58.28 -38.23 91.75 Favored 'Trans proline' 0 C--N 1.36 1.18 0 C-N-CA 121.581 1.521 . . . . 0.0 111.688 177.488 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 99' ' ' LEU . . . . . 0.476 HD12 HD23 ' A' ' 96' ' ' LEU . 34.9 mt -77.44 -34.34 54.57 Favored 'General case' 0 C--N 1.325 -0.459 0 CA-C-N 115.809 -0.632 . . . . 0.0 110.34 -178.055 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 100' ' ' TYR . . . . . . . . . . . . . 5.7 t80 -55.5 -30.55 60.86 Favored 'General case' 0 C--N 1.326 -0.436 0 CA-C-N 115.279 -0.873 . . . . 0.0 111.226 -175.922 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 101' ' ' MET . . . . . . . . . . . . . 21.6 mmt -100.69 4.2 42.99 Favored 'General case' 0 C--N 1.326 -0.438 0 CA-C-N 116.346 -0.388 . . . . 0.0 111.403 -177.044 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 102' ' ' LYS . . . . . 0.491 ' HG3' ' O ' ' A' ' 98' ' ' PRO . 99.0 mttt -107.39 160.88 15.3 Favored 'General case' 0 C--N 1.325 -0.49 0 CA-C-O 121.055 0.455 . . . . 0.0 111.193 -178.309 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 103' ' ' SER . . . . . 0.41 ' O ' HG13 ' A' ' 107' ' ' ILE . 27.9 t -88.55 162.51 16.35 Favored 'General case' 0 C--N 1.325 -0.48 0 CA-C-N 115.862 -0.608 . . . . 0.0 109.998 176.531 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 104' ' ' LEU . . . . . 0.445 ' HB3' HD13 ' A' ' 146' ' ' ILE . 67.0 mt -61.61 -29.72 70.23 Favored 'General case' 0 C--N 1.326 -0.421 0 CA-C-N 116.039 -0.528 . . . . 0.0 111.81 -174.646 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 105' ' ' SER . . . . . . . . . . . . . 19.9 p -84.84 -15.86 43.31 Favored 'General case' 0 C--N 1.325 -0.462 0 CA-C-N 116.38 -0.373 . . . . 0.0 111.332 -178.318 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 106' ' ' GLU . . . . . . . . . . . . . 47.5 mt-10 -94.97 -24.23 17.04 Favored 'General case' 0 C--N 1.327 -0.393 0 CA-C-O 121.09 0.471 . . . . 0.0 110.719 -176.319 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 107' ' ' ILE . . . . . 0.474 HG22 HD23 ' A' ' 99' ' ' LEU . 82.4 mt -71.2 113.97 8.55 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.58 0 CA-C-N 115.624 -0.716 . . . . 0.0 110.695 -179.917 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 108' ' ' LEU . . . . . . . . . . . . . 88.5 mt -96.49 147.74 33.41 Favored Pre-proline 0 C--N 1.321 -0.646 0 CA-C-N 115.573 -0.739 . . . . 0.0 110.434 -179.985 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 109' ' ' PRO . . . . . 0.702 ' HB3' ' HB3' ' A' ' 153' ' ' TYR . 15.8 Cg_endo -58.55 -35.73 98.28 Favored 'Trans proline' 0 C--N 1.343 0.24 0 C-N-CA 122.653 2.236 . . . . 0.0 112.068 178.514 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 110' ' ' ALA . . . . . . . . . . . . . . . -68.51 -31.45 70.71 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 116.041 -0.527 . . . . 0.0 110.892 179.829 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 111' ' ' ASP . . . . . . . . . . . . . 24.6 t70 -68.9 -46.98 66.96 Favored 'General case' 0 C--N 1.327 -0.396 0 CA-C-O 121.22 0.533 . . . . 0.0 109.631 179.534 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 112' ' ' ILE . . . . . . . . . . . . . 30.7 mt -62.34 -41.17 90.6 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.291 0 CA-C-N 115.633 -0.712 . . . . 0.0 109.926 175.505 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 113' ' ' GLN . . . . . . . . . . . . . 24.3 tp60 -57.09 -42.8 81.42 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-N 115.524 -0.762 . . . . 0.0 110.207 178.002 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 114' ' ' SER . . . . . . . . . . . . . 36.5 m -59.19 -38.79 80.71 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 115.971 -0.559 . . . . 0.0 110.778 179.342 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 115' ' ' ILE . . . . . . . . . . . . . 73.3 mt -64.08 -47.99 87.83 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.358 0 CA-C-N 116.238 -0.437 . . . . 0.0 110.759 176.938 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 116' ' ' ILE . . . . . . . . . . . . . 48.1 mm -59.99 -41.72 87.13 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.442 0 CA-C-O 121.001 0.429 . . . . 0.0 110.79 179.78 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 117' ' ' ASN . . . . . . . . . . . . . 9.2 m-20 -65.82 -38.96 90.32 Favored 'General case' 0 C--N 1.327 -0.408 0 CA-C-N 115.707 -0.679 . . . . 0.0 112.111 -177.321 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 118' ' ' GLU . . . . . . . . . . . . . 10.8 pt-20 -80.74 -22.09 40.55 Favored 'General case' 0 C--O 1.234 0.285 0 C-N-CA 120.973 -0.291 . . . . 0.0 111.649 -176.454 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 119' ' ' THR . . . . . . . . . . . . . 86.9 m -68.0 112.76 5.18 Favored 'General case' 0 C--N 1.325 -0.459 0 CA-C-O 121.137 0.494 . . . . 0.0 110.788 -177.95 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 120' ' ' LYS . . . . . . . . . . . . . 21.5 ptmt -91.08 26.46 2.14 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 115.896 -0.593 . . . . 0.0 111.263 -177.236 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 121' ' ' LEU . . . . . . . . . . . . . 85.7 mt -90.28 173.4 8.16 Favored 'General case' 0 C--N 1.32 -0.712 0 N-CA-C 109.571 -0.529 . . . . 0.0 109.571 179.307 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 122' ' ' ALA . . . . . . . . . . . . . . . -61.29 151.25 32.44 Favored 'General case' 0 C--N 1.326 -0.439 0 CA-C-O 120.78 0.324 . . . . 0.0 111.125 -178.015 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 123' ' ' LYS . . . . . . . . . . . . . 85.9 tttt -57.26 -36.5 71.07 Favored 'General case' 0 C--N 1.327 -0.41 0 CA-C-N 115.999 -0.546 . . . . 0.0 111.215 -178.932 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 124' ' ' ASN . . . . . . . . . . . . . 31.3 p30 -64.87 -25.21 67.8 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-O 121.084 0.468 . . . . 0.0 111.092 177.38 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 125' ' ' THR . . . . . 0.451 ' O ' HG13 ' A' ' 129' ' ' ILE . 16.6 m -81.92 -36.99 27.48 Favored 'General case' 0 N--CA 1.45 -0.464 0 CA-C-N 116.061 -0.518 . . . . 0.0 109.814 178.681 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 126' ' ' LEU . . . . . . . . . . . . . 94.2 mt -58.79 -45.89 88.82 Favored 'General case' 0 C--N 1.33 -0.246 0 CA-C-N 116.002 -0.545 . . . . 0.0 109.622 174.083 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 127' ' ' LYS . . . . . . . . . . . . . 50.1 mttm -62.16 -35.08 77.72 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-N 115.382 -0.827 . . . . 0.0 111.219 176.785 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 128' ' ' ALA . . . . . . . . . . . . . . . -65.72 -47.8 74.11 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.367 -0.379 . . . . 0.0 110.806 178.554 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 129' ' ' ILE . . . . . 0.451 HG13 ' O ' ' A' ' 125' ' ' THR . 58.3 mt -62.02 -45.68 98.17 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.226 0 CA-C-N 116.289 -0.414 . . . . 0.0 109.92 178.032 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 130' ' ' ARG . . . . . . . . . . . . . 8.9 tpt85 -55.95 -54.27 46.74 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-N 115.512 -0.767 . . . . 0.0 111.19 177.057 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 131' ' ' ASN . . . . . . . . . . . . . 8.8 t30 -57.71 -47.41 82.47 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 116.478 -0.328 . . . . 0.0 111.289 -177.312 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 132' ' ' THR . . . . . 0.485 ' O ' HG13 ' A' ' 136' ' ' ILE . 30.8 m -57.77 -51.79 68.12 Favored 'General case' 0 C--N 1.324 -0.517 0 CA-C-N 115.971 -0.559 . . . . 0.0 110.855 -178.993 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 133' ' ' ALA . . . . . . . . . . . . . . . -61.96 -41.07 97.59 Favored 'General case' 0 C--N 1.331 -0.206 0 CA-C-N 116.183 -0.462 . . . . 0.0 111.103 -179.96 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 134' ' ' SER . . . . . 0.614 ' O ' ' HG3' ' A' ' 138' ' ' ARG . 50.0 m -58.24 -49.59 76.55 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.022 -0.536 . . . . 0.0 111.284 -178.327 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 135' ' ' GLN . . . . . . . . . . . . . 22.0 mt-30 -66.62 -32.25 73.46 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.517 -0.31 . . . . 0.0 111.205 -177.162 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 136' ' ' ILE . . . . . 0.485 HG13 ' O ' ' A' ' 132' ' ' THR . 82.9 mt -61.57 -47.11 94.89 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.231 0 CA-C-O 120.799 0.333 . . . . 0.0 110.518 177.155 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 137' ' ' PHE . . . . . . . . . . . . . 54.3 m-85 -64.99 -39.74 93.93 Favored 'General case' 0 C--N 1.327 -0.401 0 CA-C-N 116.325 -0.398 . . . . 0.0 111.432 178.53 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 138' ' ' ARG . . . . . 0.614 ' HG3' ' O ' ' A' ' 134' ' ' SER . 41.0 mtp180 -67.67 -31.25 71.09 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-O 120.779 0.323 . . . . 0.0 110.409 -179.761 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 139' ' ' LEU . . . . . . . . . . . . . 60.8 tp -62.8 -40.73 98.27 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-O 121.245 0.545 . . . . 0.0 109.852 174.994 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 140' ' ' ALA . . . . . . . . . . . . . . . -64.34 -35.28 80.36 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-N 115.652 -0.704 . . . . 0.0 110.682 177.637 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 141' ' ' ILE . . . . . 0.535 ' HA ' ' O ' ' A' ' 146' ' ' ILE . 70.4 mt -63.3 -44.04 98.92 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.224 0 CA-C-O 120.858 0.361 . . . . 0.0 110.462 175.126 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 142' ' ' GLU . . . . . . . . . . . . . 19.1 mm-40 -67.57 -25.47 65.8 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.148 -0.478 . . . . 0.0 111.538 179.796 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 143' ' ' ASN . . . . . 0.45 HD21 ' N ' ' A' ' 143' ' ' ASN . 0.9 OUTLIER -94.12 5.04 52.99 Favored 'General case' 0 C--N 1.323 -0.58 0 CA-C-N 116.278 -0.419 . . . . 0.0 110.446 176.423 . . . . . . . . 3 3 . 1 . 008 nuclear orig core ' A' A ' 144' ' ' ARG . . . . . . . . . . . . . 57.5 mtp85 64.62 25.22 13.1 Favored 'General case' 0 N--CA 1.465 0.313 0 CA-C-N 115.517 -0.765 . . . . 0.0 112.787 174.001 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 145' ' ' ALA . . . . . . . . . . . . . . . -83.43 -27.52 29.48 Favored 'General case' 0 C--N 1.325 -0.46 0 CA-C-O 121.294 0.569 . . . . 0.0 109.993 176.384 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 146' ' ' ILE . . . . . 0.535 ' O ' ' HA ' ' A' ' 141' ' ' ILE . 18.1 tt -145.91 154.56 13.05 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.461 0 CA-C-N 115.653 -0.703 . . . . 0.0 109.185 178.728 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 147' ' ' ASP . . . . . . . . . . . . . 4.9 p-10 -103.44 -5.2 23.11 Favored 'General case' 0 N--CA 1.467 0.393 0 N-CA-C 111.963 0.357 . . . . 0.0 111.963 -174.455 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 148' ' ' PHE . . . . . . . . . . . . . 76.2 t80 -155.66 145.23 21.11 Favored 'General case' 0 C--N 1.324 -0.513 0 N-CA-C 110.166 -0.309 . . . . 0.0 110.166 -176.7 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 149' ' ' ASN . . . . . . . . . . . . . 20.0 p-10 -107.28 112.27 62.87 Favored Pre-proline 0 C--N 1.323 -0.563 0 CA-C-O 121.053 0.454 . . . . 0.0 110.943 178.99 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 150' ' ' PRO . . . . . . . . . . . . . 35.6 Cg_endo -65.34 -11.0 28.17 Favored 'Trans proline' 0 N--CA 1.473 0.323 0 C-N-CA 122.969 2.446 . . . . 0.0 112.291 179.31 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 151' ' ' ALA . . . . . . . . . . . . . . . -67.5 -31.85 72.26 Favored 'General case' 0 C--N 1.327 -0.387 0 CA-C-N 115.968 -0.56 . . . . 0.0 110.775 178.088 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 152' ' ' ASP . . . . . . . . . . . . . 25.9 t70 -72.91 -15.77 61.57 Favored 'General case' 0 N--CA 1.464 0.262 0 CA-C-O 121.589 0.709 . . . . 0.0 110.04 179.594 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 153' ' ' TYR . . . . . 0.702 ' HB3' ' HB3' ' A' ' 109' ' ' PRO . 3.1 t80 -84.26 -20.82 31.56 Favored 'General case' 0 C--N 1.325 -0.48 0 CA-C-N 115.234 -0.894 . . . . 0.0 109.458 179.444 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 154' ' ' VAL . . . . . . . . . . . . . 59.1 t -72.85 129.54 35.92 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.423 0 CA-C-N 115.726 -0.67 . . . . 0.0 110.812 -178.768 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 155' ' ' ARG . . . . . . . . . . . . . 59.2 mtm180 -86.6 146.99 26.12 Favored 'General case' 0 C--N 1.324 -0.538 0 CA-C-N 116.218 -0.446 . . . . 0.0 110.675 -178.3 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 156' ' ' ILE . . . . . . . . . . . . . 37.8 mm -108.36 113.49 60.27 Favored Pre-proline 0 C--N 1.317 -0.823 0 CA-C-N 115.669 -0.696 . . . . 0.0 109.517 172.754 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 157' ' ' PRO . . . . . . . . . . . . . 51.1 Cg_exo . . . . . 0 C--N 1.344 0.325 0 C-N-CA 122.542 2.162 . . . . 0.0 111.62 -179.982 . . . . . . . . 0 0 . 1 . 009 nuclear orig core ' A' A ' 63' ' ' SER . . . . . 0.53 ' HA ' ' HA ' ' A' ' 103' ' ' SER . 1.3 m . . . . . 0 N--CA 1.451 -0.414 0 N-CA-C 109.366 -0.605 . . . . 0.0 109.366 . . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 64' ' ' PHE . . . . . 0.54 ' HB2' HD13 ' A' ' 107' ' ' ILE . 56.0 t80 -63.44 -44.58 94.15 Favored 'General case' 0 C--N 1.324 -0.504 0 C-N-CA 120.959 -0.297 . . . . 0.0 110.434 -179.319 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 65' ' ' GLY . . . . . . . . . . . . . . . -65.35 -29.76 76.02 Favored Glycine 0 C--N 1.331 0.289 0 C-N-CA 120.845 -0.693 . . . . 0.0 112.062 177.654 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 66' ' ' ASP . . . . . . . . . . . . . 12.2 t0 -65.89 -54.16 30.21 Favored 'General case' 0 C--O 1.24 0.579 0 CA-C-O 121.475 0.655 . . . . 0.0 110.209 177.91 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 67' ' ' TRP . . . . . . . . . . . . . 96.3 m95 -70.62 -23.78 62.61 Favored 'General case' 0 C--N 1.325 -0.463 0 CA-C-N 115.802 -0.635 . . . . 0.0 110.91 178.162 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 68' ' ' ALA . . . . . . . . . . . . . . . -62.61 -48.81 77.77 Favored 'General case' 0 C--O 1.225 -0.208 0 CA-C-N 116.406 -0.361 . . . . 0.0 110.671 176.419 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 69' ' ' GLU . . . . . . . . . . . . . 43.6 tt0 -59.05 -44.57 91.82 Favored 'General case' 0 C--O 1.234 0.281 0 C-N-CA 120.856 -0.338 . . . . 0.0 110.114 177.382 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 70' ' ' LYS . . . . . . . . . . . . . 24.5 ttmm -58.91 -43.02 91.0 Favored 'General case' 0 CA--C 1.535 0.399 0 CA-C-N 116.105 -0.498 . . . . 0.0 110.955 179.151 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 71' ' ' PHE . . . . . . . . . . . . . 82.3 t80 -72.11 -44.56 62.99 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-O 120.88 0.371 . . . . 0.0 111.332 -179.626 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 72' ' ' LEU . . . . . 0.455 HD22 ' HG2' ' A' ' 89' ' ' LYS . 7.3 mp -61.38 -39.44 90.67 Favored 'General case' 0 C--N 1.325 -0.472 0 CA-C-N 116.332 -0.395 . . . . 0.0 111.32 -178.297 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 73' ' ' LYS . . . . . 0.474 ' O ' ' HB3' ' A' ' 76' ' ' GLU . 57.3 tttp -77.21 -33.32 56.27 Favored 'General case' 0 C--N 1.326 -0.429 0 C-N-CA 120.644 -0.422 . . . . 0.0 111.416 -178.403 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 74' ' ' SER . . . . . . . . . . . . . 12.3 p -68.76 -29.34 67.71 Favored 'General case' 0 C--N 1.324 -0.513 0 C-N-CA 120.268 -0.573 . . . . 0.0 109.847 176.679 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 75' ' ' LYS . . . . . 0.509 ' O ' HG23 ' A' ' 80' ' ' VAL . 43.3 mmtt -77.39 -34.73 54.84 Favored 'General case' 0 C--N 1.331 -0.217 0 CA-C-N 116.267 -0.424 . . . . 0.0 110.529 173.14 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 76' ' ' GLU . . . . . 0.474 ' HB3' ' O ' ' A' ' 73' ' ' LYS . 34.6 tt0 -51.75 -47.61 64.03 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 116.018 -0.537 . . . . 0.0 110.057 172.444 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 77' ' ' ALA . . . . . . . . . . . . . . . -84.56 -12.65 53.71 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 115.677 -0.692 . . . . 0.0 111.751 178.847 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 78' ' ' ASP . . . . . . . . . . . . . 29.5 t70 -65.99 -35.85 81.7 Favored 'General case' 0 N--CA 1.467 0.386 0 CA-C-O 120.876 0.369 . . . . 0.0 110.473 178.773 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 79' ' ' GLY . . . . . . . . . . . . . . . 133.76 2.07 3.61 Favored Glycine 0 N--CA 1.447 -0.567 0 C-N-CA 120.073 -1.06 . . . . 0.0 113.447 176.047 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 80' ' ' VAL . . . . . 0.509 HG23 ' O ' ' A' ' 75' ' ' LYS . 28.4 m -70.15 136.96 25.0 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.339 0 CA-C-N 117.324 0.562 . . . . 0.0 110.377 179.499 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 81' ' ' SER . . . . . . . . . . . . . 23.3 t -72.62 164.7 26.07 Favored 'General case' 0 C--N 1.322 -0.607 0 CA-C-O 121.147 0.498 . . . . 0.0 110.224 179.947 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 82' ' ' VAL . . . . . . . . . . . . . 28.8 m -57.08 -29.69 32.35 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.609 0 CA-C-N 115.305 -0.861 . . . . 0.0 111.7 -177.177 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 83' ' ' SER . . . . . . . . . . . . . 5.9 p -62.71 -48.01 81.13 Favored 'General case' 0 C--N 1.326 -0.432 0 CA-C-O 121.173 0.511 . . . . 0.0 110.701 177.337 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 84' ' ' GLN . . . . . . . . . . . . . 6.8 tp-100 -73.83 -37.13 64.94 Favored 'General case' 0 C--N 1.325 -0.484 0 CA-C-N 115.793 -0.64 . . . . 0.0 110.074 -179.954 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 85' ' ' LEU . . . . . . . . . . . . . 43.5 tp -62.49 -44.79 95.54 Favored 'General case' 0 C--N 1.326 -0.442 0 CA-C-N 115.836 -0.62 . . . . 0.0 110.655 178.734 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 86' ' ' ASN . . . . . . . . . . . . . 83.5 m-20 -61.52 -37.02 82.18 Favored 'General case' 0 CA--C 1.519 -0.214 0 CA-C-N 116.487 -0.324 . . . . 0.0 110.377 176.265 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 87' ' ' SER . . . . . . . . . . . . . 27.2 t -56.1 -49.34 74.14 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 116.176 -0.466 . . . . 0.0 110.284 178.753 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 88' ' ' TYR . . . . . . . . . . . . . 32.3 m-85 -58.47 -41.28 84.85 Favored 'General case' 0 C--O 1.233 0.188 0 CA-C-O 120.87 0.366 . . . . 0.0 110.895 178.908 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 89' ' ' LYS . . . . . 0.555 ' HA ' ' SG ' ' A' ' 92' ' ' CYS . 85.1 mttt -70.76 -31.65 68.53 Favored 'General case' 0 C--N 1.327 -0.386 0 CA-C-N 116.197 -0.456 . . . . 0.0 111.294 -177.675 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 90' ' ' ASN . . . . . . . . . . . . . 27.6 m-80 -64.55 -36.17 83.36 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-O 120.97 0.414 . . . . 0.0 110.384 175.61 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 91' ' ' TYR . . . . . . . . . . . . . 42.4 m-85 -67.01 -48.9 66.97 Favored 'General case' 0 C--N 1.326 -0.415 0 CA-C-N 116.279 -0.419 . . . . 0.0 111.306 179.43 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 92' ' ' CYS . . . . . 0.586 ' HA ' ' HB2' ' A' ' 96' ' ' LEU . 26.1 p -72.56 -32.99 66.49 Favored 'General case' 0 C--N 1.331 -0.238 0 N-CA-C 111.849 0.315 . . . . 0.0 111.849 -175.63 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 93' ' ' ARG . . . . . . . . . . . . . 99.7 mtt180 -78.53 -38.99 39.23 Favored 'General case' 0 C--N 1.328 -0.365 0 N-CA-C 112.022 0.378 . . . . 0.0 112.022 -178.358 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 94' ' ' ASN . . . . . . . . . . . . . 17.4 m120 -99.62 -60.4 1.54 Allowed 'General case' 0 C--N 1.327 -0.384 0 N-CA-C 112.539 0.57 . . . . 0.0 112.539 -175.19 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 95' ' ' HIS . . . . . . . . . . . . . 6.1 m80 -78.79 -47.73 16.17 Favored 'General case' 0 C--N 1.325 -0.463 0 N-CA-C 112.502 0.556 . . . . 0.0 112.502 -172.4 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 96' ' ' LEU . . . . . 0.586 ' HB2' ' HA ' ' A' ' 92' ' ' CYS . 86.6 mt -91.59 21.53 4.6 Favored 'General case' 0 C--N 1.32 -0.698 0 CA-C-N 116.718 -0.219 . . . . 0.0 111.188 -175.386 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 97' ' ' SER . . . . . 0.523 ' N ' ' HD2' ' A' ' 98' ' ' PRO . 3.1 p -59.94 -43.22 94.06 Favored Pre-proline 0 CA--C 1.544 0.739 0 N-CA-C 112.667 0.617 . . . . 0.0 112.667 -179.719 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 98' ' ' PRO . . . . . 0.523 ' HD2' ' N ' ' A' ' 97' ' ' SER . 22.9 Cg_endo -63.41 -32.03 71.97 Favored 'Trans proline' 0 C--N 1.362 1.241 0 C-N-CA 121.59 1.527 . . . . 0.0 112.195 175.951 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 99' ' ' LEU . . . . . 0.631 ' HA ' ' HD2' ' A' ' 102' ' ' LYS . 10.8 mp -80.1 -31.45 39.2 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.407 -0.36 . . . . 0.0 110.51 179.682 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 100' ' ' TYR . . . . . . . . . . . . . 36.1 t80 -54.39 -34.63 61.66 Favored 'General case' 0 C--N 1.327 -0.374 0 CA-C-N 115.673 -0.694 . . . . 0.0 111.193 -178.258 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 101' ' ' MET . . . . . . . . . . . . . 22.5 mmt -91.83 -4.29 55.04 Favored 'General case' 0 C--N 1.331 -0.228 0 CA-C-N 115.791 -0.64 . . . . 0.0 111.06 -176.661 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 102' ' ' LYS . . . . . 0.631 ' HD2' ' HA ' ' A' ' 99' ' ' LEU . 51.8 mttm -87.93 150.01 23.73 Favored 'General case' 0 C--N 1.323 -0.566 0 CA-C-N 116.132 -0.485 . . . . 0.0 110.71 179.662 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 103' ' ' SER . . . . . 0.53 ' HA ' ' HA ' ' A' ' 63' ' ' SER . 8.7 m -82.52 162.98 21.83 Favored 'General case' 0 C--N 1.322 -0.597 0 N-CA-C 107.972 -1.121 . . . . 0.0 107.972 167.622 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 104' ' ' LEU . . . . . . . . . . . . . 95.2 mt -52.54 -39.31 61.28 Favored 'General case' 0 C--N 1.324 -0.535 0 N-CA-C 111.983 0.364 . . . . 0.0 111.983 -177.53 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 105' ' ' SER . . . . . . . . . . . . . 9.0 m -83.65 0.24 47.76 Favored 'General case' 0 C--N 1.326 -0.446 0 N-CA-C 111.933 0.345 . . . . 0.0 111.933 -177.641 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 106' ' ' GLU . . . . . . . . . . . . . 44.9 mt-10 -102.92 -3.24 26.44 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-O 121.026 0.441 . . . . 0.0 110.253 178.4 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 107' ' ' ILE . . . . . 0.596 HG21 ' HZ ' ' A' ' 137' ' ' PHE . 62.0 mt -94.13 112.57 27.15 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.645 0 CA-C-N 115.998 -0.547 . . . . 0.0 110.5 -177.741 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 108' ' ' LEU . . . . . . . . . . . . . 64.5 mt -96.09 146.15 30.81 Favored Pre-proline 0 C--N 1.318 -0.769 0 CA-C-N 115.887 -0.597 . . . . 0.0 110.004 179.856 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 109' ' ' PRO . . . . . . . . . . . . . 42.0 Cg_exo -57.91 -28.39 82.56 Favored 'Trans proline' 0 N--CA 1.464 -0.245 0 C-N-CA 122.317 2.011 . . . . 0.0 111.33 175.437 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 110' ' ' ALA . . . . . . . . . . . . . . . -65.6 -34.73 78.92 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-N 115.724 -0.671 . . . . 0.0 110.983 177.083 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 111' ' ' ASP . . . . . 0.456 ' O ' HG13 ' A' ' 115' ' ' ILE . 70.6 m-20 -61.6 -46.24 90.68 Favored 'General case' 0 CA--C 1.516 -0.354 0 CA-C-O 121.027 0.441 . . . . 0.0 109.814 178.864 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 112' ' ' ILE . . . . . 0.525 ' O ' HG12 ' A' ' 116' ' ' ILE . 46.0 mt -69.73 -45.16 78.3 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.585 0 CA-C-N 115.892 -0.595 . . . . 0.0 110.293 179.67 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 113' ' ' GLN . . . . . . . . . . . . . 7.0 tp-100 -57.81 -43.45 85.71 Favored 'General case' 0 C--N 1.332 -0.18 0 CA-C-N 116.374 -0.376 . . . . 0.0 111.143 179.721 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 114' ' ' SER . . . . . 0.501 ' O ' ' HG2' ' A' ' 118' ' ' GLU . 13.5 p -66.33 -37.56 85.64 Favored 'General case' 0 C--N 1.327 -0.399 0 C-N-CA 120.903 -0.319 . . . . 0.0 110.814 -179.906 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 115' ' ' ILE . . . . . 0.456 HG13 ' O ' ' A' ' 111' ' ' ASP . 69.0 mt -63.47 -41.92 94.39 Favored 'Isoleucine or valine' 0 N--CA 1.465 0.288 0 CA-C-O 120.731 0.301 . . . . 0.0 110.548 176.184 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 116' ' ' ILE . . . . . 0.525 HG12 ' O ' ' A' ' 112' ' ' ILE . 50.0 mm -65.01 -26.33 39.76 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.323 0 CA-C-O 121.307 0.575 . . . . 0.0 110.439 178.005 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 117' ' ' ASN . . . . . . . . . . . . . 8.8 t30 -86.63 -37.17 18.31 Favored 'General case' 0 C--N 1.325 -0.499 0 CA-C-N 115.759 -0.655 . . . . 0.0 111.435 -179.916 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 118' ' ' GLU . . . . . 0.501 ' HG2' ' O ' ' A' ' 114' ' ' SER . 33.9 mm-40 -79.78 -29.21 40.31 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-N 116.514 -0.312 . . . . 0.0 111.388 -176.212 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 119' ' ' THR . . . . . 0.475 ' HB ' HD22 ' A' ' 126' ' ' LEU . 62.0 m -76.03 111.31 11.3 Favored 'General case' 0 C--N 1.323 -0.573 0 CA-C-O 121.415 0.626 . . . . 0.0 109.752 176.83 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 120' ' ' LYS . . . . . . . . . . . . . 45.4 mtmt -96.11 31.59 2.13 Favored 'General case' 0 C--N 1.322 -0.599 0 CA-C-N 115.499 -0.773 . . . . 0.0 110.766 -174.157 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 121' ' ' LEU . . . . . 0.413 HD12 HG21 ' A' ' 119' ' ' THR . 11.2 mp -90.09 -174.93 4.39 Favored 'General case' 0 C--N 1.321 -0.641 0 CA-C-N 115.296 -0.865 . . . . 0.0 110.235 178.11 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 122' ' ' ALA . . . . . . . . . . . . . . . -62.33 152.62 33.31 Favored 'General case' 0 C--N 1.326 -0.439 0 CA-C-N 115.955 -0.566 . . . . 0.0 111.581 -177.301 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 123' ' ' LYS . . . . . 0.761 ' HE3' ' HA ' ' A' ' 123' ' ' LYS . 1.0 OUTLIER -56.88 -39.65 74.75 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 115.508 -0.769 . . . . 0.0 110.791 -177.784 . . . . . . . . 3 3 . 1 . 009 nuclear orig core ' A' A ' 124' ' ' ASN . . . . . . . . . . . . . 17.7 m120 -55.85 -47.33 77.47 Favored 'General case' 0 C--N 1.331 -0.217 0 CA-C-N 116.056 -0.52 . . . . 0.0 111.156 179.594 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 125' ' ' THR . . . . . 0.552 ' O ' HG13 ' A' ' 129' ' ' ILE . 19.0 m -59.41 -44.94 92.75 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.054 -0.521 . . . . 0.0 110.715 -178.955 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 126' ' ' LEU . . . . . 0.475 HD22 ' HB ' ' A' ' 119' ' ' THR . 97.5 mt -61.53 -41.68 97.7 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 115.932 -0.576 . . . . 0.0 111.033 179.553 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 127' ' ' LYS . . . . . 0.464 ' HG3' ' O ' ' A' ' 123' ' ' LYS . 51.5 mtpt -66.35 -37.53 85.53 Favored 'General case' 0 C--N 1.326 -0.437 0 CA-C-N 115.872 -0.604 . . . . 0.0 110.359 179.626 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 128' ' ' ALA . . . . . . . . . . . . . . . -67.3 -36.14 80.91 Favored 'General case' 0 C--N 1.326 -0.428 0 CA-C-N 116.055 -0.52 . . . . 0.0 111.149 179.442 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 129' ' ' ILE . . . . . 0.552 HG13 ' O ' ' A' ' 125' ' ' THR . 80.2 mt -58.86 -51.96 66.04 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.277 0 CA-C-O 120.851 0.358 . . . . 0.0 110.432 177.355 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 130' ' ' ARG . . . . . . . . . . . . . 39.8 ttt-85 -62.94 -44.07 97.07 Favored 'General case' 0 C--N 1.331 -0.203 0 CA-C-N 116.045 -0.525 . . . . 0.0 110.602 178.606 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 131' ' ' ASN . . . . . . . . . . . . . 47.5 t30 -57.5 -47.0 83.1 Favored 'General case' 0 N--CA 1.465 0.278 0 CA-C-N 116.111 -0.495 . . . . 0.0 111.277 -179.297 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 132' ' ' THR . . . . . . . . . . . . . 34.6 m -61.31 -49.17 78.11 Favored 'General case' 0 C--N 1.326 -0.413 0 CA-C-N 116.34 -0.391 . . . . 0.0 110.816 -179.748 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 133' ' ' ALA . . . . . . . . . . . . . . . -62.75 -41.72 99.34 Favored 'General case' 0 C--N 1.331 -0.211 0 CA-C-N 116.274 -0.421 . . . . 0.0 111.126 -179.173 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 134' ' ' SER . . . . . . . . . . . . . 32.7 t -60.04 -42.41 94.39 Favored 'General case' 0 C--N 1.327 -0.402 0 CA-C-N 116.182 -0.463 . . . . 0.0 110.993 -178.189 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 135' ' ' GLN . . . . . . . . . . . . . 49.8 mt-30 -65.13 -35.68 81.89 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-N 116.382 -0.372 . . . . 0.0 110.709 179.953 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 136' ' ' ILE . . . . . . . . . . . . . 74.4 mt -65.32 -44.37 94.8 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.272 0 CA-C-N 116.338 -0.392 . . . . 0.0 110.44 177.143 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 137' ' ' PHE . . . . . 0.596 ' HZ ' HG21 ' A' ' 107' ' ' ILE . 50.1 m-85 -62.02 -39.47 92.38 Favored 'General case' 0 N--CA 1.461 0.119 0 CA-C-N 116.3 -0.409 . . . . 0.0 110.675 177.243 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 138' ' ' ARG . . . . . 0.592 ' O ' ' HG2' ' A' ' 142' ' ' GLU . 73.9 mtp180 -58.64 -44.8 90.16 Favored 'General case' 0 C--N 1.33 -0.242 0 CA-C-N 116.395 -0.366 . . . . 0.0 110.768 177.645 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 139' ' ' LEU . . . . . . . . . . . . . 53.9 tp -59.13 -36.93 76.05 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-O 121.061 0.457 . . . . 0.0 110.686 179.232 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 140' ' ' ALA . . . . . . . . . . . . . . . -67.97 -41.0 83.06 Favored 'General case' 0 C--N 1.326 -0.417 0 CA-C-N 116.096 -0.502 . . . . 0.0 110.515 176.792 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 141' ' ' ILE . . . . . 0.561 ' HA ' ' O ' ' A' ' 146' ' ' ILE . 72.2 mt -61.12 -44.33 98.09 Favored 'Isoleucine or valine' 0 C--O 1.234 0.239 0 CA-C-N 116.254 -0.43 . . . . 0.0 110.482 176.482 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 142' ' ' GLU . . . . . 0.592 ' HG2' ' O ' ' A' ' 138' ' ' ARG . 24.8 mm-40 -54.57 -43.99 72.54 Favored 'General case' 0 C--N 1.33 -0.241 0 CA-C-N 115.993 -0.549 . . . . 0.0 110.862 178.458 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 143' ' ' ASN . . . . . . . . . . . . . 42.5 m-80 -90.0 14.05 13.22 Favored 'General case' 0 C--N 1.325 -0.496 0 CA-C-N 115.695 -0.684 . . . . 0.0 111.558 -176.718 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 144' ' ' ARG . . . . . . . . . . . . . 92.6 mtt180 61.98 32.14 17.82 Favored 'General case' 0 N--CA 1.467 0.419 0 N-CA-C 112.144 0.424 . . . . 0.0 112.144 174.367 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 145' ' ' ALA . . . . . . . . . . . . . . . -89.8 -29.95 18.3 Favored 'General case' 0 C--N 1.324 -0.513 0 CA-C-O 121.219 0.533 . . . . 0.0 110.416 177.047 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 146' ' ' ILE . . . . . 0.561 ' O ' ' HA ' ' A' ' 141' ' ' ILE . 16.4 tt -147.32 155.94 10.58 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.69 0 N-CA-C 108.457 -0.942 . . . . 0.0 108.457 177.941 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 147' ' ' ASP . . . . . . . . . . . . . 16.9 t70 -122.34 18.72 10.61 Favored 'General case' 0 C--N 1.323 -0.57 0 CA-C-O 121.122 0.486 . . . . 0.0 111.569 -176.446 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 148' ' ' PHE . . . . . . . . . . . . . 49.7 p90 -149.29 154.77 39.51 Favored 'General case' 0 C--N 1.321 -0.635 0 N-CA-C 110.147 -0.316 . . . . 0.0 110.147 176.797 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 149' ' ' ASN . . . . . . . . . . . . . 57.3 t-20 -118.72 96.84 50.42 Favored Pre-proline 0 C--N 1.324 -0.51 0 CA-C-N 116.271 -0.422 . . . . 0.0 110.427 -176.696 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 150' ' ' PRO . . . . . . . . . . . . . 31.9 Cg_exo -59.33 -33.63 97.72 Favored 'Trans proline' 0 C--N 1.342 0.188 0 C-N-CA 122.897 2.398 . . . . 0.0 111.939 179.312 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 151' ' ' ALA . . . . . . . . . . . . . . . -69.37 -32.06 70.86 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.12 -0.491 . . . . 0.0 110.68 -179.555 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 152' ' ' ASP . . . . . . . . . . . . . 30.6 t70 -70.84 -22.72 62.28 Favored 'General case' 0 C--N 1.326 -0.421 0 CA-C-O 121.226 0.536 . . . . 0.0 109.91 178.624 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 153' ' ' TYR . . . . . . . . . . . . . 75.5 t80 -82.85 -16.08 49.05 Favored 'General case' 0 C--N 1.324 -0.512 0 CA-C-N 115.518 -0.765 . . . . 0.0 110.213 -179.04 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 154' ' ' VAL . . . . . . . . . . . . . 24.2 t -68.98 132.44 33.04 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.304 0 CA-C-N 116.25 -0.432 . . . . 0.0 110.298 176.145 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 155' ' ' ARG . . . . . . . . . . . . . 17.3 tpp180 -109.41 119.49 39.62 Favored 'General case' 0 C--N 1.318 -0.79 0 N-CA-C 109.816 -0.438 . . . . 0.0 109.816 173.897 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 156' ' ' ILE . . . . . . . . . . . . . 33.1 mm -66.02 124.48 87.87 Favored Pre-proline 0 C--N 1.327 -0.396 0 CA-C-N 115.658 -0.701 . . . . 0.0 109.731 174.121 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 157' ' ' PRO . . . . . . . . . . . . . 14.7 Cg_exo . . . . . 0 N--CA 1.455 -0.748 0 C-N-CA 121.92 1.747 . . . . 0.0 110.91 173.41 . . . . . . . . 0 0 . 1 . 010 nuclear orig core ' A' A ' 63' ' ' SER . . . . . . . . . . . . . 29.1 t . . . . . 0 N--CA 1.452 -0.358 0 N-CA-C 109.703 -0.48 . . . . 0.0 109.703 . . . . . . . . . 0 0 . 1 . 010 nuclear orig core ' A' A ' 64' ' ' PHE . . . . . 0.498 ' HB2' HD12 ' A' ' 107' ' ' ILE . 73.4 t80 -60.11 -30.04 69.0 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-O 120.76 0.314 . . . . 0.0 110.427 179.194 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 65' ' ' GLY . . . . . 0.442 ' HA2' ' CD1' ' A' ' 100' ' ' TYR . . . -61.11 -41.04 99.34 Favored Glycine 0 N--CA 1.449 -0.472 0 C-N-CA 121.08 -0.581 . . . . 0.0 112.217 176.675 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 66' ' ' ASP . . . . . 0.491 ' O ' ' HG2' ' A' ' 70' ' ' LYS . 33.9 t70 -66.69 -42.58 86.23 Favored 'General case' 0 C--N 1.325 -0.463 0 N-CA-C 109.767 -0.457 . . . . 0.0 109.767 178.185 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 67' ' ' TRP . . . . . . . . . . . . . 93.8 m95 -67.72 -27.82 67.13 Favored 'General case' 0 C--N 1.331 -0.23 0 CA-C-N 115.827 -0.624 . . . . 0.0 111.54 -179.961 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 68' ' ' ALA . . . . . 0.471 ' O ' ' HG ' ' A' ' 72' ' ' LEU . . . -62.22 -49.55 75.3 Favored 'General case' 0 C--N 1.328 -0.355 0 N-CA-C 109.779 -0.452 . . . . 0.0 109.779 174.291 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 69' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER -61.83 -37.64 85.19 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.087 -0.506 . . . . 0.0 110.65 175.262 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 70' ' ' LYS . . . . . 0.491 ' HG2' ' O ' ' A' ' 66' ' ' ASP . 27.0 mmmt -57.58 -52.09 66.83 Favored 'General case' 0 N--CA 1.464 0.254 0 CA-C-N 116.356 -0.384 . . . . 0.0 110.47 176.364 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 71' ' ' PHE . . . . . . . . . . . . . 92.0 t80 -62.12 -40.3 95.44 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 115.998 -0.546 . . . . 0.0 110.829 -179.669 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 72' ' ' LEU . . . . . 0.471 ' HG ' ' O ' ' A' ' 68' ' ' ALA . 79.5 mt -61.74 -51.65 67.48 Favored 'General case' 0 C--N 1.326 -0.456 0 CA-C-N 116.223 -0.444 . . . . 0.0 111.097 179.496 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 73' ' ' LYS . . . . . 0.436 ' HA ' ' HB3' ' A' ' 76' ' ' GLU . 55.0 tttp -71.44 -24.06 61.95 Favored 'General case' 0 C--N 1.326 -0.441 0 C-N-CA 120.216 -0.594 . . . . 0.0 110.59 -179.165 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 74' ' ' SER . . . . . . . . . . . . . 33.5 t -60.26 -45.47 93.19 Favored 'General case' 0 C--N 1.328 -0.358 0 N-CA-C 109.795 -0.446 . . . . 0.0 109.795 173.745 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 75' ' ' LYS . . . . . . . . . . . . . 27.5 mmtm -76.11 -30.35 58.2 Favored 'General case' 0 C--N 1.327 -0.399 0 CA-C-N 116.384 -0.371 . . . . 0.0 110.855 177.605 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 76' ' ' GLU . . . . . 0.436 ' HB3' ' HA ' ' A' ' 73' ' ' LYS . 2.7 tm-20 -58.08 -53.43 58.38 Favored 'General case' 0 C--N 1.327 -0.379 0 CA-C-N 116.092 -0.504 . . . . 0.0 109.722 173.969 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 77' ' ' ALA . . . . . . . . . . . . . . . -71.33 -27.04 63.09 Favored 'General case' 0 C--N 1.325 -0.473 0 CA-C-N 115.721 -0.672 . . . . 0.0 111.229 179.322 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 78' ' ' ASP . . . . . . . . . . . . . 17.4 t70 -64.08 -49.09 73.62 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.114 -0.494 . . . . 0.0 110.528 178.117 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 79' ' ' GLY . . . . . . . . . . . . . . . 131.32 55.15 0.09 OUTLIER Glycine 0 N--CA 1.448 -0.555 0 C-N-CA 120.633 -0.794 . . . . 0.0 112.975 177.084 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 80' ' ' VAL . . . . . 0.646 HG22 ' HG ' ' A' ' 85' ' ' LEU . 22.8 m -112.16 168.91 4.69 Favored 'Isoleucine or valine' 0 C--O 1.237 0.431 0 O-C-N 122.462 -0.434 . . . . 0.0 110.732 175.328 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 81' ' ' SER . . . . . . . . . . . . . 74.9 p -83.08 169.31 16.03 Favored 'General case' 0 C--N 1.322 -0.612 0 CA-C-N 115.929 -0.578 . . . . 0.0 110.944 -178.721 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 82' ' ' VAL . . . . . . . . . . . . . 94.3 t -64.33 -37.83 80.98 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.431 0 N-CA-C 109.379 -0.601 . . . . 0.0 109.379 173.817 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 83' ' ' SER . . . . . . . . . . . . . 13.6 t -60.38 -47.65 85.13 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 115.758 -0.655 . . . . 0.0 110.536 178.657 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 84' ' ' GLN . . . . . . . . . . . . . 6.7 tp-100 -63.71 -45.1 91.51 Favored 'General case' 0 C--N 1.332 -0.157 0 CA-C-N 116.369 -0.378 . . . . 0.0 110.396 179.704 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 85' ' ' LEU . . . . . 0.646 ' HG ' HG22 ' A' ' 80' ' ' VAL . 19.1 mt -62.46 -36.07 81.28 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.225 -0.443 . . . . 0.0 111.266 177.418 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 86' ' ' ASN . . . . . . . . . . . . . 53.7 t30 -72.77 -29.95 63.72 Favored 'General case' 0 C--N 1.322 -0.621 0 CA-C-N 115.837 -0.62 . . . . 0.0 109.856 -177.9 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 87' ' ' SER . . . . . 0.412 ' O ' ' HD1' ' A' ' 91' ' ' TYR . 42.4 t -64.27 -49.94 69.87 Favored 'General case' 0 N--CA 1.452 -0.363 0 CA-C-N 115.655 -0.702 . . . . 0.0 109.682 172.877 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 88' ' ' TYR . . . . . . . . . . . . . 25.7 m-85 -59.86 -38.72 82.95 Favored 'General case' 0 C--N 1.331 -0.234 0 CA-C-N 116.208 -0.451 . . . . 0.0 111.265 179.733 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 89' ' ' LYS . . . . . 0.466 ' HG3' ' O ' ' A' ' 85' ' ' LEU . 64.6 mttp -57.92 -44.58 86.94 Favored 'General case' 0 C--N 1.333 -0.115 0 CA-C-O 120.801 0.334 . . . . 0.0 110.89 177.625 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 90' ' ' ASN . . . . . . . . . . . . . 20.7 t-20 -64.49 -42.9 95.57 Favored 'General case' 0 C--N 1.325 -0.487 0 CA-C-N 116.038 -0.528 . . . . 0.0 111.048 -177.295 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 91' ' ' TYR . . . . . 0.412 ' HD1' ' O ' ' A' ' 87' ' ' SER . 11.8 m-85 -66.54 -46.65 75.41 Favored 'General case' 0 C--N 1.324 -0.524 0 N-CA-C 111.719 0.266 . . . . 0.0 111.719 -177.926 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 92' ' ' CYS . . . . . 0.493 ' HA ' HD13 ' A' ' 96' ' ' LEU . 24.5 p -75.98 -25.68 56.04 Favored 'General case' 0 C--N 1.327 -0.391 0 N-CA-C 111.883 0.327 . . . . 0.0 111.883 -175.122 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 93' ' ' ARG . . . . . 0.503 ' NH2' ' HH ' ' A' ' 100' ' ' TYR . 51.3 mtt85 -98.12 -31.87 11.89 Favored 'General case' 0 C--N 1.325 -0.494 0 N-CA-C 112.912 0.708 . . . . 0.0 112.912 -176.116 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 94' ' ' ASN . . . . . . . . . . . . . 16.7 m120 -95.31 -45.26 7.22 Favored 'General case' 0 C--N 1.325 -0.469 0 C-N-CA 120.581 -0.448 . . . . 0.0 111.608 -179.285 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 95' ' ' HIS . . . . . . . . . . . . . 77.4 m-70 -84.96 -44.46 13.09 Favored 'General case' 0 C--N 1.327 -0.39 0 CA-C-O 120.881 0.372 . . . . 0.0 110.501 -177.611 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 96' ' ' LEU . . . . . 0.493 HD13 ' HA ' ' A' ' 92' ' ' CYS . 79.8 mt -91.72 26.8 2.24 Favored 'General case' 0 C--N 1.324 -0.534 0 CA-C-N 116.107 -0.497 . . . . 0.0 110.061 179.854 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 97' ' ' SER . . . . . 0.576 ' OG ' ' HD3' ' A' ' 98' ' ' PRO . 1.4 p -54.43 -48.04 95.97 Favored Pre-proline 0 CA--C 1.542 0.657 0 N-CA-C 113.276 0.843 . . . . 0.0 113.276 -176.841 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 98' ' ' PRO . . . . . 0.576 ' HD3' ' OG ' ' A' ' 97' ' ' SER . 13.1 Cg_exo -69.18 -13.96 37.07 Favored 'Trans proline' 0 C--N 1.356 0.934 0 C-N-CA 121.873 1.715 . . . . 0.0 112.233 -178.837 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 99' ' ' LEU . . . . . 0.464 HD12 HD22 ' A' ' 96' ' ' LEU . 61.2 mt -95.02 -30.84 13.89 Favored 'General case' 0 C--N 1.324 -0.516 0 CA-C-N 116.353 -0.385 . . . . 0.0 110.418 -178.519 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 100' ' ' TYR . . . . . 0.503 ' HH ' ' NH2' ' A' ' 93' ' ' ARG . 84.4 t80 -56.5 -32.77 65.35 Favored 'General case' 0 C--N 1.331 -0.203 0 CA-C-N 115.855 -0.612 . . . . 0.0 111.716 -176.458 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 101' ' ' MET . . . . . . . . . . . . . 25.6 ttt -98.92 1.19 45.41 Favored 'General case' 0 C--N 1.323 -0.575 0 CA-C-O 120.871 0.367 . . . . 0.0 111.406 -176.051 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 102' ' ' LYS . . . . . 0.477 ' HG3' ' O ' ' A' ' 98' ' ' PRO . 77.8 mttt -90.42 145.65 24.76 Favored 'General case' 0 C--N 1.322 -0.595 0 CA-C-O 121.482 0.658 . . . . 0.0 111.813 -178.561 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 103' ' ' SER . . . . . 0.412 ' O ' HG13 ' A' ' 107' ' ' ILE . 44.8 t -66.88 145.02 55.91 Favored 'General case' 0 C--N 1.323 -0.576 0 CA-C-N 115.236 -0.893 . . . . 0.0 109.183 173.0 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 104' ' ' LEU . . . . . . . . . . . . . 41.9 tp -56.85 -51.19 69.98 Favored 'General case' 0 C--N 1.328 -0.353 0 N-CA-C 112.536 0.569 . . . . 0.0 112.536 -170.043 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 105' ' ' SER . . . . . . . . . . . . . 4.8 m -74.29 -11.35 60.24 Favored 'General case' 0 C--N 1.327 -0.382 0 CA-C-O 121.001 0.429 . . . . 0.0 111.388 -175.966 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 106' ' ' GLU . . . . . . . . . . . . . 2.1 mp0 -96.84 5.64 50.17 Favored 'General case' 0 C--N 1.326 -0.416 0 CA-C-N 116.071 -0.513 . . . . 0.0 111.434 -174.688 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 107' ' ' ILE . . . . . 0.498 HD12 ' HB2' ' A' ' 64' ' ' PHE . 70.2 mt -89.57 137.6 21.02 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.455 0 CA-C-O 120.992 0.425 . . . . 0.0 111.0 -179.695 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 108' ' ' LEU . . . . . 0.428 HD21 ' N ' ' A' ' 108' ' ' LEU . 2.1 mm? -108.66 148.32 37.51 Favored Pre-proline 0 C--N 1.325 -0.482 0 CA-C-N 115.777 -0.647 . . . . 0.0 110.294 -179.863 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 109' ' ' PRO . . . . . . . . . . . . . 27.5 Cg_endo -63.59 -22.52 70.44 Favored 'Trans proline' 0 C--N 1.343 0.239 0 C-N-CA 122.182 1.921 . . . . 0.0 111.031 174.296 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 110' ' ' ALA . . . . . . . . . . . . . . . -63.76 -41.81 97.92 Favored 'General case' 0 N--CA 1.454 -0.255 0 CA-C-N 115.464 -0.789 . . . . 0.0 111.16 -179.641 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 111' ' ' ASP . . . . . 0.486 ' O ' HG13 ' A' ' 115' ' ' ILE . 20.2 m-20 -58.33 -44.43 88.68 Favored 'General case' 0 N--CA 1.465 0.288 0 CA-C-O 121.189 0.519 . . . . 0.0 110.897 178.837 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 112' ' ' ILE . . . . . 0.561 HG22 HH22 ' A' ' 130' ' ' ARG . 12.7 mt -72.09 -33.89 48.49 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.59 0 CA-C-N 115.863 -0.608 . . . . 0.0 110.652 -176.373 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 113' ' ' GLN . . . . . . . . . . . . . 25.1 tp60 -64.92 -40.55 95.23 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 115.996 -0.547 . . . . 0.0 110.626 -179.619 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 114' ' ' SER . . . . . . . . . . . . . 6.8 p -72.52 -36.13 68.26 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 116.46 -0.336 . . . . 0.0 110.935 179.616 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 115' ' ' ILE . . . . . 0.486 HG13 ' O ' ' A' ' 111' ' ' ASP . 77.5 mt -56.4 -46.78 82.1 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.158 0 CA-C-O 120.896 0.379 . . . . 0.0 110.292 175.729 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 116' ' ' ILE . . . . . . . . . . . . . 49.1 mm -67.22 -35.59 74.47 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.316 0 CA-C-N 116.094 -0.503 . . . . 0.0 110.686 178.661 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 117' ' ' ASN . . . . . . . . . . . . . 50.8 t30 -66.05 -40.93 91.34 Favored 'General case' 0 C--N 1.327 -0.398 0 CA-C-N 116.158 -0.473 . . . . 0.0 111.171 -179.735 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 118' ' ' GLU . . . . . . . . . . . . . 43.0 mt-10 -84.91 -19.3 32.47 Favored 'General case' 0 C--N 1.326 -0.444 0 CA-C-N 116.169 -0.468 . . . . 0.0 111.787 -176.605 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 119' ' ' THR . . . . . . . . . . . . . 69.6 m -84.04 112.94 20.65 Favored 'General case' 0 C--N 1.326 -0.444 0 CA-C-O 121.209 0.528 . . . . 0.0 109.763 175.042 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 120' ' ' LYS . . . . . 0.402 ' HB3' ' HE2' ' A' ' 120' ' ' LYS . 11.4 ptpt -110.34 86.29 2.28 Favored 'General case' 0 C--N 1.32 -0.696 0 CA-C-O 121.817 0.818 . . . . 0.0 110.887 -177.614 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 121' ' ' LEU . . . . . . . . . . . . . 96.0 mt -133.16 -175.04 3.66 Favored 'General case' 0 C--N 1.322 -0.622 0 CA-C-N 114.65 -1.159 . . . . 0.0 109.122 179.29 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 122' ' ' ALA . . . . . . . . . . . . . . . -58.52 145.58 38.55 Favored 'General case' 0 C--N 1.326 -0.419 0 O-C-N 123.123 0.264 . . . . 0.0 110.644 178.009 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 123' ' ' LYS . . . . . . . . . . . . . 21.4 ptmt -60.75 -33.93 73.67 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.662 -0.244 . . . . 0.0 111.537 -175.563 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 124' ' ' ASN . . . . . . . . . . . . . 1.9 p-10 -68.66 -27.15 65.74 Favored 'General case' 0 N--CA 1.463 0.208 0 CA-C-O 121.127 0.489 . . . . 0.0 110.036 178.925 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 125' ' ' THR . . . . . . . . . . . . . 20.7 m -78.22 -34.63 49.19 Favored 'General case' 0 N--CA 1.452 -0.356 0 CA-C-N 115.932 -0.576 . . . . 0.0 109.828 178.877 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 126' ' ' LEU . . . . . . . . . . . . . 91.8 mt -67.42 -38.14 84.15 Favored 'General case' 0 C--N 1.327 -0.407 0 CA-C-N 115.809 -0.632 . . . . 0.0 109.879 175.723 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 127' ' ' LYS . . . . . 0.503 ' HG2' HG23 ' A' ' 156' ' ' ILE . 50.2 mtpt -70.4 -26.61 63.77 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.009 -0.541 . . . . 0.0 110.706 176.184 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 128' ' ' ALA . . . . . . . . . . . . . . . -67.09 -41.19 86.73 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-O 120.845 0.355 . . . . 0.0 110.132 174.97 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 129' ' ' ILE . . . . . . . . . . . . . 62.6 mt -65.29 -43.33 95.15 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.289 0 CA-C-N 116.017 -0.538 . . . . 0.0 109.791 175.628 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 130' ' ' ARG . . . . . 0.655 ' CZ ' ' HA ' ' A' ' 130' ' ' ARG . 0.5 OUTLIER -58.39 -49.92 75.53 Favored 'General case' 0 C--N 1.331 -0.229 0 CA-C-N 115.562 -0.745 . . . . 0.0 110.435 176.721 . . . . . . . . 3 3 . 1 . 010 nuclear orig core ' A' A ' 131' ' ' ASN . . . . . . . . . . . . . 5.4 t30 -55.96 -55.86 27.6 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 115.677 -0.692 . . . . 0.0 111.233 178.041 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 132' ' ' THR . . . . . 0.495 ' O ' HG13 ' A' ' 136' ' ' ILE . 37.3 m -56.12 -53.56 55.62 Favored 'General case' 0 C--N 1.327 -0.373 0 CA-C-N 116.055 -0.52 . . . . 0.0 111.488 -175.16 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 133' ' ' ALA . . . . . . . . . . . . . . . -63.2 -37.57 87.74 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.52 -0.309 . . . . 0.0 111.133 -177.858 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 134' ' ' SER . . . . . 0.468 ' O ' ' HG3' ' A' ' 138' ' ' ARG . 8.3 t -66.26 -44.3 84.02 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.433 -0.349 . . . . 0.0 110.512 -177.486 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 135' ' ' GLN . . . . . . . . . . . . . 44.5 mt-30 -62.93 -33.53 75.53 Favored 'General case' 0 C--O 1.233 0.199 0 CA-C-O 120.669 0.271 . . . . 0.0 110.914 -179.078 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 136' ' ' ILE . . . . . 0.495 HG13 ' O ' ' A' ' 132' ' ' THR . 66.3 mt -63.61 -48.44 86.75 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.218 0 CA-C-N 116.347 -0.388 . . . . 0.0 110.696 176.95 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 137' ' ' PHE . . . . . 0.415 ' O ' HG13 ' A' ' 141' ' ' ILE . 56.4 m-85 -66.25 -37.53 85.71 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-N 116.635 -0.257 . . . . 0.0 110.879 178.579 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 138' ' ' ARG . . . . . 0.468 ' HG3' ' O ' ' A' ' 134' ' ' SER . 41.4 mtp-105 -60.03 -40.3 88.85 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-N 116.449 -0.342 . . . . 0.0 110.454 176.871 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 139' ' ' LEU . . . . . . . . . . . . . 62.1 tp -62.73 -38.56 90.97 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 115.947 -0.569 . . . . 0.0 110.225 177.35 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 140' ' ' ALA . . . . . . . . . . . . . . . -63.94 -41.55 97.58 Favored 'General case' 0 C--N 1.326 -0.427 0 CA-C-N 115.942 -0.572 . . . . 0.0 110.522 176.408 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 141' ' ' ILE . . . . . 0.415 HG13 ' O ' ' A' ' 137' ' ' PHE . 58.9 mt -63.62 -39.04 83.88 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.267 0 CA-C-N 116.565 -0.289 . . . . 0.0 111.021 174.76 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 142' ' ' GLU . . . . . 0.446 ' HG3' ' O ' ' A' ' 138' ' ' ARG . 48.8 mt-10 -60.87 -39.29 88.65 Favored 'General case' 0 N--CA 1.462 0.157 0 CA-C-O 120.858 0.361 . . . . 0.0 110.626 177.169 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 143' ' ' ASN . . . . . 0.43 ' N ' HD21 ' A' ' 143' ' ' ASN . 0.9 OUTLIER -84.87 0.94 49.25 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.204 -0.453 . . . . 0.0 110.189 177.074 . . . . . . . . 3 3 . 1 . 010 nuclear orig core ' A' A ' 144' ' ' ARG . . . . . . . . . . . . . 99.5 mtt180 55.15 44.7 27.41 Favored 'General case' 0 C--O 1.232 0.139 0 CA-C-N 115.341 -0.845 . . . . 0.0 111.713 179.222 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 145' ' ' ALA . . . . . . . . . . . . . . . -88.21 -55.59 3.68 Favored 'General case' 0 C--N 1.327 -0.4 0 CA-C-N 115.44 -0.8 . . . . 0.0 109.632 173.897 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 146' ' ' ILE . . . . . . . . . . . . . 18.3 tt -104.85 147.49 10.68 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.44 0 N-CA-C 109.359 -0.608 . . . . 0.0 109.359 175.966 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 147' ' ' ASP . . . . . . . . . . . . . 27.2 t70 -87.7 -6.3 58.28 Favored 'General case' 0 C--N 1.324 -0.52 0 CA-C-N 116.4 -0.364 . . . . 0.0 111.891 -172.593 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 148' ' ' PHE . . . . . . . . . . . . . 33.0 p90 -155.33 168.7 26.23 Favored 'General case' 0 C--N 1.325 -0.458 0 CA-C-O 120.885 0.374 . . . . 0.0 111.023 -174.003 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 149' ' ' ASN . . . . . . . . . . . . . 29.6 t30 -115.15 102.16 54.63 Favored Pre-proline 0 C--N 1.324 -0.527 0 CA-C-N 115.857 -0.611 . . . . 0.0 110.163 178.303 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 150' ' ' PRO . . . . . . . . . . . . . 40.7 Cg_endo -68.04 -17.96 46.0 Favored 'Trans proline' 0 C--N 1.343 0.254 0 C-N-CA 122.787 2.324 . . . . 0.0 112.48 -178.367 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 151' ' ' ALA . . . . . 0.448 ' HB2' HH21 ' A' ' 130' ' ' ARG . . . -71.54 -20.35 62.04 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 116.269 -0.423 . . . . 0.0 110.942 -179.453 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 152' ' ' ASP . . . . . . . . . . . . . 36.7 t70 -72.92 -15.39 61.58 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 115.821 -0.627 . . . . 0.0 110.822 -178.301 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 153' ' ' TYR . . . . . . . . . . . . . 88.4 m-85 -92.21 2.51 56.56 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.061 -0.518 . . . . 0.0 111.255 -177.922 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 154' ' ' VAL . . . . . . . . . . . . . 81.1 t -90.99 121.86 41.8 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.449 0 CA-C-O 120.752 0.31 . . . . 0.0 111.107 -177.505 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 155' ' ' ARG . . . . . . . . . . . . . 12.4 ttm180 -80.97 134.12 35.64 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 116.155 -0.475 . . . . 0.0 110.03 177.865 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 156' ' ' ILE . . . . . 0.503 HG23 ' HG2' ' A' ' 127' ' ' LYS . 46.1 mm -105.95 130.26 23.28 Favored Pre-proline 0 C--N 1.325 -0.484 0 CA-C-N 116.174 -0.466 . . . . 0.0 109.765 176.613 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 157' ' ' PRO . . . . . . . . . . . . . 18.4 Cg_endo . . . . . 0 C--N 1.344 0.335 0 C-N-CA 122.343 2.029 . . . . 0.0 111.912 179.323 . . . . . . . . 0 0 . 1 . 011 nuclear orig core ' A' A ' 63' ' ' SER . . . . . 0.5 ' HA ' ' HA ' ' A' ' 103' ' ' SER . 97.7 p . . . . . 0 N--CA 1.452 -0.333 0 N-CA-C 109.556 -0.535 . . . . 0.0 109.556 . . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 64' ' ' PHE . . . . . . . . . . . . . 82.4 t80 -62.02 -28.74 69.79 Favored 'General case' 0 C--N 1.324 -0.542 0 CA-C-O 120.994 0.426 . . . . 0.0 109.987 178.021 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 65' ' ' GLY . . . . . . . . . . . . . . . -63.8 -37.57 94.87 Favored Glycine 0 N--CA 1.449 -0.497 0 CA-C-N 115.941 -0.572 . . . . 0.0 112.144 176.711 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 66' ' ' ASP . . . . . . . . . . . . . 56.1 m-20 -65.31 -43.77 90.02 Favored 'General case' 0 C--O 1.234 0.243 0 CA-C-O 120.958 0.408 . . . . 0.0 109.957 178.308 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 67' ' ' TRP . . . . . . . . . . . . . 99.4 m95 -69.6 -36.74 76.5 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 115.787 -0.642 . . . . 0.0 111.059 178.371 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 68' ' ' ALA . . . . . 0.457 ' O ' ' HG ' ' A' ' 72' ' ' LEU . . . -59.13 -43.4 92.0 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-O 120.868 0.366 . . . . 0.0 110.544 176.998 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 69' ' ' GLU . . . . . 0.46 ' O ' ' HG2' ' A' ' 73' ' ' LYS . 36.6 tt0 -62.4 -44.77 95.66 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.229 -0.442 . . . . 0.0 110.166 175.506 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 70' ' ' LYS . . . . . 0.457 ' HG2' HD21 ' A' ' 139' ' ' LEU . 64.2 tttp -59.42 -39.99 85.27 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 115.886 -0.597 . . . . 0.0 110.66 -179.963 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 71' ' ' PHE . . . . . . . . . . . . . 68.7 t80 -63.62 -44.42 93.98 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.207 -0.451 . . . . 0.0 110.142 176.619 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 72' ' ' LEU . . . . . 0.457 ' HG ' ' O ' ' A' ' 68' ' ' ALA . 82.8 mt -64.62 -36.65 84.92 Favored 'General case' 0 C--N 1.325 -0.486 0 CA-C-N 116.177 -0.465 . . . . 0.0 110.982 -179.913 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 73' ' ' LYS . . . . . 0.46 ' HG2' ' O ' ' A' ' 69' ' ' GLU . 33.3 mmtp -70.6 -40.84 72.97 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-O 120.681 0.277 . . . . 0.0 111.268 -179.912 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 74' ' ' SER . . . . . . . . . . . . . 8.1 p -71.97 -34.56 69.05 Favored 'General case' 0 C--N 1.324 -0.535 0 CA-C-O 120.829 0.347 . . . . 0.0 110.513 179.169 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 75' ' ' LYS . . . . . 0.514 ' HE3' HG13 ' A' ' 80' ' ' VAL . 46.1 tptt -74.02 -30.24 62.34 Favored 'General case' 0 N--CA 1.444 -0.752 0 CA-C-O 120.928 0.394 . . . . 0.0 110.065 177.087 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 76' ' ' GLU . . . . . . . . . . . . . 33.9 tt0 -59.48 -50.24 74.69 Favored 'General case' 0 C--N 1.327 -0.403 0 CA-C-O 121.183 0.516 . . . . 0.0 109.628 171.291 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 77' ' ' ALA . . . . . . . . . . . . . . . -72.69 -10.96 60.41 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-N 115.332 -0.849 . . . . 0.0 111.06 179.131 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 78' ' ' ASP . . . . . 0.49 ' HB3' ' O ' ' A' ' 75' ' ' LYS . 27.9 t70 -73.54 -15.83 61.29 Favored 'General case' 0 C--N 1.326 -0.439 0 CA-C-N 115.844 -0.616 . . . . 0.0 109.983 175.649 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 79' ' ' GLY . . . . . . . . . . . . . . . 91.87 60.42 1.27 Allowed Glycine 0 N--CA 1.446 -0.655 0 CA-C-N 115.762 -0.654 . . . . 0.0 112.06 177.354 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 80' ' ' VAL . . . . . 0.514 HG13 ' HE3' ' A' ' 75' ' ' LYS . 34.9 m -115.79 152.42 17.47 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.433 0 CA-C-O 120.87 0.367 . . . . 0.0 110.74 178.76 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 81' ' ' SER . . . . . . . . . . . . . 31.2 t -64.45 153.01 40.09 Favored 'General case' 0 C--N 1.322 -0.627 0 CA-C-N 115.732 -0.667 . . . . 0.0 109.829 175.668 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 82' ' ' VAL . . . . . . . . . . . . . 59.2 t -62.56 -43.53 98.51 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.336 0 CA-C-O 120.874 0.369 . . . . 0.0 110.575 -179.203 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 83' ' ' SER . . . . . . . . . . . . . 18.0 t -64.48 -30.71 71.74 Favored 'General case' 0 C--N 1.326 -0.428 0 CA-C-N 116.135 -0.484 . . . . 0.0 110.421 177.509 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 84' ' ' GLN . . . . . . . . . . . . . 47.9 tp60 -71.86 -38.79 70.01 Favored 'General case' 0 C--N 1.332 -0.187 0 CA-C-N 116.076 -0.511 . . . . 0.0 109.738 176.961 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 85' ' ' LEU . . . . . . . . . . . . . 40.1 tp -66.56 -38.76 87.77 Favored 'General case' 0 C--N 1.327 -0.389 0 CA-C-N 115.878 -0.601 . . . . 0.0 110.217 176.226 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 86' ' ' ASN . . . . . . . . . . . . . 86.0 m-20 -64.47 -26.87 68.63 Favored 'General case' 0 C--O 1.233 0.201 0 CA-C-N 116.129 -0.487 . . . . 0.0 110.716 176.382 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 87' ' ' SER . . . . . . . . . . . . . 13.0 t -65.71 -48.54 71.65 Favored 'General case' 0 C--N 1.324 -0.501 0 N-CA-C 109.711 -0.477 . . . . 0.0 109.711 175.771 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 88' ' ' TYR . . . . . . . . . . . . . 77.7 m-85 -62.45 -35.5 79.49 Favored 'General case' 0 N--CA 1.464 0.25 0 CA-C-O 121.084 0.468 . . . . 0.0 110.38 175.638 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 89' ' ' LYS . . . . . . . . . . . . . 39.1 ttmt -61.2 -37.17 82.01 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-N 115.709 -0.678 . . . . 0.0 110.154 178.809 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 90' ' ' ASN . . . . . 0.471 ' O ' ' HB3' ' A' ' 94' ' ' ASN . 26.6 t-20 -65.49 -39.2 91.63 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 115.79 -0.641 . . . . 0.0 110.414 177.66 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 91' ' ' TYR . . . . . . . . . . . . . 56.5 m-85 -63.91 -59.75 4.13 Favored 'General case' 0 C--N 1.327 -0.409 0 CA-C-N 116.363 -0.38 . . . . 0.0 110.879 176.96 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 92' ' ' CYS . . . . . 0.487 ' HA ' HD11 ' A' ' 96' ' ' LEU . 58.3 m -63.55 -46.71 84.71 Favored 'General case' 0 C--N 1.326 -0.456 0 N-CA-C 112.594 0.59 . . . . 0.0 112.594 -173.485 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 93' ' ' ARG . . . . . . . . . . . . . 40.8 ttm180 -86.13 -39.98 16.15 Favored 'General case' 0 C--N 1.327 -0.405 0 N-CA-C 112.355 0.502 . . . . 0.0 112.355 -172.71 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 94' ' ' ASN . . . . . 0.471 ' HB3' ' O ' ' A' ' 90' ' ' ASN . 49.8 t30 -92.78 -52.81 4.44 Favored 'General case' 0 C--N 1.328 -0.368 0 C-N-CA 120.726 -0.39 . . . . 0.0 111.842 -173.876 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 95' ' ' HIS . . . . . . . . . . . . . 8.8 m80 -77.71 -36.17 51.27 Favored 'General case' 0 C--N 1.326 -0.427 0 C-N-CA 120.789 -0.364 . . . . 0.0 111.57 -176.204 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 96' ' ' LEU . . . . . 0.487 HD11 ' HA ' ' A' ' 92' ' ' CYS . 84.3 mt -98.16 27.05 4.83 Favored 'General case' 0 C--N 1.321 -0.65 0 CA-C-N 116.441 -0.345 . . . . 0.0 110.37 178.678 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 97' ' ' SER . . . . . 0.502 ' N ' ' HD2' ' A' ' 98' ' ' PRO . 1.8 p -53.01 -46.72 97.47 Favored Pre-proline 0 CA--C 1.543 0.686 0 N-CA-C 113.444 0.905 . . . . 0.0 113.444 -175.884 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 98' ' ' PRO . . . . . 0.502 ' HD2' ' N ' ' A' ' 97' ' ' SER . 18.3 Cg_endo -60.43 -34.24 93.32 Favored 'Trans proline' 0 C--N 1.359 1.091 0 C-N-CA 121.771 1.647 . . . . 0.0 112.106 178.301 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 99' ' ' LEU . . . . . 0.46 HD22 HG23 ' A' ' 107' ' ' ILE . 41.1 mt -83.81 -28.78 27.85 Favored 'General case' 0 C--N 1.325 -0.475 0 CA-C-O 121.071 0.462 . . . . 0.0 110.366 -177.668 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 100' ' ' TYR . . . . . . . . . . . . . 44.1 t80 -59.38 -25.79 64.55 Favored 'General case' 0 C--N 1.325 -0.497 0 CA-C-N 115.218 -0.901 . . . . 0.0 111.603 -176.802 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 101' ' ' MET . . . . . . . . . . . . . 22.5 ptp -104.17 5.18 34.76 Favored 'General case' 0 C--N 1.327 -0.385 0 CA-C-N 116.347 -0.388 . . . . 0.0 111.24 -178.867 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 102' ' ' LYS . . . . . 0.526 ' HB3' ' HB3' ' A' ' 106' ' ' GLU . 64.0 mttm -105.43 166.96 10.06 Favored 'General case' 0 C--N 1.324 -0.501 0 CA-C-N 116.55 -0.295 . . . . 0.0 110.521 -179.561 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 103' ' ' SER . . . . . 0.5 ' HA ' ' HA ' ' A' ' 63' ' ' SER . 50.9 p -94.97 170.8 9.17 Favored 'General case' 0 C--N 1.32 -0.688 0 N-CA-C 109.613 -0.514 . . . . 0.0 109.613 173.806 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 104' ' ' LEU . . . . . . . . . . . . . 96.5 mt -58.69 -31.04 67.86 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-O 120.747 0.308 . . . . 0.0 111.028 179.222 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 105' ' ' SER . . . . . . . . . . . . . 14.0 m -86.91 -20.99 26.57 Favored 'General case' 0 C--N 1.327 -0.391 0 CA-C-N 116.344 -0.389 . . . . 0.0 111.112 -179.109 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 106' ' ' GLU . . . . . 0.526 ' HB3' ' HB3' ' A' ' 102' ' ' LYS . 0.6 OUTLIER -83.04 -25.23 32.31 Favored 'General case' 0 C--N 1.326 -0.433 0 CA-C-O 121.219 0.533 . . . . 0.0 110.443 -176.901 . . . . . . . . 3 3 . 1 . 011 nuclear orig core ' A' A ' 107' ' ' ILE . . . . . 0.46 HG23 HD22 ' A' ' 99' ' ' LEU . 78.9 mt -70.84 127.11 32.36 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.571 0 CA-C-N 115.929 -0.578 . . . . 0.0 111.329 -179.004 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 108' ' ' LEU . . . . . 0.4 ' HA ' ' HD3' ' A' ' 109' ' ' PRO . 93.5 mt -100.44 137.89 20.05 Favored Pre-proline 0 C--N 1.326 -0.452 0 CA-C-N 115.691 -0.686 . . . . 0.0 110.457 176.669 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 109' ' ' PRO . . . . . 0.4 ' HD3' ' HA ' ' A' ' 108' ' ' LEU . 44.2 Cg_exo -56.62 -44.04 49.32 Favored 'Trans proline' 0 CA--C 1.53 0.315 0 C-N-CA 122.709 2.273 . . . . 0.0 112.528 178.97 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 110' ' ' ALA . . . . . . . . . . . . . . . -65.78 -27.99 68.69 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-O 120.818 0.342 . . . . 0.0 111.469 -178.502 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 111' ' ' ASP . . . . . 0.535 ' O ' HG13 ' A' ' 115' ' ' ILE . 10.3 t70 -68.68 -39.82 80.37 Favored 'General case' 0 C--N 1.325 -0.486 0 CA-C-O 121.383 0.611 . . . . 0.0 109.703 179.996 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 112' ' ' ILE . . . . . 0.498 ' HB ' HG23 ' A' ' 154' ' ' VAL . 40.5 mt -67.62 -38.25 80.14 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.39 0 CA-C-N 115.583 -0.735 . . . . 0.0 109.829 175.178 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 113' ' ' GLN . . . . . 0.43 ' HA ' HG12 ' A' ' 154' ' ' VAL . 25.2 tp60 -62.88 -41.23 99.33 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-N 115.466 -0.788 . . . . 0.0 110.794 -179.012 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 114' ' ' SER . . . . . . . . . . . . . 41.3 p -70.1 -30.66 67.93 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.761 -0.2 . . . . 0.0 111.024 -179.516 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 115' ' ' ILE . . . . . 0.535 HG13 ' O ' ' A' ' 111' ' ' ASP . 83.6 mt -56.55 -55.32 20.03 Favored 'Isoleucine or valine' 0 N--CA 1.463 0.193 0 CA-C-O 120.951 0.405 . . . . 0.0 110.045 174.442 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 116' ' ' ILE . . . . . 0.41 HG23 ' HB3' ' A' ' 126' ' ' LEU . 45.2 mm -64.71 -30.04 49.12 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.378 0 CA-C-N 115.815 -0.63 . . . . 0.0 110.432 179.569 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 117' ' ' ASN . . . . . . . . . . . . . 8.1 t30 -66.37 -43.25 86.49 Favored 'General case' 0 C--N 1.324 -0.505 0 CA-C-N 115.564 -0.744 . . . . 0.0 111.524 -178.587 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 118' ' ' GLU . . . . . . . . . . . . . 39.3 mt-10 -91.61 -30.46 16.35 Favored 'General case' 0 C--N 1.327 -0.39 0 N-CA-C 112.41 0.522 . . . . 0.0 112.41 -175.897 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 119' ' ' THR . . . . . . . . . . . . . 63.4 m -64.99 111.9 3.07 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-O 120.96 0.409 . . . . 0.0 110.356 -178.68 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 120' ' ' LYS . . . . . . . . . . . . . 91.2 mttt -92.93 79.58 4.63 Favored 'General case' 0 C--N 1.326 -0.42 0 CA-C-O 121.309 0.576 . . . . 0.0 110.734 -176.896 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 121' ' ' LEU . . . . . . . . . . . . . 76.5 mt -126.97 -175.66 3.48 Favored 'General case' 0 C--N 1.321 -0.658 0 CA-C-N 115.5 -0.773 . . . . 0.0 109.612 177.559 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 122' ' ' ALA . . . . . . . . . . . . . . . -65.53 152.28 44.42 Favored 'General case' 0 C--N 1.325 -0.495 0 CA-C-N 116.497 -0.319 . . . . 0.0 110.328 178.812 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 123' ' ' LYS . . . . . . . . . . . . . 0.4 OUTLIER -63.56 -35.66 81.22 Favored 'General case' 0 C--N 1.325 -0.491 0 CA-C-N 116.273 -0.421 . . . . 0.0 110.238 -176.043 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 124' ' ' ASN . . . . . 0.764 ' HA ' ' HE3' ' A' ' 127' ' ' LYS . 11.6 t30 -69.61 -35.69 75.5 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 116.176 -0.465 . . . . 0.0 110.246 177.979 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 125' ' ' THR . . . . . 0.539 ' O ' HG13 ' A' ' 129' ' ' ILE . 8.6 m -65.43 -44.25 87.92 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.226 -0.443 . . . . 0.0 110.274 177.015 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 126' ' ' LEU . . . . . 0.41 ' HB3' HG23 ' A' ' 116' ' ' ILE . 98.6 mt -61.55 -43.27 99.16 Favored 'General case' 0 C--N 1.33 -0.246 0 CA-C-N 115.911 -0.586 . . . . 0.0 110.57 178.665 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 127' ' ' LYS . . . . . 0.764 ' HE3' ' HA ' ' A' ' 124' ' ' ASN . 44.9 mtmt -60.87 -40.06 91.53 Favored 'General case' 0 C--N 1.331 -0.219 0 CA-C-N 116.118 -0.492 . . . . 0.0 110.519 175.824 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 128' ' ' ALA . . . . . . . . . . . . . . . -64.47 -34.38 78.06 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 116.086 -0.506 . . . . 0.0 110.995 179.48 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 129' ' ' ILE . . . . . 0.539 HG13 ' O ' ' A' ' 125' ' ' THR . 71.3 mt -63.26 -53.42 46.04 Favored 'Isoleucine or valine' 0 C--O 1.234 0.244 0 CA-C-N 116.565 -0.289 . . . . 0.0 110.347 177.196 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 130' ' ' ARG . . . . . . . . . . . . . 40.4 ttp180 -62.85 -40.69 98.23 Favored 'General case' 0 CA--C 1.521 -0.154 0 CA-C-O 120.793 0.33 . . . . 0.0 110.126 178.455 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 131' ' ' ASN . . . . . 0.629 ' O ' ' HG2' ' A' ' 135' ' ' GLN . 7.5 t30 -54.98 -55.91 25.55 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-N 115.777 -0.647 . . . . 0.0 110.832 178.538 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 132' ' ' THR . . . . . 0.464 ' O ' HG13 ' A' ' 136' ' ' ILE . 32.0 m -57.04 -45.6 83.04 Favored 'General case' 0 C--N 1.326 -0.433 0 CA-C-N 116.295 -0.412 . . . . 0.0 110.79 -178.705 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 133' ' ' ALA . . . . . . . . . . . . . . . -63.34 -48.67 77.03 Favored 'General case' 0 C--N 1.332 -0.193 0 CA-C-N 116.325 -0.398 . . . . 0.0 111.56 179.796 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 134' ' ' SER . . . . . 0.574 ' O ' ' HG3' ' A' ' 138' ' ' ARG . 26.9 p -66.53 -32.0 73.08 Favored 'General case' 0 C--N 1.327 -0.39 0 CA-C-N 116.633 -0.258 . . . . 0.0 111.27 -177.108 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 135' ' ' GLN . . . . . 0.629 ' HG2' ' O ' ' A' ' 131' ' ' ASN . 11.0 mm100 -65.53 -38.24 89.08 Favored 'General case' 0 C--N 1.331 -0.205 0 C-N-CA 120.967 -0.293 . . . . 0.0 110.36 176.777 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 136' ' ' ILE . . . . . 0.464 HG13 ' O ' ' A' ' 132' ' ' THR . 76.3 mt -64.0 -39.9 87.11 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.262 0 CA-C-N 116.285 -0.416 . . . . 0.0 109.986 176.699 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 137' ' ' PHE . . . . . 0.514 ' O ' HG13 ' A' ' 141' ' ' ILE . 44.2 m-85 -62.86 -42.89 99.92 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.183 -0.462 . . . . 0.0 110.638 175.435 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 138' ' ' ARG . . . . . 0.574 ' HG3' ' O ' ' A' ' 134' ' ' SER . 42.4 mtt180 -60.84 -38.56 85.91 Favored 'General case' 0 N--CA 1.465 0.283 0 CA-C-O 120.804 0.335 . . . . 0.0 110.537 178.559 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 139' ' ' LEU . . . . . 0.457 HD21 ' HG2' ' A' ' 70' ' ' LYS . 65.5 tp -56.45 -38.65 71.92 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 115.821 -0.627 . . . . 0.0 110.519 177.071 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 140' ' ' ALA . . . . . . . . . . . . . . . -74.87 -33.27 62.07 Favored 'General case' 0 C--N 1.325 -0.47 0 CA-C-N 115.872 -0.604 . . . . 0.0 110.706 177.43 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 141' ' ' ILE . . . . . 0.641 ' HA ' ' O ' ' A' ' 146' ' ' ILE . 73.6 mt -64.35 -43.59 97.12 Favored 'Isoleucine or valine' 0 C--O 1.233 0.228 0 CA-C-N 116.08 -0.509 . . . . 0.0 111.01 177.983 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 142' ' ' GLU . . . . . 0.477 ' HG3' ' O ' ' A' ' 138' ' ' ARG . 48.4 mt-10 -60.69 -39.33 88.08 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.113 -0.494 . . . . 0.0 110.657 178.976 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 143' ' ' ASN . . . . . . . . . . . . . 43.7 m-80 -83.97 3.09 35.77 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 115.782 -0.645 . . . . 0.0 110.622 179.555 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 144' ' ' ARG . . . . . . . . . . . . . 99.5 mtt180 60.87 28.66 18.42 Favored 'General case' 0 C--O 1.234 0.267 0 CA-C-N 115.423 -0.808 . . . . 0.0 111.762 174.014 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 145' ' ' ALA . . . . . . . . . . . . . . . -78.25 -37.77 44.43 Favored 'General case' 0 C--N 1.326 -0.428 0 CA-C-N 115.672 -0.694 . . . . 0.0 109.224 174.276 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 146' ' ' ILE . . . . . 0.641 ' O ' ' HA ' ' A' ' 141' ' ' ILE . 13.8 tt -144.73 140.26 23.47 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.626 0 CA-C-N 115.011 -0.995 . . . . 0.0 108.847 175.961 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 147' ' ' ASP . . . . . . . . . . . . . 31.6 t70 -117.1 46.12 1.74 Allowed 'General case' 0 C--N 1.318 -0.791 0 N-CA-C 108.75 -0.833 . . . . 0.0 108.75 178.53 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 148' ' ' PHE . . . . . . . . . . . . . 70.5 t80 -151.42 123.9 8.39 Favored 'General case' 0 C--N 1.322 -0.603 0 CA-C-N 114.851 -1.068 . . . . 0.0 109.321 -177.105 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 149' ' ' ASN . . . . . . . . . . . . . 49.0 t-20 -110.74 98.12 36.26 Favored Pre-proline 0 C--N 1.321 -0.634 0 N-CA-C 110.119 -0.326 . . . . 0.0 110.119 -179.354 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 150' ' ' PRO . . . . . . . . . . . . . 26.6 Cg_exo -62.37 -33.2 80.64 Favored 'Trans proline' 0 C--O 1.232 0.181 0 C-N-CA 122.689 2.259 . . . . 0.0 111.98 -179.335 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 151' ' ' ALA . . . . . . . . . . . . . . . -73.46 -18.11 61.16 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 115.988 -0.551 . . . . 0.0 111.386 -176.51 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 152' ' ' ASP . . . . . . . . . . . . . 34.6 t70 -72.49 -24.3 61.15 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-O 121.288 0.566 . . . . 0.0 110.234 179.216 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 153' ' ' TYR . . . . . . . . . . . . . 62.5 m-85 -89.91 -4.41 57.54 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-N 115.954 -0.567 . . . . 0.0 110.138 179.916 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 154' ' ' VAL . . . . . 0.498 HG23 ' HB ' ' A' ' 112' ' ' ILE . 60.3 t -89.67 139.11 18.01 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.544 0 CA-C-N 115.531 -0.759 . . . . 0.0 109.495 176.437 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 155' ' ' ARG . . . . . . . . . . . . . 15.9 ptt180 -124.58 155.55 38.9 Favored 'General case' 0 C--N 1.321 -0.648 0 C-N-CA 120.554 -0.458 . . . . 0.0 110.963 179.855 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 156' ' ' ILE . . . . . 0.426 ' HA ' ' HD3' ' A' ' 157' ' ' PRO . 2.4 mp -96.43 116.29 66.07 Favored Pre-proline 0 C--N 1.324 -0.51 0 CA-C-N 115.843 -0.617 . . . . 0.0 109.986 179.734 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 157' ' ' PRO . . . . . 0.426 ' HD3' ' HA ' ' A' ' 156' ' ' ILE . 14.2 Cg_exo . . . . . 0 N--CA 1.456 -0.685 0 C-N-CA 122.591 2.194 . . . . 0.0 111.181 177.191 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 63' ' ' SER . . . . . 0.568 ' HB2' ' HB2' ' A' ' 66' ' ' ASP . 5.5 m . . . . . 0 N--CA 1.454 -0.24 0 N-CA-C 109.784 -0.451 . . . . 0.0 109.784 . . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 64' ' ' PHE . . . . . 0.464 ' HB2' HD12 ' A' ' 107' ' ' ILE . 80.0 t80 -64.23 -50.37 68.28 Favored 'General case' 0 C--N 1.328 -0.365 0 N-CA-C 109.989 -0.374 . . . . 0.0 109.989 178.588 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 65' ' ' GLY . . . . . . . . . . . . . . . -62.87 -27.67 70.58 Favored Glycine 0 C--N 1.33 0.247 0 C-N-CA 120.816 -0.707 . . . . 0.0 112.193 177.378 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 66' ' ' ASP . . . . . 0.568 ' HB2' ' HB2' ' A' ' 63' ' ' SER . 8.1 t70 -62.68 -53.28 56.88 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-O 121.107 0.479 . . . . 0.0 110.34 177.692 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 67' ' ' TRP . . . . . . . . . . . . . 90.8 m95 -75.22 -27.26 59.47 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 115.788 -0.642 . . . . 0.0 111.256 -179.922 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 68' ' ' ALA . . . . . 0.545 ' O ' ' HG ' ' A' ' 72' ' ' LEU . . . -60.34 -48.54 81.33 Favored 'General case' 0 C--N 1.326 -0.419 0 N-CA-C 110.025 -0.361 . . . . 0.0 110.025 174.995 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 69' ' ' GLU . . . . . . . . . . . . . 17.8 tp10 -56.68 -44.06 81.07 Favored 'General case' 0 C--O 1.233 0.236 0 CA-C-N 115.885 -0.598 . . . . 0.0 110.527 175.358 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 70' ' ' LYS . . . . . . . . . . . . . 59.2 mttp -61.27 -45.1 95.91 Favored 'General case' 0 C--N 1.326 -0.416 0 CA-C-N 116.07 -0.514 . . . . 0.0 110.832 177.597 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 71' ' ' PHE . . . . . . . . . . . . . 69.8 t80 -66.04 -42.79 89.12 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.352 -0.385 . . . . 0.0 111.058 -178.974 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 72' ' ' LEU . . . . . 0.545 ' HG ' ' O ' ' A' ' 68' ' ' ALA . 88.6 mt -63.74 -49.94 71.05 Favored 'General case' 0 C--N 1.326 -0.417 0 CA-C-O 120.857 0.361 . . . . 0.0 110.667 179.805 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 73' ' ' LYS . . . . . 0.517 ' HZ1' ' HB3' ' A' ' 73' ' ' LYS . 5.7 ttpm? -69.32 -32.32 71.36 Favored 'General case' 0 C--N 1.323 -0.548 0 CA-C-N 116.173 -0.467 . . . . 0.0 111.406 -175.653 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 74' ' ' SER . . . . . . . . . . . . . 37.9 p -71.04 -32.25 68.94 Favored 'General case' 0 C--N 1.328 -0.327 0 C-N-CA 120.628 -0.429 . . . . 0.0 110.216 175.955 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 75' ' ' LYS . . . . . 0.407 ' O ' HG23 ' A' ' 80' ' ' VAL . 39.5 mmtt -70.59 -35.92 73.27 Favored 'General case' 0 C--O 1.233 0.203 0 CA-C-O 120.801 0.334 . . . . 0.0 110.687 174.082 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 76' ' ' GLU . . . . . . . . . . . . . 33.9 tt0 -56.22 -44.8 79.9 Favored 'General case' 0 C--N 1.327 -0.403 0 CA-C-N 116.011 -0.54 . . . . 0.0 110.175 176.083 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 77' ' ' ALA . . . . . . . . . . . . . . . -80.96 -24.1 38.32 Favored 'General case' 0 C--N 1.326 -0.423 0 CA-C-N 115.818 -0.628 . . . . 0.0 111.276 177.417 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 78' ' ' ASP . . . . . . . . . . . . . 15.6 t70 -57.35 -54.6 45.03 Favored 'General case' 0 N--CA 1.466 0.343 0 CA-C-N 116.108 -0.496 . . . . 0.0 110.735 179.192 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 79' ' ' GLY . . . . . . . . . . . . . . . 146.52 56.37 0.02 OUTLIER Glycine 0 N--CA 1.443 -0.884 0 C-N-CA 120.335 -0.936 . . . . 0.0 112.656 178.2 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 80' ' ' VAL . . . . . 0.594 ' HB ' ' HB2' ' A' ' 84' ' ' GLN . 32.9 m -121.2 148.88 24.27 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.642 0 CA-C-O 120.763 0.316 . . . . 0.0 110.223 176.67 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 81' ' ' SER . . . . . . . . . . . . . 13.1 p -81.94 172.78 12.88 Favored 'General case' 0 C--N 1.319 -0.733 0 CA-C-N 116.146 -0.479 . . . . 0.0 110.076 176.789 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 82' ' ' VAL . . . . . . . . . . . . . 7.9 p -58.7 -40.08 78.38 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.47 0 CA-C-N 116.49 -0.323 . . . . 0.0 111.463 -176.178 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 83' ' ' SER . . . . . . . . . . . . . 13.7 t -62.86 -33.43 75.25 Favored 'General case' 0 C--N 1.331 -0.206 0 CA-C-O 120.623 0.249 . . . . 0.0 110.734 -178.631 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 84' ' ' GLN . . . . . 0.594 ' HB2' ' HB ' ' A' ' 80' ' ' VAL . 17.1 mm100 -68.35 -57.49 5.83 Favored 'General case' 0 C--N 1.332 -0.191 0 N-CA-C 109.896 -0.409 . . . . 0.0 109.896 177.464 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 85' ' ' LEU . . . . . 0.48 HD23 ' O ' ' A' ' 72' ' ' LEU . 0.2 OUTLIER -58.93 -39.87 82.86 Favored 'General case' 0 C--N 1.325 -0.462 0 CA-C-N 116.051 -0.522 . . . . 0.0 110.507 -176.618 . . . . . . . . 3 3 . 1 . 012 nuclear orig core ' A' A ' 86' ' ' ASN . . . . . . . . . . . . . 62.7 t30 -63.83 -35.67 81.38 Favored 'General case' 0 C--N 1.326 -0.453 0 CA-C-N 115.865 -0.607 . . . . 0.0 110.832 -179.486 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 87' ' ' SER . . . . . . . . . . . . . 75.9 p -78.55 -36.85 44.08 Favored 'General case' 0 CA--C 1.531 0.239 0 C-N-CA 121.033 -0.267 . . . . 0.0 111.143 178.448 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 88' ' ' TYR . . . . . . . . . . . . . 29.8 m-85 -56.6 -47.69 79.05 Favored 'General case' 0 N--CA 1.463 0.182 0 CA-C-O 121.381 0.61 . . . . 0.0 109.728 173.791 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 89' ' ' LYS . . . . . . . . . . . . . 21.9 ttmm -64.64 -41.81 95.9 Favored 'General case' 0 C--N 1.327 -0.392 0 CA-C-N 115.173 -0.921 . . . . 0.0 110.554 178.859 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 90' ' ' ASN . . . . . . . . . . . . . 20.3 t30 -53.41 -50.02 66.04 Favored 'General case' 0 C--O 1.237 0.427 0 CA-C-O 120.945 0.402 . . . . 0.0 111.094 177.831 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 91' ' ' TYR . . . . . 0.415 ' O ' ' HB2' ' A' ' 95' ' ' HIS . 34.0 m-85 -60.39 -48.97 79.46 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.335 -0.393 . . . . 0.0 111.112 179.599 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 92' ' ' CYS . . . . . 0.537 ' HA ' ' HB2' ' A' ' 96' ' ' LEU . 51.2 t -71.14 -24.99 62.37 Favored 'General case' 0 C--N 1.324 -0.532 0 CA-C-O 120.878 0.37 . . . . 0.0 111.609 -176.299 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 93' ' ' ARG . . . . . 0.404 ' O ' ' HB3' ' A' ' 97' ' ' SER . 37.5 ttt180 -77.31 -52.24 9.52 Favored 'General case' 0 C--N 1.324 -0.512 0 CA-C-N 116.371 -0.377 . . . . 0.0 111.844 -174.951 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 94' ' ' ASN . . . . . . . . . . . . . 3.5 t-20 -103.65 -36.45 7.9 Favored 'General case' 0 C--N 1.33 -0.269 0 C-N-CA 120.937 -0.305 . . . . 0.0 111.812 -175.211 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 95' ' ' HIS . . . . . 0.415 ' HB2' ' O ' ' A' ' 91' ' ' TYR . 42.6 m80 -85.71 -21.14 28.44 Favored 'General case' 0 C--N 1.322 -0.605 0 C-N-CA 120.688 -0.405 . . . . 0.0 111.344 -175.544 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 96' ' ' LEU . . . . . 0.537 ' HB2' ' HA ' ' A' ' 92' ' ' CYS . 89.7 mt -117.66 24.52 11.02 Favored 'General case' 0 C--N 1.324 -0.511 0 CA-C-O 121.124 0.487 . . . . 0.0 110.173 177.123 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 97' ' ' SER . . . . . 0.581 ' OG ' ' HD3' ' A' ' 98' ' ' PRO . 8.1 p -61.16 -43.12 89.37 Favored Pre-proline 0 CA--C 1.541 0.63 0 N-CA-C 113.272 0.841 . . . . 0.0 113.272 -177.548 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 98' ' ' PRO . . . . . 0.581 ' HD3' ' OG ' ' A' ' 97' ' ' SER . 17.5 Cg_exo -66.9 -15.06 46.02 Favored 'Trans proline' 0 C--N 1.361 1.208 0 C-N-CA 121.711 1.607 . . . . 0.0 112.028 -179.924 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 99' ' ' LEU . . . . . . . . . . . . . 49.9 mt -98.33 -33.69 10.97 Favored 'General case' 0 C--N 1.324 -0.501 0 CA-C-N 115.942 -0.572 . . . . 0.0 110.575 -178.835 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 100' ' ' TYR . . . . . . . . . . . . . 45.0 t80 -53.94 -43.44 69.81 Favored 'General case' 0 N--CA 1.465 0.279 0 CA-C-N 115.931 -0.577 . . . . 0.0 111.956 -175.434 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 101' ' ' MET . . . . . . . . . . . . . 0.7 OUTLIER -80.18 -16.13 55.51 Favored 'General case' 0 C--N 1.328 -0.335 0 N-CA-C 112.175 0.435 . . . . 0.0 112.175 -176.601 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 102' ' ' LYS . . . . . . . . . . . . . 95.4 mttt -88.95 153.64 20.87 Favored 'General case' 0 C--N 1.325 -0.5 0 CA-C-O 121.204 0.526 . . . . 0.0 110.975 -176.731 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 103' ' ' SER . . . . . 0.596 ' HB2' ' CG ' ' A' ' 106' ' ' GLU . 3.1 m -69.69 148.09 49.71 Favored 'General case' 0 C--N 1.324 -0.521 0 CA-C-N 115.651 -0.704 . . . . 0.0 109.174 175.003 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 104' ' ' LEU . . . . . . . . . . . . . 25.1 tp -59.87 -55.37 34.99 Favored 'General case' 0 C--N 1.323 -0.548 0 CA-C-O 120.803 0.335 . . . . 0.0 111.582 -171.466 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 105' ' ' SER . . . . . . . . . . . . . 34.4 t -73.09 -11.87 60.7 Favored 'General case' 0 C--N 1.325 -0.465 0 CA-C-N 116.212 -0.449 . . . . 0.0 111.45 -176.741 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 106' ' ' GLU . . . . . 0.596 ' CG ' ' HB2' ' A' ' 103' ' ' SER . 6.6 mm-40 -88.29 -15.55 35.48 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-O 120.686 0.279 . . . . 0.0 110.657 -178.465 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 107' ' ' ILE . . . . . 0.52 HG13 ' O ' ' A' ' 103' ' ' SER . 81.5 mt -69.78 129.27 34.05 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.376 0 CA-C-N 116.246 -0.433 . . . . 0.0 110.691 -179.49 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 108' ' ' LEU . . . . . . . . . . . . . 65.6 mt -88.3 146.01 37.04 Favored Pre-proline 0 C--N 1.322 -0.618 0 CA-C-N 115.916 -0.583 . . . . 0.0 109.871 178.267 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 109' ' ' PRO . . . . . . . . . . . . . 52.6 Cg_exo -55.38 -31.05 75.79 Favored 'Trans proline' 0 N--CA 1.463 -0.318 0 C-N-CA 122.184 1.923 . . . . 0.0 111.123 173.387 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 110' ' ' ALA . . . . . . . . . . . . . . . -60.98 -37.93 84.21 Favored 'General case' 0 N--CA 1.453 -0.287 0 CA-C-N 115.342 -0.844 . . . . 0.0 111.434 178.319 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 111' ' ' ASP . . . . . 0.431 ' O ' HG13 ' A' ' 115' ' ' ILE . 5.9 m-20 -58.46 -56.58 20.24 Favored 'General case' 0 N--CA 1.466 0.329 0 CA-C-O 120.9 0.381 . . . . 0.0 110.999 -179.247 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 112' ' ' ILE . . . . . . . . . . . . . 18.6 mt -65.43 -43.35 94.66 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.514 0 CA-C-N 115.578 -0.737 . . . . 0.0 110.684 -176.332 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 113' ' ' GLN . . . . . 0.467 ' HA ' HG11 ' A' ' 154' ' ' VAL . 24.7 tp60 -61.96 -40.95 97.32 Favored 'General case' 0 C--N 1.332 -0.195 0 CA-C-N 116.227 -0.442 . . . . 0.0 110.524 -179.927 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 114' ' ' SER . . . . . 0.424 ' O ' ' HG2' ' A' ' 118' ' ' GLU . 48.3 t -59.42 -46.22 89.33 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.088 -0.505 . . . . 0.0 110.492 178.194 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 115' ' ' ILE . . . . . 0.431 HG13 ' O ' ' A' ' 111' ' ' ASP . 79.2 mt -58.87 -57.63 10.37 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.224 0 CA-C-N 116.162 -0.472 . . . . 0.0 110.683 179.812 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 116' ' ' ILE . . . . . . . . . . . . . 47.3 mm -57.86 -38.48 66.22 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.371 0 CA-C-N 116.196 -0.456 . . . . 0.0 111.55 -177.51 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 117' ' ' ASN . . . . . . . . . . . . . 7.8 t30 -65.93 -38.32 88.35 Favored 'General case' 0 C--N 1.327 -0.384 0 CA-C-N 116.457 -0.338 . . . . 0.0 111.707 -175.452 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 118' ' ' GLU . . . . . 0.424 ' HG2' ' O ' ' A' ' 114' ' ' SER . 11.0 pt-20 -96.43 -12.41 24.28 Favored 'General case' 0 C--N 1.33 -0.279 0 N-CA-C 112.239 0.459 . . . . 0.0 112.239 -176.255 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 119' ' ' THR . . . . . . . . . . . . . 90.3 m -68.95 113.7 6.59 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-O 121.259 0.552 . . . . 0.0 110.103 177.98 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 120' ' ' LYS . . . . . . . . . . . . . 47.9 mttp -93.8 81.28 4.22 Favored 'General case' 0 C--N 1.322 -0.618 0 CA-C-N 115.726 -0.67 . . . . 0.0 110.429 -174.924 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 121' ' ' LEU . . . . . . . . . . . . . 85.2 mt -133.86 -175.48 3.85 Favored 'General case' 0 C--N 1.325 -0.499 0 CA-C-N 115.308 -0.86 . . . . 0.0 109.695 179.825 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 122' ' ' ALA . . . . . . . . . . . . . . . -71.78 158.3 36.36 Favored 'General case' 0 C--N 1.325 -0.489 0 CA-C-O 120.83 0.348 . . . . 0.0 111.097 -179.045 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 123' ' ' LYS . . . . . . . . . . . . . 54.9 mtpt -60.04 -40.2 88.54 Favored 'General case' 0 C--N 1.33 -0.244 0 CA-C-N 115.858 -0.61 . . . . 0.0 111.3 -176.08 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 124' ' ' ASN . . . . . . . . . . . . . 20.4 p-10 -73.36 -30.52 63.36 Favored 'General case' 0 C--N 1.326 -0.442 0 CA-C-N 116.077 -0.51 . . . . 0.0 110.726 -179.76 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 125' ' ' THR . . . . . 0.403 ' O ' HG13 ' A' ' 129' ' ' ILE . 8.0 m -70.5 -41.17 73.02 Favored 'General case' 0 C--N 1.323 -0.578 0 CA-C-N 116.326 -0.397 . . . . 0.0 110.623 178.982 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 126' ' ' LEU . . . . . . . . . . . . . 91.1 mt -61.74 -44.02 97.71 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 116.105 -0.498 . . . . 0.0 110.675 178.348 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 127' ' ' LYS . . . . . 0.62 ' HG2' HG13 ' A' ' 156' ' ' ILE . 87.8 mttt -64.45 -39.0 92.99 Favored 'General case' 0 C--N 1.331 -0.213 0 CA-C-N 116.126 -0.488 . . . . 0.0 111.005 178.985 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 128' ' ' ALA . . . . . . . . . . . . . . . -58.32 -44.41 88.62 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.276 -0.42 . . . . 0.0 110.895 -179.874 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 129' ' ' ILE . . . . . 0.403 HG13 ' O ' ' A' ' 125' ' ' THR . 65.2 mt -61.97 -47.81 91.45 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.37 0 CA-C-N 115.86 -0.609 . . . . 0.0 110.446 179.024 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 130' ' ' ARG . . . . . . . . . . . . . 10.4 ttp180 -64.95 -43.82 91.46 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 115.864 -0.607 . . . . 0.0 110.952 -178.188 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 131' ' ' ASN . . . . . . . . . . . . . 9.9 t30 -62.12 -44.56 96.38 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.421 -0.354 . . . . 0.0 111.084 -179.317 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 132' ' ' THR . . . . . 0.483 ' O ' HG13 ' A' ' 136' ' ' ILE . 35.8 m -58.17 -48.22 80.98 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.268 -0.424 . . . . 0.0 110.292 178.844 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 133' ' ' ALA . . . . . . . . . . . . . . . -65.1 -38.83 91.98 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.131 -0.486 . . . . 0.0 110.991 178.905 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 134' ' ' SER . . . . . 0.434 ' HA ' ' HB3' ' A' ' 151' ' ' ALA . 18.5 t -61.76 -41.92 98.31 Favored 'General case' 0 C--N 1.327 -0.393 0 CA-C-N 116.048 -0.524 . . . . 0.0 110.622 -179.199 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 135' ' ' GLN . . . . . . . . . . . . . 49.7 mt-30 -66.8 -31.0 71.35 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 116.544 -0.298 . . . . 0.0 111.322 178.101 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 136' ' ' ILE . . . . . 0.483 HG13 ' O ' ' A' ' 132' ' ' THR . 76.1 mt -65.95 -50.93 66.44 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.225 0 CA-C-O 120.807 0.337 . . . . 0.0 110.202 176.761 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 137' ' ' PHE . . . . . 0.482 ' O ' HG13 ' A' ' 141' ' ' ILE . 66.0 m-85 -62.7 -37.46 86.57 Favored 'General case' 0 C--N 1.331 -0.213 0 CA-C-N 116.279 -0.418 . . . . 0.0 110.539 176.431 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 138' ' ' ARG . . . . . . . . . . . . . 26.5 ttp85 -60.1 -44.28 94.94 Favored 'General case' 0 N--CA 1.45 -0.469 0 CA-C-N 116.11 -0.496 . . . . 0.0 110.549 178.88 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 139' ' ' LEU . . . . . . . . . . . . . 65.9 tp -60.29 -34.92 74.44 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 115.678 -0.692 . . . . 0.0 110.562 177.87 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 140' ' ' ALA . . . . . 0.478 ' HB1' ' HB1' ' A' ' 145' ' ' ALA . . . -72.62 -34.65 67.48 Favored 'General case' 0 C--N 1.323 -0.579 0 CA-C-N 115.975 -0.557 . . . . 0.0 110.868 178.512 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 141' ' ' ILE . . . . . 0.55 ' HA ' ' O ' ' A' ' 146' ' ' ILE . 81.7 mt -60.31 -49.96 82.18 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.235 0 CA-C-N 116.708 -0.224 . . . . 0.0 111.281 176.982 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 142' ' ' GLU . . . . . . . . . . . . . 14.9 pt-20 -70.08 -18.78 63.28 Favored 'General case' 0 N--CA 1.464 0.252 0 CA-C-O 120.943 0.402 . . . . 0.0 111.298 -179.216 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 143' ' ' ASN . . . . . . . . . . . . . 20.8 m-80 -97.74 6.22 48.18 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.37 -0.377 . . . . 0.0 110.515 175.32 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 144' ' ' ARG . . . . . 0.4 HH11 ' HD3' ' A' ' 144' ' ' ARG . 44.7 mtt180 60.1 32.45 20.97 Favored 'General case' 0 N--CA 1.464 0.26 0 CA-C-N 115.65 -0.705 . . . . 0.0 112.037 173.966 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 145' ' ' ALA . . . . . 0.478 ' HB1' ' HB1' ' A' ' 140' ' ' ALA . . . -88.4 -32.09 18.51 Favored 'General case' 0 C--N 1.324 -0.524 0 CA-C-O 121.073 0.463 . . . . 0.0 109.754 175.009 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 146' ' ' ILE . . . . . 0.55 ' O ' ' HA ' ' A' ' 141' ' ' ILE . 16.5 tt -143.11 144.5 23.81 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.444 0 CA-C-N 115.32 -0.854 . . . . 0.0 108.882 176.293 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 147' ' ' ASP . . . . . . . . . . . . . 34.6 t70 -96.89 -0.45 47.67 Favored 'General case' 0 C--N 1.323 -0.551 0 CA-C-O 120.953 0.406 . . . . 0.0 111.887 -172.823 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 148' ' ' PHE . . . . . . . . . . . . . 46.7 p90 -144.43 163.28 34.27 Favored 'General case' 0 C--N 1.324 -0.52 0 O-C-N 122.026 -0.421 . . . . 0.0 111.07 -175.949 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 149' ' ' ASN . . . . . 0.491 ' HB2' HD13 ' A' ' 141' ' ' ILE . 47.1 t-20 -120.67 89.84 45.36 Favored Pre-proline 0 C--N 1.328 -0.365 0 CA-C-N 116.24 -0.436 . . . . 0.0 110.394 -177.492 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 150' ' ' PRO . . . . . . . . . . . . . 35.9 Cg_endo -66.15 -22.08 54.69 Favored 'Trans proline' 0 C--N 1.343 0.246 0 C-N-CA 122.59 2.193 . . . . 0.0 112.173 -178.223 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 151' ' ' ALA . . . . . 0.434 ' HB3' ' HA ' ' A' ' 134' ' ' SER . . . -70.75 -30.66 67.22 Favored 'General case' 0 C--N 1.327 -0.399 0 CA-C-N 116.269 -0.423 . . . . 0.0 110.553 179.694 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 152' ' ' ASP . . . . . . . . . . . . . 9.3 t70 -77.81 -15.29 59.19 Favored 'General case' 0 C--N 1.329 -0.306 0 N-CA-C 109.195 -0.669 . . . . 0.0 109.195 178.561 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 153' ' ' TYR . . . . . . . . . . . . . 73.3 t80 -83.18 -16.44 46.58 Favored 'General case' 0 C--N 1.327 -0.411 0 CA-C-N 115.656 -0.702 . . . . 0.0 109.453 177.396 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 154' ' ' VAL . . . . . 0.467 HG11 ' HA ' ' A' ' 113' ' ' GLN . 63.2 t -71.83 136.26 26.13 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.422 0 CA-C-N 115.724 -0.671 . . . . 0.0 110.006 177.474 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 155' ' ' ARG . . . . . 0.418 HH11 ' HD2' ' A' ' 155' ' ' ARG . 40.4 mtt180 -98.43 141.43 31.31 Favored 'General case' 0 C--N 1.322 -0.627 0 CA-C-N 115.838 -0.619 . . . . 0.0 111.167 -177.535 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 156' ' ' ILE . . . . . 0.62 HG13 ' HG2' ' A' ' 127' ' ' LYS . 46.8 mm -98.22 107.27 40.51 Favored Pre-proline 0 C--N 1.321 -0.672 0 N-CA-C 108.593 -0.891 . . . . 0.0 108.593 170.922 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 157' ' ' PRO . . . . . . . . . . . . . 58.8 Cg_endo . . . . . 0 N--CA 1.451 -0.976 0 C-N-CA 121.281 1.321 . . . . 0.0 113.288 -173.754 . . . . . . . . 0 0 . 1 . 013 nuclear orig core ' A' A ' 63' ' ' SER . . . . . 0.584 ' HA ' ' HA ' ' A' ' 103' ' ' SER . 18.7 m . . . . . 0 C--O 1.242 0.693 0 CA-C-O 121.408 0.623 . . . . 0.0 111.177 . . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 64' ' ' PHE . . . . . 0.45 ' HB2' HD13 ' A' ' 107' ' ' ILE . 79.5 t80 -60.01 -37.18 78.97 Favored 'General case' 0 C--N 1.325 -0.484 0 CA-C-N 115.206 -0.906 . . . . 0.0 110.32 179.479 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 65' ' ' GLY . . . . . . . . . . . . . . . -58.19 -40.83 94.33 Favored Glycine 0 N--CA 1.451 -0.305 0 C-N-CA 121.145 -0.55 . . . . 0.0 112.692 177.606 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 66' ' ' ASP . . . . . . . . . . . . . 7.3 m-20 -59.9 -53.2 60.62 Favored 'General case' 0 C--O 1.236 0.357 0 CA-C-O 121.375 0.607 . . . . 0.0 110.756 179.04 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 67' ' ' TRP . . . . . 0.41 ' CE3' ' HD3' ' A' ' 70' ' ' LYS . 87.4 m95 -76.91 -23.25 52.52 Favored 'General case' 0 C--N 1.325 -0.494 0 CA-C-N 115.614 -0.721 . . . . 0.0 111.955 -175.804 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 68' ' ' ALA . . . . . 0.585 ' O ' ' HG ' ' A' ' 72' ' ' LEU . . . -63.51 -48.59 76.95 Favored 'General case' 0 C--N 1.325 -0.473 0 CA-C-O 120.837 0.351 . . . . 0.0 110.573 175.969 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 69' ' ' GLU . . . . . 0.528 ' HA ' HD11 ' A' ' 72' ' ' LEU . 26.4 mt-10 -74.2 -22.12 59.52 Favored 'General case' 0 C--N 1.327 -0.375 0 CA-C-N 116.469 -0.332 . . . . 0.0 110.939 -179.965 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 70' ' ' LYS . . . . . 0.41 ' HD3' ' CE3' ' A' ' 67' ' ' TRP . 60.9 tttp -68.19 -41.81 80.87 Favored 'General case' 0 C--N 1.326 -0.43 0 N-CA-C 109.568 -0.53 . . . . 0.0 109.568 172.637 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 71' ' ' PHE . . . . . . . . . . . . . 61.9 t80 -61.61 -44.09 97.65 Favored 'General case' 0 N--CA 1.454 -0.251 0 CA-C-N 116.038 -0.528 . . . . 0.0 109.935 174.2 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 72' ' ' LEU . . . . . 0.585 ' HG ' ' O ' ' A' ' 68' ' ' ALA . 87.3 mt -56.87 -43.96 81.74 Favored 'General case' 0 C--N 1.327 -0.38 0 CA-C-N 116.162 -0.472 . . . . 0.0 110.361 176.802 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 73' ' ' LYS . . . . . . . . . . . . . 24.8 ttmm -64.49 -37.08 86.29 Favored 'General case' 0 C--N 1.326 -0.422 0 CA-C-N 115.763 -0.653 . . . . 0.0 111.207 -179.358 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 74' ' ' SER . . . . . . . . . . . . . 96.8 p -68.89 -34.13 74.92 Favored 'General case' 0 C--O 1.226 -0.181 0 C-N-CA 120.588 -0.445 . . . . 0.0 110.458 179.288 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 75' ' ' LYS . . . . . 0.63 ' HE2' ' HA ' ' A' ' 75' ' ' LYS . 11.3 mmpt? -70.04 -39.47 75.72 Favored 'General case' 0 C--O 1.233 0.189 0 CA-C-O 121.117 0.484 . . . . 0.0 109.989 175.589 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 76' ' ' GLU . . . . . . . . . . . . . 33.2 tt0 -57.17 -46.05 83.13 Favored 'General case' 0 C--N 1.324 -0.517 0 CA-C-N 115.222 -0.899 . . . . 0.0 110.867 177.394 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 77' ' ' ALA . . . . . . . . . . . . . . . -80.31 -20.07 45.15 Favored 'General case' 0 C--N 1.323 -0.567 0 CA-C-N 115.762 -0.654 . . . . 0.0 111.518 179.638 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 78' ' ' ASP . . . . . . . . . . . . . 20.6 t70 -68.22 -53.22 26.3 Favored 'General case' 0 C--N 1.327 -0.384 0 CA-C-O 121.003 0.43 . . . . 0.0 110.604 -179.894 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 79' ' ' GLY . . . . . . . . . . . . . . . 137.51 65.77 0.05 OUTLIER Glycine 0 N--CA 1.447 -0.595 0 C-N-CA 120.518 -0.848 . . . . 0.0 112.42 179.539 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 80' ' ' VAL . . . . . . . . . . . . . 35.0 m -121.69 150.19 24.94 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.558 0 CA-C-O 120.737 0.303 . . . . 0.0 110.407 177.253 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 81' ' ' SER . . . . . . . . . . . . . 45.9 t -76.09 168.57 19.8 Favored 'General case' 0 C--N 1.324 -0.501 0 CA-C-N 116.398 -0.365 . . . . 0.0 110.252 179.02 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 82' ' ' VAL . . . . . . . . . . . . . 67.4 t -56.87 -51.07 72.54 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.215 0 CA-C-N 116.381 -0.372 . . . . 0.0 110.782 -178.657 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 83' ' ' SER . . . . . . . . . . . . . 14.9 m -59.73 -28.07 67.03 Favored 'General case' 0 C--N 1.327 -0.381 0 CA-C-N 116.361 -0.381 . . . . 0.0 111.358 -178.912 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 84' ' ' GLN . . . . . . . . . . . . . 6.5 tp-100 -80.48 -48.18 13.19 Favored 'General case' 0 C--N 1.327 -0.38 0 CA-C-O 120.824 0.345 . . . . 0.0 110.458 -179.328 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 85' ' ' LEU . . . . . . . . . . . . . 51.2 tp -64.55 -42.36 95.75 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-O 121.105 0.479 . . . . 0.0 110.229 178.738 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 86' ' ' ASN . . . . . . . . . . . . . 50.2 t30 -63.42 -33.9 76.56 Favored 'General case' 0 C--N 1.325 -0.457 0 CA-C-N 115.626 -0.715 . . . . 0.0 110.062 177.627 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 87' ' ' SER . . . . . . . . . . . . . 9.1 t -63.31 -45.19 92.46 Favored 'General case' 0 C--N 1.329 -0.283 0 N-CA-C 109.634 -0.506 . . . . 0.0 109.634 175.7 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 88' ' ' TYR . . . . . . . . . . . . . 18.5 m-85 -58.88 -43.61 90.96 Favored 'General case' 0 C--O 1.234 0.289 0 CA-C-N 116.465 -0.334 . . . . 0.0 110.531 176.708 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 89' ' ' LYS . . . . . 0.518 ' HG2' HD13 ' A' ' 72' ' ' LEU . 67.5 mttm -60.59 -42.35 96.57 Favored 'General case' 0 C--N 1.332 -0.163 0 CA-C-N 116.138 -0.483 . . . . 0.0 110.398 176.983 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 90' ' ' ASN . . . . . . . . . . . . . 26.3 t30 -56.95 -44.84 82.98 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.002 -0.545 . . . . 0.0 111.17 178.144 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 91' ' ' TYR . . . . . . . . . . . . . 63.3 m-85 -63.52 -49.2 74.47 Favored 'General case' 0 C--N 1.325 -0.458 0 C-N-CA 120.891 -0.323 . . . . 0.0 111.094 179.384 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 92' ' ' CYS . . . . . 0.458 ' HA ' HD12 ' A' ' 96' ' ' LEU . 58.6 m -65.88 -42.54 90.21 Favored 'General case' 0 C--N 1.326 -0.443 0 CA-C-O 121.064 0.459 . . . . 0.0 111.574 -177.308 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 93' ' ' ARG . . . . . . . . . . . . . 10.0 ttt180 -82.35 -51.06 8.24 Favored 'General case' 0 C--N 1.323 -0.553 0 N-CA-C 112.434 0.531 . . . . 0.0 112.434 -174.353 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 94' ' ' ASN . . . . . . . . . . . . . 31.9 t30 -89.53 -40.5 12.6 Favored 'General case' 0 C--N 1.325 -0.475 0 N-CA-C 112.121 0.415 . . . . 0.0 112.121 -172.04 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 95' ' ' HIS . . . . . . . . . . . . . 82.4 m-70 -85.46 -34.38 21.66 Favored 'General case' 0 C--N 1.322 -0.629 0 O-C-N 122.056 -0.402 . . . . 0.0 111.435 -176.755 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 96' ' ' LEU . . . . . 0.458 HD12 ' HA ' ' A' ' 92' ' ' CYS . 86.9 mt -106.46 27.07 9.13 Favored 'General case' 0 C--N 1.323 -0.574 0 CA-C-N 116.374 -0.376 . . . . 0.0 111.164 -176.647 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 97' ' ' SER . . . . . 0.43 ' N ' ' HD2' ' A' ' 98' ' ' PRO . 15.3 m -46.92 -53.05 29.04 Favored Pre-proline 0 CA--C 1.541 0.608 0 N-CA-C 112.715 0.635 . . . . 0.0 112.715 -178.985 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 98' ' ' PRO . . . . . 0.43 ' HD2' ' N ' ' A' ' 97' ' ' SER . 38.0 Cg_endo -66.44 -20.82 54.24 Favored 'Trans proline' 0 C--N 1.356 0.954 0 C-N-CA 121.936 1.757 . . . . 0.0 113.285 -178.185 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 99' ' ' LEU . . . . . 0.538 HD23 HG12 ' A' ' 112' ' ' ILE . 11.2 mp -88.89 -27.79 20.76 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-O 120.903 0.383 . . . . 0.0 110.476 -179.559 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 100' ' ' TYR . . . . . . . . . . . . . 5.9 t80 -57.76 -31.75 66.8 Favored 'General case' 0 C--N 1.325 -0.472 0 CA-C-N 115.541 -0.754 . . . . 0.0 111.394 -174.962 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 101' ' ' MET . . . . . . . . . . . . . 66.3 mtt -102.17 14.05 33.01 Favored 'General case' 0 C--N 1.327 -0.394 0 CA-C-N 116.217 -0.447 . . . . 0.0 111.334 -178.447 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 102' ' ' LYS . . . . . . . . . . . . . 96.5 mttt -103.26 151.11 23.05 Favored 'General case' 0 C--N 1.326 -0.422 0 N-CA-C 110.136 -0.32 . . . . 0.0 110.136 176.825 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 103' ' ' SER . . . . . 0.584 ' HA ' ' HA ' ' A' ' 63' ' ' SER . 46.6 t -75.85 161.41 29.02 Favored 'General case' 0 C--N 1.322 -0.588 0 N-CA-C 109.084 -0.71 . . . . 0.0 109.084 171.296 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 104' ' ' LEU . . . . . 0.406 ' HB3' HD12 ' A' ' 146' ' ' ILE . 90.3 mt -58.91 -28.93 66.66 Favored 'General case' 0 C--N 1.323 -0.56 0 CA-C-O 121.041 0.448 . . . . 0.0 110.613 179.208 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 105' ' ' SER . . . . . . . . . . . . . 26.4 t -87.97 -7.57 56.91 Favored 'General case' 0 CA--C 1.534 0.357 0 CA-C-N 115.98 -0.555 . . . . 0.0 111.472 -179.269 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 106' ' ' GLU . . . . . 0.521 ' HG3' ' HB3' ' A' ' 103' ' ' SER . 45.2 mt-10 -96.67 -6.38 36.68 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-O 120.792 0.33 . . . . 0.0 111.049 -177.553 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 107' ' ' ILE . . . . . 0.45 HD13 ' HB2' ' A' ' 64' ' ' PHE . 72.4 mt -93.89 122.23 45.2 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.594 0 CA-C-O 120.972 0.415 . . . . 0.0 110.778 -176.963 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 108' ' ' LEU . . . . . . . . . . . . . 86.4 mt -96.72 143.79 26.72 Favored Pre-proline 0 C--N 1.326 -0.445 0 CA-C-N 115.944 -0.571 . . . . 0.0 110.641 -178.88 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 109' ' ' PRO . . . . . 0.568 ' HB3' ' HB2' ' A' ' 153' ' ' TYR . 50.2 Cg_exo -55.31 -45.33 40.95 Favored 'Trans proline' 0 CA--C 1.531 0.374 0 C-N-CA 122.81 2.34 . . . . 0.0 112.378 176.823 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 110' ' ' ALA . . . . . . . . . . . . . . . -69.34 -25.11 64.04 Favored 'General case' 0 C--N 1.332 -0.186 0 CA-C-N 116.497 -0.32 . . . . 0.0 111.134 -179.46 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 111' ' ' ASP . . . . . . . . . . . . . 38.2 t70 -65.99 -45.14 82.7 Favored 'General case' 0 C--N 1.326 -0.437 0 CA-C-O 121.131 0.491 . . . . 0.0 109.785 179.309 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 112' ' ' ILE . . . . . 0.538 HG12 HD23 ' A' ' 99' ' ' LEU . 19.2 mt -69.14 -39.95 79.98 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.295 0 CA-C-N 115.752 -0.658 . . . . 0.0 110.071 176.557 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 113' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -58.18 -43.22 87.4 Favored 'General case' 0 C--N 1.331 -0.215 0 CA-C-N 115.892 -0.595 . . . . 0.0 109.89 178.877 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 114' ' ' SER . . . . . . . . . . . . . 40.8 t -56.12 -50.25 71.63 Favored 'General case' 0 C--N 1.331 -0.231 0 CA-C-N 116.039 -0.528 . . . . 0.0 110.226 177.052 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 115' ' ' ILE . . . . . . . . . . . . . 67.1 mt -58.15 -44.44 87.59 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.193 0 CA-C-N 116.372 -0.376 . . . . 0.0 111.002 179.309 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 116' ' ' ILE . . . . . . . . . . . . . 47.3 mm -62.81 -41.35 92.17 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.326 0 CA-C-O 120.821 0.343 . . . . 0.0 111.1 -179.93 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 117' ' ' ASN . . . . . . . . . . . . . 8.4 t30 -69.98 -33.67 72.37 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-N 116.391 -0.368 . . . . 0.0 111.165 -179.251 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 118' ' ' GLU . . . . . . . . . . . . . 28.3 mm-40 -80.1 -21.94 42.74 Favored 'General case' 0 C--N 1.327 -0.396 0 CA-C-N 116.251 -0.431 . . . . 0.0 110.846 179.48 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 119' ' ' THR . . . . . . . . . . . . . 61.7 m -78.38 111.04 13.98 Favored 'General case' 0 N--CA 1.448 -0.526 0 N-CA-C 108.937 -0.764 . . . . 0.0 108.937 173.897 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 120' ' ' LYS . . . . . 0.463 ' C ' HD13 ' A' ' 121' ' ' LEU . 96.2 mttt -111.61 78.22 1.1 Allowed 'General case' 0 C--N 1.32 -0.693 0 CA-C-O 121.992 0.901 . . . . 0.0 110.993 -173.001 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 121' ' ' LEU . . . . . 0.463 HD13 ' C ' ' A' ' 120' ' ' LYS . 8.0 mp -131.61 -174.44 3.41 Favored 'General case' 0 C--N 1.326 -0.426 0 CA-C-N 114.093 -1.412 . . . . 0.0 108.825 178.462 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 122' ' ' ALA . . . . . . . . . . . . . . . -59.88 148.54 34.49 Favored 'General case' 0 C--N 1.326 -0.431 0 CA-C-O 120.611 0.243 . . . . 0.0 110.568 177.296 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 123' ' ' LYS . . . . . . . . . . . . . 56.0 mtmt -60.79 -29.46 69.46 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-N 116.332 -0.395 . . . . 0.0 111.241 -176.719 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 124' ' ' ASN . . . . . . . . . . . . . 0.2 OUTLIER -59.93 -37.97 81.02 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.193 -0.458 . . . . 0.0 109.882 176.959 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 125' ' ' THR . . . . . 0.435 HG21 HD22 ' A' ' 121' ' ' LEU . 17.7 m -71.82 -39.63 69.67 Favored 'General case' 0 C--N 1.327 -0.394 0 CA-C-N 115.921 -0.582 . . . . 0.0 110.361 179.512 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 126' ' ' LEU . . . . . . . . . . . . . 93.3 mt -61.72 -40.91 96.73 Favored 'General case' 0 C--N 1.327 -0.383 0 CA-C-N 116.051 -0.522 . . . . 0.0 110.345 177.802 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 127' ' ' LYS . . . . . . . . . . . . . 90.6 mttt -66.18 -31.83 72.9 Favored 'General case' 0 C--N 1.327 -0.377 0 CA-C-N 116.025 -0.534 . . . . 0.0 111.399 177.961 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 128' ' ' ALA . . . . . . . . . . . . . . . -62.25 -43.96 97.64 Favored 'General case' 0 C--N 1.325 -0.457 0 CA-C-O 120.766 0.317 . . . . 0.0 110.602 178.923 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 129' ' ' ILE . . . . . . . . . . . . . 35.4 mt -67.16 -43.67 88.37 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.313 0 CA-C-N 116.145 -0.479 . . . . 0.0 109.736 177.264 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 130' ' ' ARG . . . . . 0.533 ' HB2' HD11 ' A' ' 156' ' ' ILE . 16.4 tpt85 -55.8 -51.74 66.39 Favored 'General case' 0 C--N 1.331 -0.219 0 CA-C-N 115.35 -0.841 . . . . 0.0 111.005 178.159 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 131' ' ' ASN . . . . . . . . . . . . . 14.4 m-80 -58.59 -54.41 47.42 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.202 -0.454 . . . . 0.0 111.109 179.986 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 132' ' ' THR . . . . . 0.421 ' O ' HG13 ' A' ' 136' ' ' ILE . 33.6 m -52.9 -50.7 63.38 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-N 116.136 -0.483 . . . . 0.0 111.255 -178.519 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 133' ' ' ALA . . . . . . . . . . . . . . . -61.45 -48.46 81.06 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.301 -0.409 . . . . 0.0 111.39 -178.266 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 134' ' ' SER . . . . . 0.504 ' O ' ' HG2' ' A' ' 138' ' ' ARG . 52.9 p -62.44 -36.35 82.15 Favored 'General case' 0 C--N 1.331 -0.214 0 CA-C-N 116.569 -0.287 . . . . 0.0 111.157 -177.918 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 135' ' ' GLN . . . . . 0.416 ' HA ' ' HG2' ' A' ' 138' ' ' ARG . 14.7 mm100 -66.37 -36.26 82.43 Favored 'General case' 0 C--N 1.333 -0.138 0 CA-C-N 116.576 -0.284 . . . . 0.0 111.266 -178.723 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 136' ' ' ILE . . . . . 0.421 HG13 ' O ' ' A' ' 132' ' ' THR . 79.5 mt -66.75 -45.68 87.42 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.505 0 CA-C-O 120.786 0.327 . . . . 0.0 110.73 179.624 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 137' ' ' PHE . . . . . 0.479 ' O ' HG13 ' A' ' 141' ' ' ILE . 58.5 m-85 -67.47 -45.21 76.6 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.373 -0.376 . . . . 0.0 111.566 -178.962 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 138' ' ' ARG . . . . . 0.504 ' HG2' ' O ' ' A' ' 134' ' ' SER . 13.3 ptm180 -65.17 -33.02 75.02 Favored 'General case' 0 N--CA 1.463 0.19 0 C-N-CA 120.796 -0.362 . . . . 0.0 110.77 -179.327 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 139' ' ' LEU . . . . . . . . . . . . . 54.6 tp -63.93 -41.19 97.71 Favored 'General case' 0 C--N 1.33 -0.239 0 CA-C-O 121.014 0.435 . . . . 0.0 109.901 176.608 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 140' ' ' ALA . . . . . . . . . . . . . . . -64.62 -37.67 88.37 Favored 'General case' 0 C--N 1.326 -0.42 0 CA-C-N 116.033 -0.531 . . . . 0.0 110.499 176.629 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 141' ' ' ILE . . . . . 0.479 HG13 ' O ' ' A' ' 137' ' ' PHE . 78.4 mt -63.7 -42.86 97.43 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.299 0 CA-C-N 116.22 -0.445 . . . . 0.0 110.469 177.138 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 142' ' ' GLU . . . . . 0.459 ' HG3' ' O ' ' A' ' 138' ' ' ARG . 43.5 mt-10 -69.07 -8.9 49.44 Favored 'General case' 0 N--CA 1.463 0.219 0 CA-C-N 116.248 -0.433 . . . . 0.0 111.558 179.758 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 143' ' ' ASN . . . . . . . . . . . . . 43.2 m-80 -114.38 14.52 17.95 Favored 'General case' 0 C--N 1.327 -0.378 0 CA-C-N 116.656 -0.247 . . . . 0.0 111.425 177.617 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 144' ' ' ARG . . . . . . . . . . . . . 99.4 mtt180 62.12 26.24 15.76 Favored 'General case' 0 N--CA 1.471 0.59 0 O-C-N 123.434 0.459 . . . . 0.0 112.063 176.738 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 145' ' ' ALA . . . . . . . . . . . . . . . -90.48 -23.52 20.94 Favored 'General case' 0 C--N 1.324 -0.537 0 CA-C-O 120.823 0.344 . . . . 0.0 110.924 -179.35 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 146' ' ' ILE . . . . . 0.457 ' O ' ' HA ' ' A' ' 141' ' ' ILE . 13.3 tt -159.95 157.62 2.83 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.596 0 N-CA-C 109.231 -0.655 . . . . 0.0 109.231 178.131 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 147' ' ' ASP . . . . . . . . . . . . . 31.2 t70 -126.62 27.54 6.08 Favored 'General case' 0 C--N 1.322 -0.598 0 CA-C-O 121.849 0.833 . . . . 0.0 110.188 -179.436 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 148' ' ' PHE . . . . . . . . . . . . . 78.2 t80 -141.26 132.73 26.85 Favored 'General case' 0 C--N 1.319 -0.732 0 CA-C-N 115.579 -0.737 . . . . 0.0 109.589 -179.906 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 149' ' ' ASN . . . . . . . . . . . . . 48.6 t-20 -114.93 92.6 31.14 Favored Pre-proline 0 C--N 1.322 -0.607 0 CA-C-N 116.488 -0.324 . . . . 0.0 110.322 -179.657 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 150' ' ' PRO . . . . . . . . . . . . . 23.7 Cg_exo -64.71 -27.9 60.21 Favored 'Trans proline' 0 C--N 1.344 0.297 0 C-N-CA 122.803 2.335 . . . . 0.0 112.243 -178.714 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 151' ' ' ALA . . . . . 0.409 ' HA ' HG22 ' A' ' 154' ' ' VAL . . . -73.5 -21.32 60.44 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.087 -0.506 . . . . 0.0 111.219 -177.063 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 152' ' ' ASP . . . . . . . . . . . . . 3.9 t70 -76.58 -17.08 59.4 Favored 'General case' 0 C--N 1.326 -0.455 0 CA-C-O 121.357 0.599 . . . . 0.0 109.865 -179.877 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 153' ' ' TYR . . . . . 0.568 ' HB2' ' HB3' ' A' ' 109' ' ' PRO . 47.3 m-85 -93.45 2.45 56.47 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-N 115.737 -0.665 . . . . 0.0 110.799 179.133 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 154' ' ' VAL . . . . . 0.409 HG22 ' HA ' ' A' ' 151' ' ' ALA . 98.6 t -83.31 115.92 26.53 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.485 0 CA-C-N 116.299 -0.41 . . . . 0.0 110.639 -178.92 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 155' ' ' ARG . . . . . . . . . . . . . 39.8 ttm-85 -77.88 132.94 38.18 Favored 'General case' 0 C--N 1.322 -0.626 0 CA-C-N 115.802 -0.635 . . . . 0.0 110.526 179.406 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 156' ' ' ILE . . . . . 0.533 HD11 ' HB2' ' A' ' 130' ' ' ARG . 45.1 mm -96.85 120.7 61.2 Favored Pre-proline 0 C--N 1.322 -0.59 0 N-CA-C 109.458 -0.571 . . . . 0.0 109.458 174.729 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 157' ' ' PRO . . . . . 0.429 ' HD3' ' HA ' ' A' ' 156' ' ' ILE . 35.7 Cg_exo . . . . . 0 N--CA 1.463 -0.313 0 C-N-CA 122.655 2.237 . . . . 0.0 112.588 -178.034 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 63' ' ' SER . . . . . 0.555 ' HA ' ' HA ' ' A' ' 103' ' ' SER . 87.5 p . . . . . 0 N--CA 1.448 -0.562 0 CA-C-O 120.813 0.339 . . . . 0.0 110.428 . . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 64' ' ' PHE . . . . . 0.548 ' HB2' HD12 ' A' ' 107' ' ' ILE . 64.9 t80 -60.84 -31.82 71.24 Favored 'General case' 0 C--N 1.323 -0.573 0 N-CA-C 109.229 -0.656 . . . . 0.0 109.229 175.647 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 65' ' ' GLY . . . . . . . . . . . . . . . -61.03 -32.67 81.13 Favored Glycine 0 N--CA 1.451 -0.363 0 CA-C-N 115.969 -0.56 . . . . 0.0 112.505 176.934 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 66' ' ' ASP . . . . . . . . . . . . . 24.9 m-20 -68.9 -55.3 11.48 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-O 121.208 0.527 . . . . 0.0 110.18 177.195 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 67' ' ' TRP . . . . . . . . . . . . . 99.4 m95 -68.18 -32.32 72.48 Favored 'General case' 0 C--N 1.326 -0.431 0 CA-C-N 115.705 -0.68 . . . . 0.0 111.869 -176.813 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 68' ' ' ALA . . . . . 0.601 ' O ' ' HG ' ' A' ' 72' ' ' LEU . . . -64.21 -47.43 79.77 Favored 'General case' 0 C--N 1.326 -0.432 0 N-CA-C 110.17 -0.308 . . . . 0.0 110.17 176.706 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 69' ' ' GLU . . . . . . . . . . . . . 7.5 tp10 -63.3 -40.08 96.35 Favored 'General case' 0 C--N 1.329 -0.297 0 N-CA-C 109.497 -0.557 . . . . 0.0 109.497 177.838 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 70' ' ' LYS . . . . . . . . . . . . . 10.7 tppt? -56.12 -49.6 73.43 Favored 'General case' 0 C--N 1.331 -0.223 0 CA-C-N 115.622 -0.717 . . . . 0.0 110.36 174.519 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 71' ' ' PHE . . . . . . . . . . . . . 80.3 t80 -64.71 -46.68 81.29 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 116.123 -0.49 . . . . 0.0 111.477 -179.08 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 72' ' ' LEU . . . . . 0.601 ' HG ' ' O ' ' A' ' 68' ' ' ALA . 85.7 mt -61.02 -43.63 98.61 Favored 'General case' 0 C--N 1.327 -0.396 0 CA-C-O 121.01 0.433 . . . . 0.0 110.422 179.776 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 73' ' ' LYS . . . . . . . . . . . . . 58.3 tttm -67.43 -26.53 66.46 Favored 'General case' 0 C--N 1.326 -0.42 0 CA-C-O 121.192 0.52 . . . . 0.0 110.155 179.015 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 74' ' ' SER . . . . . . . . . . . . . 60.7 m -68.39 -37.8 80.73 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 116.122 -0.49 . . . . 0.0 110.01 174.716 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 75' ' ' LYS . . . . . . . . . . . . . 71.4 mmtt -69.67 -34.03 73.4 Favored 'General case' 0 C--O 1.233 0.19 0 CA-C-N 116.346 -0.388 . . . . 0.0 110.892 177.575 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 76' ' ' GLU . . . . . . . . . . . . . 6.8 tp10 -54.27 -49.55 69.31 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-O 121.095 0.474 . . . . 0.0 109.847 173.591 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 77' ' ' ALA . . . . . . . . . . . . . . . -80.26 -16.66 54.21 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 115.961 -0.563 . . . . 0.0 111.325 179.781 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 78' ' ' ASP . . . . . . . . . . . . . 19.9 t70 -69.57 -34.38 74.08 Favored 'General case' 0 N--CA 1.464 0.24 0 CA-C-O 121.016 0.436 . . . . 0.0 110.196 -179.15 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 79' ' ' GLY . . . . . . . . . . . . . . . 108.09 37.16 2.2 Favored Glycine 0 N--CA 1.449 -0.5 0 C-N-CA 120.497 -0.859 . . . . 0.0 113.375 174.159 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 80' ' ' VAL . . . . . 0.488 ' HB ' ' HB2' ' A' ' 84' ' ' GLN . 17.7 m -88.51 155.73 3.15 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.503 0 CA-C-N 116.973 0.387 . . . . 0.0 110.431 175.511 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 81' ' ' SER . . . . . . . . . . . . . 19.5 m -66.44 159.12 27.76 Favored 'General case' 0 C--N 1.325 -0.49 0 N-CA-C 109.943 -0.391 . . . . 0.0 109.943 177.402 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 82' ' ' VAL . . . . . . . . . . . . . 61.2 t -56.75 -36.71 50.12 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.27 0 CA-C-O 120.905 0.383 . . . . 0.0 110.538 -178.966 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 83' ' ' SER . . . . . . . . . . . . . 14.4 m -57.27 -42.09 80.94 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 115.962 -0.563 . . . . 0.0 110.969 177.352 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 84' ' ' GLN . . . . . 0.488 ' HB2' ' HB ' ' A' ' 80' ' ' VAL . 75.9 mm-40 -64.88 -56.61 12.36 Favored 'General case' 0 CA--C 1.518 -0.269 0 CA-C-N 116.718 -0.219 . . . . 0.0 110.44 -179.951 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 85' ' ' LEU . . . . . . . . . . . . . 53.7 tp -57.82 -39.13 76.9 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.131 -0.486 . . . . 0.0 110.866 -177.657 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 86' ' ' ASN . . . . . . . . . . . . . 24.4 t-20 -61.14 -47.65 85.26 Favored 'General case' 0 C--N 1.327 -0.37 0 CA-C-N 115.864 -0.607 . . . . 0.0 110.074 177.215 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 87' ' ' SER . . . . . . . . . . . . . 49.7 m -64.78 -42.01 95.41 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-N 116.384 -0.371 . . . . 0.0 111.101 179.051 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 88' ' ' TYR . . . . . . . . . . . . . 29.4 m-85 -57.53 -48.68 78.62 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-O 120.976 0.417 . . . . 0.0 110.835 178.683 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 89' ' ' LYS . . . . . . . . . . . . . 22.0 ttmm -72.36 -32.35 66.39 Favored 'General case' 0 C--N 1.326 -0.415 0 CA-C-N 116.131 -0.486 . . . . 0.0 110.82 179.599 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 90' ' ' ASN . . . . . . . . . . . . . 62.0 t30 -66.46 -46.4 76.51 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-O 121.124 0.488 . . . . 0.0 110.447 178.739 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 91' ' ' TYR . . . . . . . . . . . . . 5.1 m-85 -62.42 -37.99 87.96 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.043 -0.526 . . . . 0.0 110.442 177.813 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 92' ' ' CYS . . . . . 0.539 ' HA ' ' HB2' ' A' ' 96' ' ' LEU . 53.2 t -67.59 -36.73 81.45 Favored 'General case' 0 C--N 1.327 -0.412 0 CA-C-N 115.929 -0.578 . . . . 0.0 110.723 177.966 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 93' ' ' ARG . . . . . 0.502 ' O ' ' HB3' ' A' ' 97' ' ' SER . 39.3 ttt180 -71.51 -44.97 63.69 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-O 121.029 0.442 . . . . 0.0 110.815 179.758 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 94' ' ' ASN . . . . . . . . . . . . . 95.1 m-20 -81.19 -61.2 2.02 Favored 'General case' 0 C--N 1.325 -0.499 0 N-CA-C 112.219 0.452 . . . . 0.0 112.219 -175.414 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 95' ' ' HIS . . . . . . . . . . . . . 95.0 m-70 -85.52 -40.34 16.44 Favored 'General case' 0 C--N 1.327 -0.385 0 CA-C-O 120.704 0.288 . . . . 0.0 111.697 -170.272 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 96' ' ' LEU . . . . . 0.539 ' HB2' ' HA ' ' A' ' 92' ' ' CYS . 74.9 mt -91.87 16.99 9.78 Favored 'General case' 0 C--N 1.325 -0.48 0 CA-C-N 116.622 -0.263 . . . . 0.0 111.279 -174.074 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 97' ' ' SER . . . . . 0.576 ' OG ' ' HD3' ' A' ' 98' ' ' PRO . 3.5 p -61.16 -45.7 95.79 Favored Pre-proline 0 CA--C 1.544 0.741 0 N-CA-C 113.123 0.786 . . . . 0.0 113.123 -177.661 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 98' ' ' PRO . . . . . 0.576 ' HD3' ' OG ' ' A' ' 97' ' ' SER . 21.9 Cg_exo -63.6 -33.66 66.56 Favored 'Trans proline' 0 C--N 1.361 1.211 0 C-N-CA 121.657 1.572 . . . . 0.0 111.622 179.133 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 99' ' ' LEU . . . . . 0.437 ' O ' ' HB3' ' A' ' 64' ' ' PHE . 40.4 mt -74.27 -40.22 62.47 Favored 'General case' 0 C--N 1.323 -0.572 0 CA-C-N 115.523 -0.762 . . . . 0.0 109.759 179.849 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 100' ' ' TYR . . . . . . . . . . . . . 36.0 t80 -51.71 -40.89 60.97 Favored 'General case' 0 C--N 1.33 -0.248 0 CA-C-N 115.235 -0.893 . . . . 0.0 111.394 -178.3 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 101' ' ' MET . . . . . . . . . . . . . 24.8 mmt -91.34 11.56 23.3 Favored 'General case' 0 C--N 1.326 -0.425 0 CA-C-N 116.325 -0.398 . . . . 0.0 112.047 -177.13 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 102' ' ' LYS . . . . . . . . . . . . . 66.0 mttt -105.8 150.33 25.65 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-O 120.862 0.363 . . . . 0.0 110.916 176.807 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 103' ' ' SER . . . . . 0.555 ' HA ' ' HA ' ' A' ' 63' ' ' SER . 24.1 t -72.93 150.33 42.64 Favored 'General case' 0 C--N 1.324 -0.526 0 N-CA-C 109.224 -0.658 . . . . 0.0 109.224 171.816 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 104' ' ' LEU . . . . . . . . . . . . . 26.2 tp -56.69 -29.48 62.42 Favored 'General case' 0 C--N 1.324 -0.543 0 CA-C-O 120.933 0.397 . . . . 0.0 112.045 -175.399 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 105' ' ' SER . . . . . . . . . . . . . 40.3 t -83.65 -22.34 32.18 Favored 'General case' 0 C--N 1.326 -0.415 0 N-CA-C 112.211 0.448 . . . . 0.0 112.211 -175.545 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 106' ' ' GLU . . . . . . . . . . . . . 12.1 pt-20 -97.94 6.08 48.13 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-O 120.817 0.341 . . . . 0.0 111.22 -174.298 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 107' ' ' ILE . . . . . 0.59 HG22 ' HZ ' ' A' ' 137' ' ' PHE . 63.4 mt -83.5 121.5 36.34 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.575 0 CA-C-N 116.296 -0.411 . . . . 0.0 110.1 178.93 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 108' ' ' LEU . . . . . . . . . . . . . 84.8 mt -103.44 151.16 38.6 Favored Pre-proline 0 C--N 1.32 -0.698 0 CA-C-N 116.062 -0.517 . . . . 0.0 110.073 179.991 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 109' ' ' PRO . . . . . . . . . . . . . 31.3 Cg_exo -59.88 -27.9 85.97 Favored 'Trans proline' 0 C--N 1.343 0.266 0 C-N-CA 122.27 1.98 . . . . 0.0 111.042 174.47 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 110' ' ' ALA . . . . . . . . . . . . . . . -61.66 -41.14 97.12 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 115.244 -0.889 . . . . 0.0 111.003 178.576 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 111' ' ' ASP . . . . . . . . . . . . . 33.3 m-20 -52.9 -58.41 7.03 Favored 'General case' 0 C--O 1.236 0.351 0 CA-C-O 121.423 0.63 . . . . 0.0 110.547 178.842 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 112' ' ' ILE . . . . . 0.413 HG12 HD13 ' A' ' 99' ' ' LEU . 21.4 mt -66.23 -40.59 87.32 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.557 0 CA-C-N 114.871 -1.059 . . . . 0.0 111.141 -174.651 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 113' ' ' GLN . . . . . . . . . . . . . 17.3 tm0? -65.01 -39.43 93.43 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.404 -0.362 . . . . 0.0 110.401 -178.29 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 114' ' ' SER . . . . . . . . . . . . . 50.0 m -60.57 -38.29 84.08 Favored 'General case' 0 C--O 1.233 0.226 0 CA-C-O 121.041 0.448 . . . . 0.0 110.485 178.039 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 115' ' ' ILE . . . . . . . . . . . . . 78.3 mt -60.12 -46.14 94.84 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.239 0 CA-C-N 115.938 -0.573 . . . . 0.0 110.432 176.592 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 116' ' ' ILE . . . . . . . . . . . . . 51.2 mm -60.33 -37.06 72.72 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.277 0 CA-C-N 115.992 -0.549 . . . . 0.0 111.043 -179.984 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 117' ' ' ASN . . . . . . . . . . . . . 93.6 m-20 -60.79 -44.49 96.75 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.492 -0.322 . . . . 0.0 111.169 179.124 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 118' ' ' GLU . . . . . . . . . . . . . 48.9 mt-10 -80.95 -18.25 47.68 Favored 'General case' 0 C--N 1.327 -0.377 0 CA-C-N 116.292 -0.413 . . . . 0.0 111.506 -176.982 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 119' ' ' THR . . . . . . . . . . . . . 29.2 m -90.86 111.8 23.37 Favored 'General case' 0 C--N 1.324 -0.539 0 CA-C-O 121.054 0.454 . . . . 0.0 110.48 -178.807 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 120' ' ' LYS . . . . . 0.451 ' C ' HD12 ' A' ' 121' ' ' LEU . 48.7 mtpt -106.82 86.9 2.4 Favored 'General case' 0 C--N 1.327 -0.4 0 CA-C-O 120.991 0.424 . . . . 0.0 110.828 -178.491 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 121' ' ' LEU . . . . . 0.451 HD12 ' C ' ' A' ' 120' ' ' LYS . 7.8 mp -132.75 -174.87 3.59 Favored 'General case' 0 C--N 1.323 -0.554 0 CA-C-N 115.547 -0.751 . . . . 0.0 109.622 177.62 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 122' ' ' ALA . . . . . . . . . . . . . . . -65.37 152.69 43.25 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-O 120.629 0.252 . . . . 0.0 111.247 178.927 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 123' ' ' LYS . . . . . 0.827 ' HB2' ' HZ2' ' A' ' 123' ' ' LYS . 9.5 mtmp? -55.85 -43.17 76.79 Favored 'General case' 0 C--N 1.331 -0.235 0 CA-C-N 115.998 -0.546 . . . . 0.0 110.735 -178.428 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 124' ' ' ASN . . . . . . . . . . . . . 3.2 m-20 -61.19 -37.81 84.28 Favored 'General case' 0 C--N 1.327 -0.408 0 CA-C-N 115.362 -0.836 . . . . 0.0 110.774 -178.124 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 125' ' ' THR . . . . . 0.436 ' O ' HG13 ' A' ' 129' ' ' ILE . 10.8 m -69.96 -41.58 74.32 Favored 'General case' 0 C--N 1.325 -0.457 0 CA-C-N 116.201 -0.454 . . . . 0.0 110.532 178.64 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 126' ' ' LEU . . . . . . . . . . . . . 92.5 mt -61.96 -43.68 98.34 Favored 'General case' 0 C--O 1.235 0.292 0 CA-C-N 116.08 -0.509 . . . . 0.0 110.741 179.184 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 127' ' ' LYS . . . . . . . . . . . . . 52.3 mtpt -68.93 -30.99 69.56 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.27 -0.423 . . . . 0.0 110.756 179.133 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 128' ' ' ALA . . . . . . . . . . . . . . . -64.11 -45.74 87.29 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.321 -0.4 . . . . 0.0 110.57 176.94 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 129' ' ' ILE . . . . . 0.436 HG13 ' O ' ' A' ' 125' ' ' THR . 70.1 mt -59.25 -50.25 80.48 Favored 'Isoleucine or valine' 0 C--O 1.235 0.319 0 CA-C-N 116.103 -0.499 . . . . 0.0 110.414 177.865 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 130' ' ' ARG . . . . . . . . . . . . . 45.7 ttt-85 -61.88 -40.97 97.23 Favored 'General case' 0 C--N 1.327 -0.384 0 CA-C-N 115.758 -0.656 . . . . 0.0 111.039 179.427 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 131' ' ' ASN . . . . . . . . . . . . . 63.8 t30 -62.8 -44.81 95.18 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-O 120.648 0.261 . . . . 0.0 110.45 -179.314 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 132' ' ' THR . . . . . 0.483 ' O ' HG13 ' A' ' 136' ' ' ILE . 39.2 m -55.1 -52.7 62.43 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 115.774 -0.648 . . . . 0.0 110.482 178.695 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 133' ' ' ALA . . . . . . . . . . . . . . . -65.45 -38.98 91.47 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.219 -0.446 . . . . 0.0 110.803 179.098 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 134' ' ' SER . . . . . . . . . . . . . 26.9 t -60.28 -43.23 96.4 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 115.964 -0.562 . . . . 0.0 110.84 -179.45 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 135' ' ' GLN . . . . . 0.416 HE21 ' HB3' ' A' ' 135' ' ' GLN . 9.1 mt-30 -67.55 -30.66 70.35 Favored 'General case' 0 C--N 1.33 -0.28 0 C-N-CA 121.133 -0.227 . . . . 0.0 110.791 179.178 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 136' ' ' ILE . . . . . 0.483 HG13 ' O ' ' A' ' 132' ' ' THR . 86.8 mt -65.13 -45.21 94.8 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.333 0 CA-C-N 116.346 -0.388 . . . . 0.0 110.203 175.959 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 137' ' ' PHE . . . . . 0.59 ' HZ ' HG22 ' A' ' 107' ' ' ILE . 60.0 m-85 -65.35 -44.98 85.98 Favored 'General case' 0 C--N 1.331 -0.208 0 CA-C-N 116.292 -0.413 . . . . 0.0 110.353 175.603 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 138' ' ' ARG . . . . . 0.457 ' O ' ' HG3' ' A' ' 142' ' ' GLU . 29.0 mtp180 -55.39 -41.19 72.31 Favored 'General case' 0 C--O 1.223 -0.31 0 CA-C-N 116.029 -0.532 . . . . 0.0 111.092 177.053 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 139' ' ' LEU . . . . . . . . . . . . . 29.4 tp -59.36 -43.09 92.87 Favored 'General case' 0 C--N 1.321 -0.645 0 CA-C-N 115.999 -0.546 . . . . 0.0 110.525 179.829 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 140' ' ' ALA . . . . . . . . . . . . . . . -68.0 -31.47 71.19 Favored 'General case' 0 C--N 1.331 -0.217 0 CA-C-N 116.348 -0.387 . . . . 0.0 110.255 176.443 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 141' ' ' ILE . . . . . 0.646 ' HA ' ' O ' ' A' ' 146' ' ' ILE . 79.7 mt -66.54 -45.93 87.59 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.236 0 CA-C-N 116.275 -0.42 . . . . 0.0 110.465 175.585 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 142' ' ' GLU . . . . . 0.457 ' HG3' ' O ' ' A' ' 138' ' ' ARG . 43.3 mt-10 -67.73 -21.65 65.28 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-O 121.021 0.439 . . . . 0.0 110.774 -179.843 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 143' ' ' ASN . . . . . 0.428 ' N ' HD21 ' A' ' 143' ' ' ASN . 0.9 OUTLIER -94.83 1.42 55.37 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.138 -0.483 . . . . 0.0 110.643 175.991 . . . . . . . . 3 3 . 1 . 014 nuclear orig core ' A' A ' 144' ' ' ARG . . . . . 0.411 HH11 ' HD2' ' A' ' 144' ' ' ARG . 29.3 mtp85 59.58 36.91 22.82 Favored 'General case' 0 N--CA 1.465 0.304 0 CA-C-N 115.721 -0.672 . . . . 0.0 112.444 178.37 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 145' ' ' ALA . . . . . . . . . . . . . . . -90.4 -24.68 20.71 Favored 'General case' 0 C--N 1.323 -0.556 0 CA-C-O 121.547 0.689 . . . . 0.0 109.455 173.413 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 146' ' ' ILE . . . . . 0.646 ' O ' ' HA ' ' A' ' 141' ' ' ILE . 11.4 tt -156.84 157.96 3.48 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.569 0 N-CA-C 108.007 -1.108 . . . . 0.0 108.007 177.567 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 147' ' ' ASP . . . . . . . . . . . . . 7.3 p-10 -123.83 21.81 9.04 Favored 'General case' 0 C--N 1.322 -0.604 0 CA-C-O 121.1 0.476 . . . . 0.0 110.862 179.628 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 148' ' ' PHE . . . . . 0.425 ' H ' HG12 ' A' ' 146' ' ' ILE . 73.7 m-85 -121.6 151.06 40.81 Favored 'General case' 0 C--N 1.326 -0.433 0 CA-C-N 115.877 -0.601 . . . . 0.0 109.986 178.537 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 149' ' ' ASN . . . . . . . . . . . . . 53.7 t-20 -124.6 87.77 54.17 Favored Pre-proline 0 C--N 1.321 -0.658 0 N-CA-C 109.682 -0.488 . . . . 0.0 109.682 173.552 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 150' ' ' PRO . . . . . . . . . . . . . 77.6 Cg_exo -52.18 -34.64 59.72 Favored 'Trans proline' 0 C--N 1.344 0.329 0 C-N-CA 122.958 2.439 . . . . 0.0 112.925 177.408 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 151' ' ' ALA . . . . . . . . . . . . . . . -71.39 -26.06 62.62 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.321 -0.399 . . . . 0.0 110.982 -177.31 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 152' ' ' ASP . . . . . . . . . . . . . 39.0 t70 -74.98 -18.25 60.4 Favored 'General case' 0 C--N 1.325 -0.476 0 CA-C-O 120.815 0.341 . . . . 0.0 110.601 -179.59 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 153' ' ' TYR . . . . . . . . . . . . . 96.3 m-85 -83.81 -11.48 56.99 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.284 -0.416 . . . . 0.0 110.863 179.057 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 154' ' ' VAL . . . . . . . . . . . . . 57.4 t -64.63 123.83 18.25 Favored 'Isoleucine or valine' 0 C--O 1.235 0.336 0 CA-C-O 120.876 0.37 . . . . 0.0 111.364 -177.507 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 155' ' ' ARG . . . . . . . . . . . . . 88.7 mtt180 -73.04 117.72 15.11 Favored 'General case' 0 C--N 1.325 -0.488 0 CA-C-N 115.828 -0.624 . . . . 0.0 110.404 174.603 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 156' ' ' ILE . . . . . . . . . . . . . 37.2 mm -92.47 119.6 67.95 Favored Pre-proline 0 C--N 1.318 -0.778 0 N-CA-C 109.317 -0.623 . . . . 0.0 109.317 173.453 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 157' ' ' PRO . . . . . . . . . . . . . 42.1 Cg_endo . . . . . 0 N--CA 1.457 -0.637 0 C-N-CA 122.107 1.871 . . . . 0.0 112.237 -178.851 . . . . . . . . 0 0 . 1 . 015 nuclear orig core ' A' A ' 63' ' ' SER . . . . . . . . . . . . . 36.1 t . . . . . 0 C--O 1.237 0.435 0 CA-C-O 120.971 0.415 . . . . 0.0 110.522 . . . . . . . . . 0 0 . 1 . 015 nuclear orig core ' A' A ' 64' ' ' PHE . . . . . . . . . . . . . 81.2 t80 -63.74 -30.12 71.26 Favored 'General case' 0 C--N 1.327 -0.411 0 CA-C-N 115.857 -0.61 . . . . 0.0 109.723 177.254 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 65' ' ' GLY . . . . . . . . . . . . . . . -62.93 -36.15 93.03 Favored Glycine 0 N--CA 1.448 -0.559 0 C-N-CA 120.862 -0.685 . . . . 0.0 112.157 178.205 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 66' ' ' ASP . . . . . . . . . . . . . 22.7 t70 -69.6 -43.19 73.27 Favored 'General case' 0 C--N 1.327 -0.398 0 CA-C-O 120.931 0.396 . . . . 0.0 110.371 179.515 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 67' ' ' TRP . . . . . . . . . . . . . 83.8 m95 -72.33 -28.02 62.8 Favored 'General case' 0 C--N 1.325 -0.488 0 CA-C-N 116.153 -0.476 . . . . 0.0 111.392 179.477 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 68' ' ' ALA . . . . . 0.476 ' O ' ' HG ' ' A' ' 72' ' ' LEU . . . -65.82 -44.87 84.28 Favored 'General case' 0 C--N 1.329 -0.302 0 N-CA-C 109.57 -0.53 . . . . 0.0 109.57 173.312 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 69' ' ' GLU . . . . . . . . . . . . . 10.3 tp10 -59.46 -46.39 88.92 Favored 'General case' 0 C--O 1.234 0.244 0 CA-C-N 115.605 -0.725 . . . . 0.0 109.998 175.17 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 70' ' ' LYS . . . . . . . . . . . . . 54.7 mttp -63.35 -34.54 77.94 Favored 'General case' 0 C--N 1.331 -0.228 0 CA-C-N 115.793 -0.639 . . . . 0.0 111.645 178.663 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 71' ' ' PHE . . . . . . . . . . . . . 62.7 t80 -67.17 -43.72 81.53 Favored 'General case' 0 C--N 1.326 -0.421 0 CA-C-O 120.887 0.375 . . . . 0.0 110.578 178.809 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 72' ' ' LEU . . . . . 0.476 ' HG ' ' O ' ' A' ' 68' ' ' ALA . 85.7 mt -62.21 -44.21 97.1 Favored 'General case' 0 C--N 1.324 -0.543 0 CA-C-N 116.111 -0.495 . . . . 0.0 110.397 178.355 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 73' ' ' LYS . . . . . . . . . . . . . 35.6 mttp -72.55 -36.37 68.24 Favored 'General case' 0 C--N 1.327 -0.377 0 CA-C-N 116.001 -0.545 . . . . 0.0 112.233 -178.695 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 74' ' ' SER . . . . . . . . . . . . . 35.1 p -66.27 -34.37 77.84 Favored 'General case' 0 C--N 1.328 -0.336 0 C-N-CA 120.725 -0.39 . . . . 0.0 110.31 178.022 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 75' ' ' LYS . . . . . . . . . . . . . 25.8 mmtp -75.07 -32.88 61.6 Favored 'General case' 0 C--N 1.332 -0.187 0 CA-C-O 120.894 0.378 . . . . 0.0 110.903 174.958 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 76' ' ' GLU . . . . . . . . . . . . . 43.1 tt0 -63.46 -38.94 93.06 Favored 'General case' 0 C--N 1.323 -0.56 0 CA-C-O 121.219 0.533 . . . . 0.0 110.098 175.198 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 77' ' ' ALA . . . . . . . . . . . . . . . -76.4 -28.99 56.92 Favored 'General case' 0 C--N 1.325 -0.487 0 CA-C-N 115.841 -0.618 . . . . 0.0 110.741 174.578 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 78' ' ' ASP . . . . . . . . . . . . . 16.4 t70 -65.37 -46.3 80.7 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 115.898 -0.592 . . . . 0.0 110.357 178.056 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 79' ' ' GLY . . . . . . . . . . . . . . . 121.77 58.28 0.22 Allowed Glycine 0 N--CA 1.445 -0.714 0 C-N-CA 120.858 -0.687 . . . . 0.0 112.378 177.827 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 80' ' ' VAL . . . . . . . . . . . . . 29.8 m -100.65 141.36 17.59 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.5 0 CA-C-O 120.714 0.292 . . . . 0.0 110.533 177.492 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 81' ' ' SER . . . . . . . . . . . . . 32.0 m -57.56 156.17 8.6 Favored 'General case' 0 C--N 1.326 -0.438 0 CA-C-N 115.815 -0.629 . . . . 0.0 110.932 178.645 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 82' ' ' VAL . . . . . . . . . . . . . 7.1 p -58.2 -44.59 88.13 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.281 0 CA-C-N 116.651 -0.249 . . . . 0.0 111.504 -175.506 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 83' ' ' SER . . . . . . . . . . . . . 22.3 m -66.01 -33.13 75.11 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-O 120.771 0.32 . . . . 0.0 110.258 179.041 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 84' ' ' GLN . . . . . . . . . . . . . 52.6 tp60 -68.47 -39.17 81.5 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 115.798 -0.637 . . . . 0.0 110.26 -179.177 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 85' ' ' LEU . . . . . . . . . . . . . 49.1 tp -68.24 -33.49 74.48 Favored 'General case' 0 C--N 1.325 -0.483 0 CA-C-N 116.12 -0.491 . . . . 0.0 110.2 177.166 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 86' ' ' ASN . . . . . . . . . . . . . 90.5 m-20 -76.76 -30.64 56.61 Favored 'General case' 0 C--N 1.327 -0.4 0 CA-C-N 116.111 -0.495 . . . . 0.0 111.144 -179.791 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 87' ' ' SER . . . . . . . . . . . . . 2.9 p -69.75 -38.89 76.96 Favored 'General case' 0 N--CA 1.453 -0.28 0 C-N-CA 120.535 -0.466 . . . . 0.0 109.959 175.25 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 88' ' ' TYR . . . . . . . . . . . . . 16.3 m-85 -60.5 -43.06 97.43 Favored 'General case' 0 C--O 1.232 0.183 0 N-CA-C 109.491 -0.559 . . . . 0.0 109.491 171.32 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 89' ' ' LYS . . . . . 0.412 ' HD3' HD13 ' A' ' 72' ' ' LEU . 1.5 tppp? -54.81 -43.87 73.3 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 115.01 -0.996 . . . . 0.0 110.004 177.392 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 90' ' ' ASN . . . . . . . . . . . . . 48.1 t30 -63.94 -57.18 10.53 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 115.07 -0.968 . . . . 0.0 111.307 -178.571 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 91' ' ' TYR . . . . . . . . . . . . . 31.3 m-85 -54.48 -45.42 73.19 Favored 'General case' 0 C--O 1.235 0.33 0 CA-C-O 120.614 0.245 . . . . 0.0 111.551 -176.411 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 92' ' ' CYS . . . . . 0.402 ' HA ' HD11 ' A' ' 96' ' ' LEU . 62.1 m -68.13 -42.35 80.32 Favored 'General case' 0 C--N 1.326 -0.416 0 N-CA-C 112.518 0.562 . . . . 0.0 112.518 -175.235 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 93' ' ' ARG . . . . . 0.436 ' O ' ' HB3' ' A' ' 97' ' ' SER . 52.0 ttt180 -94.89 -24.85 16.83 Favored 'General case' 0 C--N 1.326 -0.419 0 C-N-CA 120.158 -0.617 . . . . 0.0 112.133 -172.698 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 94' ' ' ASN . . . . . . . . . . . . . 49.8 t-20 -85.79 -61.64 1.71 Allowed 'General case' 0 C--N 1.324 -0.521 0 C-N-CA 120.816 -0.354 . . . . 0.0 110.709 -178.159 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 95' ' ' HIS . . . . . . . . . . . . . 14.3 m80 -86.94 -40.73 14.54 Favored 'General case' 0 C--N 1.326 -0.415 0 N-CA-C 112.387 0.514 . . . . 0.0 112.387 -176.558 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 96' ' ' LEU . . . . . 0.516 HD21 HD12 ' A' ' 99' ' ' LEU . 89.7 mt -88.31 20.91 3.05 Favored 'General case' 0 C--N 1.327 -0.393 0 CA-C-O 120.828 0.346 . . . . 0.0 111.141 -177.037 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 97' ' ' SER . . . . . 0.518 ' N ' ' HD2' ' A' ' 98' ' ' PRO . 1.6 p -58.51 -45.55 99.66 Favored Pre-proline 0 CA--C 1.543 0.681 0 N-CA-C 112.925 0.713 . . . . 0.0 112.925 -177.901 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 98' ' ' PRO . . . . . 0.518 ' HD2' ' N ' ' A' ' 97' ' ' SER . 18.1 Cg_endo -61.28 -34.44 87.9 Favored 'Trans proline' 0 C--N 1.361 1.186 0 C-N-CA 121.623 1.549 . . . . 0.0 112.215 178.091 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 99' ' ' LEU . . . . . 0.516 HD12 HD21 ' A' ' 96' ' ' LEU . 80.6 mt -74.1 -33.37 63.6 Favored 'General case' 0 C--N 1.326 -0.42 0 CA-C-O 120.968 0.413 . . . . 0.0 110.451 -179.288 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 100' ' ' TYR . . . . . . . . . . . . . 38.2 t80 -60.14 -26.29 66.16 Favored 'General case' 0 CA--C 1.532 0.272 0 CA-C-N 115.688 -0.687 . . . . 0.0 110.301 178.551 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 101' ' ' MET . . . . . . . . . . . . . 55.0 mtt -96.54 6.92 47.74 Favored 'General case' 0 C--O 1.236 0.361 0 CA-C-N 115.666 -0.697 . . . . 0.0 111.005 -178.439 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 102' ' ' LYS . . . . . 0.498 ' HE3' HG12 ' A' ' 107' ' ' ILE . 27.3 mtpp -109.15 166.7 10.65 Favored 'General case' 0 C--N 1.324 -0.518 0 CA-C-N 116.172 -0.467 . . . . 0.0 110.984 -179.068 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 103' ' ' SER . . . . . 0.53 ' HB3' ' HG2' ' A' ' 106' ' ' GLU . 20.0 t -94.13 149.12 21.53 Favored 'General case' 0 N--CA 1.449 -0.495 0 N-CA-C 108.743 -0.836 . . . . 0.0 108.743 176.796 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 104' ' ' LEU . . . . . 0.519 HD23 ' HB3' ' A' ' 140' ' ' ALA . 35.9 tp -52.54 -52.3 55.44 Favored 'General case' 0 C--N 1.322 -0.615 0 N-CA-C 112.78 0.659 . . . . 0.0 112.78 -170.147 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 105' ' ' SER . . . . . . . . . . . . . 38.4 m -82.91 -7.36 59.67 Favored 'General case' 0 C--N 1.322 -0.61 0 N-CA-C 112.905 0.706 . . . . 0.0 112.905 -172.828 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 106' ' ' GLU . . . . . 0.53 ' HG2' ' HB3' ' A' ' 103' ' ' SER . 1.1 pp20? -106.48 15.42 25.95 Favored 'General case' 0 C--O 1.233 0.196 0 CA-C-O 121.233 0.54 . . . . 0.0 111.19 -178.899 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 107' ' ' ILE . . . . . 0.498 HG12 ' HE3' ' A' ' 102' ' ' LYS . 80.0 mt -88.14 134.57 27.69 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.56 0 CA-C-N 115.866 -0.606 . . . . 0.0 109.664 173.061 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 108' ' ' LEU . . . . . . . . . . . . . 97.9 mt -105.21 150.21 38.58 Favored Pre-proline 0 C--N 1.327 -0.413 0 CA-C-N 116.465 -0.334 . . . . 0.0 110.479 178.505 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 109' ' ' PRO . . . . . . . . . . . . . 36.5 Cg_exo -60.88 -26.27 82.8 Favored 'Trans proline' 0 C--N 1.343 0.275 0 C-N-CA 122.491 2.127 . . . . 0.0 111.257 175.136 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 110' ' ' ALA . . . . . . . . . . . . . . . -64.77 -38.94 92.69 Favored 'General case' 0 C--N 1.331 -0.227 0 CA-C-N 115.495 -0.775 . . . . 0.0 110.958 178.786 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 111' ' ' ASP . . . . . . . . . . . . . 41.5 m-20 -61.88 -49.66 75.35 Favored 'General case' 0 CA--C 1.52 -0.209 0 CA-C-O 121.074 0.464 . . . . 0.0 109.935 177.759 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 112' ' ' ILE . . . . . 0.427 ' O ' HG12 ' A' ' 116' ' ' ILE . 39.2 mt -62.31 -43.46 98.08 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.249 0 CA-C-N 115.556 -0.747 . . . . 0.0 110.871 -179.193 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 113' ' ' GLN . . . . . . . . . . . . . 7.8 tp-100 -61.34 -38.61 87.56 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.364 -0.38 . . . . 0.0 110.642 178.908 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 114' ' ' SER . . . . . . . . . . . . . 48.2 m -62.72 -41.32 99.1 Favored 'General case' 0 C--N 1.326 -0.42 0 CA-C-N 116.137 -0.483 . . . . 0.0 110.253 177.14 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 115' ' ' ILE . . . . . . . . . . . . . 74.4 mt -62.53 -44.2 99.1 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.214 0 CA-C-N 116.338 -0.392 . . . . 0.0 110.454 176.982 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 116' ' ' ILE . . . . . 0.427 HG12 ' O ' ' A' ' 112' ' ' ILE . 45.4 mm -58.96 -46.88 91.24 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.337 0 CA-C-N 116.034 -0.53 . . . . 0.0 110.915 178.717 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 117' ' ' ASN . . . . . . . . . . . . . 28.7 t-20 -75.07 -23.16 58.0 Favored 'General case' 0 C--N 1.326 -0.442 0 CA-C-N 116.388 -0.369 . . . . 0.0 111.227 -178.189 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 118' ' ' GLU . . . . . . . . . . . . . 7.6 mm-40 -79.7 -20.71 45.9 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-O 120.755 0.312 . . . . 0.0 110.42 175.075 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 119' ' ' THR . . . . . . . . . . . . . 80.9 m -73.48 112.9 10.0 Favored 'General case' 0 N--CA 1.449 -0.488 0 N-CA-C 109.661 -0.496 . . . . 0.0 109.661 175.456 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 120' ' ' LYS . . . . . . . . . . . . . 6.5 ptmt -93.55 26.55 2.98 Favored 'General case' 0 C--N 1.321 -0.639 0 CA-C-N 115.863 -0.608 . . . . 0.0 111.364 -174.846 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 121' ' ' LEU . . . . . . . . . . . . . 3.8 mm? -95.95 -175.82 3.52 Favored 'General case' 0 C--N 1.327 -0.398 0 CA-C-N 115.763 -0.653 . . . . 0.0 110.374 178.879 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 122' ' ' ALA . . . . . . . . . . . . . . . -87.58 174.03 8.71 Favored 'General case' 0 C--N 1.327 -0.391 0 N-CA-C 112.38 0.511 . . . . 0.0 112.38 -173.521 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 123' ' ' LYS . . . . . . . . . . . . . 14.4 tttm -48.24 -48.22 35.38 Favored 'General case' 0 N--CA 1.467 0.382 0 CA-C-N 115.198 -0.91 . . . . 0.0 113.037 -178.122 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 124' ' ' ASN . . . . . . . . . . . . . 7.1 m-20 -63.52 -40.78 97.94 Favored 'General case' 0 C--N 1.326 -0.418 0 CA-C-O 120.533 0.206 . . . . 0.0 111.354 -176.204 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 125' ' ' THR . . . . . . . . . . . . . 13.3 m -66.77 -39.59 87.92 Favored 'General case' 0 C--N 1.325 -0.46 0 CA-C-O 120.739 0.304 . . . . 0.0 110.739 179.071 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 126' ' ' LEU . . . . . . . . . . . . . 94.1 mt -59.93 -45.81 91.39 Favored 'General case' 0 N--CA 1.462 0.165 0 CA-C-O 121.197 0.522 . . . . 0.0 110.644 179.239 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 127' ' ' LYS . . . . . . . . . . . . . 58.0 mttm -71.08 -29.68 65.61 Favored 'General case' 0 C--N 1.326 -0.453 0 CA-C-N 115.712 -0.677 . . . . 0.0 111.274 -178.926 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 128' ' ' ALA . . . . . . . . . . . . . . . -62.48 -47.06 85.64 Favored 'General case' 0 C--N 1.326 -0.444 0 CA-C-N 116.223 -0.444 . . . . 0.0 110.322 175.753 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 129' ' ' ILE . . . . . . . . . . . . . 57.9 mt -65.15 -41.07 90.82 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.332 0 CA-C-N 116.112 -0.494 . . . . 0.0 110.021 176.734 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 130' ' ' ARG . . . . . 0.713 HH12 ' HB2' ' A' ' 151' ' ' ALA . 3.8 tpm_? -57.08 -56.21 24.75 Favored 'General case' 0 C--N 1.33 -0.24 0 CA-C-N 115.57 -0.741 . . . . 0.0 111.102 178.796 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 131' ' ' ASN . . . . . 0.488 ' O ' ' HG2' ' A' ' 135' ' ' GLN . 58.1 t30 -59.22 -46.5 88.3 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.359 -0.382 . . . . 0.0 110.822 -178.174 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 132' ' ' THR . . . . . 0.419 ' O ' HG13 ' A' ' 136' ' ' ILE . 61.0 m -56.67 -53.58 56.0 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.314 -0.403 . . . . 0.0 111.224 -179.312 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 133' ' ' ALA . . . . . . . . . . . . . . . -62.48 -34.7 77.35 Favored 'General case' 0 C--N 1.331 -0.217 0 CA-C-O 121.093 0.473 . . . . 0.0 110.965 -179.808 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 134' ' ' SER . . . . . . . . . . . . . 14.0 t -63.27 -46.58 86.16 Favored 'General case' 0 C--N 1.327 -0.374 0 CA-C-N 115.891 -0.595 . . . . 0.0 110.198 179.534 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 135' ' ' GLN . . . . . 0.488 ' HG2' ' O ' ' A' ' 131' ' ' ASN . 82.6 mm-40 -60.2 -39.73 87.59 Favored 'General case' 0 C--N 1.332 -0.175 0 CA-C-N 116.19 -0.459 . . . . 0.0 111.246 -178.952 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 136' ' ' ILE . . . . . 0.419 HG13 ' O ' ' A' ' 132' ' ' THR . 62.8 mt -59.16 -49.73 82.32 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.253 0 CA-C-N 116.343 -0.39 . . . . 0.0 110.733 -179.881 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 137' ' ' PHE . . . . . 0.559 ' O ' HG13 ' A' ' 141' ' ' ILE . 52.8 m-85 -63.29 -41.69 98.99 Favored 'General case' 0 C--N 1.331 -0.217 0 CA-C-N 116.344 -0.389 . . . . 0.0 110.764 177.625 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 138' ' ' ARG . . . . . 0.442 ' O ' ' HG2' ' A' ' 142' ' ' GLU . 72.9 mtp180 -59.79 -42.98 94.58 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.067 -0.515 . . . . 0.0 111.137 179.571 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 139' ' ' LEU . . . . . . . . . . . . . 50.3 tp -60.21 -39.0 85.06 Favored 'General case' 0 C--N 1.325 -0.481 0 CA-C-N 116.091 -0.504 . . . . 0.0 110.685 178.069 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 140' ' ' ALA . . . . . 0.519 ' HB3' HD23 ' A' ' 104' ' ' LEU . . . -67.57 -39.73 84.88 Favored 'General case' 0 C--N 1.326 -0.434 0 CA-C-N 116.193 -0.458 . . . . 0.0 110.668 178.014 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 141' ' ' ILE . . . . . 0.559 HG13 ' O ' ' A' ' 137' ' ' PHE . 66.5 mt -62.96 -39.42 85.06 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.27 0 CA-C-N 116.064 -0.517 . . . . 0.0 110.662 177.007 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 142' ' ' GLU . . . . . 0.442 ' HG2' ' O ' ' A' ' 138' ' ' ARG . 35.8 mm-40 -54.5 -45.07 73.19 Favored 'General case' 0 N--CA 1.463 0.196 0 CA-C-O 121.161 0.505 . . . . 0.0 111.053 177.521 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 143' ' ' ASN . . . . . . . . . . . . . 41.0 m-80 -85.78 6.55 27.5 Favored 'General case' 0 C--N 1.327 -0.409 0 CA-C-N 115.683 -0.69 . . . . 0.0 110.676 -178.34 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 144' ' ' ARG . . . . . . . . . . . . . 41.1 mtp85 58.02 28.09 15.77 Favored 'General case' 0 N--CA 1.465 0.315 0 CA-C-N 115.706 -0.679 . . . . 0.0 112.106 179.54 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 145' ' ' ALA . . . . . . . . . . . . . . . -76.53 -23.01 53.63 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-O 121.739 0.78 . . . . 0.0 109.496 174.663 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 146' ' ' ILE . . . . . 0.539 ' O ' ' HA ' ' A' ' 141' ' ' ILE . 14.6 tt -149.77 144.01 17.77 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.713 0 CA-C-N 114.772 -1.103 . . . . 0.0 108.169 173.578 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 147' ' ' ASP . . . . . . . . . . . . . 30.4 t70 -116.55 27.3 9.28 Favored 'General case' 0 C--N 1.319 -0.755 0 CA-C-O 122.117 0.961 . . . . 0.0 109.158 -179.233 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 148' ' ' PHE . . . . . . . . . . . . . 69.8 t80 -137.39 136.97 38.35 Favored 'General case' 0 C--N 1.318 -0.786 0 CA-C-N 114.603 -1.18 . . . . 0.0 109.032 -175.755 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 149' ' ' ASN . . . . . . . . . . . . . 3.8 t-20 -120.19 90.06 44.11 Favored Pre-proline 0 C--N 1.322 -0.616 0 C-N-CA 120.89 -0.324 . . . . 0.0 110.74 -177.318 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 150' ' ' PRO . . . . . . . . . . . . . 21.7 Cg_exo -64.45 -22.85 65.32 Favored 'Trans proline' 0 C--N 1.345 0.35 0 C-N-CA 122.559 2.173 . . . . 0.0 111.108 178.542 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 151' ' ' ALA . . . . . 0.713 ' HB2' HH12 ' A' ' 130' ' ' ARG . . . -66.11 -27.45 68.06 Favored 'General case' 0 N--CA 1.45 -0.428 0 CA-C-N 115.062 -0.972 . . . . 0.0 111.514 -177.819 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 152' ' ' ASP . . . . . . . . . . . . . 14.6 t70 -71.69 -25.35 62.07 Favored 'General case' 0 C--N 1.327 -0.401 0 CA-C-O 121.07 0.462 . . . . 0.0 110.498 -177.354 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 153' ' ' TYR . . . . . . . . . . . . . 92.4 m-85 -87.41 0.15 55.93 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 115.893 -0.594 . . . . 0.0 110.977 -178.464 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 154' ' ' VAL . . . . . . . . . . . . . 55.9 t -88.34 107.24 17.38 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.416 0 N-CA-C 109.967 -0.383 . . . . 0.0 109.967 178.822 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 155' ' ' ARG . . . . . . . . . . . . . 10.4 tpt180 -89.49 130.44 35.83 Favored 'General case' 0 C--N 1.323 -0.554 0 CA-C-N 116.0 -0.545 . . . . 0.0 110.892 -177.374 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 156' ' ' ILE . . . . . 0.406 HD12 ' HB2' ' A' ' 130' ' ' ARG . 48.0 mm -96.81 115.61 65.76 Favored Pre-proline 0 C--N 1.323 -0.545 0 CA-C-N 116.116 -0.493 . . . . 0.0 110.052 175.021 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 157' ' ' PRO . . . . . . . . . . . . . 93.9 Cg_endo . . . . . 0 N--CA 1.458 -0.57 0 C-N-CA 122.708 2.272 . . . . 0.0 112.318 176.933 . . . . . . . . 0 0 . 1 . 016 nuclear orig core ' A' A ' 63' ' ' SER . . . . . . . . . . . . . 19.4 m . . . . . 0 C--O 1.234 0.279 0 N-CA-C 110.152 -0.314 . . . . 0.0 110.152 . . . . . . . . . 0 0 . 1 . 016 nuclear orig core ' A' A ' 64' ' ' PHE . . . . . . . . . . . . . 77.8 t80 -59.04 -33.01 70.27 Favored 'General case' 0 N--CA 1.464 0.236 0 CA-C-O 120.68 0.276 . . . . 0.0 110.578 -177.491 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 65' ' ' GLY . . . . . . . . . . . . . . . -57.87 -41.21 94.03 Favored Glycine 0 N--CA 1.448 -0.559 0 C-N-CA 120.856 -0.688 . . . . 0.0 112.366 176.495 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 66' ' ' ASP . . . . . 0.574 ' O ' ' HG3' ' A' ' 70' ' ' LYS . 6.8 t0 -72.66 -41.27 65.61 Favored 'General case' 0 C--N 1.327 -0.392 0 N-CA-C 109.618 -0.512 . . . . 0.0 109.618 179.78 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 67' ' ' TRP . . . . . . . . . . . . . 97.6 m95 -59.71 -38.33 81.32 Favored 'General case' 0 N--CA 1.464 0.268 0 CA-C-N 116.344 -0.389 . . . . 0.0 110.751 177.184 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 68' ' ' ALA . . . . . . . . . . . . . . . -61.23 -44.5 97.16 Favored 'General case' 0 C--N 1.326 -0.435 0 CA-C-N 116.293 -0.412 . . . . 0.0 110.081 176.314 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 69' ' ' GLU . . . . . . . . . . . . . 28.7 tt0 -62.26 -41.17 98.21 Favored 'General case' 0 CA--C 1.53 0.175 0 CA-C-N 116.116 -0.493 . . . . 0.0 110.024 176.943 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 70' ' ' LYS . . . . . 0.574 ' HG3' ' O ' ' A' ' 66' ' ' ASP . 51.8 mttm -57.34 -44.31 84.16 Favored 'General case' 0 C--O 1.232 0.158 0 CA-C-N 116.354 -0.385 . . . . 0.0 110.587 177.711 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 71' ' ' PHE . . . . . . . . . . . . . 89.2 t80 -60.4 -52.52 64.89 Favored 'General case' 0 C--N 1.331 -0.22 0 CA-C-N 115.905 -0.589 . . . . 0.0 110.63 -179.709 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 72' ' ' LEU . . . . . 0.435 HD12 HD13 ' A' ' 85' ' ' LEU . 4.2 mm? -59.65 -47.4 85.77 Favored 'General case' 0 C--N 1.331 -0.231 0 CA-C-N 116.292 -0.413 . . . . 0.0 110.755 178.856 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 73' ' ' LYS . . . . . 0.444 ' HE3' ' HB2' ' A' ' 73' ' ' LYS . 36.0 ttmt -56.43 -46.64 80.16 Favored 'General case' 0 C--N 1.325 -0.469 0 CA-C-N 115.556 -0.747 . . . . 0.0 110.547 179.774 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 74' ' ' SER . . . . . . . . . . . . . 42.0 m -68.15 -43.79 77.46 Favored 'General case' 0 C--N 1.327 -0.395 0 CA-C-N 115.778 -0.646 . . . . 0.0 111.186 -179.69 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 75' ' ' LYS . . . . . 0.444 ' O ' HG23 ' A' ' 80' ' ' VAL . 3.6 mmtm -69.18 -32.5 71.85 Favored 'General case' 0 C--N 1.331 -0.215 0 CA-C-N 116.701 -0.227 . . . . 0.0 111.423 -177.64 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 76' ' ' GLU . . . . . . . . . . . . . 39.3 tt0 -58.27 -50.68 72.74 Favored 'General case' 0 C--N 1.327 -0.413 0 CA-C-O 121.009 0.433 . . . . 0.0 109.978 173.975 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 77' ' ' ALA . . . . . . . . . . . . . . . -75.45 -10.06 59.12 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 115.689 -0.687 . . . . 0.0 111.108 179.137 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 78' ' ' ASP . . . . . . . . . . . . . 34.5 t70 -76.13 -11.81 60.0 Favored 'General case' 0 C--N 1.324 -0.502 0 CA-C-N 115.727 -0.67 . . . . 0.0 110.885 -177.925 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 79' ' ' GLY . . . . . . . . . . . . . . . 103.55 33.99 3.99 Favored Glycine 0 N--CA 1.451 -0.366 0 C-N-CA 120.632 -0.794 . . . . 0.0 113.332 174.012 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 80' ' ' VAL . . . . . 0.444 HG23 ' O ' ' A' ' 75' ' ' LYS . 31.4 m -101.09 159.53 3.93 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.411 0 CA-C-N 116.935 0.368 . . . . 0.0 110.549 176.653 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 81' ' ' SER . . . . . . . . . . . . . 7.1 p -81.78 174.95 10.84 Favored 'General case' 0 C--N 1.324 -0.54 0 CA-C-N 116.164 -0.471 . . . . 0.0 110.868 179.195 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 82' ' ' VAL . . . . . . . . . . . . . 61.0 t -68.29 -41.66 83.9 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.397 0 CA-C-N 116.341 -0.391 . . . . 0.0 110.615 -177.707 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 83' ' ' SER . . . . . . . . . . . . . 53.0 p -58.9 -39.19 80.74 Favored 'General case' 0 C--N 1.332 -0.188 0 CA-C-O 121.248 0.547 . . . . 0.0 110.507 177.964 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 84' ' ' GLN . . . . . . . . . . . . . 6.5 tp-100 -66.52 -47.98 71.21 Favored 'General case' 0 C--N 1.325 -0.465 0 CA-C-N 115.65 -0.705 . . . . 0.0 110.146 177.822 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 85' ' ' LEU . . . . . 0.435 HD13 HD12 ' A' ' 72' ' ' LEU . 0.6 OUTLIER -62.47 -43.43 98.84 Favored 'General case' 0 C--N 1.326 -0.432 0 CA-C-N 115.599 -0.728 . . . . 0.0 110.559 -178.364 . . . . . . . . 3 3 . 1 . 016 nuclear orig core ' A' A ' 86' ' ' ASN . . . . . . . . . . . . . 11.8 m120 -61.44 -38.85 88.68 Favored 'General case' 0 N--CA 1.465 0.297 0 CA-C-O 120.689 0.28 . . . . 0.0 111.005 179.409 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 87' ' ' SER . . . . . . . . . . . . . 49.6 m -60.2 -44.38 95.16 Favored 'General case' 0 C--N 1.327 -0.378 0 CA-C-N 116.32 -0.4 . . . . 0.0 110.772 -179.707 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 88' ' ' TYR . . . . . 0.405 ' HB2' HD13 ' A' ' 72' ' ' LEU . 25.8 m-85 -62.56 -37.97 88.23 Favored 'General case' 0 C--N 1.331 -0.235 0 CA-C-N 116.452 -0.34 . . . . 0.0 110.495 177.706 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 89' ' ' LYS . . . . . 0.613 ' HA ' ' SG ' ' A' ' 92' ' ' CYS . 56.3 mtpt -66.09 -36.74 83.99 Favored 'General case' 0 C--N 1.331 -0.226 0 CA-C-N 116.201 -0.454 . . . . 0.0 110.589 178.522 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 90' ' ' ASN . . . . . 0.51 ' O ' ' HB2' ' A' ' 94' ' ' ASN . 27.3 t-20 -60.98 -33.34 73.07 Favored 'General case' 0 C--N 1.327 -0.382 0 CA-C-O 121.347 0.594 . . . . 0.0 110.375 176.234 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 91' ' ' TYR . . . . . . . . . . . . . 24.1 m-85 -72.18 -50.58 26.57 Favored 'General case' 0 C--N 1.322 -0.616 0 CA-C-N 116.064 -0.516 . . . . 0.0 110.841 178.783 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 92' ' ' CYS . . . . . 0.613 ' SG ' ' HA ' ' A' ' 89' ' ' LYS . 24.9 p -76.81 -40.82 46.73 Favored 'General case' 0 C--N 1.328 -0.331 0 N-CA-C 112.226 0.454 . . . . 0.0 112.226 -174.593 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 93' ' ' ARG . . . . . . . . . . . . . 35.6 ttt180 -78.17 -52.75 8.23 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-O 120.812 0.339 . . . . 0.0 111.834 -176.68 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 94' ' ' ASN . . . . . 0.51 ' HB2' ' O ' ' A' ' 90' ' ' ASN . 3.9 m-20 -77.88 -50.21 12.7 Favored 'General case' 0 C--N 1.324 -0.508 0 CA-C-O 120.976 0.417 . . . . 0.0 111.161 -173.266 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 95' ' ' HIS . . . . . . . . . . . . . 76.0 m80 -86.9 -54.12 4.52 Favored 'General case' 0 C--N 1.323 -0.564 0 CA-C-N 116.193 -0.458 . . . . 0.0 112.101 -173.827 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 96' ' ' LEU . . . . . 0.535 ' HB2' ' HA ' ' A' ' 92' ' ' CYS . 81.8 mt -87.54 26.81 1.2 Allowed 'General case' 0 C--N 1.326 -0.415 0 N-CA-C 111.789 0.292 . . . . 0.0 111.789 -173.471 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 97' ' ' SER . . . . . 0.528 ' N ' ' HD2' ' A' ' 98' ' ' PRO . 0.0 OUTLIER -56.66 -48.05 97.91 Favored Pre-proline 0 CA--C 1.54 0.595 0 N-CA-C 112.595 0.591 . . . . 0.0 112.595 -179.16 . . . . . . . . 3 3 . 1 . 016 nuclear orig core ' A' A ' 98' ' ' PRO . . . . . 0.528 ' HD2' ' N ' ' A' ' 97' ' ' SER . 15.7 Cg_endo -58.62 -36.54 97.12 Favored 'Trans proline' 0 C--N 1.358 1.037 0 C-N-CA 122.032 1.821 . . . . 0.0 112.336 176.409 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 99' ' ' LEU . . . . . 0.409 HD22 HD21 ' A' ' 96' ' ' LEU . 8.1 mp -70.09 -33.65 72.15 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-N 116.304 -0.407 . . . . 0.0 110.503 -179.342 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 100' ' ' TYR . . . . . . . . . . . . . 62.9 t80 -57.42 -29.79 64.44 Favored 'General case' 0 C--N 1.327 -0.391 0 CA-C-N 115.541 -0.754 . . . . 0.0 110.926 179.272 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 101' ' ' MET . . . . . . . . . . . . . 47.4 ttm -86.6 -18.61 30.99 Favored 'General case' 0 C--N 1.325 -0.468 0 CA-C-N 116.008 -0.542 . . . . 0.0 110.88 -177.344 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 102' ' ' LYS . . . . . . . . . . . . . 89.2 mttt -91.02 165.2 13.66 Favored 'General case' 0 C--N 1.325 -0.495 0 CA-C-O 121.453 0.644 . . . . 0.0 111.944 -174.348 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 103' ' ' SER . . . . . 0.464 ' O ' HG13 ' A' ' 107' ' ' ILE . 18.1 t -95.02 172.2 8.29 Favored 'General case' 0 C--N 1.323 -0.582 0 CA-C-N 115.396 -0.82 . . . . 0.0 109.051 169.336 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 104' ' ' LEU . . . . . . . . . . . . . 89.0 mt -59.07 -43.72 91.8 Favored 'General case' 0 C--N 1.325 -0.458 0 N-CA-C 111.993 0.368 . . . . 0.0 111.993 -174.686 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 105' ' ' SER . . . . . . . . . . . . . 24.1 t -85.04 1.97 45.32 Favored 'General case' 0 C--N 1.326 -0.447 0 CA-C-O 121.099 0.476 . . . . 0.0 110.74 -177.315 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 106' ' ' GLU . . . . . . . . . . . . . 19.7 tp10 -102.36 -14.06 17.07 Favored 'General case' 0 C--N 1.322 -0.63 0 CA-C-O 121.268 0.556 . . . . 0.0 110.531 -178.128 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 107' ' ' ILE . . . . . 0.464 HG13 ' O ' ' A' ' 103' ' ' SER . 68.3 mt -83.81 140.38 16.27 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.45 0 CA-C-N 116.09 -0.504 . . . . 0.0 110.953 -178.626 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 108' ' ' LEU . . . . . . . . . . . . . 76.1 mt -110.81 151.22 42.76 Favored Pre-proline 0 C--N 1.324 -0.513 0 CA-C-N 116.023 -0.535 . . . . 0.0 109.71 178.161 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 109' ' ' PRO . . . . . . . . . . . . . 18.9 Cg_endo -61.08 -26.8 83.43 Favored 'Trans proline' 0 N--CA 1.464 -0.212 0 C-N-CA 121.979 1.786 . . . . 0.0 111.166 174.633 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 110' ' ' ALA . . . . . . . . . . . . . . . -71.48 -26.34 62.65 Favored 'General case' 0 N--CA 1.453 -0.288 0 CA-C-N 115.351 -0.841 . . . . 0.0 111.683 -178.78 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 111' ' ' ASP . . . . . 0.47 ' O ' HG13 ' A' ' 115' ' ' ILE . 29.7 m-20 -57.74 -57.15 14.02 Favored 'General case' 0 N--CA 1.463 0.223 0 CA-C-O 121.272 0.558 . . . . 0.0 109.648 176.426 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 112' ' ' ILE . . . . . . . . . . . . . 19.5 mt -67.23 -37.49 79.22 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.538 0 CA-C-N 115.449 -0.796 . . . . 0.0 110.337 -179.162 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 113' ' ' GLN . . . . . . . . . . . . . 23.4 tp60 -58.27 -50.12 74.71 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 115.864 -0.607 . . . . 0.0 111.446 179.651 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 114' ' ' SER . . . . . . . . . . . . . 31.6 p -64.7 -35.2 80.27 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 116.335 -0.393 . . . . 0.0 110.956 -177.963 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 115' ' ' ILE . . . . . 0.47 HG13 ' O ' ' A' ' 111' ' ' ASP . 92.7 mt -60.44 -53.3 50.69 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.299 0 CA-C-O 120.694 0.283 . . . . 0.0 110.359 175.979 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 116' ' ' ILE . . . . . . . . . . . . . 47.5 mm -60.16 -41.95 88.47 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.289 0 CA-C-N 116.121 -0.49 . . . . 0.0 110.924 -179.435 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 117' ' ' ASN . . . . . . . . . . . . . 27.9 t-20 -65.49 -32.67 74.41 Favored 'General case' 0 C--N 1.326 -0.447 0 CA-C-N 116.066 -0.515 . . . . 0.0 111.926 -176.896 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 118' ' ' GLU . . . . . . . . . . . . . 21.3 mt-10 -103.17 4.18 36.6 Favored 'General case' 0 C--N 1.329 -0.311 0 N-CA-C 112.176 0.436 . . . . 0.0 112.176 -177.663 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 119' ' ' THR . . . . . . . . . . . . . 96.7 m -97.85 112.06 24.12 Favored 'General case' 0 C--N 1.322 -0.596 0 CA-C-O 121.176 0.512 . . . . 0.0 110.239 173.636 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 120' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -93.86 88.62 5.82 Favored 'General case' 0 C--N 1.325 -0.458 0 CA-C-N 115.943 -0.571 . . . . 0.0 110.362 -177.869 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 121' ' ' LEU . . . . . . . . . . . . . 57.6 mt -138.69 -174.7 3.9 Favored 'General case' 0 C--N 1.32 -0.694 0 CA-C-N 115.392 -0.822 . . . . 0.0 110.025 179.541 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 122' ' ' ALA . . . . . . . . . . . . . . . -64.85 147.39 53.36 Favored 'General case' 0 C--N 1.322 -0.612 0 CA-C-N 116.277 -0.42 . . . . 0.0 110.465 178.439 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 123' ' ' LYS . . . . . . . . . . . . . 52.6 mttp -55.94 -33.96 65.21 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 115.997 -0.547 . . . . 0.0 111.353 -179.345 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 124' ' ' ASN . . . . . . . . . . . . . 65.5 t30 -64.74 -38.49 91.17 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 115.978 -0.555 . . . . 0.0 110.413 -179.987 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 125' ' ' THR . . . . . 0.472 ' O ' HG13 ' A' ' 129' ' ' ILE . 7.3 m -68.25 -37.52 80.85 Favored 'General case' 0 C--N 1.326 -0.417 0 CA-C-N 115.774 -0.648 . . . . 0.0 110.801 -179.444 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 126' ' ' LEU . . . . . . . . . . . . . 88.5 mt -61.84 -41.8 98.26 Favored 'General case' 0 C--O 1.234 0.289 0 CA-C-O 121.144 0.497 . . . . 0.0 110.221 178.595 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 127' ' ' LYS . . . . . . . . . . . . . 93.5 mttt -63.49 -44.68 93.66 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 115.663 -0.698 . . . . 0.0 110.201 177.142 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 128' ' ' ALA . . . . . . . . . . . . . . . -57.57 -40.45 78.98 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 115.717 -0.674 . . . . 0.0 111.477 -178.404 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 129' ' ' ILE . . . . . 0.472 HG13 ' O ' ' A' ' 125' ' ' THR . 67.3 mt -62.63 -50.19 80.77 Favored 'Isoleucine or valine' 0 C--O 1.235 0.295 0 CA-C-N 116.478 -0.328 . . . . 0.0 110.687 178.809 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 130' ' ' ARG . . . . . . . . . . . . . 13.7 ttt180 -61.63 -45.68 93.02 Favored 'General case' 0 C--O 1.231 0.107 0 CA-C-N 116.467 -0.333 . . . . 0.0 110.782 178.106 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 131' ' ' ASN . . . . . . . . . . . . . 7.1 m-20 -58.29 -49.54 76.77 Favored 'General case' 0 C--N 1.325 -0.457 0 CA-C-N 116.36 -0.382 . . . . 0.0 111.49 -179.061 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 132' ' ' THR . . . . . 0.483 ' O ' HG13 ' A' ' 136' ' ' ILE . 52.9 m -54.76 -50.72 67.76 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 116.227 -0.442 . . . . 0.0 110.594 178.268 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 133' ' ' ALA . . . . . . . . . . . . . . . -61.06 -40.91 95.46 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.209 -0.451 . . . . 0.0 111.103 179.436 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 134' ' ' SER . . . . . 0.455 ' O ' ' HG3' ' A' ' 138' ' ' ARG . 58.7 m -59.29 -45.57 90.9 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.044 -0.526 . . . . 0.0 111.123 -179.884 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 135' ' ' GLN . . . . . . . . . . . . . 12.3 mm100 -66.0 -34.85 79.04 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.399 -0.364 . . . . 0.0 111.071 -177.716 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 136' ' ' ILE . . . . . 0.483 HG13 ' O ' ' A' ' 132' ' ' THR . 64.3 mt -64.68 -43.81 96.61 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.264 0 CA-C-O 120.843 0.354 . . . . 0.0 110.166 177.219 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 137' ' ' PHE . . . . . 0.527 ' O ' HG13 ' A' ' 141' ' ' ILE . 43.5 m-85 -63.9 -39.86 95.16 Favored 'General case' 0 C--N 1.332 -0.18 0 CA-C-N 116.179 -0.464 . . . . 0.0 110.671 176.346 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 138' ' ' ARG . . . . . 0.455 ' HG3' ' O ' ' A' ' 134' ' ' SER . 79.0 mtt180 -64.0 -36.38 83.8 Favored 'General case' 0 C--N 1.332 -0.185 0 CA-C-O 120.738 0.304 . . . . 0.0 110.634 178.605 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 139' ' ' LEU . . . . . . . . . . . . . 54.8 tp -59.22 -41.52 88.84 Favored 'General case' 0 C--N 1.326 -0.423 0 CA-C-N 116.056 -0.52 . . . . 0.0 110.043 176.13 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 140' ' ' ALA . . . . . . . . . . . . . . . -67.0 -36.3 81.86 Favored 'General case' 0 C--N 1.327 -0.385 0 CA-C-N 116.243 -0.435 . . . . 0.0 110.537 176.715 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 141' ' ' ILE . . . . . 0.594 ' HA ' ' O ' ' A' ' 146' ' ' ILE . 77.3 mt -63.51 -45.58 97.4 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.301 0 CA-C-N 116.083 -0.508 . . . . 0.0 110.582 176.776 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 142' ' ' GLU . . . . . . . . . . . . . 46.4 mt-10 -63.16 -27.66 69.52 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.015 -0.539 . . . . 0.0 111.159 179.534 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 143' ' ' ASN . . . . . . . . . . . . . 35.1 m-80 -95.97 11.85 32.48 Favored 'General case' 0 C--N 1.326 -0.421 0 CA-C-N 116.284 -0.416 . . . . 0.0 110.821 179.43 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 144' ' ' ARG . . . . . . . . . . . . . 81.5 mtm180 60.88 25.24 15.19 Favored 'General case' 0 N--CA 1.469 0.498 0 CA-C-N 115.7 -0.682 . . . . 0.0 112.553 174.589 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 145' ' ' ALA . . . . . . . . . . . . . . . -80.41 -42.35 22.92 Favored 'General case' 0 C--N 1.323 -0.553 0 CA-C-O 121.25 0.548 . . . . 0.0 110.309 177.835 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 146' ' ' ILE . . . . . 0.594 ' O ' ' HA ' ' A' ' 141' ' ' ILE . 13.7 tt -147.13 152.19 13.28 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.542 0 CA-C-N 115.677 -0.692 . . . . 0.0 109.336 179.412 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 147' ' ' ASP . . . . . . . . . . . . . 25.9 t70 -125.83 70.06 1.2 Allowed 'General case' 0 C--N 1.321 -0.634 0 N-CA-C 109.314 -0.625 . . . . 0.0 109.314 175.096 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 148' ' ' PHE . . . . . . . . . . . . . 61.5 t80 -169.48 133.8 1.37 Allowed 'General case' 0 C--N 1.324 -0.535 0 CA-C-N 115.618 -0.719 . . . . 0.0 109.647 -177.905 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 149' ' ' ASN . . . . . . . . . . . . . 4.5 t-20 -115.7 96.3 46.06 Favored Pre-proline 0 C--N 1.322 -0.591 0 CA-C-N 116.478 -0.328 . . . . 0.0 110.737 179.369 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 150' ' ' PRO . . . . . . . . . . . . . 17.3 Cg_exo -67.4 -21.47 47.03 Favored 'Trans proline' 0 C--N 1.344 0.311 0 C-N-CA 122.852 2.368 . . . . 0.0 112.07 179.682 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 151' ' ' ALA . . . . . . . . . . . . . . . -72.18 -15.8 61.96 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-N 115.972 -0.558 . . . . 0.0 111.246 -178.582 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 152' ' ' ASP . . . . . . . . . . . . . 25.2 t70 -72.01 -19.56 61.84 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-O 121.212 0.53 . . . . 0.0 110.568 179.997 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 153' ' ' TYR . . . . . . . . . . . . . 97.8 m-85 -93.38 1.52 56.87 Favored 'General case' 0 C--N 1.326 -0.435 0 CA-C-N 115.958 -0.565 . . . . 0.0 111.251 -177.573 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 154' ' ' VAL . . . . . . . . . . . . . 48.8 t -77.2 110.82 13.3 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.373 0 CA-C-N 116.374 -0.376 . . . . 0.0 110.334 179.615 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 155' ' ' ARG . . . . . . . . . . . . . 77.0 mtt-85 -77.22 135.39 38.48 Favored 'General case' 0 C--N 1.321 -0.637 0 CA-C-N 116.181 -0.463 . . . . 0.0 110.273 179.279 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 156' ' ' ILE . . . . . . . . . . . . . 49.8 mm -105.06 104.92 49.48 Favored Pre-proline 0 C--N 1.321 -0.646 0 CA-C-N 115.736 -0.665 . . . . 0.0 109.77 -179.113 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 157' ' ' PRO . . . . . . . . . . . . . 58.2 Cg_endo . . . . . 0 N--CA 1.461 -0.394 0 C-N-CA 122.412 2.075 . . . . 0.0 112.227 -177.937 . . . . . . . . 0 0 . 1 . 017 nuclear orig core ' A' A ' 63' ' ' SER . . . . . . . . . . . . . 21.9 p . . . . . 0 N--CA 1.451 -0.392 0 N-CA-C 110.077 -0.342 . . . . 0.0 110.077 . . . . . . . . . 0 0 . 1 . 017 nuclear orig core ' A' A ' 64' ' ' PHE . . . . . . . . . . . . . 83.0 t80 -61.84 -42.44 99.04 Favored 'General case' 0 C--N 1.326 -0.445 0 CA-C-N 116.448 -0.342 . . . . 0.0 110.746 -177.055 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 65' ' ' GLY . . . . . . . . . . . . . . . -63.46 -30.64 78.21 Favored Glycine 0 C--N 1.329 0.188 0 C-N-CA 120.898 -0.668 . . . . 0.0 113.019 -178.534 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 66' ' ' ASP . . . . . . . . . . . . . 23.7 t70 -71.31 -45.18 63.64 Favored 'General case' 0 C--N 1.326 -0.434 0 CA-C-O 121.067 0.46 . . . . 0.0 110.574 -179.525 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 67' ' ' TRP . . . . . 0.426 ' HA ' ' HE2' ' A' ' 70' ' ' LYS . 83.2 m95 -74.79 -28.89 60.92 Favored 'General case' 0 C--N 1.325 -0.493 0 CA-C-N 116.285 -0.416 . . . . 0.0 110.942 178.559 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 68' ' ' ALA . . . . . . . . . . . . . . . -64.28 -37.15 86.48 Favored 'General case' 0 C--N 1.331 -0.219 0 CA-C-O 121.008 0.432 . . . . 0.0 110.142 173.971 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 69' ' ' GLU . . . . . . . . . . . . . 43.4 tt0 -59.08 -48.64 80.85 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 115.661 -0.699 . . . . 0.0 109.964 175.661 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 70' ' ' LYS . . . . . 0.426 ' HE2' ' HA ' ' A' ' 67' ' ' TRP . 19.2 mtmm -62.45 -31.63 72.38 Favored 'General case' 0 C--N 1.328 -0.326 0 CA-C-N 115.665 -0.698 . . . . 0.0 111.427 177.428 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 71' ' ' PHE . . . . . . . . . . . . . 92.1 t80 -68.14 -45.13 74.44 Favored 'General case' 0 C--O 1.235 0.298 0 CA-C-O 120.578 0.228 . . . . 0.0 111.072 178.78 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 72' ' ' LEU . . . . . . . . . . . . . 8.0 mp -60.07 -42.5 94.69 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-O 121.09 0.471 . . . . 0.0 110.637 177.668 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 73' ' ' LYS . . . . . . . . . . . . . 58.2 mtpt -72.6 -24.6 61.1 Favored 'General case' 0 C--N 1.325 -0.457 0 CA-C-N 115.874 -0.603 . . . . 0.0 110.707 179.207 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 74' ' ' SER . . . . . . . . . . . . . 26.7 t -68.44 -51.32 44.97 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 115.89 -0.596 . . . . 0.0 110.277 177.634 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 75' ' ' LYS . . . . . 0.409 ' O ' HG22 ' A' ' 80' ' ' VAL . 5.2 mptp? -68.42 -27.93 66.62 Favored 'General case' 0 C--O 1.234 0.241 0 CA-C-O 120.865 0.364 . . . . 0.0 110.719 178.741 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 76' ' ' GLU . . . . . . . . . . . . . 36.0 tt0 -56.48 -47.84 78.39 Favored 'General case' 0 C--N 1.324 -0.534 0 CA-C-N 115.803 -0.635 . . . . 0.0 109.772 172.07 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 77' ' ' ALA . . . . . . . . . . . . . . . -75.06 -23.72 58.1 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 115.645 -0.707 . . . . 0.0 111.164 177.904 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 78' ' ' ASP . . . . . . . . . . . . . 20.2 t70 -63.58 -31.61 72.83 Favored 'General case' 0 N--CA 1.464 0.237 0 CA-C-O 121.194 0.521 . . . . 0.0 110.581 178.318 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 79' ' ' GLY . . . . . . . . . . . . . . . 105.14 21.06 9.17 Favored Glycine 0 N--CA 1.446 -0.656 0 C-N-CA 120.636 -0.792 . . . . 0.0 112.795 176.229 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 80' ' ' VAL . . . . . 0.409 HG22 ' O ' ' A' ' 75' ' ' LYS . 25.7 m -71.02 153.5 8.3 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.451 0 CA-C-O 120.838 0.352 . . . . 0.0 110.29 178.986 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 81' ' ' SER . . . . . . . . . . . . . 10.7 p -68.77 160.58 30.16 Favored 'General case' 0 C--N 1.323 -0.573 0 CA-C-N 116.131 -0.486 . . . . 0.0 110.67 179.476 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 82' ' ' VAL . . . . . . . . . . . . . 13.3 p -61.51 -34.35 61.13 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.393 0 CA-C-O 120.735 0.302 . . . . 0.0 110.514 179.6 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 83' ' ' SER . . . . . . . . . . . . . 4.0 p -66.79 -42.29 86.23 Favored 'General case' 0 C--O 1.236 0.387 0 CA-C-O 121.087 0.47 . . . . 0.0 110.282 177.497 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 84' ' ' GLN . . . . . . . . . . . . . 6.3 tp-100 -64.65 -43.87 92.25 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 115.809 -0.632 . . . . 0.0 110.019 176.936 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 85' ' ' LEU . . . . . 0.483 ' O ' ' HG3' ' A' ' 89' ' ' LYS . 52.7 tp -62.68 -45.15 94.12 Favored 'General case' 0 C--N 1.326 -0.431 0 CA-C-N 115.921 -0.581 . . . . 0.0 110.496 178.4 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 86' ' ' ASN . . . . . . . . . . . . . 78.1 m-20 -57.15 -35.49 69.59 Favored 'General case' 0 N--CA 1.464 0.233 0 CA-C-N 116.459 -0.337 . . . . 0.0 110.808 177.325 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 87' ' ' SER . . . . . . . . . . . . . 48.2 m -60.54 -45.36 94.17 Favored 'General case' 0 C--N 1.327 -0.393 0 CA-C-N 116.318 -0.401 . . . . 0.0 110.29 177.827 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 88' ' ' TYR . . . . . . . . . . . . . 54.1 m-85 -66.24 -38.85 88.86 Favored 'General case' 0 C--N 1.331 -0.229 0 CA-C-O 120.926 0.393 . . . . 0.0 110.842 179.126 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 89' ' ' LYS . . . . . 0.483 ' HG3' ' O ' ' A' ' 85' ' ' LEU . 51.7 mtpt -64.29 -40.96 97.02 Favored 'General case' 0 C--N 1.324 -0.504 0 CA-C-N 116.15 -0.477 . . . . 0.0 110.223 178.106 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 90' ' ' ASN . . . . . 0.494 ' O ' ' HB2' ' A' ' 94' ' ' ASN . 0.9 OUTLIER -66.2 -28.89 69.1 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.073 -0.512 . . . . 0.0 110.897 177.617 . . . . . . . . 3 3 . 1 . 017 nuclear orig core ' A' A ' 91' ' ' TYR . . . . . . . . . . . . . 19.7 m-85 -71.88 -50.21 31.31 Favored 'General case' 0 C--N 1.323 -0.574 0 N-CA-C 109.905 -0.405 . . . . 0.0 109.905 174.381 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 92' ' ' CYS . . . . . 0.496 ' HA ' ' HB2' ' A' ' 96' ' ' LEU . 40.5 t -67.25 -54.62 19.29 Favored 'General case' 0 C--N 1.325 -0.458 0 CA-C-N 116.093 -0.503 . . . . 0.0 112.324 -176.601 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 93' ' ' ARG . . . . . 0.516 ' O ' ' HB3' ' A' ' 97' ' ' SER . 7.8 mpt_? -71.33 -36.82 71.7 Favored 'General case' 0 C--N 1.328 -0.361 0 N-CA-C 112.542 0.571 . . . . 0.0 112.542 -172.539 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 94' ' ' ASN . . . . . 0.494 ' HB2' ' O ' ' A' ' 90' ' ' ASN . 3.4 m-20 -93.72 -55.94 3.07 Favored 'General case' 0 C--N 1.324 -0.525 0 CA-C-O 120.871 0.367 . . . . 0.0 111.73 -175.412 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 95' ' ' HIS . . . . . . . . . . . . . 79.6 m80 -84.92 -47.18 10.55 Favored 'General case' 0 C--N 1.323 -0.549 0 CA-C-N 116.212 -0.449 . . . . 0.0 111.515 -170.346 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 96' ' ' LEU . . . . . 0.496 ' HB2' ' HA ' ' A' ' 92' ' ' CYS . 88.6 mt -88.62 19.51 3.91 Favored 'General case' 0 C--N 1.324 -0.536 0 CA-C-N 116.388 -0.369 . . . . 0.0 111.035 -178.237 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 97' ' ' SER . . . . . 0.555 ' OG ' ' HD3' ' A' ' 98' ' ' PRO . 12.4 p -60.76 -42.09 85.79 Favored Pre-proline 0 CA--C 1.542 0.664 0 N-CA-C 113.102 0.778 . . . . 0.0 113.102 -177.986 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 98' ' ' PRO . . . . . 0.555 ' HD3' ' OG ' ' A' ' 97' ' ' SER . 17.3 Cg_exo -65.81 -33.57 43.07 Favored 'Trans proline' 0 C--N 1.359 1.079 0 C-N-CA 121.424 1.416 . . . . 0.0 111.737 178.396 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 99' ' ' LEU . . . . . . . . . . . . . 68.0 mt -79.72 -29.11 40.55 Favored 'General case' 0 C--N 1.327 -0.382 0 CA-C-N 115.742 -0.663 . . . . 0.0 110.679 -177.221 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 100' ' ' TYR . . . . . . . . . . . . . 46.9 t80 -52.79 -40.31 63.09 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 115.775 -0.648 . . . . 0.0 110.916 179.794 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 101' ' ' MET . . . . . . . . . . . . . 21.0 ptp -95.81 14.16 24.23 Favored 'General case' 0 C--N 1.323 -0.567 0 CA-C-N 115.931 -0.577 . . . . 0.0 111.423 -176.51 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 102' ' ' LYS . . . . . 0.501 ' HG3' ' O ' ' A' ' 98' ' ' PRO . 96.7 mttt -104.33 152.88 21.72 Favored 'General case' 0 C--N 1.324 -0.536 0 CA-C-O 121.054 0.454 . . . . 0.0 111.016 178.442 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 103' ' ' SER . . . . . 0.429 ' O ' HG13 ' A' ' 107' ' ' ILE . 37.9 t -70.74 146.37 49.88 Favored 'General case' 0 C--N 1.322 -0.615 0 CA-C-N 115.57 -0.741 . . . . 0.0 109.576 176.416 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 104' ' ' LEU . . . . . . . . . . . . . 30.6 tp -60.47 -31.87 70.87 Favored 'General case' 0 C--N 1.323 -0.574 0 CA-C-N 116.21 -0.45 . . . . 0.0 111.038 -176.56 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 105' ' ' SER . . . . . . . . . . . . . 56.3 p -87.89 -17.35 31.59 Favored 'General case' 0 C--N 1.329 -0.319 0 N-CA-C 112.29 0.478 . . . . 0.0 112.29 -176.019 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 106' ' ' GLU . . . . . 0.411 ' HG2' ' O ' ' A' ' 103' ' ' SER . 8.4 pt-20 -89.03 -18.53 27.14 Favored 'General case' 0 N--CA 1.464 0.234 0 C-N-CA 120.755 -0.378 . . . . 0.0 111.289 -174.263 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 107' ' ' ILE . . . . . 0.429 HG13 ' O ' ' A' ' 103' ' ' SER . 66.3 mt -73.0 111.08 6.87 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.467 0 CA-C-O 120.993 0.425 . . . . 0.0 110.961 -176.412 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 108' ' ' LEU . . . . . 0.407 ' HA ' ' HD3' ' A' ' 109' ' ' PRO . 1.7 pp -97.46 145.4 29.61 Favored Pre-proline 0 C--N 1.323 -0.58 0 CA-C-N 115.83 -0.623 . . . . 0.0 110.102 176.951 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 109' ' ' PRO . . . . . 0.453 ' HG3' ' HA ' ' A' ' 150' ' ' PRO . 52.4 Cg_exo -54.96 -33.19 81.83 Favored 'Trans proline' 0 C--N 1.343 0.283 0 C-N-CA 123.438 2.759 . . . . 0.0 113.74 -174.516 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 110' ' ' ALA . . . . . . . . . . . . . . . -59.62 -32.32 70.31 Favored 'General case' 0 C--N 1.331 -0.209 0 CA-C-O 120.697 0.284 . . . . 0.0 111.43 -178.98 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 111' ' ' ASP . . . . . . . . . . . . . 38.7 t70 -73.41 -46.82 46.47 Favored 'General case' 0 C--N 1.325 -0.473 0 CA-C-O 121.05 0.453 . . . . 0.0 110.374 -177.159 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 112' ' ' ILE . . . . . . . . . . . . . 27.9 mt -62.01 -39.93 85.49 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.399 0 CA-C-N 115.686 -0.688 . . . . 0.0 110.223 177.992 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 113' ' ' GLN . . . . . 0.415 ' O ' ' HB ' ' A' ' 116' ' ' ILE . 14.6 tm0? -65.54 -35.12 79.92 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 115.889 -0.596 . . . . 0.0 109.857 179.175 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 114' ' ' SER . . . . . 0.465 ' O ' ' HG2' ' A' ' 118' ' ' GLU . 57.5 m -64.74 -38.95 92.74 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.434 -0.348 . . . . 0.0 110.453 177.225 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 115' ' ' ILE . . . . . . . . . . . . . 67.7 mt -62.42 -36.55 75.38 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.337 0 CA-C-O 121.175 0.512 . . . . 0.0 109.951 176.235 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 116' ' ' ILE . . . . . 0.415 ' HB ' ' O ' ' A' ' 113' ' ' GLN . 42.1 mm -61.69 -42.09 92.96 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.338 0 CA-C-N 115.675 -0.693 . . . . 0.0 110.339 175.21 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 117' ' ' ASN . . . . . . . . . . . . . 83.9 m-20 -66.47 -32.02 73.13 Favored 'General case' 0 N--CA 1.466 0.368 0 CA-C-N 116.121 -0.491 . . . . 0.0 110.908 178.627 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 118' ' ' GLU . . . . . 0.465 ' HG2' ' O ' ' A' ' 114' ' ' SER . 65.9 mm-40 -80.63 -17.84 49.98 Favored 'General case' 0 C--N 1.327 -0.383 0 CA-C-N 116.146 -0.479 . . . . 0.0 111.011 -178.306 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 119' ' ' THR . . . . . . . . . . . . . 36.4 m -87.97 113.71 23.88 Favored 'General case' 0 C--N 1.321 -0.638 0 CA-C-N 116.13 -0.486 . . . . 0.0 109.871 178.69 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 120' ' ' LYS . . . . . . . . . . . . . 59.5 pttt -90.53 29.19 1.33 Allowed 'General case' 0 C--N 1.326 -0.424 0 CA-C-N 116.005 -0.543 . . . . 0.0 111.322 -175.294 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 121' ' ' LEU . . . . . 0.506 HD11 HG21 ' A' ' 125' ' ' THR . 95.9 mt -91.92 162.27 14.48 Favored 'General case' 0 C--N 1.32 -0.707 0 CA-C-N 116.167 -0.47 . . . . 0.0 109.999 179.348 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 122' ' ' ALA . . . . . . . . . . . . . . . -64.81 163.22 14.61 Favored 'General case' 0 C--N 1.326 -0.431 0 CA-C-O 120.979 0.419 . . . . 0.0 111.714 -176.967 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 123' ' ' LYS . . . . . 0.502 ' O ' ' HG3' ' A' ' 127' ' ' LYS . 19.7 pttp -55.05 -35.65 64.72 Favored 'General case' 0 C--N 1.331 -0.197 0 CA-C-N 115.624 -0.717 . . . . 0.0 111.897 -177.804 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 124' ' ' ASN . . . . . . . . . . . . . 48.5 t-20 -56.99 -52.14 66.46 Favored 'General case' 0 C--O 1.234 0.249 0 CA-C-O 121.156 0.503 . . . . 0.0 110.16 178.975 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 125' ' ' THR . . . . . 0.506 HG21 HD11 ' A' ' 121' ' ' LEU . 1.3 m -66.77 -37.2 84.12 Favored 'General case' 0 N--CA 1.449 -0.493 0 CA-C-N 115.801 -0.636 . . . . 0.0 110.809 -178.814 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 126' ' ' LEU . . . . . . . . . . . . . 90.9 mt -61.22 -43.52 98.75 Favored 'General case' 0 C--O 1.234 0.28 0 CA-C-N 116.274 -0.421 . . . . 0.0 110.873 178.52 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 127' ' ' LYS . . . . . 0.502 ' HG3' ' O ' ' A' ' 123' ' ' LYS . 47.6 mtpt -64.15 -41.53 97.14 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.307 -0.406 . . . . 0.0 110.455 178.21 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 128' ' ' ALA . . . . . . . . . . . . . . . -60.36 -44.09 95.9 Favored 'General case' 0 C--O 1.234 0.246 0 CA-C-N 116.168 -0.469 . . . . 0.0 111.173 179.855 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 129' ' ' ILE . . . . . 0.465 HG13 ' O ' ' A' ' 125' ' ' THR . 77.6 mt -62.54 -45.79 97.96 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.291 0 CA-C-N 116.249 -0.432 . . . . 0.0 110.27 177.728 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 130' ' ' ARG . . . . . 0.531 ' CZ ' ' HA ' ' A' ' 152' ' ' ASP . 0.3 OUTLIER -65.21 -40.59 94.35 Favored 'General case' 0 C--N 1.331 -0.206 0 CA-C-N 116.056 -0.52 . . . . 0.0 110.485 -179.139 . . . . . . . . 3 3 . 1 . 017 nuclear orig core ' A' A ' 131' ' ' ASN . . . . . 0.596 ' O ' ' HG2' ' A' ' 135' ' ' GLN . 9.2 m120 -59.67 -52.31 66.08 Favored 'General case' 0 CA--C 1.518 -0.26 0 CA-C-N 116.291 -0.413 . . . . 0.0 110.298 177.25 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 132' ' ' THR . . . . . 0.487 ' O ' HG13 ' A' ' 136' ' ' ILE . 55.1 m -51.7 -49.41 62.49 Favored 'General case' 0 C--N 1.329 -0.316 0 O-C-N 123.678 0.611 . . . . 0.0 110.785 178.74 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 133' ' ' ALA . . . . . . . . . . . . . . . -63.81 -44.15 94.12 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.19 -0.459 . . . . 0.0 111.508 -179.744 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 134' ' ' SER . . . . . . . . . . . . . 34.6 p -66.71 -29.51 69.52 Favored 'General case' 0 C--N 1.33 -0.254 0 C-N-CA 121.168 -0.213 . . . . 0.0 111.463 -177.141 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 135' ' ' GLN . . . . . 0.596 ' HG2' ' O ' ' A' ' 131' ' ' ASN . 11.1 mm100 -73.03 -32.68 65.25 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-O 120.784 0.326 . . . . 0.0 110.237 178.094 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 136' ' ' ILE . . . . . 0.487 HG13 ' O ' ' A' ' 132' ' ' THR . 75.2 mt -64.33 -48.06 86.97 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.21 0 CA-C-N 116.159 -0.473 . . . . 0.0 110.058 176.265 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 137' ' ' PHE . . . . . 0.509 ' O ' HG13 ' A' ' 141' ' ' ILE . 62.5 m-85 -62.38 -40.73 97.4 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.147 -0.479 . . . . 0.0 110.532 176.241 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 138' ' ' ARG . . . . . 0.405 HH11 ' HD2' ' A' ' 138' ' ' ARG . 9.7 mtp180 -57.02 -43.1 81.53 Favored 'General case' 0 CA--C 1.519 -0.247 0 CA-C-N 116.331 -0.395 . . . . 0.0 111.109 176.56 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 139' ' ' LEU . . . . . . . . . . . . . 41.2 tp -60.63 -35.76 76.97 Favored 'General case' 0 C--N 1.326 -0.451 0 CA-C-N 116.004 -0.544 . . . . 0.0 110.34 178.938 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 140' ' ' ALA . . . . . . . . . . . . . . . -72.74 -38.76 67.3 Favored 'General case' 0 C--N 1.324 -0.535 0 CA-C-N 116.12 -0.491 . . . . 0.0 110.652 176.555 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 141' ' ' ILE . . . . . 0.631 ' HA ' ' O ' ' A' ' 146' ' ' ILE . 76.1 mt -64.49 -47.37 89.55 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.272 0 CA-C-N 116.535 -0.302 . . . . 0.0 111.502 179.282 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 142' ' ' GLU . . . . . . . . . . . . . 13.0 pt-20 -67.15 -24.6 65.91 Favored 'General case' 0 C--N 1.33 -0.242 0 CA-C-O 120.787 0.327 . . . . 0.0 111.493 -176.796 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 143' ' ' ASN . . . . . . . . . . . . . 37.8 m-80 -99.11 9.45 43.47 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-O 120.823 0.344 . . . . 0.0 110.408 177.791 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 144' ' ' ARG . . . . . . . . . . . . . 25.9 mtm180 59.47 50.93 6.99 Favored 'General case' 0 N--CA 1.463 0.196 0 CA-C-N 115.53 -0.759 . . . . 0.0 112.707 174.827 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 145' ' ' ALA . . . . . . . . . . . . . . . -101.99 -35.36 8.99 Favored 'General case' 0 C--N 1.323 -0.549 0 CA-C-O 121.446 0.641 . . . . 0.0 109.624 170.384 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 146' ' ' ILE . . . . . 0.631 ' O ' ' HA ' ' A' ' 141' ' ' ILE . 13.5 tt -144.32 158.34 15.25 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.458 0 N-CA-C 108.663 -0.865 . . . . 0.0 108.663 176.322 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 147' ' ' ASP . . . . . . . . . . . . . 7.8 p-10 -121.57 16.72 11.22 Favored 'General case' 0 C--N 1.324 -0.536 0 CA-C-O 121.002 0.429 . . . . 0.0 110.766 -177.992 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 148' ' ' PHE . . . . . 0.4 ' H ' HG12 ' A' ' 146' ' ' ILE . 67.6 t80 -135.55 137.6 42.18 Favored 'General case' 0 C--N 1.324 -0.531 0 CA-C-N 116.012 -0.54 . . . . 0.0 109.757 -176.609 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 149' ' ' ASN . . . . . . . . . . . . . 43.0 t-20 -115.47 89.69 22.92 Favored Pre-proline 0 C--N 1.324 -0.538 0 CA-C-N 116.558 -0.292 . . . . 0.0 110.557 -179.311 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 150' ' ' PRO . . . . . 0.453 ' HA ' ' HG3' ' A' ' 109' ' ' PRO . 28.1 Cg_exo -61.71 -32.12 86.48 Favored 'Trans proline' 0 C--N 1.345 0.382 0 C-N-CA 122.78 2.32 . . . . 0.0 111.861 -179.208 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 151' ' ' ALA . . . . . . . . . . . . . . . -67.53 -30.57 70.27 Favored 'General case' 0 C--N 1.326 -0.445 0 CA-C-N 115.768 -0.651 . . . . 0.0 110.969 -177.932 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 152' ' ' ASP . . . . . 0.531 ' HA ' ' CZ ' ' A' ' 130' ' ' ARG . 33.6 t70 -77.03 -22.3 53.24 Favored 'General case' 0 C--N 1.326 -0.447 0 CA-C-O 121.419 0.628 . . . . 0.0 110.159 179.912 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 153' ' ' TYR . . . . . . . . . . . . . 29.6 t80 -85.14 -1.47 56.92 Favored 'General case' 0 C--N 1.324 -0.519 0 CA-C-N 115.562 -0.744 . . . . 0.0 109.786 178.997 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 154' ' ' VAL . . . . . . . . . . . . . 86.8 t -70.82 118.61 15.7 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.316 0 CA-C-N 115.959 -0.564 . . . . 0.0 109.499 173.412 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 155' ' ' ARG . . . . . . . . . . . . . 28.5 ttt85 -84.68 111.57 19.69 Favored 'General case' 0 C--N 1.319 -0.724 0 CA-C-N 116.115 -0.493 . . . . 0.0 110.355 -176.98 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 156' ' ' ILE . . . . . 0.495 HG21 ' HG2' ' A' ' 127' ' ' LYS . 47.6 mm -89.53 120.64 69.6 Favored Pre-proline 0 C--N 1.324 -0.505 0 CA-C-N 115.604 -0.726 . . . . 0.0 110.109 -178.727 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 157' ' ' PRO . . . . . 0.421 ' HD3' ' HA ' ' A' ' 156' ' ' ILE . 6.5 Cg_exo . . . . . 0 N--CA 1.453 -0.861 0 C-N-CA 122.298 1.999 . . . . 0.0 111.123 177.376 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 63' ' ' SER . . . . . 0.537 ' HA ' ' HA ' ' A' ' 103' ' ' SER . 7.6 m . . . . . 0 N--CA 1.454 -0.252 0 N-CA-C 109.844 -0.428 . . . . 0.0 109.844 . . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 64' ' ' PHE . . . . . 0.525 ' HB2' HD12 ' A' ' 107' ' ' ILE . 84.1 t80 -64.42 -42.52 95.99 Favored 'General case' 0 C--N 1.326 -0.455 0 N-CA-C 109.834 -0.432 . . . . 0.0 109.834 178.639 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 65' ' ' GLY . . . . . . . . . . . . . . . -62.8 -29.43 73.97 Favored Glycine 0 N--CA 1.45 -0.424 0 C-N-CA 120.784 -0.722 . . . . 0.0 112.083 176.137 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 66' ' ' ASP . . . . . . . . . . . . . 20.1 t70 -68.04 -48.13 66.5 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-O 120.837 0.351 . . . . 0.0 110.083 177.386 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 67' ' ' TRP . . . . . . . . . . . . . 52.8 m95 -70.99 -30.49 66.76 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 115.94 -0.573 . . . . 0.0 111.573 178.497 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 68' ' ' ALA . . . . . 0.496 ' O ' ' HG ' ' A' ' 72' ' ' LEU . . . -60.01 -49.34 78.04 Favored 'General case' 0 C--N 1.328 -0.359 0 N-CA-C 109.812 -0.44 . . . . 0.0 109.812 173.813 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 69' ' ' GLU . . . . . . . . . . . . . 5.6 mm-40 -58.19 -41.72 84.54 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 115.976 -0.556 . . . . 0.0 110.843 175.918 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 70' ' ' LYS . . . . . . . . . . . . . 61.6 tttm -62.45 -47.93 81.89 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.3 -0.409 . . . . 0.0 110.219 179.299 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 71' ' ' PHE . . . . . . . . . . . . . 33.7 t80 -59.56 -49.61 77.12 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 115.96 -0.564 . . . . 0.0 110.742 176.955 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 72' ' ' LEU . . . . . 0.496 ' HG ' ' O ' ' A' ' 68' ' ' ALA . 91.6 mt -61.01 -35.74 77.67 Favored 'General case' 0 C--N 1.327 -0.401 0 CA-C-N 116.281 -0.418 . . . . 0.0 111.154 -178.918 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 73' ' ' LYS . . . . . . . . . . . . . 61.8 mmtt -72.45 -41.64 65.89 Favored 'General case' 0 C--N 1.327 -0.376 0 C-N-CA 121.234 -0.186 . . . . 0.0 111.379 178.52 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 74' ' ' SER . . . . . . . . . . . . . 12.3 p -68.17 -29.43 68.31 Favored 'General case' 0 C--N 1.327 -0.396 0 CA-C-O 120.956 0.408 . . . . 0.0 110.399 177.139 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 75' ' ' LYS . . . . . . . . . . . . . 45.5 tptt -78.22 -31.43 49.36 Favored 'General case' 0 N--CA 1.446 -0.666 0 CA-C-O 121.085 0.469 . . . . 0.0 110.028 177.154 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 76' ' ' GLU . . . . . . . . . . . . . 37.1 tt0 -63.78 -40.34 96.44 Favored 'General case' 0 C--N 1.326 -0.431 0 CA-C-N 115.768 -0.651 . . . . 0.0 109.863 175.485 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 77' ' ' ALA . . . . . . . . . . . . . . . -80.02 -18.02 51.28 Favored 'General case' 0 C--N 1.327 -0.412 0 CA-C-N 115.891 -0.595 . . . . 0.0 111.123 176.318 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 78' ' ' ASP . . . . . . . . . . . . . 28.5 t70 -68.45 -21.41 64.65 Favored 'General case' 0 N--CA 1.465 0.3 0 CA-C-N 115.913 -0.585 . . . . 0.0 110.538 178.771 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 79' ' ' GLY . . . . . . . . . . . . . . . 102.51 71.26 0.89 Allowed Glycine 0 N--CA 1.447 -0.622 0 C-N-CA 120.734 -0.746 . . . . 0.0 112.276 177.387 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 80' ' ' VAL . . . . . . . . . . . . . 28.0 m -123.87 148.62 27.93 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.5 0 CA-C-O 121.083 0.468 . . . . 0.0 110.763 179.765 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 81' ' ' SER . . . . . . . . . . . . . 14.6 m -75.9 162.46 28.1 Favored 'General case' 0 C--N 1.322 -0.618 0 CA-C-N 115.649 -0.705 . . . . 0.0 109.941 177.093 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 82' ' ' VAL . . . . . . . . . . . . . 57.0 t -58.12 -45.23 88.58 Favored 'Isoleucine or valine' 0 C--O 1.222 -0.375 0 CA-C-N 116.414 -0.357 . . . . 0.0 111.195 -176.566 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 83' ' ' SER . . . . . . . . . . . . . 17.2 t -65.46 -32.65 74.37 Favored 'General case' 0 C--N 1.326 -0.419 0 CA-C-O 120.874 0.368 . . . . 0.0 111.272 -177.955 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 84' ' ' GLN . . . . . . . . . . . . . 8.7 tp-100 -69.85 -42.61 73.33 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-O 121.074 0.464 . . . . 0.0 110.314 179.258 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 85' ' ' LEU . . . . . . . . . . . . . 25.5 tp -75.07 -26.73 59.57 Favored 'General case' 0 C--N 1.321 -0.641 0 CA-C-O 121.282 0.563 . . . . 0.0 109.924 178.556 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 86' ' ' ASN . . . . . . . . . . . . . 26.5 t-20 -64.54 -47.7 77.81 Favored 'General case' 0 C--N 1.325 -0.464 0 CA-C-N 115.314 -0.857 . . . . 0.0 110.454 176.498 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 87' ' ' SER . . . . . . . . . . . . . 11.3 p -65.14 -35.89 82.55 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.295 -0.411 . . . . 0.0 110.623 179.75 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 88' ' ' TYR . . . . . . . . . . . . . 11.5 m-85 -57.99 -43.77 86.78 Favored 'General case' 0 C--O 1.234 0.28 0 CA-C-O 120.858 0.361 . . . . 0.0 110.393 174.265 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 89' ' ' LYS . . . . . . . . . . . . . 63.9 mttp -62.69 -38.57 90.92 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 116.044 -0.525 . . . . 0.0 110.605 176.617 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 90' ' ' ASN . . . . . . . . . . . . . 95.4 m-20 -62.64 -42.94 99.88 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.201 -0.454 . . . . 0.0 111.242 -178.9 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 91' ' ' TYR . . . . . . . . . . . . . 43.3 m-85 -59.25 -45.67 90.56 Favored 'General case' 0 C--O 1.235 0.334 0 CA-C-O 121.09 0.471 . . . . 0.0 110.14 177.217 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 92' ' ' CYS . . . . . 0.587 ' HA ' ' HB2' ' A' ' 96' ' ' LEU . 57.9 m -71.45 -43.52 66.53 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 115.626 -0.715 . . . . 0.0 112.014 -175.552 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 93' ' ' ARG . . . . . . . . . . . . . 18.8 mtp180 -84.58 -7.77 59.14 Favored 'General case' 0 C--N 1.325 -0.457 0 N-CA-C 112.454 0.538 . . . . 0.0 112.454 -173.576 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 94' ' ' ASN . . . . . . . . . . . . . 12.3 t-20 -111.1 -61.26 1.72 Allowed 'General case' 0 C--N 1.328 -0.355 0 CA-C-O 120.769 0.319 . . . . 0.0 111.859 179.006 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 95' ' ' HIS . . . . . . . . . . . . . 0.2 OUTLIER -87.67 -34.57 18.39 Favored 'General case' 0 C--N 1.324 -0.531 0 N-CA-C 112.363 0.505 . . . . 0.0 112.363 -175.473 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 96' ' ' LEU . . . . . 0.587 ' HB2' ' HA ' ' A' ' 92' ' ' CYS . 85.4 mt -91.65 12.45 21.05 Favored 'General case' 0 C--N 1.324 -0.507 0 C-N-CA 121.215 -0.194 . . . . 0.0 111.212 -176.809 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 97' ' ' SER . . . . . 0.509 ' N ' ' HD2' ' A' ' 98' ' ' PRO . 18.6 m -50.85 -50.2 75.46 Favored Pre-proline 0 CA--C 1.539 0.541 0 N-CA-C 112.284 0.476 . . . . 0.0 112.284 179.483 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 98' ' ' PRO . . . . . 0.509 ' HD2' ' N ' ' A' ' 97' ' ' SER . 13.8 Cg_endo -58.09 -41.33 68.85 Favored 'Trans proline' 0 C--N 1.358 1.034 0 C-N-CA 121.962 1.775 . . . . 0.0 112.585 177.622 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 99' ' ' LEU . . . . . . . . . . . . . 11.2 mp -79.8 -29.74 40.37 Favored 'General case' 0 C--N 1.326 -0.416 0 CA-C-N 116.459 -0.337 . . . . 0.0 111.801 -174.972 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 100' ' ' TYR . . . . . . . . . . . . . 46.3 t80 -52.74 -40.73 63.35 Favored 'General case' 0 C--N 1.328 -0.349 0 C-N-CA 122.795 0.438 . . . . 0.0 111.434 -176.738 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 101' ' ' MET . . . . . . . . . . . . . 64.5 mtt -89.94 -0.53 57.62 Favored 'General case' 0 C--N 1.325 -0.469 0 CA-C-N 116.258 -0.428 . . . . 0.0 111.69 -176.755 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 102' ' ' LYS . . . . . 0.453 ' HG3' ' O ' ' A' ' 98' ' ' PRO . 97.3 mttt -91.13 161.89 14.9 Favored 'General case' 0 C--N 1.326 -0.444 0 CA-C-O 121.047 0.451 . . . . 0.0 110.438 179.493 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 103' ' ' SER . . . . . 0.537 ' HA ' ' HA ' ' A' ' 63' ' ' SER . 29.0 t -82.12 154.87 25.33 Favored 'General case' 0 N--CA 1.447 -0.598 0 N-CA-C 108.881 -0.785 . . . . 0.0 108.881 172.423 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 104' ' ' LEU . . . . . . . . . . . . . 23.6 tp -61.62 -25.35 67.3 Favored 'General case' 0 C--N 1.321 -0.671 0 CA-C-O 121.092 0.473 . . . . 0.0 110.4 -179.041 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 105' ' ' SER . . . . . . . . . . . . . 35.5 t -86.27 -14.4 43.87 Favored 'General case' 0 C--N 1.327 -0.377 0 CA-C-N 116.003 -0.544 . . . . 0.0 111.375 178.855 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 106' ' ' GLU . . . . . 0.521 ' HG3' ' HB3' ' A' ' 103' ' ' SER . 49.4 mt-10 -93.03 4.72 53.52 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-O 120.861 0.362 . . . . 0.0 111.113 -177.258 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 107' ' ' ILE . . . . . 0.54 HG21 ' HZ ' ' A' ' 137' ' ' PHE . 74.7 mt -95.81 118.13 41.42 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.756 0 CA-C-O 121.23 0.538 . . . . 0.0 111.035 -177.456 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 108' ' ' LEU . . . . . . . . . . . . . 7.6 mp -97.05 138.88 21.27 Favored Pre-proline 0 C--N 1.323 -0.582 0 CA-C-N 115.364 -0.835 . . . . 0.0 110.038 -179.992 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 109' ' ' PRO . . . . . . . . . . . . . 11.2 Cg_endo -56.7 -35.74 97.82 Favored 'Trans proline' 0 C--O 1.234 0.322 0 C-N-CA 122.63 2.22 . . . . 0.0 112.268 177.404 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 110' ' ' ALA . . . . . . . . . . . . . . . -70.61 -29.67 66.13 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.236 -0.438 . . . . 0.0 111.232 179.788 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 111' ' ' ASP . . . . . . . . . . . . . 33.2 t70 -68.27 -41.52 80.92 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-O 121.073 0.463 . . . . 0.0 110.048 179.997 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 112' ' ' ILE . . . . . . . . . . . . . 18.7 mt -67.1 -43.04 88.99 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.355 0 CA-C-N 115.809 -0.632 . . . . 0.0 109.698 176.385 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 113' ' ' GLN . . . . . 0.574 ' HG2' ' HA ' ' A' ' 154' ' ' VAL . 0.0 OUTLIER -55.16 -41.62 72.1 Favored 'General case' 0 C--O 1.233 0.211 0 CA-C-N 115.627 -0.715 . . . . 0.0 111.023 176.568 . . . . . . . . 3 3 . 1 . 018 nuclear orig core ' A' A ' 114' ' ' SER . . . . . . . . . . . . . 14.3 t -59.75 -46.54 88.85 Favored 'General case' 0 N--CA 1.453 -0.319 0 CA-C-N 116.101 -0.5 . . . . 0.0 110.387 178.889 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 115' ' ' ILE . . . . . . . . . . . . . 69.3 mt -55.88 -51.93 54.91 Favored 'Isoleucine or valine' 0 C--O 1.233 0.225 0 CA-C-O 120.919 0.39 . . . . 0.0 110.918 -179.485 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 116' ' ' ILE . . . . . . . . . . . . . 49.8 mm -62.08 -39.38 83.6 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.322 0 CA-C-N 115.902 -0.59 . . . . 0.0 111.225 -178.421 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 117' ' ' ASN . . . . . 0.41 ' C ' HD21 ' A' ' 117' ' ' ASN . 0.2 OUTLIER -69.81 -39.27 76.62 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-O 120.929 0.395 . . . . 0.0 110.503 -178.873 . . . . . . . . 3 3 . 1 . 018 nuclear orig core ' A' A ' 118' ' ' GLU . . . . . . . . . . . . . 49.5 mt-10 -80.76 -8.7 59.75 Favored 'General case' 0 C--N 1.327 -0.374 0 CA-C-N 116.368 -0.378 . . . . 0.0 111.271 -177.192 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 119' ' ' THR . . . . . . . . . . . . . 89.5 m -89.88 123.47 33.85 Favored 'General case' 0 C--N 1.326 -0.438 0 CA-C-O 120.834 0.349 . . . . 0.0 110.912 176.17 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 120' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -98.9 80.52 2.51 Favored 'General case' 0 C--N 1.326 -0.443 0 CA-C-O 121.041 0.448 . . . . 0.0 110.692 178.358 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 121' ' ' LEU . . . . . . . . . . . . . 65.1 mt -132.54 -175.77 3.87 Favored 'General case' 0 C--N 1.324 -0.543 0 CA-C-N 115.713 -0.676 . . . . 0.0 109.747 178.463 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 122' ' ' ALA . . . . . . . . . . . . . . . -72.6 146.04 46.92 Favored 'General case' 0 C--N 1.325 -0.499 0 CA-C-N 116.434 -0.348 . . . . 0.0 110.33 177.722 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 123' ' ' LYS . . . . . 0.513 ' O ' ' HG3' ' A' ' 127' ' ' LYS . 59.6 pttt -58.54 -29.53 66.41 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-O 120.844 0.354 . . . . 0.0 110.915 -179.71 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 124' ' ' ASN . . . . . . . . . . . . . 14.4 m120 -68.34 -40.47 81.56 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.178 -0.465 . . . . 0.0 110.48 178.642 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 125' ' ' THR . . . . . . . . . . . . . 6.2 m -67.67 -35.76 79.46 Favored 'General case' 0 C--N 1.327 -0.378 0 CA-C-N 116.095 -0.502 . . . . 0.0 110.219 179.273 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 126' ' ' LEU . . . . . . . . . . . . . 90.7 mt -64.72 -37.17 86.7 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 115.885 -0.598 . . . . 0.0 110.493 178.068 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 127' ' ' LYS . . . . . 0.513 ' HG3' ' O ' ' A' ' 123' ' ' LYS . 97.7 mttt -68.58 -28.87 67.33 Favored 'General case' 0 C--N 1.332 -0.192 0 CA-C-N 116.092 -0.503 . . . . 0.0 110.835 178.032 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 128' ' ' ALA . . . . . . . . . . . . . . . -65.79 -43.86 87.45 Favored 'General case' 0 C--N 1.327 -0.378 0 CA-C-O 120.981 0.42 . . . . 0.0 110.492 176.606 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 129' ' ' ILE . . . . . . . . . . . . . 47.9 mt -64.71 -47.08 90.22 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.221 0 CA-C-N 115.909 -0.587 . . . . 0.0 109.773 176.166 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 130' ' ' ARG . . . . . . . . . . . . . 5.5 tpt180 -52.87 -45.05 67.28 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 115.587 -0.733 . . . . 0.0 110.882 174.768 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 131' ' ' ASN . . . . . . . . . . . . . 10.5 t30 -61.97 -55.95 24.15 Favored 'General case' 0 C--N 1.326 -0.445 0 CA-C-N 116.144 -0.48 . . . . 0.0 111.744 -176.872 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 132' ' ' THR . . . . . 0.411 ' O ' HG13 ' A' ' 136' ' ' ILE . 14.9 t -65.59 -33.03 74.96 Favored 'General case' 0 CA--C 1.531 0.222 0 C-N-CA 120.84 -0.344 . . . . 0.0 110.938 -175.371 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 133' ' ' ALA . . . . . . . . . . . . . . . -69.75 -46.39 65.97 Favored 'General case' 0 C--N 1.331 -0.205 0 CA-C-O 120.919 0.39 . . . . 0.0 110.515 178.358 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 134' ' ' SER . . . . . . . . . . . . . 22.9 t -61.0 -37.67 83.32 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 115.893 -0.594 . . . . 0.0 110.27 -179.977 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 135' ' ' GLN . . . . . . . . . . . . . 1.1 mp0 -59.08 -45.34 91.08 Favored 'General case' 0 C--N 1.331 -0.232 0 CA-C-N 116.401 -0.363 . . . . 0.0 111.042 176.489 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 136' ' ' ILE . . . . . 0.411 HG13 ' O ' ' A' ' 132' ' ' THR . 73.1 mt -65.03 -47.79 86.55 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.296 0 CA-C-O 120.904 0.383 . . . . 0.0 110.691 179.017 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 137' ' ' PHE . . . . . 0.54 ' HZ ' HG21 ' A' ' 107' ' ' ILE . 41.8 m-85 -62.28 -47.06 85.98 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 116.195 -0.457 . . . . 0.0 111.696 -179.645 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 138' ' ' ARG . . . . . 0.406 ' O ' ' HG2' ' A' ' 142' ' ' GLU . 11.3 ptm180 -74.05 -21.03 60.1 Favored 'General case' 0 C--N 1.327 -0.385 0 C-N-CA 120.538 -0.465 . . . . 0.0 110.853 -176.39 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 139' ' ' LEU . . . . . . . . . . . . . 62.6 tp -63.59 -41.8 98.32 Favored 'General case' 0 C--O 1.234 0.266 0 N-CA-C 109.232 -0.655 . . . . 0.0 109.232 173.256 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 140' ' ' ALA . . . . . 0.498 ' HB2' ' HB3' ' A' ' 145' ' ' ALA . . . -65.24 -32.57 74.31 Favored 'General case' 0 C--N 1.326 -0.429 0 CA-C-N 115.495 -0.775 . . . . 0.0 110.152 176.211 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 141' ' ' ILE . . . . . . . . . . . . . 60.4 mt -64.94 -44.16 96.15 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.29 0 CA-C-N 116.233 -0.44 . . . . 0.0 110.191 175.653 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 142' ' ' GLU . . . . . 0.406 ' HG2' ' O ' ' A' ' 138' ' ' ARG . 34.3 mm-40 -63.33 -29.31 70.64 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-O 121.088 0.471 . . . . 0.0 110.716 177.71 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 143' ' ' ASN . . . . . 0.465 HD21 ' N ' ' A' ' 143' ' ' ASN . 0.9 OUTLIER -93.23 0.85 57.2 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.064 -0.517 . . . . 0.0 111.003 -179.031 . . . . . . . . 3 3 . 1 . 018 nuclear orig core ' A' A ' 144' ' ' ARG . . . . . . . . . . . . . 35.1 mtp85 57.47 36.0 26.5 Favored 'General case' 0 N--CA 1.464 0.26 0 CA-C-N 115.752 -0.658 . . . . 0.0 112.272 -178.933 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 145' ' ' ALA . . . . . 0.498 ' HB3' ' HB2' ' A' ' 140' ' ' ALA . . . -82.29 -33.73 28.97 Favored 'General case' 0 C--N 1.325 -0.5 0 N-CA-C 109.268 -0.641 . . . . 0.0 109.268 173.357 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 146' ' ' ILE . . . . . . . . . . . . . 9.8 tt -159.22 125.63 0.54 Allowed 'Isoleucine or valine' 0 C--N 1.324 -0.526 0 CA-C-N 114.873 -1.058 . . . . 0.0 109.433 178.998 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 147' ' ' ASP . . . . . . . . . . . . . 20.9 t70 -99.1 68.46 1.68 Allowed 'General case' 0 C--N 1.319 -0.738 0 CA-C-O 121.662 0.744 . . . . 0.0 109.624 178.575 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 148' ' ' PHE . . . . . 0.465 ' O ' ' HD3' ' A' ' 150' ' ' PRO . 55.8 t80 -169.38 126.44 0.92 Allowed 'General case' 0 C--N 1.321 -0.667 0 CA-C-N 115.086 -0.961 . . . . 0.0 109.178 -179.158 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 149' ' ' ASN . . . . . . . . . . . . . 48.8 t-20 -108.52 95.96 17.85 Favored Pre-proline 0 C--N 1.323 -0.57 0 N-CA-C 110.076 -0.342 . . . . 0.0 110.076 179.272 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 150' ' ' PRO . . . . . 0.465 ' HD3' ' O ' ' A' ' 148' ' ' PHE . 21.6 Cg_exo -65.34 -26.37 56.04 Favored 'Trans proline' 0 C--N 1.342 0.229 0 C-N-CA 122.756 2.304 . . . . 0.0 112.03 -179.626 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 151' ' ' ALA . . . . . . . . . . . . . . . -72.6 -20.38 61.31 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 115.941 -0.572 . . . . 0.0 110.806 -178.032 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 152' ' ' ASP . . . . . . . . . . . . . 28.3 t70 -70.76 -24.91 62.69 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-O 121.089 0.471 . . . . 0.0 110.149 178.488 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 153' ' ' TYR . . . . . . . . . . . . . 58.8 m-85 -83.86 -1.47 54.5 Favored 'General case' 0 C--N 1.327 -0.374 0 CA-C-N 115.772 -0.649 . . . . 0.0 110.51 179.585 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 154' ' ' VAL . . . . . 0.574 ' HA ' ' HG2' ' A' ' 113' ' ' GLN . 55.9 t -88.74 111.52 22.72 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.504 0 CA-C-N 115.807 -0.633 . . . . 0.0 110.311 179.65 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 155' ' ' ARG . . . . . . . . . . . . . 83.9 mtm180 -83.99 141.24 31.35 Favored 'General case' 0 C--N 1.319 -0.742 0 CA-C-N 115.41 -0.814 . . . . 0.0 109.944 179.807 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 156' ' ' ILE . . . . . . . . . . . . . 50.7 mm -96.97 113.67 63.35 Favored Pre-proline 0 C--N 1.319 -0.741 0 N-CA-C 109.408 -0.59 . . . . 0.0 109.408 178.704 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 157' ' ' PRO . . . . . . . . . . . . . 28.4 Cg_exo . . . . . 0 N--CA 1.46 -0.444 0 C-N-CA 122.53 2.153 . . . . 0.0 112.196 -177.754 . . . . . . . . 0 0 . 1 . 019 nuclear orig core ' A' A ' 63' ' ' SER . . . . . . . . . . . . . 78.6 p . . . . . 0 N--CA 1.453 -0.321 0 N-CA-C 109.274 -0.639 . . . . 0.0 109.274 . . . . . . . . . 0 0 . 1 . 019 nuclear orig core ' A' A ' 64' ' ' PHE . . . . . 0.468 ' HB3' ' O ' ' A' ' 99' ' ' LEU . 74.6 t80 -63.45 -35.93 82.05 Favored 'General case' 0 C--N 1.327 -0.378 0 C-N-CA 120.862 -0.335 . . . . 0.0 110.384 -177.409 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 65' ' ' GLY . . . . . . . . . . . . . . . -60.0 -38.33 94.05 Favored Glycine 0 N--CA 1.452 -0.249 0 C-N-CA 120.964 -0.636 . . . . 0.0 112.411 178.072 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 66' ' ' ASP . . . . . . . . . . . . . 16.4 m-20 -65.8 -43.57 88.33 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-O 120.917 0.389 . . . . 0.0 110.417 -179.921 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 67' ' ' TRP . . . . . . . . . . . . . 98.7 m95 -73.02 -34.21 66.21 Favored 'General case' 0 C--N 1.326 -0.43 0 CA-C-N 115.938 -0.573 . . . . 0.0 111.026 179.675 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 68' ' ' ALA . . . . . 0.537 ' O ' ' HG ' ' A' ' 72' ' ' LEU . . . -61.02 -44.22 97.73 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-O 120.903 0.382 . . . . 0.0 110.101 175.564 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 69' ' ' GLU . . . . . . . . . . . . . 31.2 tt0 -59.75 -45.98 90.57 Favored 'General case' 0 C--O 1.232 0.14 0 CA-C-N 115.806 -0.634 . . . . 0.0 110.22 175.127 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 70' ' ' LYS . . . . . . . . . . . . . 51.5 tttp -57.69 -42.95 84.69 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-N 115.541 -0.754 . . . . 0.0 110.442 179.326 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 71' ' ' PHE . . . . . . . . . . . . . 77.9 t80 -62.31 -49.99 73.44 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-N 115.77 -0.65 . . . . 0.0 110.627 176.525 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 72' ' ' LEU . . . . . 0.537 ' HG ' ' O ' ' A' ' 68' ' ' ALA . 93.4 mt -56.57 -41.54 77.08 Favored 'General case' 0 C--N 1.327 -0.379 0 CA-C-N 116.163 -0.472 . . . . 0.0 110.794 -179.915 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 73' ' ' LYS . . . . . 0.409 ' HA ' ' HB3' ' A' ' 76' ' ' GLU . 36.9 tttp -77.49 -28.45 52.21 Favored 'General case' 0 C--N 1.324 -0.514 0 CA-C-N 116.024 -0.535 . . . . 0.0 111.441 -175.963 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 74' ' ' SER . . . . . 0.41 ' O ' ' HB2' ' A' ' 78' ' ' ASP . 95.3 p -65.67 -31.43 72.44 Favored 'General case' 0 C--N 1.33 -0.262 0 C-N-CA 120.493 -0.483 . . . . 0.0 109.988 178.254 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 75' ' ' LYS . . . . . . . . . . . . . 0.8 OUTLIER -79.32 -42.0 26.7 Favored 'General case' 0 C--O 1.234 0.262 0 CA-C-N 116.444 -0.344 . . . . 0.0 110.509 173.606 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 76' ' ' GLU . . . . . 0.409 ' HB3' ' HA ' ' A' ' 73' ' ' LYS . 42.8 tt0 -52.43 -50.16 63.12 Favored 'General case' 0 CA--C 1.532 0.261 0 CA-C-N 116.137 -0.483 . . . . 0.0 110.776 175.307 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 77' ' ' ALA . . . . . . . . . . . . . . . -73.79 -30.13 62.57 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 115.958 -0.565 . . . . 0.0 111.726 -178.94 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 78' ' ' ASP . . . . . 0.41 ' HB2' ' O ' ' A' ' 74' ' ' SER . 16.1 t70 -62.03 -40.53 96.03 Favored 'General case' 0 N--CA 1.464 0.237 0 CA-C-O 120.985 0.421 . . . . 0.0 110.436 179.802 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 79' ' ' GLY . . . . . . . . . . . . . . . 121.01 33.26 0.99 Allowed Glycine 0 N--CA 1.447 -0.582 0 C-N-CA 120.702 -0.761 . . . . 0.0 113.269 176.291 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 80' ' ' VAL . . . . . . . . . . . . . 24.3 m -81.22 147.01 6.58 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.451 0 N-CA-C 109.894 -0.41 . . . . 0.0 109.894 176.471 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 81' ' ' SER . . . . . . . . . . . . . 23.2 t -68.14 155.58 39.31 Favored 'General case' 0 C--N 1.321 -0.649 0 CA-C-O 120.939 0.399 . . . . 0.0 110.952 -178.071 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 82' ' ' VAL . . . . . . . . . . . . . 7.5 p -56.8 -33.93 42.27 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.24 0 CA-C-N 115.769 -0.65 . . . . 0.0 111.457 -177.893 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 83' ' ' SER . . . . . . . . . . . . . 16.0 m -60.65 -39.62 89.0 Favored 'General case' 0 C--O 1.235 0.299 0 CA-C-O 121.061 0.458 . . . . 0.0 110.592 178.347 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 84' ' ' GLN . . . . . . . . . . . . . 5.8 tp-100 -76.01 -39.36 55.93 Favored 'General case' 0 C--N 1.327 -0.392 0 CA-C-N 116.175 -0.466 . . . . 0.0 109.912 -179.909 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 85' ' ' LEU . . . . . 0.427 HD23 ' HA ' ' A' ' 85' ' ' LEU . 0.3 OUTLIER -63.03 -40.23 97.12 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.06 -0.518 . . . . 0.0 109.932 178.548 . . . . . . . . 3 3 . 1 . 019 nuclear orig core ' A' A ' 86' ' ' ASN . . . . . 0.563 ' HA ' ' HD2' ' A' ' 89' ' ' LYS . 80.2 m-20 -62.58 -37.51 86.46 Favored 'General case' 0 CA--C 1.516 -0.338 0 CA-C-N 116.018 -0.537 . . . . 0.0 110.918 176.201 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 87' ' ' SER . . . . . . . . . . . . . 9.6 t -60.8 -41.82 96.39 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-O 120.888 0.375 . . . . 0.0 110.07 178.435 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 88' ' ' TYR . . . . . . . . . . . . . 34.0 m-85 -60.43 -34.43 73.96 Favored 'General case' 0 C--N 1.332 -0.171 0 CA-C-N 116.05 -0.523 . . . . 0.0 110.755 176.681 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 89' ' ' LYS . . . . . 0.563 ' HD2' ' HA ' ' A' ' 86' ' ' ASN . 56.3 mttm -63.88 -39.35 93.98 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.377 -0.374 . . . . 0.0 110.504 176.255 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 90' ' ' ASN . . . . . . . . . . . . . 23.9 m120 -60.0 -34.84 73.88 Favored 'General case' 0 C--O 1.233 0.228 0 CA-C-O 121.061 0.458 . . . . 0.0 110.495 177.164 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 91' ' ' TYR . . . . . . . . . . . . . 31.3 m-85 -80.75 -62.9 1.53 Allowed 'General case' 0 C--N 1.325 -0.467 0 CA-C-N 116.251 -0.431 . . . . 0.0 110.841 179.295 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 92' ' ' CYS . . . . . 0.417 ' HA ' ' HB2' ' A' ' 96' ' ' LEU . 70.2 m -68.54 -49.53 58.79 Favored 'General case' 0 C--N 1.324 -0.502 0 N-CA-C 112.595 0.591 . . . . 0.0 112.595 -171.4 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 93' ' ' ARG . . . . . 0.539 ' HD3' ' O ' ' A' ' 93' ' ' ARG . 0.7 OUTLIER -83.21 -38.41 22.3 Favored 'General case' 0 C--N 1.32 -0.708 0 C-N-CA 120.681 -0.408 . . . . 0.0 111.069 -171.639 . . . . . . . . 3 3 . 1 . 019 nuclear orig core ' A' A ' 94' ' ' ASN . . . . . . . . . . . . . 6.7 t30 -91.8 -41.49 10.63 Favored 'General case' 0 C--N 1.326 -0.431 0 N-CA-C 112.172 0.434 . . . . 0.0 112.172 -172.72 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 95' ' ' HIS . . . . . . . . . . . . . 45.6 m80 -88.7 -49.43 6.86 Favored 'General case' 0 C--N 1.328 -0.343 0 N-CA-C 112.069 0.396 . . . . 0.0 112.069 178.678 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 96' ' ' LEU . . . . . 0.536 ' HG ' HD12 ' A' ' 99' ' ' LEU . 9.9 mp -84.91 26.69 0.82 Allowed 'General case' 0 C--N 1.324 -0.507 0 CA-C-N 116.318 -0.401 . . . . 0.0 111.214 -175.743 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 97' ' ' SER . . . . . 0.496 ' N ' ' HD2' ' A' ' 98' ' ' PRO . 5.2 m -53.96 -52.05 71.58 Favored Pre-proline 0 CA--C 1.538 0.498 0 CA-C-N 116.174 -0.467 . . . . 0.0 112.167 -178.762 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 98' ' ' PRO . . . . . 0.496 ' HD2' ' N ' ' A' ' 97' ' ' SER . 18.8 Cg_endo -59.6 -38.27 83.15 Favored 'Trans proline' 0 C--N 1.355 0.92 0 C-N-CA 121.814 1.676 . . . . 0.0 112.142 178.162 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 99' ' ' LEU . . . . . 0.536 HD12 ' HG ' ' A' ' 96' ' ' LEU . 65.4 mt -69.26 -25.31 64.21 Favored 'General case' 0 C--N 1.327 -0.391 0 CA-C-N 116.103 -0.499 . . . . 0.0 111.157 -176.094 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 100' ' ' TYR . . . . . . . . . . . . . 0.2 OUTLIER -58.05 -34.13 69.76 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.361 -0.381 . . . . 0.0 111.449 179.784 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 101' ' ' MET . . . . . . . . . . . . . 23.8 ttt -98.08 2.99 49.28 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-O 121.499 0.666 . . . . 0.0 110.472 -178.773 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 102' ' ' LYS . . . . . 0.579 ' HB3' ' OE2' ' A' ' 106' ' ' GLU . 8.5 mtpm? -102.98 167.67 9.69 Favored 'General case' 0 C--N 1.322 -0.6 0 CA-C-N 115.872 -0.604 . . . . 0.0 110.277 -179.133 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 103' ' ' SER . . . . . 0.538 ' O ' HG13 ' A' ' 107' ' ' ILE . 44.3 m -110.14 136.03 50.0 Favored 'General case' 0 C--N 1.319 -0.723 0 N-CA-C 109.248 -0.649 . . . . 0.0 109.248 178.936 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 104' ' ' LEU . . . . . . . . . . . . . 1.6 pp -60.58 -13.43 14.18 Favored 'General case' 0 C--N 1.325 -0.487 0 N-CA-C 112.541 0.571 . . . . 0.0 112.541 -175.167 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 105' ' ' SER . . . . . . . . . . . . . 35.3 t -87.08 -14.61 40.92 Favored 'General case' 0 C--N 1.327 -0.404 0 CA-C-N 116.518 -0.31 . . . . 0.0 110.882 178.296 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 106' ' ' GLU . . . . . 0.579 ' OE2' ' HB3' ' A' ' 102' ' ' LYS . 0.8 OUTLIER -123.02 12.44 9.66 Favored 'General case' 0 CA--C 1.532 0.271 0 CA-C-O 121.162 0.506 . . . . 0.0 111.077 179.283 . . . . . . . . 3 3 . 1 . 019 nuclear orig core ' A' A ' 107' ' ' ILE . . . . . 0.538 HG13 ' O ' ' A' ' 103' ' ' SER . 77.4 mt -90.06 121.66 40.55 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.276 0 CA-C-N 116.018 -0.537 . . . . 0.0 109.884 173.607 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 108' ' ' LEU . . . . . . . . . . . . . 7.6 mp -85.48 147.52 47.02 Favored Pre-proline 0 C--N 1.323 -0.576 0 CA-C-N 116.105 -0.498 . . . . 0.0 110.723 -178.997 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 109' ' ' PRO . . . . . 0.411 ' HB3' ' HB2' ' A' ' 153' ' ' TYR . 35.2 Cg_exo -59.32 -31.61 95.33 Favored 'Trans proline' 0 N--CA 1.465 -0.191 0 C-N-CA 122.551 2.167 . . . . 0.0 111.249 174.136 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 110' ' ' ALA . . . . . . . . . . . . . . . -75.82 -20.91 57.81 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 115.742 -0.663 . . . . 0.0 111.108 179.129 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 111' ' ' ASP . . . . . . . . . . . . . 23.5 t0 -71.83 -48.49 45.8 Favored 'General case' 0 C--N 1.327 -0.413 0 N-CA-C 109.009 -0.737 . . . . 0.0 109.009 178.222 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 112' ' ' ILE . . . . . . . . . . . . . 46.4 mt -63.76 -38.49 82.44 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.284 0 CA-C-N 115.345 -0.843 . . . . 0.0 109.624 173.895 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 113' ' ' GLN . . . . . . . . . . . . . 27.2 tp60 -53.86 -44.49 70.4 Favored 'General case' 0 C--N 1.33 -0.241 0 CA-C-N 115.32 -0.855 . . . . 0.0 110.584 176.743 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 114' ' ' SER . . . . . . . . . . . . . 45.0 m -59.11 -46.61 87.86 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 115.821 -0.627 . . . . 0.0 110.509 178.898 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 115' ' ' ILE . . . . . . . . . . . . . 66.2 mt -56.86 -49.64 78.13 Favored 'Isoleucine or valine' 0 C--O 1.234 0.248 0 CA-C-O 120.967 0.413 . . . . 0.0 110.855 177.921 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 116' ' ' ILE . . . . . 0.42 HG13 HG13 ' A' ' 154' ' ' VAL . 47.6 mm -57.59 -42.44 81.27 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.262 0 CA-C-N 115.892 -0.594 . . . . 0.0 111.245 -179.886 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 117' ' ' ASN . . . . . . . . . . . . . 13.2 m120 -71.37 -30.93 66.74 Favored 'General case' 0 C--N 1.326 -0.451 0 CA-C-N 116.328 -0.396 . . . . 0.0 111.438 -176.991 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 118' ' ' GLU . . . . . . . . . . . . . 43.0 mt-10 -89.33 -5.26 57.67 Favored 'General case' 0 C--N 1.326 -0.428 0 CA-C-O 120.735 0.303 . . . . 0.0 111.279 -178.362 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 119' ' ' THR . . . . . . . . . . . . . 98.3 m -79.32 112.37 16.48 Favored 'General case' 0 C--N 1.323 -0.587 0 CA-C-O 121.078 0.466 . . . . 0.0 111.009 176.59 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 120' ' ' LYS . . . . . . . . . . . . . 69.6 mmtt -94.37 83.03 4.11 Favored 'General case' 0 C--N 1.325 -0.487 0 CA-C-N 116.31 -0.405 . . . . 0.0 110.121 176.289 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 121' ' ' LEU . . . . . 0.461 HD12 HG23 ' A' ' 125' ' ' THR . 77.8 mt -145.46 -175.35 4.68 Favored 'General case' 0 C--N 1.323 -0.564 0 CA-C-N 115.744 -0.662 . . . . 0.0 109.768 179.938 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 122' ' ' ALA . . . . . . . . . . . . . . . -62.66 149.49 43.43 Favored 'General case' 0 C--N 1.324 -0.525 0 CA-C-N 116.488 -0.324 . . . . 0.0 110.978 178.565 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 123' ' ' LYS . . . . . . . . . . . . . 17.8 ptpt -61.65 -30.96 71.06 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.132 -0.485 . . . . 0.0 111.475 -177.174 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 124' ' ' ASN . . . . . . . . . . . . . 9.6 t30 -66.29 -40.46 90.05 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-O 120.69 0.281 . . . . 0.0 110.436 176.15 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 125' ' ' THR . . . . . 0.583 ' O ' HG13 ' A' ' 129' ' ' ILE . 53.9 m -64.14 -39.13 93.37 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 116.197 -0.456 . . . . 0.0 110.678 179.151 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 126' ' ' LEU . . . . . . . . . . . . . 89.3 mt -56.58 -48.73 76.77 Favored 'General case' 0 C--O 1.234 0.25 0 CA-C-O 121.254 0.55 . . . . 0.0 110.24 177.253 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 127' ' ' LYS . . . . . . . . . . . . . 98.4 mttt -63.76 -40.03 95.72 Favored 'General case' 0 C--N 1.327 -0.37 0 CA-C-N 115.434 -0.803 . . . . 0.0 110.614 177.535 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 128' ' ' ALA . . . . . . . . . . . . . . . -64.65 -34.66 78.81 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.104 -0.498 . . . . 0.0 111.661 -178.872 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 129' ' ' ILE . . . . . 0.583 HG13 ' O ' ' A' ' 125' ' ' THR . 78.0 mt -62.47 -50.45 79.8 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.282 0 CA-C-O 121.052 0.453 . . . . 0.0 109.951 176.254 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 130' ' ' ARG . . . . . 0.501 ' HD2' ' HB ' ' A' ' 154' ' ' VAL . 47.8 ttt180 -60.72 -44.3 96.78 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 115.693 -0.685 . . . . 0.0 110.472 176.072 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 131' ' ' ASN . . . . . . . . . . . . . 2.8 t-20 -56.24 -48.45 76.5 Favored 'General case' 0 C--N 1.326 -0.413 0 CA-C-N 115.889 -0.596 . . . . 0.0 110.518 178.295 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 132' ' ' THR . . . . . . . . . . . . . 96.7 m -57.41 -51.4 69.55 Favored 'General case' 0 C--N 1.327 -0.404 0 CA-C-N 115.973 -0.558 . . . . 0.0 110.802 177.414 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 133' ' ' ALA . . . . . . . . . . . . . . . -61.1 -42.9 99.36 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 115.909 -0.587 . . . . 0.0 111.446 -178.634 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 134' ' ' SER . . . . . . . . . . . . . 51.1 p -64.18 -30.16 71.23 Favored 'General case' 0 C--N 1.33 -0.263 0 N-CA-C 111.755 0.28 . . . . 0.0 111.755 -176.73 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 135' ' ' GLN . . . . . . . . . . . . . 41.4 mt-30 -71.35 -38.37 71.63 Favored 'General case' 0 C--N 1.328 -0.329 0 C-N-CA 120.924 -0.31 . . . . 0.0 110.298 176.101 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 136' ' ' ILE . . . . . . . . . . . . . 65.7 mt -61.1 -46.11 97.28 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.251 0 CA-C-N 116.196 -0.456 . . . . 0.0 110.452 177.818 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 137' ' ' PHE . . . . . 0.48 ' O ' HG13 ' A' ' 141' ' ' ILE . 64.4 m-85 -66.03 -38.31 88.09 Favored 'General case' 0 C--N 1.33 -0.245 0 CA-C-N 116.355 -0.384 . . . . 0.0 110.827 177.745 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 138' ' ' ARG . . . . . 0.494 ' O ' ' HG3' ' A' ' 142' ' ' GLU . 19.9 mtp85 -59.19 -45.55 90.78 Favored 'General case' 0 CA--C 1.518 -0.279 0 CA-C-O 120.725 0.298 . . . . 0.0 110.739 175.952 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 139' ' ' LEU . . . . . . . . . . . . . 48.4 tp -55.81 -36.4 67.39 Favored 'General case' 0 C--N 1.327 -0.386 0 CA-C-N 115.753 -0.658 . . . . 0.0 110.42 178.697 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 140' ' ' ALA . . . . . 0.504 ' HB1' ' HB3' ' A' ' 145' ' ' ALA . . . -69.88 -45.14 68.33 Favored 'General case' 0 C--N 1.324 -0.518 0 CA-C-N 115.858 -0.61 . . . . 0.0 110.748 176.032 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 141' ' ' ILE . . . . . 0.568 ' HA ' ' O ' ' A' ' 146' ' ' ILE . 78.5 mt -55.86 -46.94 80.28 Favored 'Isoleucine or valine' 0 C--O 1.234 0.275 0 CA-C-O 120.997 0.427 . . . . 0.0 110.94 177.606 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 142' ' ' GLU . . . . . 0.494 ' HG3' ' O ' ' A' ' 138' ' ' ARG . 91.7 mt-10 -63.24 -27.55 69.43 Favored 'General case' 0 C--N 1.326 -0.416 0 CA-C-N 115.844 -0.616 . . . . 0.0 111.373 -177.564 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 143' ' ' ASN . . . . . . . . . . . . . 29.0 m-80 -99.49 14.64 29.14 Favored 'General case' 0 C--N 1.327 -0.402 0 CA-C-N 116.329 -0.396 . . . . 0.0 111.418 -178.704 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 144' ' ' ARG . . . . . . . . . . . . . 16.7 mmm180 65.68 27.94 11.23 Favored 'General case' 0 N--CA 1.468 0.462 0 N-CA-C 112.424 0.527 . . . . 0.0 112.424 176.409 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 145' ' ' ALA . . . . . 0.504 ' HB3' ' HB1' ' A' ' 140' ' ' ALA . . . -84.76 -39.66 18.17 Favored 'General case' 0 C--N 1.323 -0.568 0 CA-C-O 121.157 0.503 . . . . 0.0 110.51 177.918 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 146' ' ' ILE . . . . . 0.568 ' O ' ' HA ' ' A' ' 141' ' ' ILE . 15.5 tt -145.36 155.41 13.5 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.423 0 CA-C-N 115.688 -0.687 . . . . 0.0 109.217 -179.154 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 147' ' ' ASP . . . . . . . . . . . . . 3.8 m-20 -105.01 -1.56 25.58 Favored 'General case' 0 C--N 1.327 -0.401 0 N-CA-C 112.381 0.512 . . . . 0.0 112.381 -175.448 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 148' ' ' PHE . . . . . 0.41 ' H ' HG12 ' A' ' 146' ' ' ILE . 50.0 p90 -142.13 165.34 27.7 Favored 'General case' 0 C--N 1.322 -0.614 0 CA-C-O 120.76 0.314 . . . . 0.0 110.998 -176.569 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 149' ' ' ASN . . . . . . . . . . . . . 44.9 t-20 -119.11 101.8 49.44 Favored Pre-proline 0 C--N 1.322 -0.616 0 CA-C-N 116.021 -0.536 . . . . 0.0 110.549 -176.306 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 150' ' ' PRO . . . . . . . . . . . . . 35.2 Cg_exo -59.35 -32.69 97.1 Favored 'Trans proline' 0 C--N 1.342 0.197 0 C-N-CA 122.838 2.359 . . . . 0.0 112.724 178.915 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 151' ' ' ALA . . . . . 0.492 ' HA ' HG23 ' A' ' 154' ' ' VAL . . . -74.81 -19.47 60.18 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-O 121.047 0.451 . . . . 0.0 110.968 -178.466 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 152' ' ' ASP . . . . . . . . . . . . . 24.8 t70 -71.74 -19.81 61.98 Favored 'General case' 0 C--N 1.325 -0.46 0 CA-C-N 115.762 -0.653 . . . . 0.0 110.033 178.662 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 153' ' ' TYR . . . . . 0.411 ' HB2' ' HB3' ' A' ' 109' ' ' PRO . 68.6 m-85 -95.77 1.77 53.49 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 115.744 -0.662 . . . . 0.0 111.513 -178.238 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 154' ' ' VAL . . . . . 0.501 ' HB ' ' HD2' ' A' ' 130' ' ' ARG . 98.0 t -72.32 123.53 27.1 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.514 0 CA-C-O 121.043 0.449 . . . . 0.0 110.514 -178.954 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 155' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -86.12 101.58 13.11 Favored 'General case' 0 C--N 1.32 -0.711 0 N-CA-C 109.251 -0.648 . . . . 0.0 109.251 179.279 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 156' ' ' ILE . . . . . 0.413 HD12 ' HD3' ' A' ' 130' ' ' ARG . 0.9 OUTLIER -71.12 131.31 87.17 Favored Pre-proline 0 C--N 1.325 -0.469 0 N-CA-C 109.275 -0.639 . . . . 0.0 109.275 176.146 . . . . . . . . 3 3 . 1 . 019 nuclear orig core ' A' A ' 157' ' ' PRO . . . . . . . . . . . . . 92.4 Cg_endo . . . . . 0 N--CA 1.456 -0.685 0 C-N-CA 122.522 2.148 . . . . 0.0 112.856 -176.088 . . . . . . . . 0 0 . 1 . 020 nuclear orig core ' A' A ' 63' ' ' SER . . . . . 0.538 ' HA ' ' HA ' ' A' ' 103' ' ' SER . 39.5 t . . . . . 0 N--CA 1.449 -0.525 0 CA-C-O 121.011 0.434 . . . . 0.0 110.341 . . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 64' ' ' PHE . . . . . 0.477 ' HB2' HD11 ' A' ' 107' ' ' ILE . 78.9 t80 -59.85 -31.82 70.12 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 115.82 -0.627 . . . . 0.0 109.999 178.37 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 65' ' ' GLY . . . . . . . . . . . . . . . -59.24 -31.7 70.14 Favored Glycine 0 N--CA 1.447 -0.582 0 CA-C-N 115.685 -0.689 . . . . 0.0 112.571 178.894 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 66' ' ' ASP . . . . . . . . . . . . . 39.0 t70 -79.66 -48.38 13.81 Favored 'General case' 0 C--N 1.329 -0.308 0 C-N-CA 120.911 -0.316 . . . . 0.0 110.491 -179.959 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 67' ' ' TRP . . . . . . . . . . . . . 83.8 m95 -62.16 -36.59 82.31 Favored 'General case' 0 N--CA 1.465 0.282 0 CA-C-N 116.474 -0.33 . . . . 0.0 111.32 179.582 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 68' ' ' ALA . . . . . 0.583 ' O ' ' HG ' ' A' ' 72' ' ' LEU . . . -63.93 -50.92 66.77 Favored 'General case' 0 C--N 1.325 -0.495 0 CA-C-N 116.273 -0.421 . . . . 0.0 110.535 177.28 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 69' ' ' GLU . . . . . . . . . . . . . 14.9 tp10 -61.88 -35.18 77.58 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.083 -0.508 . . . . 0.0 110.07 178.055 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 70' ' ' LYS . . . . . . . . . . . . . 48.5 tttp -59.17 -44.97 92.16 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 115.932 -0.577 . . . . 0.0 110.325 177.145 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 71' ' ' PHE . . . . . . . . . . . . . 79.5 t80 -69.28 -41.22 77.14 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-O 120.98 0.419 . . . . 0.0 110.441 178.912 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 72' ' ' LEU . . . . . 0.583 ' HG ' ' O ' ' A' ' 68' ' ' ALA . 86.1 mt -63.9 -34.28 77.6 Favored 'General case' 0 C--N 1.325 -0.478 0 CA-C-N 116.14 -0.482 . . . . 0.0 110.526 179.647 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 73' ' ' LYS . . . . . 0.443 ' O ' ' HB3' ' A' ' 76' ' ' GLU . 14.0 ttmm -84.08 -33.33 24.43 Favored 'General case' 0 C--N 1.324 -0.543 0 CA-C-N 116.138 -0.483 . . . . 0.0 111.238 -176.505 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 74' ' ' SER . . . . . . . . . . . . . 15.4 p -71.47 -30.58 66.16 Favored 'General case' 0 C--N 1.324 -0.501 0 N-CA-C 110.051 -0.352 . . . . 0.0 110.051 175.982 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 75' ' ' LYS . . . . . 0.498 ' O ' ' HB3' ' A' ' 78' ' ' ASP . 22.0 tptp -76.62 -32.05 57.8 Favored 'General case' 0 N--CA 1.447 -0.612 0 CA-C-O 121.302 0.572 . . . . 0.0 109.475 174.589 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 76' ' ' GLU . . . . . 0.443 ' HB3' ' O ' ' A' ' 73' ' ' LYS . 30.3 tt0 -58.88 -47.87 83.43 Favored 'General case' 0 C--N 1.327 -0.407 0 CA-C-N 115.377 -0.829 . . . . 0.0 110.072 172.921 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 77' ' ' ALA . . . . . . . . . . . . . . . -76.08 -16.24 59.96 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 115.808 -0.633 . . . . 0.0 111.018 178.584 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 78' ' ' ASP . . . . . 0.498 ' HB3' ' O ' ' A' ' 75' ' ' LYS . 3.8 t70 -65.57 -53.78 37.09 Favored 'General case' 0 C--N 1.331 -0.218 0 CA-C-N 116.014 -0.539 . . . . 0.0 110.519 177.101 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 79' ' ' GLY . . . . . . . . . . . . . . . 142.34 63.97 0.03 OUTLIER Glycine 0 N--CA 1.446 -0.69 0 C-N-CA 120.506 -0.854 . . . . 0.0 112.26 178.495 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 80' ' ' VAL . . . . . . . . . . . . . 36.0 m -115.5 158.43 15.86 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.644 0 CA-C-O 120.759 0.314 . . . . 0.0 110.808 179.634 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 81' ' ' SER . . . . . . . . . . . . . 47.5 t -78.72 151.48 32.11 Favored 'General case' 0 C--N 1.321 -0.665 0 N-CA-C 109.487 -0.56 . . . . 0.0 109.487 174.777 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 82' ' ' VAL . . . . . . . . . . . . . 8.3 p -56.68 -34.4 42.57 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.329 0 CA-C-O 120.834 0.35 . . . . 0.0 110.667 177.631 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 83' ' ' SER . . . . . . . . . . . . . 3.4 m -62.98 -42.42 99.83 Favored 'General case' 0 C--O 1.235 0.291 0 CA-C-O 121.425 0.631 . . . . 0.0 110.181 178.199 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 84' ' ' GLN . . . . . 0.417 ' HG3' ' CE2' ' A' ' 88' ' ' TYR . 23.4 tp60 -74.78 -33.78 62.32 Favored 'General case' 0 C--N 1.325 -0.486 0 CA-C-N 115.497 -0.774 . . . . 0.0 110.389 -179.519 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 85' ' ' LEU . . . . . . . . . . . . . 36.7 tp -68.99 -42.97 75.79 Favored 'General case' 0 C--N 1.323 -0.562 0 CA-C-N 116.084 -0.507 . . . . 0.0 110.607 178.966 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 86' ' ' ASN . . . . . . . . . . . . . 86.3 m-20 -60.36 -44.83 95.21 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.32 -0.4 . . . . 0.0 111.075 178.78 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 87' ' ' SER . . . . . . . . . . . . . 2.0 p -63.58 -38.31 90.65 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 116.649 -0.25 . . . . 0.0 111.201 -179.489 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 88' ' ' TYR . . . . . 0.423 ' HB3' HD21 ' A' ' 72' ' ' LEU . 10.7 m-85 -60.48 -47.95 83.9 Favored 'General case' 0 N--CA 1.465 0.282 0 CA-C-O 121.037 0.446 . . . . 0.0 110.515 175.082 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 89' ' ' LYS . . . . . 0.493 ' HG2' HD13 ' A' ' 72' ' ' LEU . 68.4 mttm -63.38 -37.66 88.12 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 115.787 -0.642 . . . . 0.0 110.767 179.64 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 90' ' ' ASN . . . . . 0.5 ' O ' ' HB3' ' A' ' 94' ' ' ASN . 7.4 m-80 -62.48 -47.65 83.05 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.302 -0.408 . . . . 0.0 111.008 177.354 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 91' ' ' TYR . . . . . 0.775 ' HA ' ' HD2' ' A' ' 95' ' ' HIS . 14.0 m-85 -57.23 -45.36 83.95 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-O 120.991 0.424 . . . . 0.0 110.507 175.693 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 92' ' ' CYS . . . . . 0.542 ' SG ' ' HB1' ' A' ' 68' ' ' ALA . 47.8 t -66.54 -54.08 27.63 Favored 'General case' 0 C--N 1.321 -0.668 0 CA-C-N 115.507 -0.769 . . . . 0.0 112.407 -175.561 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 93' ' ' ARG . . . . . . . . . . . . . 31.7 ttm-85 -82.45 -35.02 27.91 Favored 'General case' 0 C--N 1.326 -0.451 0 N-CA-C 111.965 0.357 . . . . 0.0 111.965 -171.751 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 94' ' ' ASN . . . . . 0.5 ' HB3' ' O ' ' A' ' 90' ' ' ASN . 22.0 t-20 -83.97 -51.6 7.01 Favored 'General case' 0 C--N 1.326 -0.43 0 CA-C-O 120.651 0.262 . . . . 0.0 111.582 -176.583 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 95' ' ' HIS . . . . . 0.775 ' HD2' ' HA ' ' A' ' 91' ' ' TYR . 96.5 m-70 -85.49 -42.91 14.03 Favored 'General case' 0 C--N 1.327 -0.371 0 CA-C-O 120.701 0.286 . . . . 0.0 111.452 -174.207 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 96' ' ' LEU . . . . . 0.44 HD22 ' HB2' ' A' ' 133' ' ' ALA . 10.1 mp -91.56 26.73 2.21 Favored 'General case' 0 C--N 1.326 -0.435 0 CA-C-O 120.864 0.364 . . . . 0.0 110.464 -179.794 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 97' ' ' SER . . . . . 0.51 ' OG ' ' HD3' ' A' ' 98' ' ' PRO . 0.5 OUTLIER -55.44 -47.12 99.35 Favored Pre-proline 0 CA--C 1.539 0.526 0 N-CA-C 113.02 0.748 . . . . 0.0 113.02 -178.481 . . . . . . . . 3 3 . 1 . 020 nuclear orig core ' A' A ' 98' ' ' PRO . . . . . 0.51 ' HD3' ' OG ' ' A' ' 97' ' ' SER . 38.8 Cg_exo -58.08 -34.91 98.99 Favored 'Trans proline' 0 C--N 1.358 1.066 0 C-N-CA 121.663 1.575 . . . . 0.0 111.967 178.095 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 99' ' ' LEU . . . . . 0.443 HD22 HG22 ' A' ' 107' ' ' ILE . 33.2 mt -79.02 -36.82 40.5 Favored 'General case' 0 C--N 1.327 -0.391 0 CA-C-N 115.874 -0.603 . . . . 0.0 110.282 -177.275 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 100' ' ' TYR . . . . . . . . . . . . . 25.8 t80 -60.47 -24.82 65.56 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 115.509 -0.769 . . . . 0.0 111.072 -177.112 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 101' ' ' MET . . . . . . . . . . . . . 65.4 mtt -97.72 -2.58 40.94 Favored 'General case' 0 C--N 1.327 -0.375 0 CA-C-N 116.21 -0.45 . . . . 0.0 111.784 -177.153 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 102' ' ' LYS . . . . . . . . . . . . . 87.7 mttt -102.53 167.35 9.99 Favored 'General case' 0 C--O 1.237 0.402 0 CA-C-O 121.026 0.441 . . . . 0.0 111.012 -179.312 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 103' ' ' SER . . . . . 0.538 ' HA ' ' HA ' ' A' ' 63' ' ' SER . 5.2 m -83.13 156.77 23.1 Favored 'General case' 0 C--N 1.323 -0.569 0 CA-C-N 115.82 -0.627 . . . . 0.0 109.69 174.702 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 104' ' ' LEU . . . . . . . . . . . . . 52.1 tp -55.83 -45.11 78.44 Favored 'General case' 0 C--N 1.325 -0.457 0 CA-C-N 116.501 -0.318 . . . . 0.0 111.525 -176.828 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 105' ' ' SER . . . . . . . . . . . . . 14.8 m -87.12 0.38 55.36 Favored 'General case' 0 C--N 1.325 -0.493 0 CA-C-N 116.453 -0.34 . . . . 0.0 111.896 -174.572 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 106' ' ' GLU . . . . . . . . . . . . . 44.3 mt-10 -104.02 -2.46 25.98 Favored 'General case' 0 C--N 1.327 -0.377 0 O-C-N 122.247 -0.283 . . . . 0.0 111.624 -178.372 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 107' ' ' ILE . . . . . 0.477 HD11 ' HB2' ' A' ' 64' ' ' PHE . 66.9 mt -81.15 126.82 39.87 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.556 0 CA-C-O 121.133 0.492 . . . . 0.0 111.303 -178.116 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 108' ' ' LEU . . . . . . . . . . . . . 62.9 mt -97.61 147.28 32.78 Favored Pre-proline 0 C--N 1.323 -0.583 0 CA-C-N 115.724 -0.671 . . . . 0.0 110.444 -179.488 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 109' ' ' PRO . . . . . . . . . . . . . 19.1 Cg_endo -60.18 -30.33 91.06 Favored 'Trans proline' 0 N--CA 1.464 -0.241 0 C-N-CA 122.351 2.034 . . . . 0.0 111.352 174.977 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 110' ' ' ALA . . . . . . . . . . . . . . . -65.17 -29.85 70.71 Favored 'General case' 0 N--CA 1.454 -0.257 0 CA-C-N 115.868 -0.605 . . . . 0.0 111.043 178.662 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 111' ' ' ASP . . . . . 0.413 ' O ' HG13 ' A' ' 115' ' ' ILE . 79.2 m-20 -64.91 -51.26 62.85 Favored 'General case' 0 CA--C 1.519 -0.244 0 CA-C-O 121.141 0.496 . . . . 0.0 110.025 179.226 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 112' ' ' ILE . . . . . 0.47 ' O ' HG12 ' A' ' 116' ' ' ILE . 30.6 mt -65.16 -40.61 89.36 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.491 0 CA-C-N 115.67 -0.696 . . . . 0.0 110.15 179.741 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 113' ' ' GLN . . . . . . . . . . . . . 6.7 tp-100 -59.01 -42.54 90.35 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.018 -0.537 . . . . 0.0 110.514 175.663 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 114' ' ' SER . . . . . . . . . . . . . 7.4 t -60.25 -45.58 92.78 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-N 116.257 -0.429 . . . . 0.0 109.862 178.304 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 115' ' ' ILE . . . . . 0.413 HG13 ' O ' ' A' ' 111' ' ' ASP . 75.8 mt -56.69 -47.23 82.76 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.221 0 CA-C-N 116.434 -0.348 . . . . 0.0 110.822 178.401 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 116' ' ' ILE . . . . . 0.47 HG12 ' O ' ' A' ' 112' ' ' ILE . 50.3 mm -61.09 -40.99 87.61 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.36 0 CA-C-O 121.108 0.48 . . . . 0.0 110.876 179.165 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 117' ' ' ASN . . . . . . . . . . . . . 46.8 t-20 -71.6 -42.03 68.21 Favored 'General case' 0 C--N 1.324 -0.515 0 CA-C-N 115.797 -0.638 . . . . 0.0 111.067 -177.032 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 118' ' ' GLU . . . . . . . . . . . . . 46.9 mt-10 -80.65 -16.76 53.21 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.253 -0.43 . . . . 0.0 112.035 -174.467 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 119' ' ' THR . . . . . . . . . . . . . 94.8 m -82.0 112.86 19.46 Favored 'General case' 0 C--N 1.325 -0.481 0 CA-C-O 121.331 0.586 . . . . 0.0 110.96 179.985 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 120' ' ' LYS . . . . . . . . . . . . . 24.1 mtmt -93.47 63.24 3.47 Favored 'General case' 0 C--N 1.323 -0.548 0 CA-C-N 115.441 -0.799 . . . . 0.0 110.544 -177.959 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 121' ' ' LEU . . . . . . . . . . . . . 88.8 mt -126.92 -175.75 3.51 Favored 'General case' 0 C--N 1.322 -0.62 0 CA-C-N 115.16 -0.927 . . . . 0.0 109.939 178.305 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 122' ' ' ALA . . . . . . . . . . . . . . . -64.01 157.12 25.97 Favored 'General case' 0 C--N 1.327 -0.37 0 CA-C-O 120.964 0.411 . . . . 0.0 111.808 -176.729 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 123' ' ' LYS . . . . . . . . . . . . . 48.3 mmtm -62.01 -38.39 88.47 Favored 'General case' 0 C--N 1.331 -0.237 0 CA-C-N 115.979 -0.555 . . . . 0.0 111.12 -177.926 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 124' ' ' ASN . . . . . . . . . . . . . 28.9 p30 -65.45 -27.31 68.42 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.321 -0.399 . . . . 0.0 111.064 179.453 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 125' ' ' THR . . . . . 0.492 ' O ' HG13 ' A' ' 129' ' ' ILE . 10.2 m -76.18 -39.2 55.38 Favored 'General case' 0 C--N 1.325 -0.47 0 CA-C-N 116.257 -0.429 . . . . 0.0 110.061 179.125 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 126' ' ' LEU . . . . . 0.415 ' HB3' HG22 ' A' ' 116' ' ' ILE . 84.5 mt -62.42 -44.83 95.5 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.008 -0.542 . . . . 0.0 110.141 177.289 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 127' ' ' LYS . . . . . . . . . . . . . 98.6 mttt -59.7 -43.53 94.04 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 115.774 -0.648 . . . . 0.0 110.18 177.384 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 128' ' ' ALA . . . . . . . . . . . . . . . -60.71 -39.12 87.36 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 115.7 -0.682 . . . . 0.0 111.308 -178.861 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 129' ' ' ILE . . . . . 0.492 HG13 ' O ' ' A' ' 125' ' ' THR . 87.6 mt -58.36 -51.65 68.73 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.245 0 CA-C-N 116.462 -0.336 . . . . 0.0 110.654 178.394 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 130' ' ' ARG . . . . . 0.677 HH21 ' HA ' ' A' ' 152' ' ' ASP . 33.4 ttt-85 -65.15 -45.97 82.8 Favored 'General case' 0 C--N 1.331 -0.206 0 C-N-CA 120.885 -0.326 . . . . 0.0 110.92 179.079 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 131' ' ' ASN . . . . . . . . . . . . . 10.9 m120 -53.15 -53.06 56.06 Favored 'General case' 0 N--CA 1.466 0.343 0 O-C-N 123.184 0.302 . . . . 0.0 110.833 179.654 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 132' ' ' THR . . . . . 0.53 ' O ' HG12 ' A' ' 136' ' ' ILE . 29.7 m -55.7 -45.23 77.9 Favored 'General case' 0 C--N 1.327 -0.401 0 CA-C-N 116.303 -0.408 . . . . 0.0 110.824 -179.997 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 133' ' ' ALA . . . . . 0.44 ' HB2' HD22 ' A' ' 96' ' ' LEU . . . -64.3 -42.84 96.17 Favored 'General case' 0 C--N 1.331 -0.207 0 CA-C-N 116.21 -0.45 . . . . 0.0 111.388 -179.356 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 134' ' ' SER . . . . . 0.451 ' O ' ' HG3' ' A' ' 138' ' ' ARG . 70.5 p -64.4 -32.69 74.41 Favored 'General case' 0 C--N 1.33 -0.246 0 C-N-CA 121.033 -0.267 . . . . 0.0 110.959 -178.704 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 135' ' ' GLN . . . . . . . . . . . . . 1.2 mp0 -62.88 -41.18 99.3 Favored 'General case' 0 C--N 1.331 -0.206 0 CA-C-O 120.779 0.323 . . . . 0.0 110.245 175.169 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 136' ' ' ILE . . . . . 0.54 HD13 ' HA ' ' A' ' 68' ' ' ALA . 23.1 mm -61.63 -50.77 78.93 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.25 0 CA-C-N 116.014 -0.539 . . . . 0.0 110.402 178.737 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 137' ' ' PHE . . . . . 0.488 ' O ' HG13 ' A' ' 141' ' ' ILE . 62.2 m-85 -62.14 -38.15 87.88 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 115.843 -0.617 . . . . 0.0 111.405 -179.529 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 138' ' ' ARG . . . . . 0.578 ' O ' ' HG2' ' A' ' 142' ' ' GLU . 68.2 mtp180 -64.7 -37.54 87.94 Favored 'General case' 0 C--N 1.329 -0.314 0 C-N-CA 120.823 -0.351 . . . . 0.0 110.877 179.356 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 139' ' ' LEU . . . . . . . . . . . . . 63.4 tp -57.54 -41.77 81.59 Favored 'General case' 0 C--N 1.327 -0.387 0 CA-C-O 121.107 0.479 . . . . 0.0 109.975 176.301 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 140' ' ' ALA . . . . . . . . . . . . . . . -66.6 -38.74 87.63 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 115.716 -0.675 . . . . 0.0 110.711 177.355 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 141' ' ' ILE . . . . . 0.531 ' HA ' ' O ' ' A' ' 146' ' ' ILE . 75.7 mt -64.07 -43.74 97.58 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.268 0 CA-C-N 116.3 -0.409 . . . . 0.0 110.73 177.168 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 142' ' ' GLU . . . . . 0.578 ' HG2' ' O ' ' A' ' 138' ' ' ARG . 39.7 mm-40 -62.77 -30.43 71.44 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.274 -0.421 . . . . 0.0 110.955 179.434 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 143' ' ' ASN . . . . . . . . . . . . . 0.9 OUTLIER -91.23 1.9 56.76 Favored 'General case' 0 N--CA 1.464 0.229 0 CA-C-N 116.269 -0.423 . . . . 0.0 110.919 179.987 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 144' ' ' ARG . . . . . . . . . . . . . 24.5 mtp85 57.68 40.92 26.1 Favored 'General case' 0 C--O 1.233 0.233 0 CA-C-N 115.633 -0.712 . . . . 0.0 112.054 -177.892 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 145' ' ' ALA . . . . . . . . . . . . . . . -88.41 -28.78 20.7 Favored 'General case' 0 C--N 1.324 -0.508 0 N-CA-C 109.338 -0.616 . . . . 0.0 109.338 172.435 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 146' ' ' ILE . . . . . 0.531 ' O ' ' HA ' ' A' ' 141' ' ' ILE . 13.4 tt -155.07 146.49 13.18 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.479 0 CA-C-N 115.237 -0.892 . . . . 0.0 108.941 177.493 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 147' ' ' ASP . . . . . . . . . . . . . 7.6 m-20 -110.48 24.02 13.51 Favored 'General case' 0 C--N 1.323 -0.548 0 CA-C-O 121.283 0.563 . . . . 0.0 110.192 179.53 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 148' ' ' PHE . . . . . . . . . . . . . 1.2 m-85 -129.97 143.95 51.07 Favored 'General case' 0 C--N 1.323 -0.572 0 CA-C-N 115.631 -0.713 . . . . 0.0 110.336 -178.712 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 149' ' ' ASN . . . . . . . . . . . . . 48.0 t-20 -126.36 91.14 48.39 Favored Pre-proline 0 C--N 1.321 -0.664 0 CA-C-N 116.131 -0.486 . . . . 0.0 110.003 178.494 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 150' ' ' PRO . . . . . . . . . . . . . 35.8 Cg_exo -62.19 -26.52 77.78 Favored 'Trans proline' 0 C--N 1.343 0.258 0 C-N-CA 122.798 2.332 . . . . 0.0 112.082 -179.582 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 151' ' ' ALA . . . . . . . . . . . . . . . -70.21 -27.6 64.62 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 116.124 -0.489 . . . . 0.0 111.179 -177.635 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 152' ' ' ASP . . . . . 0.677 ' HA ' HH21 ' A' ' 130' ' ' ARG . 19.3 t70 -75.58 -17.65 59.98 Favored 'General case' 0 C--N 1.323 -0.552 0 CA-C-O 120.887 0.375 . . . . 0.0 110.514 -179.53 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 153' ' ' TYR . . . . . . . . . . . . . 43.7 m-85 -83.35 -10.84 58.23 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.243 -0.435 . . . . 0.0 110.653 178.819 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 154' ' ' VAL . . . . . . . . . . . . . 41.9 t -72.7 117.77 16.79 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.396 0 CA-C-N 116.101 -0.5 . . . . 0.0 110.945 -178.987 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 155' ' ' ARG . . . . . . . . . . . . . 3.8 mmp_? -89.91 131.68 35.7 Favored 'General case' 0 C--N 1.319 -0.719 0 CA-C-N 116.133 -0.485 . . . . 0.0 110.326 174.016 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 156' ' ' ILE . . . . . 0.425 ' HA ' ' HD2' ' A' ' 157' ' ' PRO . 1.9 mp -91.96 117.08 67.54 Favored Pre-proline 0 C--N 1.31 -1.109 0 N-CA-C 107.988 -1.116 . . . . 0.0 107.988 173.481 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 157' ' ' PRO . . . . . 0.425 ' HD2' ' HA ' ' A' ' 156' ' ' ILE . 5.7 Cg_endo . . . . . 0 C--N 1.345 0.368 0 C-N-CA 123.22 2.613 . . . . 0.0 112.488 -173.657 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 61' ' ' ARG . . . . . . . . . . . . . 9.9 mmm180 . . . . . 0 N--CA 1.484 1.244 0 N-CA-C 111.388 0.144 . . . . 0.0 111.388 . . . . . . . . . 0 0 . 1 . 001 nuclear orig full ' A' A ' 62' ' ' ASP . . . . . . . . . . . . . 5.5 m-20 -117.37 106.28 13.05 Favored 'General case' 0 C--N 1.327 -0.399 0 CA-C-O 120.801 0.334 . . . . 0.0 111.177 -175.918 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 63' ' ' SER . . . . . 0.594 ' HA ' ' HA ' ' A' ' 103' ' ' SER . 29.4 p -82.23 145.22 30.15 Favored 'General case' 0 C--N 1.321 -0.662 0 CA-C-N 116.182 -0.463 . . . . 0.0 110.518 -179.138 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 64' ' ' PHE . . . . . 0.487 ' HB2' HD12 ' A' ' 107' ' ' ILE . 83.2 t80 -62.32 -35.62 79.62 Favored 'General case' 0 C--N 1.327 -0.372 0 N-CA-C 109.852 -0.425 . . . . 0.0 109.852 179.174 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 65' ' ' GLY . . . . . . . . . . . . . . . -60.92 -37.57 94.0 Favored Glycine 0 N--CA 1.449 -0.483 0 CA-C-N 115.904 -0.589 . . . . 0.0 112.329 176.964 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 66' ' ' ASP . . . . . . . . . . . . . 9.4 t70 -59.84 -54.39 46.77 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-O 120.894 0.378 . . . . 0.0 110.603 178.063 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 67' ' ' TRP . . . . . . . . . . . . . 87.5 m95 -72.44 -31.38 65.42 Favored 'General case' 0 C--N 1.325 -0.464 0 CA-C-N 115.941 -0.572 . . . . 0.0 111.94 -176.953 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 68' ' ' ALA . . . . . 0.504 ' O ' HD11 ' A' ' 72' ' ' LEU . . . -64.03 -44.87 91.24 Favored 'General case' 0 C--N 1.327 -0.408 0 CA-C-O 120.872 0.368 . . . . 0.0 110.325 176.336 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 69' ' ' GLU . . . . . . . . . . . . . 15.7 tm-20 -62.47 -38.68 90.77 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 115.981 -0.554 . . . . 0.0 110.05 178.916 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 70' ' ' LYS . . . . . . . . . . . . . 90.0 mttt -68.07 -38.49 82.46 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.244 -0.434 . . . . 0.0 111.055 177.399 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 71' ' ' PHE . . . . . . . . . . . . . 87.8 t80 -64.04 -44.15 93.36 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-O 120.958 0.408 . . . . 0.0 110.355 176.786 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 72' ' ' LEU . . . . . 0.513 ' HG ' ' HG2' ' A' ' 89' ' ' LYS . 3.9 mp -56.6 -51.55 68.24 Favored 'General case' 0 C--N 1.327 -0.387 0 CA-C-N 115.735 -0.666 . . . . 0.0 110.421 175.866 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 73' ' ' LYS . . . . . . . . . . . . . 39.9 ttmt -63.01 -37.8 88.63 Favored 'General case' 0 C--N 1.326 -0.423 0 CA-C-N 115.968 -0.56 . . . . 0.0 110.635 179.229 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 74' ' ' SER . . . . . . . . . . . . . 31.4 t -57.68 -51.87 67.75 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.144 -0.48 . . . . 0.0 110.949 177.819 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 75' ' ' LYS . . . . . 0.532 ' HA ' ' HB2' ' A' ' 78' ' ' ASP . 25.9 mmtm -69.84 -30.21 67.65 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-O 120.862 0.363 . . . . 0.0 111.119 -178.044 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 76' ' ' GLU . . . . . . . . . . . . . 35.5 tt0 -64.68 -38.55 91.37 Favored 'General case' 0 C--N 1.323 -0.561 0 CA-C-N 116.105 -0.498 . . . . 0.0 110.195 175.332 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 77' ' ' ALA . . . . . . . . . . . . . . . -80.15 -23.72 40.91 Favored 'General case' 0 C--N 1.325 -0.461 0 CA-C-N 115.83 -0.623 . . . . 0.0 111.158 176.058 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 78' ' ' ASP . . . . . 0.532 ' HB2' ' HA ' ' A' ' 75' ' ' LYS . 11.2 m-20 -67.6 -33.38 74.87 Favored 'General case' 0 CA--C 1.517 -0.294 0 CA-C-N 116.443 -0.344 . . . . 0.0 110.795 177.43 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 79' ' ' GLY . . . . . . . . . . . . . . . 105.7 41.2 1.89 Allowed Glycine 0 N--CA 1.446 -0.669 0 C-N-CA 120.557 -0.83 . . . . 0.0 112.934 176.208 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 80' ' ' VAL . . . . . . . . . . . . . 30.0 m -87.26 158.25 3.15 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.567 0 N-CA-C 109.674 -0.491 . . . . 0.0 109.674 174.549 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 81' ' ' SER . . . . . . . . . . . . . 61.1 m -61.43 146.16 49.33 Favored 'General case' 0 C--N 1.323 -0.561 0 CA-C-N 116.581 -0.282 . . . . 0.0 110.546 177.636 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 82' ' ' VAL . . . . . . . . . . . . . 60.3 t -57.05 -43.17 80.7 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.378 0 CA-C-N 116.384 -0.371 . . . . 0.0 111.03 -178.345 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 83' ' ' SER . . . . . . . . . . . . . 27.9 m -59.65 -39.11 83.3 Favored 'General case' 0 C--N 1.326 -0.441 0 CA-C-N 116.374 -0.375 . . . . 0.0 110.545 176.889 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 84' ' ' GLN . . . . . . . . . . . . . 6.7 tp-100 -69.15 -44.24 72.69 Favored 'General case' 0 C--N 1.326 -0.423 0 CA-C-N 115.964 -0.562 . . . . 0.0 110.091 179.154 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 85' ' ' LEU . . . . . 0.517 ' O ' ' HG3' ' A' ' 89' ' ' LYS . 2.4 tm? -62.64 -43.76 97.98 Favored 'General case' 0 C--N 1.326 -0.438 0 CA-C-N 115.849 -0.614 . . . . 0.0 109.933 178.953 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 86' ' ' ASN . . . . . . . . . . . . . 77.4 m-20 -64.18 -26.94 68.74 Favored 'General case' 0 C--N 1.332 -0.182 0 CA-C-N 116.116 -0.493 . . . . 0.0 111.259 177.564 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 87' ' ' SER . . . . . . . . . . . . . 60.5 m -64.92 -47.27 78.3 Favored 'General case' 0 C--N 1.33 -0.263 0 N-CA-C 109.896 -0.409 . . . . 0.0 109.896 176.403 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 88' ' ' TYR . . . . . . . . . . . . . 44.2 m-85 -58.7 -45.92 88.46 Favored 'General case' 0 C--O 1.232 0.168 0 CA-C-N 116.252 -0.431 . . . . 0.0 110.215 177.298 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 89' ' ' LYS . . . . . 0.517 ' HG3' ' O ' ' A' ' 85' ' ' LEU . 46.5 mtpt -58.71 -44.05 90.27 Favored 'General case' 0 C--N 1.332 -0.19 0 CA-C-N 115.747 -0.661 . . . . 0.0 110.549 179.85 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 90' ' ' ASN . . . . . . . . . . . . . 8.8 t30 -63.66 -39.41 94.26 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 116.196 -0.456 . . . . 0.0 110.832 -179.532 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 91' ' ' TYR . . . . . . . . . . . . . 18.4 m-85 -60.59 -48.65 80.83 Favored 'General case' 0 C--N 1.331 -0.215 0 CA-C-N 116.615 -0.266 . . . . 0.0 111.054 179.895 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 92' ' ' CYS . . . . . 0.589 ' HA ' ' HB2' ' A' ' 96' ' ' LEU . 24.2 p -76.42 -27.47 56.28 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-O 120.711 0.291 . . . . 0.0 111.748 -176.465 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 93' ' ' ARG . . . . . . . . . . . . . 56.0 ttp180 -81.84 -42.9 18.98 Favored 'General case' 0 C--N 1.327 -0.406 0 CA-C-O 120.772 0.32 . . . . 0.0 111.833 -175.914 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 94' ' ' ASN . . . . . . . . . . . . . 13.5 m120 -95.46 -57.27 2.44 Favored 'General case' 0 C--N 1.325 -0.485 0 CA-C-N 116.305 -0.407 . . . . 0.0 111.909 -173.644 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 95' ' ' HIS . . . . . . . . . . . . . 36.6 m80 -78.59 -48.58 14.88 Favored 'General case' 0 C--N 1.327 -0.4 0 CA-C-O 120.849 0.357 . . . . 0.0 111.249 -174.355 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 96' ' ' LEU . . . . . 0.589 ' HB2' ' HA ' ' A' ' 92' ' ' CYS . 66.3 mt -88.82 21.98 2.85 Favored 'General case' 0 C--N 1.324 -0.536 0 CA-C-N 116.342 -0.39 . . . . 0.0 110.253 -179.504 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 97' ' ' SER . . . . . 0.542 ' N ' ' HD2' ' A' ' 98' ' ' PRO . 4.3 t -55.3 -48.26 96.64 Favored Pre-proline 0 CA--C 1.541 0.607 0 CA-C-N 115.881 -0.599 . . . . 0.0 111.477 -178.822 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 98' ' ' PRO . . . . . 0.542 ' HD2' ' N ' ' A' ' 97' ' ' SER . 17.3 Cg_endo -58.97 -33.0 98.57 Favored 'Trans proline' 0 C--N 1.358 1.054 0 C-N-CA 121.988 1.792 . . . . 0.0 112.264 176.314 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 99' ' ' LEU . . . . . 0.505 HD12 HD11 ' A' ' 115' ' ' ILE . 2.5 mp -78.51 -33.57 47.96 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 116.512 -0.313 . . . . 0.0 111.015 -179.129 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 100' ' ' TYR . . . . . . . . . . . . . 19.1 t80 -59.27 -28.07 66.4 Favored 'General case' 0 C--N 1.327 -0.374 0 CA-C-N 115.972 -0.558 . . . . 0.0 111.295 -176.325 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 101' ' ' MET . . . . . . . . . . . . . 27.0 ptt? -95.23 -0.68 52.82 Favored 'General case' 0 C--N 1.327 -0.374 0 CA-C-N 116.161 -0.472 . . . . 0.0 111.379 -179.329 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 102' ' ' LYS . . . . . 0.538 ' HG3' ' O ' ' A' ' 98' ' ' PRO . 91.5 mttt -101.69 162.6 12.78 Favored 'General case' 0 C--N 1.326 -0.45 0 CA-C-O 121.004 0.431 . . . . 0.0 110.562 -178.838 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 103' ' ' SER . . . . . 0.594 ' HA ' ' HA ' ' A' ' 63' ' ' SER . 39.4 t -91.27 158.72 16.41 Favored 'General case' 0 C--N 1.319 -0.722 0 N-CA-C 108.969 -0.752 . . . . 0.0 108.969 172.68 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 104' ' ' LEU . . . . . . . . . . . . . 93.5 mt -56.83 -35.26 68.6 Favored 'General case' 0 C--N 1.325 -0.465 0 CA-C-O 120.824 0.345 . . . . 0.0 111.269 -177.877 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 105' ' ' SER . . . . . . . . . . . . . 25.5 p -77.41 -16.58 58.76 Favored 'General case' 0 C--N 1.324 -0.513 0 CA-C-O 120.968 0.413 . . . . 0.0 111.144 -178.994 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 106' ' ' GLU . . . . . 0.534 ' OE1' ' HB3' ' A' ' 103' ' ' SER . 1.0 OUTLIER -97.08 2.73 51.64 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.119 -0.491 . . . . 0.0 110.875 -178.945 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 107' ' ' ILE . . . . . 0.491 HG13 ' O ' ' A' ' 103' ' ' SER . 86.2 mt -96.28 128.92 47.05 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.538 0 CA-C-O 121.101 0.477 . . . . 0.0 110.658 179.749 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 108' ' ' LEU . . . . . 0.674 ' HB2' ' HB2' ' A' ' 111' ' ' ASP . 2.5 mm? -103.48 144.44 28.65 Favored Pre-proline 0 C--N 1.32 -0.682 0 CA-C-N 115.574 -0.739 . . . . 0.0 110.157 -177.937 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 109' ' ' PRO . . . . . . . . . . . . . 32.0 Cg_exo -59.35 -40.73 65.19 Favored 'Trans proline' 0 C--O 1.233 0.26 0 C-N-CA 122.429 2.086 . . . . 0.0 112.035 177.365 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 110' ' ' ALA . . . . . . . . . . . . . . . -75.92 -19.83 58.48 Favored 'General case' 0 C--N 1.332 -0.188 0 CA-C-N 116.295 -0.412 . . . . 0.0 110.794 179.247 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 111' ' ' ASP . . . . . 0.674 ' HB2' ' HB2' ' A' ' 108' ' ' LEU . 33.8 t70 -71.06 -40.83 71.42 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-O 121.299 0.571 . . . . 0.0 109.753 178.769 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 112' ' ' ILE . . . . . 0.498 HG12 HD23 ' A' ' 99' ' ' LEU . 47.9 mt -66.12 -39.34 84.14 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.41 0 CA-C-N 115.71 -0.677 . . . . 0.0 109.759 174.859 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 113' ' ' GLN . . . . . . . . . . . . . 29.6 tp60 -60.83 -31.11 70.54 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 115.388 -0.824 . . . . 0.0 110.095 176.611 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 114' ' ' SER . . . . . . . . . . . . . 22.9 t -67.82 -40.64 83.78 Favored 'General case' 0 C--N 1.33 -0.246 0 CA-C-N 115.866 -0.606 . . . . 0.0 110.29 178.35 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 115' ' ' ILE . . . . . 0.505 HD11 HD12 ' A' ' 99' ' ' LEU . 74.8 mt -59.5 -39.12 78.47 Favored 'Isoleucine or valine' 0 C--O 1.233 0.231 0 CA-C-O 121.012 0.434 . . . . 0.0 110.565 177.105 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 116' ' ' ILE . . . . . . . . . . . . . 47.6 mm -66.44 -31.81 55.24 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.455 0 CA-C-N 115.866 -0.606 . . . . 0.0 110.594 178.143 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 117' ' ' ASN . . . . . . . . . . . . . 8.2 t30 -70.09 -38.08 75.57 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-O 121.069 0.462 . . . . 0.0 110.7 178.269 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 118' ' ' GLU . . . . . . . . . . . . . 39.4 mm-40 -80.14 -30.27 38.97 Favored 'General case' 0 C--N 1.325 -0.494 0 CA-C-N 116.092 -0.503 . . . . 0.0 111.219 -177.677 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 119' ' ' THR . . . . . . . . . . . . . 51.4 m -79.67 110.87 15.42 Favored 'General case' 0 C--N 1.322 -0.591 0 CA-C-O 121.271 0.558 . . . . 0.0 109.851 176.117 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 120' ' ' LYS . . . . . . . . . . . . . 47.4 mttp -111.28 76.83 1.0 Allowed 'General case' 0 C--N 1.317 -0.806 0 CA-C-O 121.46 0.648 . . . . 0.0 110.268 -177.182 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 121' ' ' LEU . . . . . . . . . . . . . 97.9 mt -129.3 -174.88 3.4 Favored 'General case' 0 C--N 1.323 -0.576 0 CA-C-N 114.996 -1.002 . . . . 0.0 109.86 -178.666 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 122' ' ' ALA . . . . . . . . . . . . . . . -62.35 158.2 18.04 Favored 'General case' 0 C--N 1.327 -0.388 0 CA-C-O 120.997 0.427 . . . . 0.0 111.925 -179.001 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 123' ' ' LYS . . . . . . . . . . . . . 93.7 mttt -54.29 -49.6 69.27 Favored 'General case' 0 N--CA 1.464 0.252 0 CA-C-N 115.62 -0.718 . . . . 0.0 111.418 -177.823 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 124' ' ' ASN . . . . . . . . . . . . . 27.8 t-20 -55.13 -40.8 70.96 Favored 'General case' 0 C--N 1.331 -0.234 0 CA-C-N 115.607 -0.724 . . . . 0.0 111.265 -179.038 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 125' ' ' THR . . . . . 0.495 ' O ' HG13 ' A' ' 129' ' ' ILE . 6.5 m -69.13 -44.26 72.71 Favored 'General case' 0 C--N 1.327 -0.393 0 CA-C-N 116.075 -0.512 . . . . 0.0 110.717 -178.447 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 126' ' ' LEU . . . . . . . . . . . . . 87.2 mt -60.26 -45.42 93.36 Favored 'General case' 0 C--O 1.234 0.278 0 CA-C-N 116.26 -0.427 . . . . 0.0 110.907 -179.184 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 127' ' ' LYS . . . . . 0.758 ' HG2' HG13 ' A' ' 156' ' ' ILE . 96.5 mttt -68.28 -36.81 79.95 Favored 'General case' 0 C--N 1.326 -0.44 0 CA-C-N 116.062 -0.517 . . . . 0.0 110.707 179.725 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 128' ' ' ALA . . . . . . . . . . . . . . . -60.34 -41.32 93.35 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.419 -0.355 . . . . 0.0 110.912 179.196 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 129' ' ' ILE . . . . . 0.495 HG13 ' O ' ' A' ' 125' ' ' THR . 80.2 mt -59.87 -49.88 82.21 Favored 'Isoleucine or valine' 0 C--O 1.235 0.301 0 CA-C-N 116.15 -0.477 . . . . 0.0 110.239 177.485 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 130' ' ' ARG . . . . . 0.577 ' NH1' ' HA ' ' A' ' 152' ' ' ASP . 23.3 ttp85 -63.67 -46.11 87.06 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 115.845 -0.616 . . . . 0.0 110.606 -179.216 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 131' ' ' ASN . . . . . . . . . . . . . 92.5 m-20 -58.57 -40.17 82.35 Favored 'General case' 0 N--CA 1.464 0.242 0 CA-C-N 116.302 -0.408 . . . . 0.0 111.086 179.818 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 132' ' ' THR . . . . . 0.425 ' O ' HG13 ' A' ' 136' ' ' ILE . 53.8 m -61.8 -46.61 88.79 Favored 'General case' 0 C--N 1.33 -0.248 0 CA-C-O 120.813 0.34 . . . . 0.0 110.42 177.214 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 133' ' ' ALA . . . . . . . . . . . . . . . -61.15 -44.4 97.38 Favored 'General case' 0 C--N 1.331 -0.233 0 CA-C-N 116.012 -0.54 . . . . 0.0 110.64 178.938 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 134' ' ' SER . . . . . 0.478 ' O ' ' HG3' ' A' ' 138' ' ' ARG . 74.3 m -54.45 -45.9 73.2 Favored 'General case' 0 C--N 1.331 -0.227 0 CA-C-N 116.236 -0.438 . . . . 0.0 111.197 178.665 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 135' ' ' GLN . . . . . . . . . . . . . 75.2 mt-30 -64.9 -38.55 91.35 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-O 120.603 0.24 . . . . 0.0 110.969 -178.855 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 136' ' ' ILE . . . . . 0.425 HG13 ' O ' ' A' ' 132' ' ' THR . 72.4 mt -63.91 -47.01 92.51 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.269 0 CA-C-N 116.485 -0.325 . . . . 0.0 110.704 177.813 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 137' ' ' PHE . . . . . 0.54 ' O ' HG13 ' A' ' 141' ' ' ILE . 46.6 m-85 -63.03 -36.83 84.87 Favored 'General case' 0 C--N 1.331 -0.214 0 CA-C-N 116.303 -0.408 . . . . 0.0 111.004 178.2 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 138' ' ' ARG . . . . . 0.492 ' O ' ' HG3' ' A' ' 142' ' ' GLU . 91.4 mtt180 -61.5 -41.89 97.96 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.742 -0.208 . . . . 0.0 110.819 178.472 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 139' ' ' LEU . . . . . . . . . . . . . 58.2 tp -59.4 -43.02 93.03 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-O 121.147 0.498 . . . . 0.0 110.125 175.213 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 140' ' ' ALA . . . . . . . . . . . . . . . -62.22 -43.64 98.37 Favored 'General case' 0 C--N 1.324 -0.505 0 CA-C-N 115.885 -0.598 . . . . 0.0 110.527 177.201 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 141' ' ' ILE . . . . . 0.54 HG13 ' O ' ' A' ' 137' ' ' PHE . 75.0 mt -61.61 -34.0 59.88 Favored 'Isoleucine or valine' 0 CA--C 1.531 0.238 0 CA-C-N 116.466 -0.334 . . . . 0.0 111.26 176.225 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 142' ' ' GLU . . . . . 0.492 ' HG3' ' O ' ' A' ' 138' ' ' ARG . 43.6 mt-10 -60.37 -41.31 93.48 Favored 'General case' 0 C--N 1.332 -0.17 0 CA-C-O 120.874 0.369 . . . . 0.0 110.692 177.907 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 143' ' ' ASN . . . . . 0.442 ' N ' HD21 ' A' ' 143' ' ' ASN . 0.9 OUTLIER -88.75 -1.58 58.15 Favored 'General case' 0 C--N 1.327 -0.403 0 CA-C-O 121.015 0.436 . . . . 0.0 110.189 176.754 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 144' ' ' ARG . . . . . . . . . . . . . 69.2 mtt180 65.02 27.78 12.54 Favored 'General case' 0 N--CA 1.462 0.155 0 CA-C-N 115.228 -0.897 . . . . 0.0 111.668 177.515 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 145' ' ' ALA . . . . . . . . . . . . . . . -66.62 -43.89 83.51 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 115.685 -0.689 . . . . 0.0 109.508 174.859 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 146' ' ' ILE . . . . . . . . . . . . . 20.5 tt -120.75 151.73 23.72 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.477 0 N-CA-C 108.586 -0.894 . . . . 0.0 108.586 172.632 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 147' ' ' ASP . . . . . . . . . . . . . 39.0 t70 -96.66 -5.86 37.92 Favored 'General case' 0 C--N 1.322 -0.617 0 N-CA-C 112.326 0.491 . . . . 0.0 112.326 -169.723 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 148' ' ' PHE . . . . . . . . . . . . . 47.6 p90 -154.63 171.19 19.89 Favored 'General case' 0 C--N 1.323 -0.558 0 O-C-N 122.18 -0.325 . . . . 0.0 110.783 -173.934 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 149' ' ' ASN . . . . . . . . . . . . . 42.9 t-20 -118.51 95.39 48.73 Favored Pre-proline 0 C--N 1.327 -0.393 0 CA-C-N 116.292 -0.413 . . . . 0.0 110.299 -179.011 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 150' ' ' PRO . . . . . . . . . . . . . 39.2 Cg_endo -66.61 -22.33 51.02 Favored 'Trans proline' 0 C--N 1.341 0.178 0 C-N-CA 122.817 2.345 . . . . 0.0 112.166 -178.433 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 151' ' ' ALA . . . . . . . . . . . . . . . -70.52 -28.91 65.31 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.227 -0.442 . . . . 0.0 110.564 -179.51 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 152' ' ' ASP . . . . . 0.577 ' HA ' ' NH1' ' A' ' 130' ' ' ARG . 85.6 m-20 -80.01 -10.84 59.8 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-O 121.2 0.524 . . . . 0.0 110.621 179.226 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 153' ' ' TYR . . . . . . . . . . . . . 60.3 t80 -88.9 -16.98 30.55 Favored 'General case' 0 C--N 1.321 -0.661 0 CA-C-N 115.572 -0.74 . . . . 0.0 109.216 174.566 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 154' ' ' VAL . . . . . . . . . . . . . 90.5 t -73.61 130.8 35.67 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.291 0 CA-C-N 115.656 -0.702 . . . . 0.0 109.997 177.535 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 155' ' ' ARG . . . . . . . . . . . . . 71.4 ttt180 -110.7 142.49 42.55 Favored 'General case' 0 C--N 1.318 -0.766 0 N-CA-C 109.523 -0.547 . . . . 0.0 109.523 178.81 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 156' ' ' ILE . . . . . 0.758 HG13 ' HG2' ' A' ' 127' ' ' LYS . 42.3 mm -87.86 116.0 64.81 Favored Pre-proline 0 C--N 1.32 -0.694 0 N-CA-C 109.476 -0.564 . . . . 0.0 109.476 -179.664 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 157' ' ' PRO . . . . . 0.408 ' HD3' ' HA ' ' A' ' 156' ' ' ILE . 24.0 Cg_exo -62.71 130.55 29.98 Favored 'Trans proline' 0 N--CA 1.463 -0.269 0 C-N-CA 122.48 2.12 . . . . 0.0 112.144 -176.561 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 158' ' ' LYS . . . . . 0.644 ' HB2' ' HZ1' ' A' ' 158' ' ' LYS . 10.2 mtmp? -109.13 67.51 0.65 Allowed 'General case' 0 C--N 1.323 -0.563 0 CA-C-N 116.312 -0.404 . . . . 0.0 110.154 179.09 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 159' ' ' ILE . . . . . . . . . . . . . 53.6 mt -78.68 92.57 1.45 Allowed 'Isoleucine or valine' 0 C--N 1.321 -0.638 0 N-CA-C 108.888 -0.782 . . . . 0.0 108.888 176.062 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 160' ' ' ALA . . . . . . . . . . . . . . . -136.33 115.51 12.48 Favored 'General case' 0 C--N 1.318 -0.765 0 CA-C-N 116.001 -0.545 . . . . 0.0 111.257 -172.02 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 161' ' ' LEU . . . . . . . . . . . . . 4.9 mp -106.87 138.56 42.81 Favored 'General case' 0 C--N 1.317 -0.847 0 CA-C-N 115.644 -0.707 . . . . 0.0 109.524 174.332 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 162' ' ' GLU . . . . . . . . . . . . . 4.3 tm-20 -68.93 -27.5 65.81 Favored 'General case' 0 C--N 1.323 -0.577 0 CA-C-N 115.748 -0.66 . . . . 0.0 110.334 -179.252 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 163' ' ' HIS . . . . . . . . . . . . . 33.1 m170 -84.71 139.62 31.87 Favored 'General case' 0 C--N 1.323 -0.563 0 CA-C-N 116.051 -0.522 . . . . 0.0 109.848 175.127 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 164' ' ' HIS . . . . . . . . . . . . . 15.7 m-70 -74.37 151.16 39.77 Favored 'General case' 0 C--N 1.322 -0.629 0 CA-C-N 115.762 -0.654 . . . . 0.0 110.481 -174.743 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 165' ' ' HIS . . . . . . . . . . . . . 24.2 m80 -91.96 -97.76 0.12 Allowed 'General case' 0 C--N 1.328 -0.358 0 CA-C-O 121.121 0.486 . . . . 0.0 110.892 -173.192 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 166' ' ' HIS . . . . . . . . . . . . . 89.5 m-70 -110.86 -46.28 3.37 Favored 'General case' 0 CA--C 1.514 -0.406 0 N-CA-C 108.761 -0.829 . . . . 0.0 108.761 177.794 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 167' ' ' HIS . . . . . . . . . . . . . 18.1 m-70 -73.25 114.53 11.55 Favored 'General case' 0 N--CA 1.45 -0.44 0 CA-C-N 115.327 -0.852 . . . . 0.0 108.89 171.485 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 168' ' ' HIS . . . . . . . . . . . . . 56.3 p-80 . . . . . 0 C--O 1.245 0.827 0 CA-C-O 118.231 -0.89 . . . . 0.0 109.562 179.372 . . . . . . . . 0 0 . 1 . 002 nuclear orig full ' A' A ' 61' ' ' ARG . . . . . . . . . . . . . 32.5 mmt180 . . . . . 0 N--CA 1.477 0.885 0 N-CA-C 109.978 -0.378 . . . . 0.0 109.978 . . . . . . . . . 0 0 . 1 . 002 nuclear orig full ' A' A ' 62' ' ' ASP . . . . . . . . . . . . . 5.0 m-20 -99.65 122.29 42.46 Favored 'General case' 0 C--N 1.322 -0.607 0 CA-C-O 121.081 0.467 . . . . 0.0 110.62 -178.801 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 63' ' ' SER . . . . . . . . . . . . . 22.9 t -89.48 178.33 6.33 Favored 'General case' 0 C--N 1.318 -0.797 0 N-CA-C 109.001 -0.741 . . . . 0.0 109.001 176.869 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 64' ' ' PHE . . . . . 0.42 ' HB2' HD13 ' A' ' 107' ' ' ILE . 73.8 t80 -66.18 -32.53 74.03 Favored 'General case' 0 C--N 1.328 -0.332 0 N-CA-C 109.149 -0.686 . . . . 0.0 109.149 177.386 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 65' ' ' GLY . . . . . . . . . . . . . . . -59.76 -40.21 96.32 Favored Glycine 0 N--CA 1.448 -0.508 0 CA-C-N 115.775 -0.648 . . . . 0.0 111.666 175.427 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 66' ' ' ASP . . . . . 0.42 ' O ' ' HB2' ' A' ' 70' ' ' LYS . 9.1 m-20 -61.96 -45.06 95.3 Favored 'General case' 0 CA--C 1.519 -0.239 0 CA-C-O 120.83 0.347 . . . . 0.0 110.628 178.682 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 67' ' ' TRP . . . . . 0.482 ' HA ' ' HB2' ' A' ' 70' ' ' LYS . 90.2 m95 -78.13 -31.92 50.14 Favored 'General case' 0 C--N 1.327 -0.383 0 CA-C-N 116.275 -0.42 . . . . 0.0 111.861 -176.856 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 68' ' ' ALA . . . . . 0.548 ' HB3' ' HB3' ' A' ' 92' ' ' CYS . . . -63.08 -44.2 96.42 Favored 'General case' 0 C--N 1.325 -0.474 0 N-CA-C 109.687 -0.486 . . . . 0.0 109.687 174.955 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 69' ' ' GLU . . . . . . . . . . . . . 3.7 tp10 -68.56 -38.12 80.49 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 115.639 -0.71 . . . . 0.0 109.885 174.9 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 70' ' ' LYS . . . . . 0.482 ' HB2' ' HA ' ' A' ' 67' ' ' TRP . 1.7 tppt? -57.51 -45.52 84.85 Favored 'General case' 0 C--N 1.331 -0.201 0 CA-C-N 115.86 -0.609 . . . . 0.0 110.343 179.303 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 71' ' ' PHE . . . . . . . . . . . . . 70.1 t80 -62.5 -44.45 96.34 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 115.834 -0.621 . . . . 0.0 110.593 179.651 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 72' ' ' LEU . . . . . 0.518 HD23 ' HA ' ' A' ' 89' ' ' LYS . 8.5 mp -60.33 -48.86 79.92 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.076 -0.511 . . . . 0.0 110.56 177.226 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 73' ' ' LYS . . . . . . . . . . . . . 59.1 mtpt -59.77 -38.52 82.05 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 116.284 -0.416 . . . . 0.0 110.943 178.335 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 74' ' ' SER . . . . . 0.408 ' O ' ' HB2' ' A' ' 78' ' ' ASP . 58.5 m -61.61 -45.03 95.83 Favored 'General case' 0 C--N 1.327 -0.371 0 CA-C-N 116.431 -0.349 . . . . 0.0 110.947 179.36 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 75' ' ' LYS . . . . . . . . . . . . . 72.3 mmtt -71.29 -42.93 68.09 Favored 'General case' 0 C--N 1.327 -0.377 0 CA-C-O 120.757 0.313 . . . . 0.0 111.071 178.774 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 76' ' ' GLU . . . . . . . . . . . . . 9.4 tp10 -57.48 -46.08 84.1 Favored 'General case' 0 C--N 1.327 -0.383 0 CA-C-N 115.825 -0.625 . . . . 0.0 110.513 179.205 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 77' ' ' ALA . . . . . . . . . . . . . . . -79.25 -21.97 45.4 Favored 'General case' 0 C--N 1.327 -0.405 0 CA-C-N 116.022 -0.535 . . . . 0.0 111.497 -178.582 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 78' ' ' ASP . . . . . 0.408 ' HB2' ' O ' ' A' ' 74' ' ' SER . 24.3 t70 -68.8 -54.5 15.49 Favored 'General case' 0 C--N 1.327 -0.378 0 CA-C-O 121.051 0.453 . . . . 0.0 110.28 179.907 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 79' ' ' GLY . . . . . . . . . . . . . . . 137.61 65.22 0.05 OUTLIER Glycine 0 N--CA 1.445 -0.76 0 CA-C-N 115.688 -0.687 . . . . 0.0 112.194 179.482 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 80' ' ' VAL . . . . . . . . . . . . . 35.0 m -119.0 160.01 19.17 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.523 0 N-CA-C 109.882 -0.414 . . . . 0.0 109.882 176.03 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 81' ' ' SER . . . . . . . . . . . . . 8.7 t -72.35 159.56 33.81 Favored 'General case' 0 C--N 1.322 -0.591 0 N-CA-C 110.08 -0.341 . . . . 0.0 110.08 179.693 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 82' ' ' VAL . . . . . . . . . . . . . 48.2 t -59.91 -46.07 94.37 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.322 0 CA-C-O 120.785 0.326 . . . . 0.0 110.699 -177.793 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 83' ' ' SER . . . . . . . . . . . . . 52.7 p -57.09 -40.83 77.72 Favored 'General case' 0 C--N 1.326 -0.414 0 CA-C-N 115.961 -0.563 . . . . 0.0 110.591 178.252 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 84' ' ' GLN . . . . . . . . . . . . . 6.6 tp-100 -65.5 -45.72 82.51 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 115.644 -0.707 . . . . 0.0 110.336 -179.382 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 85' ' ' LEU . . . . . 0.423 HD22 ' O ' ' A' ' 72' ' ' LEU . 1.3 tm? -64.28 -42.36 96.47 Favored 'General case' 0 C--N 1.325 -0.458 0 CA-C-N 116.059 -0.519 . . . . 0.0 109.618 178.767 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 86' ' ' ASN . . . . . . . . . . . . . 5.8 m-20 -66.82 -21.83 66.02 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.259 -0.428 . . . . 0.0 111.426 178.407 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 87' ' ' SER . . . . . . . . . . . . . 50.5 m -67.08 -48.54 67.91 Favored 'General case' 0 C--N 1.326 -0.445 0 N-CA-C 109.466 -0.568 . . . . 0.0 109.466 174.222 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 88' ' ' TYR . . . . . 0.416 ' HA ' ' CD2' ' A' ' 91' ' ' TYR . 47.8 m-85 -66.06 -35.78 81.46 Favored 'General case' 0 C--N 1.334 -0.107 0 CA-C-O 121.324 0.583 . . . . 0.0 109.832 176.689 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 89' ' ' LYS . . . . . 0.518 ' HA ' HD23 ' A' ' 72' ' ' LEU . 34.5 ttmt -60.14 -43.68 95.51 Favored 'General case' 0 C--N 1.325 -0.492 0 CA-C-N 115.208 -0.906 . . . . 0.0 110.389 177.862 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 90' ' ' ASN . . . . . 0.439 ' O ' ' HB2' ' A' ' 94' ' ' ASN . 36.1 t30 -63.46 -33.39 75.46 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 115.929 -0.578 . . . . 0.0 110.749 177.829 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 91' ' ' TYR . . . . . 0.416 ' CD2' ' HA ' ' A' ' 88' ' ' TYR . 23.2 m-85 -69.88 -59.76 2.72 Favored 'General case' 0 C--N 1.324 -0.52 0 CA-C-N 116.462 -0.335 . . . . 0.0 110.36 177.395 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 92' ' ' CYS . . . . . 0.548 ' HB3' ' HB3' ' A' ' 68' ' ' ALA . 82.0 m -66.53 -47.68 72.14 Favored 'General case' 0 C--N 1.326 -0.423 0 N-CA-C 112.778 0.658 . . . . 0.0 112.778 -173.086 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 93' ' ' ARG . . . . . 0.403 HH11 ' HD3' ' A' ' 93' ' ' ARG . 10.4 mmm180 -77.17 -49.12 15.89 Favored 'General case' 0 C--N 1.326 -0.449 0 N-CA-C 111.966 0.358 . . . . 0.0 111.966 -173.669 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 94' ' ' ASN . . . . . 0.439 ' HB2' ' O ' ' A' ' 90' ' ' ASN . 2.6 m-20 -84.8 -50.73 7.32 Favored 'General case' 0 C--N 1.325 -0.496 0 CA-C-N 116.167 -0.47 . . . . 0.0 111.819 -172.209 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 95' ' ' HIS . . . . . . . . . . . . . 78.5 m80 -86.24 -40.93 15.05 Favored 'General case' 0 C--N 1.325 -0.497 0 N-CA-C 112.017 0.377 . . . . 0.0 112.017 -172.391 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 96' ' ' LEU . . . . . 0.524 HD11 ' HA ' ' A' ' 92' ' ' CYS . 96.0 mt -89.17 22.26 2.89 Favored 'General case' 0 C--N 1.323 -0.586 0 CA-C-O 120.956 0.407 . . . . 0.0 110.699 -179.765 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 97' ' ' SER . . . . . 0.472 ' OG ' ' HD3' ' A' ' 98' ' ' PRO . 3.1 p -57.36 -41.49 91.11 Favored Pre-proline 0 CA--C 1.545 0.771 0 N-CA-C 113.188 0.81 . . . . 0.0 113.188 -179.183 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 98' ' ' PRO . . . . . 0.472 ' HD3' ' OG ' ' A' ' 97' ' ' SER . 31.5 Cg_exo -58.46 -35.74 98.32 Favored 'Trans proline' 0 C--N 1.363 1.33 0 C-N-CA 121.631 1.554 . . . . 0.0 112.109 176.965 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 99' ' ' LEU . . . . . . . . . . . . . 49.2 mt -84.63 -30.07 25.22 Favored 'General case' 0 C--N 1.326 -0.45 0 CA-C-N 116.263 -0.426 . . . . 0.0 110.657 -176.85 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 100' ' ' TYR . . . . . . . . . . . . . 17.4 t80 -57.82 -26.69 62.34 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 115.811 -0.631 . . . . 0.0 111.297 -176.495 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 101' ' ' MET . . . . . . . . . . . . . 26.8 ptt? -97.81 1.92 48.81 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.215 -0.448 . . . . 0.0 111.44 -178.115 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 102' ' ' LYS . . . . . . . . . . . . . 95.5 mttt -109.23 149.29 29.62 Favored 'General case' 0 C--N 1.326 -0.435 0 CA-C-O 120.732 0.301 . . . . 0.0 110.527 -178.285 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 103' ' ' SER . . . . . 0.413 ' O ' HG13 ' A' ' 107' ' ' ILE . 62.5 m -70.04 146.95 50.62 Favored 'General case' 0 C--N 1.323 -0.579 0 CA-C-N 116.226 -0.443 . . . . 0.0 110.238 178.867 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 104' ' ' LEU . . . . . . . . . . . . . 26.5 tp -55.28 -33.6 63.36 Favored 'General case' 0 C--N 1.326 -0.419 0 CA-C-N 115.816 -0.629 . . . . 0.0 111.861 -177.272 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 105' ' ' SER . . . . . . . . . . . . . 2.9 p -81.74 -16.59 50.63 Favored 'General case' 0 C--N 1.323 -0.571 0 N-CA-C 112.769 0.655 . . . . 0.0 112.769 -173.756 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 106' ' ' GLU . . . . . . . . . . . . . 20.3 pt-20 -108.21 9.32 28.11 Favored 'General case' 0 C--N 1.329 -0.325 0 C-N-CA 120.798 -0.361 . . . . 0.0 111.884 -172.388 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 107' ' ' ILE . . . . . 0.42 HD13 ' HB2' ' A' ' 64' ' ' PHE . 69.1 mt -88.03 102.68 12.86 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.5 0 CA-C-O 121.152 0.501 . . . . 0.0 110.707 -179.873 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 108' ' ' LEU . . . . . . . . . . . . . 2.5 pt? -75.4 143.25 75.9 Favored Pre-proline 0 C--N 1.324 -0.519 0 CA-C-N 115.86 -0.609 . . . . 0.0 110.391 177.104 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 109' ' ' PRO . . . . . 0.498 ' HG3' ' HB3' ' A' ' 150' ' ' PRO . 32.5 Cg_exo -57.13 -31.41 90.33 Favored 'Trans proline' 0 C--N 1.347 0.479 0 C-N-CA 123.053 2.502 . . . . 0.0 112.347 -177.714 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 110' ' ' ALA . . . . . . . . . . . . . . . -61.55 -35.42 77.73 Favored 'General case' 0 C--N 1.327 -0.375 0 CA-C-N 115.677 -0.692 . . . . 0.0 111.375 -178.859 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 111' ' ' ASP . . . . . . . . . . . . . 26.0 t70 -72.06 -37.89 69.56 Favored 'General case' 0 C--O 1.234 0.289 0 CA-C-O 121.031 0.443 . . . . 0.0 110.338 -176.357 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 112' ' ' ILE . . . . . 0.429 ' HB ' HG21 ' A' ' 154' ' ' VAL . 34.9 mt -66.36 -38.39 81.71 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.363 0 CA-C-N 115.928 -0.578 . . . . 0.0 109.444 175.678 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 113' ' ' GLN . . . . . . . . . . . . . 27.3 tp60 -62.19 -37.46 85.36 Favored 'General case' 0 C--N 1.331 -0.216 0 CA-C-N 115.472 -0.786 . . . . 0.0 110.032 177.002 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 114' ' ' SER . . . . . . . . . . . . . 33.8 m -59.72 -40.67 88.8 Favored 'General case' 0 C--N 1.334 -0.09 0 CA-C-N 116.155 -0.475 . . . . 0.0 110.786 177.031 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 115' ' ' ILE . . . . . . . . . . . . . 69.4 mt -61.75 -47.89 91.19 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.303 0 CA-C-N 116.252 -0.431 . . . . 0.0 110.478 178.934 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 116' ' ' ILE . . . . . . . . . . . . . 38.9 mm -70.68 -18.18 20.89 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.31 0 CA-C-O 121.279 0.562 . . . . 0.0 110.653 -179.365 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 117' ' ' ASN . . . . . . . . . . . . . 1.9 m-20 -77.43 -51.29 11.03 Favored 'General case' 0 C--N 1.326 -0.421 0 CA-C-N 116.006 -0.543 . . . . 0.0 111.253 178.646 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 118' ' ' GLU . . . . . . . . . . . . . 25.3 mt-10 -82.93 -30.23 28.54 Favored 'General case' 0 C--O 1.236 0.346 0 N-CA-C 111.957 0.355 . . . . 0.0 111.957 -175.657 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 119' ' ' THR . . . . . . . . . . . . . 62.0 m -70.26 111.55 5.95 Favored 'General case' 0 C--N 1.325 -0.459 0 N-CA-C 109.474 -0.565 . . . . 0.0 109.474 177.031 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 120' ' ' LYS . . . . . . . . . . . . . 35.2 mtmm -111.91 78.29 1.11 Allowed 'General case' 0 C--N 1.323 -0.585 0 CA-C-O 121.658 0.742 . . . . 0.0 111.027 -176.68 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 121' ' ' LEU . . . . . . . . . . . . . 4.6 mm? -108.79 -174.84 2.61 Favored 'General case' 0 C--N 1.318 -0.796 0 CA-C-N 114.357 -1.292 . . . . 0.0 108.402 172.949 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 122' ' ' ALA . . . . . . . . . . . . . . . -56.04 134.03 52.24 Favored 'General case' 0 C--N 1.324 -0.523 0 N-CA-C 109.643 -0.503 . . . . 0.0 109.643 172.164 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 123' ' ' LYS . . . . . 0.586 ' HD2' HD13 ' A' ' 159' ' ' ILE . 35.1 mtmm -54.07 -35.53 62.16 Favored 'General case' 0 C--N 1.327 -0.403 0 CA-C-N 116.482 -0.326 . . . . 0.0 111.392 -178.644 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 124' ' ' ASN . . . . . . . . . . . . . 36.7 t30 -57.32 -43.39 83.27 Favored 'General case' 0 C--N 1.327 -0.407 0 CA-C-O 121.115 0.484 . . . . 0.0 110.455 175.961 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 125' ' ' THR . . . . . 0.468 ' O ' HG13 ' A' ' 129' ' ' ILE . 33.4 m -73.32 -34.75 65.85 Favored 'General case' 0 C--N 1.326 -0.432 0 CA-C-N 115.852 -0.613 . . . . 0.0 110.764 179.58 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 126' ' ' LEU . . . . . . . . . . . . . 92.2 mt -60.96 -42.17 97.74 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-O 120.981 0.42 . . . . 0.0 110.348 177.061 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 127' ' ' LYS . . . . . 0.536 ' HG3' ' O ' ' A' ' 123' ' ' LYS . 44.7 mtpt -60.12 -45.9 91.45 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 115.703 -0.68 . . . . 0.0 109.996 175.16 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 128' ' ' ALA . . . . . . . . . . . . . . . -58.04 -45.86 86.27 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 115.719 -0.673 . . . . 0.0 111.355 -179.421 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 129' ' ' ILE . . . . . 0.468 HG13 ' O ' ' A' ' 125' ' ' THR . 71.9 mt -59.02 -48.32 87.05 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.228 0 CA-C-O 121.122 0.487 . . . . 0.0 110.439 178.155 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 130' ' ' ARG . . . . . 0.408 ' HD3' ' O ' ' A' ' 151' ' ' ALA . 1.5 tmm_? -62.81 -49.56 74.47 Favored 'General case' 0 C--N 1.326 -0.431 0 CA-C-N 115.672 -0.694 . . . . 0.0 110.333 -178.851 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 131' ' ' ASN . . . . . . . . . . . . . 95.9 m-20 -62.55 -39.25 93.03 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-N 116.165 -0.47 . . . . 0.0 111.195 -176.945 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 132' ' ' THR . . . . . 0.494 ' O ' HG13 ' A' ' 136' ' ' ILE . 56.5 m -59.5 -42.16 91.53 Favored 'General case' 0 C--N 1.327 -0.407 0 CA-C-O 120.796 0.331 . . . . 0.0 110.188 176.941 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 133' ' ' ALA . . . . . . . . . . . . . . . -65.37 -44.09 88.69 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 116.162 -0.472 . . . . 0.0 111.207 179.613 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 134' ' ' SER . . . . . 0.472 ' HA ' ' HB3' ' A' ' 151' ' ' ALA . 10.9 p -64.88 -30.31 71.3 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-O 120.651 0.262 . . . . 0.0 111.123 179.916 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 135' ' ' GLN . . . . . 0.532 ' HA ' ' HG2' ' A' ' 138' ' ' ARG . 2.1 mp0 -71.79 -34.96 69.84 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.423 -0.353 . . . . 0.0 110.515 175.813 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 136' ' ' ILE . . . . . 0.494 HG13 ' O ' ' A' ' 132' ' ' THR . 77.8 mt -63.11 -47.36 92.87 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.459 0 CA-C-N 116.128 -0.487 . . . . 0.0 110.492 175.737 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 137' ' ' PHE . . . . . 0.42 ' O ' HG13 ' A' ' 141' ' ' ILE . 48.7 m-85 -64.81 -38.36 90.72 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 116.18 -0.464 . . . . 0.0 111.712 -179.911 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 138' ' ' ARG . . . . . 0.532 ' HG2' ' HA ' ' A' ' 135' ' ' GLN . 9.4 ptm180 -73.73 -25.87 60.4 Favored 'General case' 0 C--N 1.329 -0.307 0 C-N-CA 120.622 -0.431 . . . . 0.0 110.377 -179.393 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 139' ' ' LEU . . . . . . . . . . . . . 55.9 tp -67.51 -32.56 73.45 Favored 'General case' 0 C--N 1.332 -0.153 0 CA-C-O 121.58 0.705 . . . . 0.0 109.391 173.712 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 140' ' ' ALA . . . . . 0.434 ' HB1' ' HB1' ' A' ' 145' ' ' ALA . . . -72.55 -38.33 68.01 Favored 'General case' 0 C--N 1.322 -0.61 0 CA-C-N 115.46 -0.791 . . . . 0.0 110.452 175.408 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 141' ' ' ILE . . . . . 0.42 HG13 ' O ' ' A' ' 137' ' ' PHE . 75.5 mt -56.93 -47.69 82.78 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.286 0 CA-C-N 116.118 -0.492 . . . . 0.0 111.455 177.335 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 142' ' ' GLU . . . . . . . . . . . . . 11.3 pt-20 -70.44 -6.71 37.79 Favored 'General case' 0 CA--C 1.533 0.302 0 CA-C-O 120.924 0.393 . . . . 0.0 111.671 -177.401 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 143' ' ' ASN . . . . . . . . . . . . . 45.4 m-80 -110.99 9.46 22.18 Favored 'General case' 0 C--N 1.326 -0.456 0 CA-C-O 120.857 0.36 . . . . 0.0 110.399 174.678 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 144' ' ' ARG . . . . . 0.426 HH11 ' HD2' ' A' ' 144' ' ' ARG . 41.1 mtm105 62.18 23.23 13.7 Favored 'General case' 0 N--CA 1.463 0.21 0 CA-C-N 115.346 -0.843 . . . . 0.0 111.427 177.429 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 145' ' ' ALA . . . . . 0.434 ' HB1' ' HB1' ' A' ' 140' ' ' ALA . . . -77.94 -35.48 50.35 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-O 120.981 0.419 . . . . 0.0 110.285 179.407 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 146' ' ' ILE . . . . . . . . . . . . . 15.6 tt -144.0 152.0 16.08 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.509 0 CA-C-N 115.783 -0.644 . . . . 0.0 109.313 178.093 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 147' ' ' ASP . . . . . . . . . . . . . 33.4 t70 -113.03 14.93 19.71 Favored 'General case' 0 C--N 1.323 -0.573 0 CA-C-O 121.549 0.69 . . . . 0.0 110.495 -176.416 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 148' ' ' PHE . . . . . . . . . . . . . 61.2 t80 -145.13 144.3 30.84 Favored 'General case' 0 C--N 1.321 -0.669 0 CA-C-N 115.643 -0.708 . . . . 0.0 109.576 -174.972 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 149' ' ' ASN . . . . . . . . . . . . . 48.0 t-20 -119.18 88.71 37.94 Favored Pre-proline 0 C--N 1.325 -0.467 0 CA-C-O 120.963 0.411 . . . . 0.0 110.413 179.14 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 150' ' ' PRO . . . . . 0.498 ' HB3' ' HG3' ' A' ' 109' ' ' PRO . 35.8 Cg_exo -59.95 -29.25 88.94 Favored 'Trans proline' 0 C--N 1.342 0.195 0 C-N-CA 122.612 2.208 . . . . 0.0 112.154 -178.549 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 151' ' ' ALA . . . . . 0.472 ' HB3' ' HA ' ' A' ' 134' ' ' SER . . . -70.33 -27.78 64.63 Favored 'General case' 0 N--CA 1.449 -0.483 0 CA-C-N 115.69 -0.687 . . . . 0.0 112.164 -173.218 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 152' ' ' ASP . . . . . . . . . . . . . 0.0 OUTLIER -79.03 -14.37 59.22 Favored 'General case' 0 C--N 1.331 -0.232 0 C-N-CA 119.531 -0.868 . . . . 0.0 109.889 -176.953 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 153' ' ' TYR . . . . . . . . . . . . . 86.3 m-85 -88.46 -1.0 57.81 Favored 'General case' 0 C--N 1.331 -0.227 0 CA-C-N 116.036 -0.529 . . . . 0.0 110.522 176.768 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 154' ' ' VAL . . . . . 0.429 HG21 ' HB ' ' A' ' 112' ' ' ILE . 73.5 t -85.87 126.36 40.56 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.436 0 CA-C-N 115.861 -0.608 . . . . 0.0 109.793 175.788 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 155' ' ' ARG . . . . . . . . . . . . . 38.7 ttt180 -103.63 140.59 37.36 Favored 'General case' 0 C--N 1.323 -0.585 0 CA-C-N 116.222 -0.445 . . . . 0.0 111.127 -173.421 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 156' ' ' ILE . . . . . . . . . . . . . 1.9 mp -88.32 140.7 30.4 Favored Pre-proline 0 C--N 1.328 -0.346 0 CA-C-N 115.656 -0.702 . . . . 0.0 110.135 177.904 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 157' ' ' PRO . . . . . . . . . . . . . 52.0 Cg_exo -56.98 128.63 30.68 Favored 'Trans proline' 0 N--CA 1.459 -0.541 0 C-N-CA 122.083 1.855 . . . . 0.0 111.818 173.221 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 158' ' ' LYS . . . . . 0.609 ' HB2' HD11 ' A' ' 159' ' ' ILE . 41.8 mttm 68.7 -48.21 0.57 Allowed 'General case' 0 N--CA 1.466 0.347 0 C-N-CA 124.04 0.936 . . . . 0.0 113.424 175.739 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 159' ' ' ILE . . . . . 0.609 HD11 ' HB2' ' A' ' 158' ' ' LYS . 0.4 OUTLIER -88.52 126.31 41.75 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.51 0 CA-C-O 120.937 0.399 . . . . 0.0 111.469 -169.003 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' A' A ' 160' ' ' ALA . . . . . . . . . . . . . . . -135.2 -164.76 1.57 Allowed 'General case' 0 C--N 1.321 -0.642 0 CA-C-N 115.594 -0.73 . . . . 0.0 109.655 176.733 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 161' ' ' LEU . . . . . . . . . . . . . 95.2 mt -96.78 -179.44 4.58 Favored 'General case' 0 C--N 1.321 -0.64 0 N-CA-C 110.324 -0.25 . . . . 0.0 110.324 177.989 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 162' ' ' GLU . . . . . . . . . . . . . 37.2 mt-10 66.67 -171.53 0.19 Allowed 'General case' 0 N--CA 1.463 0.187 0 O-C-N 123.645 0.59 . . . . 0.0 111.28 179.587 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 163' ' ' HIS . . . . . . . . . . . . . 28.0 p80 -107.8 117.52 34.32 Favored 'General case' 0 C--N 1.325 -0.46 0 CA-C-O 121.305 0.574 . . . . 0.0 110.045 176.752 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 164' ' ' HIS . . . . . . . . . . . . . 4.5 m-70 -132.67 -13.92 2.87 Favored 'General case' 0 C--N 1.323 -0.549 0 CA-C-N 115.386 -0.825 . . . . 0.0 110.372 179.005 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 165' ' ' HIS . . . . . . . . . . . . . 42.9 t60 -131.07 -8.53 3.86 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.33 -0.396 . . . . 0.0 111.133 -176.435 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 166' ' ' HIS . . . . . . . . . . . . . 19.9 t-80 67.1 49.28 1.12 Allowed 'General case' 0 N--CA 1.468 0.434 0 CA-C-O 121.945 0.878 . . . . 0.0 109.825 -176.509 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 167' ' ' HIS . . . . . . . . . . . . . 57.1 t-80 -156.17 122.45 5.07 Favored 'General case' 0 C--N 1.323 -0.57 0 CA-C-N 115.381 -0.827 . . . . 0.0 109.973 178.706 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 168' ' ' HIS . . . . . . . . . . . . . 5.6 p-80 . . . . . 0 C--O 1.244 0.787 0 CA-C-O 119.01 -0.519 . . . . 0.0 110.671 177.887 . . . . . . . . 0 0 . 1 . 003 nuclear orig full ' A' A ' 61' ' ' ARG . . . . . . . . . . . . . 42.0 ttt85 . . . . . 0 N--CA 1.48 1.069 0 N-CA-C 110.69 -0.115 . . . . 0.0 110.69 . . . . . . . . . 0 0 . 1 . 003 nuclear orig full ' A' A ' 62' ' ' ASP . . . . . . . . . . . . . 26.6 m-20 46.95 80.07 0.05 Allowed 'General case' 0 N--CA 1.47 0.548 0 CA-C-O 121.457 0.646 . . . . 0.0 112.214 178.736 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 63' ' ' SER . . . . . 0.428 ' HA ' ' HA ' ' A' ' 103' ' ' SER . 32.3 m -92.54 145.05 24.74 Favored 'General case' 0 C--N 1.318 -0.763 0 CA-C-N 115.85 -0.614 . . . . 0.0 110.035 179.008 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 64' ' ' PHE . . . . . 0.403 ' HB3' ' O ' ' A' ' 99' ' ' LEU . 88.6 t80 -60.72 -44.71 96.29 Favored 'General case' 0 C--N 1.326 -0.438 0 CA-C-N 116.366 -0.379 . . . . 0.0 110.812 -177.888 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 65' ' ' GLY . . . . . . . . . . . . . . . -68.47 -23.83 75.15 Favored Glycine 0 N--CA 1.451 -0.365 0 C-N-CA 120.765 -0.731 . . . . 0.0 112.374 179.622 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 66' ' ' ASP . . . . . . . . . . . . . 29.9 t70 -74.64 -47.65 30.82 Favored 'General case' 0 C--N 1.322 -0.598 0 N-CA-C 109.512 -0.551 . . . . 0.0 109.512 177.221 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 67' ' ' TRP . . . . . 0.474 ' HA ' ' HG3' ' A' ' 70' ' ' LYS . 64.3 m95 -65.29 -31.37 72.47 Favored 'General case' 0 C--N 1.33 -0.243 0 CA-C-N 115.91 -0.586 . . . . 0.0 110.906 175.361 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 68' ' ' ALA . . . . . 0.541 ' O ' ' HG ' ' A' ' 72' ' ' LEU . . . -61.93 -41.69 98.25 Favored 'General case' 0 C--N 1.327 -0.403 0 CA-C-N 116.171 -0.468 . . . . 0.0 110.239 174.935 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 69' ' ' GLU . . . . . . . . . . . . . 76.8 tt0 -63.74 -41.44 98.03 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.106 -0.497 . . . . 0.0 109.884 177.2 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 70' ' ' LYS . . . . . 0.474 ' HG3' ' HA ' ' A' ' 67' ' ' TRP . 14.1 mmmt -55.72 -47.29 77.12 Favored 'General case' 0 C--N 1.333 -0.122 0 CA-C-N 115.696 -0.684 . . . . 0.0 109.695 174.919 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 71' ' ' PHE . . . . . . . . . . . . . 91.9 t80 -63.97 -44.54 92.44 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 115.378 -0.828 . . . . 0.0 111.219 179.421 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 72' ' ' LEU . . . . . 0.541 ' HG ' ' O ' ' A' ' 68' ' ' ALA . 96.4 mt -60.36 -49.11 78.88 Favored 'General case' 0 C--N 1.327 -0.405 0 CA-C-O 120.735 0.303 . . . . 0.0 111.05 -178.914 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 73' ' ' LYS . . . . . . . . . . . . . 55.7 tptt -65.26 -37.56 87.6 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-O 121.032 0.444 . . . . 0.0 110.331 179.607 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 74' ' ' SER . . . . . . . . . . . . . 27.3 t -66.11 -41.7 90.23 Favored 'General case' 0 C--N 1.326 -0.436 0 CA-C-N 116.07 -0.514 . . . . 0.0 110.277 177.994 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 75' ' ' LYS . . . . . 0.41 ' HA ' ' HD2' ' A' ' 75' ' ' LYS . 38.7 tptt -72.13 -30.8 65.41 Favored 'General case' 0 N--CA 1.447 -0.622 0 CA-C-O 121.011 0.434 . . . . 0.0 110.687 -177.927 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 76' ' ' GLU . . . . . . . . . . . . . 37.2 tt0 -58.82 -50.14 75.07 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.202 -0.454 . . . . 0.0 109.811 171.591 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 77' ' ' ALA . . . . . . . . . . . . . . . -69.3 -27.34 65.31 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 115.935 -0.575 . . . . 0.0 110.748 178.348 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 78' ' ' ASP . . . . . . . . . . . . . 24.1 t70 -59.27 -31.15 68.84 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 115.752 -0.658 . . . . 0.0 110.009 175.823 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 79' ' ' GLY . . . . . . . . . . . . . . . 105.17 53.22 0.8 Allowed Glycine 0 N--CA 1.451 -0.319 0 C-N-CA 120.715 -0.755 . . . . 0.0 113.238 172.466 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 80' ' ' VAL . . . . . . . . . . . . . 30.2 m -99.73 161.38 3.26 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.519 0 CA-C-O 120.685 0.279 . . . . 0.0 111.001 178.644 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 81' ' ' SER . . . . . . . . . . . . . 5.5 m -66.09 154.61 39.13 Favored 'General case' 0 C--N 1.325 -0.496 0 CA-C-N 115.767 -0.651 . . . . 0.0 110.379 178.164 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 82' ' ' VAL . . . . . . . . . . . . . 8.7 p -59.78 -40.21 81.93 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.297 0 CA-C-O 120.542 0.21 . . . . 0.0 111.199 -178.433 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 83' ' ' SER . . . . . . . . . . . . . 69.2 m -74.09 -22.29 59.56 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-O 120.662 0.267 . . . . 0.0 110.725 178.59 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 84' ' ' GLN . . . . . . . . . . . . . 50.8 tt0 -71.96 -44.33 63.74 Favored 'General case' 0 N--CA 1.455 -0.189 0 N-CA-C 109.336 -0.616 . . . . 0.0 109.336 178.228 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 85' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -63.4 -36.14 82.75 Favored 'General case' 0 C--N 1.327 -0.409 0 N-CA-C 109.12 -0.696 . . . . 0.0 109.12 175.869 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 86' ' ' ASN . . . . . . . . . . . . . 8.1 m-80 -66.74 -37.52 84.82 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 115.612 -0.722 . . . . 0.0 111.707 178.392 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 87' ' ' SER . . . . . . . . . . . . . 66.6 p -67.1 -29.74 69.57 Favored 'General case' 0 C--N 1.332 -0.189 0 C-N-CA 120.667 -0.413 . . . . 0.0 110.694 178.846 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 88' ' ' TYR . . . . . . . . . . . . . 26.1 m-85 -66.68 -35.63 80.61 Favored 'General case' 0 N--CA 1.454 -0.227 0 N-CA-C 109.755 -0.461 . . . . 0.0 109.755 174.827 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 89' ' ' LYS . . . . . . . . . . . . . 62.9 mttm -63.89 -38.68 91.99 Favored 'General case' 0 CA--C 1.529 0.167 0 CA-C-N 116.063 -0.517 . . . . 0.0 110.113 173.873 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 90' ' ' ASN . . . . . 0.543 ' O ' ' HB3' ' A' ' 94' ' ' ASN . 6.8 m120 -57.88 -35.68 71.33 Favored 'General case' 0 N--CA 1.467 0.389 0 CA-C-N 116.055 -0.521 . . . . 0.0 111.012 177.441 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 91' ' ' TYR . . . . . 0.49 ' CD1' HG12 ' A' ' 129' ' ' ILE . 23.1 m-85 -84.54 -49.14 8.86 Favored 'General case' 0 C--N 1.318 -0.781 0 CA-C-N 116.325 -0.398 . . . . 0.0 111.121 -179.773 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 92' ' ' CYS . . . . . 0.496 ' HA ' ' HB2' ' A' ' 96' ' ' LEU . 50.3 t -70.22 -48.72 55.79 Favored 'General case' 0 C--N 1.323 -0.564 0 N-CA-C 112.236 0.458 . . . . 0.0 112.236 -174.524 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 93' ' ' ARG . . . . . 0.522 ' O ' ' HB3' ' A' ' 97' ' ' SER . 54.7 ttt180 -80.95 -25.13 37.62 Favored 'General case' 0 C--N 1.325 -0.464 0 CA-C-O 120.741 0.305 . . . . 0.0 111.63 -172.669 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 94' ' ' ASN . . . . . 0.543 ' HB3' ' O ' ' A' ' 90' ' ' ASN . 24.0 t-20 -100.18 -61.36 1.38 Allowed 'General case' 0 C--N 1.325 -0.467 0 C-N-CA 120.66 -0.416 . . . . 0.0 111.397 -178.514 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 95' ' ' HIS . . . . . . . . . . . . . 60.5 m80 -85.82 -14.46 45.0 Favored 'General case' 0 C--N 1.326 -0.453 0 N-CA-C 112.494 0.553 . . . . 0.0 112.494 -170.987 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 96' ' ' LEU . . . . . 0.496 ' HB2' ' HA ' ' A' ' 92' ' ' CYS . 93.5 mt -119.61 17.2 12.84 Favored 'General case' 0 C--N 1.321 -0.661 0 CA-C-O 120.796 0.332 . . . . 0.0 110.449 -179.606 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 97' ' ' SER . . . . . 0.523 ' N ' ' HD2' ' A' ' 98' ' ' PRO . 22.2 p -61.88 -42.19 81.13 Favored Pre-proline 0 CA--C 1.543 0.675 0 N-CA-C 113.073 0.768 . . . . 0.0 113.073 -176.251 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 98' ' ' PRO . . . . . 0.523 ' HD2' ' N ' ' A' ' 97' ' ' SER . 36.3 Cg_endo -65.42 -26.09 55.62 Favored 'Trans proline' 0 C--N 1.36 1.137 0 C-N-CA 121.431 1.421 . . . . 0.0 112.037 178.378 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 99' ' ' LEU . . . . . 0.403 ' O ' ' HB3' ' A' ' 64' ' ' PHE . 80.9 mt -89.93 -21.67 22.36 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 115.978 -0.555 . . . . 0.0 110.673 -178.45 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 100' ' ' TYR . . . . . . . . . . . . . 28.1 t80 -55.06 -43.15 73.59 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 115.858 -0.61 . . . . 0.0 110.825 -179.07 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 101' ' ' MET . . . . . . . . . . . . . 23.1 ptt? -94.63 14.12 22.06 Favored 'General case' 0 C--N 1.319 -0.723 0 CA-C-N 115.807 -0.633 . . . . 0.0 111.52 -175.727 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 102' ' ' LYS . . . . . . . . . . . . . 64.6 mttm -108.77 165.99 11.14 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-O 120.962 0.41 . . . . 0.0 110.997 178.092 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 103' ' ' SER . . . . . 0.474 ' O ' ' HG2' ' A' ' 106' ' ' GLU . 3.1 m -79.91 143.06 34.58 Favored 'General case' 0 C--N 1.323 -0.559 0 N-CA-C 108.821 -0.807 . . . . 0.0 108.821 172.138 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 104' ' ' LEU . . . . . . . . . . . . . 1.9 pt? -68.14 -18.92 64.76 Favored 'General case' 0 C--N 1.322 -0.618 0 C-N-CA 120.898 -0.321 . . . . 0.0 111.748 -174.103 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 105' ' ' SER . . . . . . . . . . . . . 16.7 p -87.79 -22.17 24.67 Favored 'General case' 0 C--N 1.327 -0.411 0 N-CA-C 111.813 0.301 . . . . 0.0 111.813 -179.171 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 106' ' ' GLU . . . . . 0.474 ' HG2' ' O ' ' A' ' 103' ' ' SER . 11.5 pt-20 -89.66 -7.63 54.24 Favored 'General case' 0 C--N 1.331 -0.199 0 CA-C-O 120.963 0.411 . . . . 0.0 110.583 -177.633 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 107' ' ' ILE . . . . . 0.467 HG13 ' O ' ' A' ' 103' ' ' SER . 73.4 mt -70.41 135.16 28.73 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.48 0 CA-C-N 115.885 -0.598 . . . . 0.0 110.566 179.826 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 108' ' ' LEU . . . . . 0.414 ' HB2' ' HB2' ' A' ' 111' ' ' ASP . 54.3 mt -97.43 129.52 31.61 Favored Pre-proline 0 C--N 1.325 -0.49 0 CA-C-N 116.175 -0.466 . . . . 0.0 110.776 -176.434 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 109' ' ' PRO . . . . . . . . . . . . . 50.6 Cg_exo -56.95 -38.24 96.45 Favored 'Trans proline' 0 CA--C 1.529 0.274 0 C-N-CA 122.752 2.301 . . . . 0.0 112.032 177.213 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 110' ' ' ALA . . . . . . . . . . . . . . . -70.83 -32.37 69.4 Favored 'General case' 0 C--N 1.332 -0.192 0 CA-C-N 116.204 -0.453 . . . . 0.0 110.776 178.751 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 111' ' ' ASP . . . . . 0.417 ' O ' HG13 ' A' ' 115' ' ' ILE . 36.6 t70 -64.93 -45.72 84.62 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.079 -0.51 . . . . 0.0 109.925 179.038 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 112' ' ' ILE . . . . . . . . . . . . . 36.4 mt -64.25 -39.37 85.29 Favored 'Isoleucine or valine' 0 C--O 1.234 0.277 0 CA-C-N 115.589 -0.732 . . . . 0.0 110.511 176.823 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 113' ' ' GLN . . . . . . . . . . . . . 6.5 tp-100 -58.3 -44.73 88.66 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 115.774 -0.648 . . . . 0.0 110.791 178.232 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 114' ' ' SER . . . . . . . . . . . . . 53.5 m -62.57 -36.0 81.29 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.667 -0.242 . . . . 0.0 110.911 178.097 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 115' ' ' ILE . . . . . 0.417 HG13 ' O ' ' A' ' 111' ' ' ASP . 72.4 mt -64.86 -48.63 83.53 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.193 0 CA-C-O 120.686 0.279 . . . . 0.0 110.384 177.707 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 116' ' ' ILE . . . . . . . . . . . . . 40.8 mm -61.45 -43.42 96.76 Favored 'Isoleucine or valine' 0 N--CA 1.463 0.209 0 CA-C-N 116.265 -0.425 . . . . 0.0 110.53 177.833 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 117' ' ' ASN . . . . . . . . . . . . . 3.0 t-20 -60.17 -37.0 78.84 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 115.689 -0.687 . . . . 0.0 111.203 179.964 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 118' ' ' GLU . . . . . . . . . . . . . 48.4 mt-10 -93.8 0.76 56.44 Favored 'General case' 0 C--N 1.326 -0.417 0 CA-C-N 116.382 -0.372 . . . . 0.0 111.713 -178.513 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 119' ' ' THR . . . . . . . . . . . . . 94.2 m -88.04 110.02 20.29 Favored 'General case' 0 N--CA 1.447 -0.6 0 N-CA-C 108.067 -1.086 . . . . 0.0 108.067 168.876 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 120' ' ' LYS . . . . . . . . . . . . . 66.4 mttm -107.69 64.98 0.63 Allowed 'General case' 0 C--N 1.322 -0.601 0 CA-C-O 121.919 0.866 . . . . 0.0 110.471 -172.401 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 121' ' ' LEU . . . . . . . . . . . . . 87.5 mt -119.5 -174.19 2.68 Favored 'General case' 0 C--N 1.321 -0.634 0 CA-C-N 114.567 -1.197 . . . . 0.0 109.639 -179.526 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 122' ' ' ALA . . . . . . . . . . . . . . . -61.2 149.3 38.04 Favored 'General case' 0 C--N 1.325 -0.476 0 CA-C-N 116.337 -0.392 . . . . 0.0 111.364 -179.832 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 123' ' ' LYS . . . . . . . . . . . . . 55.5 pttt -56.14 -33.01 64.77 Favored 'General case' 0 C--N 1.327 -0.378 0 CA-C-N 115.802 -0.635 . . . . 0.0 111.217 178.473 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 124' ' ' ASN . . . . . . . . . . . . . 95.0 m-20 -62.18 -39.96 94.44 Favored 'General case' 0 C--N 1.331 -0.219 0 CA-C-N 116.069 -0.514 . . . . 0.0 110.472 177.944 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 125' ' ' THR . . . . . 0.552 ' O ' HG13 ' A' ' 129' ' ' ILE . 8.6 m -68.29 -41.41 81.01 Favored 'General case' 0 C--N 1.326 -0.424 0 CA-C-N 116.031 -0.532 . . . . 0.0 110.489 -179.895 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 126' ' ' LEU . . . . . . . . . . . . . 92.6 mt -59.99 -45.54 92.38 Favored 'General case' 0 C--O 1.235 0.324 0 CA-C-N 116.071 -0.513 . . . . 0.0 110.755 179.691 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 127' ' ' LYS . . . . . . . . . . . . . 98.8 mttt -67.29 -34.83 78.22 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.018 -0.537 . . . . 0.0 110.766 178.844 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 128' ' ' ALA . . . . . . . . . . . . . . . -65.82 -43.65 87.95 Favored 'General case' 0 C--N 1.327 -0.391 0 CA-C-N 116.162 -0.472 . . . . 0.0 111.059 -179.273 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 129' ' ' ILE . . . . . 0.552 HG13 ' O ' ' A' ' 125' ' ' THR . 59.1 mt -61.2 -41.82 90.98 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.185 0 CA-C-O 121.154 0.502 . . . . 0.0 109.795 176.998 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 130' ' ' ARG . . . . . 0.593 HH21 HG13 ' A' ' 154' ' ' VAL . 3.2 tpp180 -64.5 -48.1 76.45 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 115.843 -0.617 . . . . 0.0 110.723 179.032 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 131' ' ' ASN . . . . . . . . . . . . . 0.9 OUTLIER -57.83 -52.67 64.51 Favored 'General case' 0 C--N 1.328 -0.345 0 O-C-N 123.341 0.4 . . . . 0.0 110.899 -179.887 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 132' ' ' THR . . . . . 0.478 ' O ' HG13 ' A' ' 136' ' ' ILE . 33.3 m -54.55 -54.06 46.29 Favored 'General case' 0 C--N 1.327 -0.384 0 CA-C-N 116.098 -0.501 . . . . 0.0 110.94 -179.451 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 133' ' ' ALA . . . . . . . . . . . . . . . -62.9 -39.32 94.14 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 116.284 -0.416 . . . . 0.0 111.932 -176.929 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 134' ' ' SER . . . . . . . . . . . . . 79.4 p -65.46 -32.53 74.19 Favored 'General case' 0 C--O 1.233 0.188 0 CA-C-O 120.55 0.214 . . . . 0.0 111.259 -176.514 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 135' ' ' GLN . . . . . 0.474 ' O ' ' HG2' ' A' ' 138' ' ' ARG . 36.1 mt-30 -79.73 -26.11 40.9 Favored 'General case' 0 N--CA 1.453 -0.306 0 C-N-CA 120.946 -0.302 . . . . 0.0 110.808 -179.919 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 136' ' ' ILE . . . . . 0.478 HG13 ' O ' ' A' ' 132' ' ' THR . 73.5 mt -65.34 -46.59 89.94 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.323 0 N-CA-C 109.823 -0.436 . . . . 0.0 109.823 173.791 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 137' ' ' PHE . . . . . 0.42 ' O ' HG13 ' A' ' 141' ' ' ILE . 53.3 m-85 -64.87 -40.5 95.23 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 116.078 -0.51 . . . . 0.0 111.102 177.33 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 138' ' ' ARG . . . . . 0.474 ' HG2' ' O ' ' A' ' 135' ' ' GLN . 0.2 OUTLIER -67.5 -26.07 66.17 Favored 'General case' 0 CA--C 1.53 0.203 0 CA-C-O 120.805 0.336 . . . . 0.0 110.391 -177.751 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' A' A ' 139' ' ' LEU . . . . . 0.4 ' HA ' ' HG2' ' A' ' 142' ' ' GLU . 62.2 tp -67.65 -34.3 76.67 Favored 'General case' 0 C--N 1.332 -0.195 0 CA-C-O 121.28 0.562 . . . . 0.0 109.561 176.706 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 140' ' ' ALA . . . . . . . . . . . . . . . -74.61 -33.78 62.68 Favored 'General case' 0 C--N 1.325 -0.459 0 CA-C-N 115.907 -0.588 . . . . 0.0 110.081 175.697 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 141' ' ' ILE . . . . . 0.623 ' HA ' ' O ' ' A' ' 146' ' ' ILE . 75.9 mt -62.3 -47.94 90.73 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.28 0 CA-C-N 115.947 -0.569 . . . . 0.0 111.069 176.795 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 142' ' ' GLU . . . . . 0.4 ' HG2' ' HA ' ' A' ' 139' ' ' LEU . 5.3 pt-20 -69.56 -16.55 63.44 Favored 'General case' 0 C--N 1.331 -0.229 0 CA-C-O 120.917 0.389 . . . . 0.0 110.975 -179.52 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 143' ' ' ASN . . . . . . . . . . . . . 18.3 m-80 -98.41 2.9 48.31 Favored 'General case' 0 C--N 1.326 -0.435 0 CA-C-N 116.399 -0.364 . . . . 0.0 110.485 175.68 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 144' ' ' ARG . . . . . 0.416 HH11 ' HD2' ' A' ' 144' ' ' ARG . 25.6 mtm180 63.43 20.55 12.31 Favored 'General case' 0 N--CA 1.464 0.271 0 CA-C-N 115.649 -0.705 . . . . 0.0 112.146 175.663 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 145' ' ' ALA . . . . . . . . . . . . . . . -75.12 -37.58 61.38 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-O 121.367 0.604 . . . . 0.0 109.418 176.421 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 146' ' ' ILE . . . . . 0.623 ' O ' ' HA ' ' A' ' 141' ' ' ILE . 13.7 tt -146.85 137.9 18.17 Favored 'Isoleucine or valine' 0 N--CA 1.449 -0.513 0 CA-C-N 115.254 -0.885 . . . . 0.0 108.823 175.192 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 147' ' ' ASP . . . . . . . . . . . . . 7.9 p-10 -106.04 19.71 20.1 Favored 'General case' 0 C--N 1.321 -0.639 0 CA-C-O 121.19 0.519 . . . . 0.0 110.188 -178.947 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 148' ' ' PHE . . . . . 0.412 ' H ' HG12 ' A' ' 146' ' ' ILE . 70.6 t80 -132.12 123.35 26.96 Favored 'General case' 0 C--N 1.32 -0.689 0 CA-C-N 115.353 -0.84 . . . . 0.0 109.846 -175.058 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 149' ' ' ASN . . . . . 0.518 ' HB2' HD13 ' A' ' 141' ' ' ILE . 31.5 t-20 -107.58 98.12 22.79 Favored Pre-proline 0 C--N 1.325 -0.494 0 N-CA-C 110.058 -0.349 . . . . 0.0 110.058 -179.656 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 150' ' ' PRO . . . . . . . . . . . . . 55.2 Cg_endo -70.44 -13.89 33.41 Favored 'Trans proline' 0 C--N 1.344 0.338 0 C-N-CA 122.765 2.31 . . . . 0.0 112.661 -176.51 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 151' ' ' ALA . . . . . . . . . . . . . . . -71.24 -20.02 62.29 Favored 'General case' 0 C--N 1.326 -0.414 0 CA-C-N 116.206 -0.452 . . . . 0.0 110.987 -179.374 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 152' ' ' ASP . . . . . . . . . . . . . 31.0 t70 -71.99 -21.74 61.53 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-O 121.186 0.517 . . . . 0.0 110.902 -179.82 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 153' ' ' TYR . . . . . . . . . . . . . 99.2 m-85 -92.58 1.73 57.1 Favored 'General case' 0 C--N 1.324 -0.532 0 CA-C-N 115.893 -0.594 . . . . 0.0 110.81 -177.962 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 154' ' ' VAL . . . . . 0.593 HG13 HH21 ' A' ' 130' ' ' ARG . 60.6 t -88.11 106.52 16.56 Favored 'Isoleucine or valine' 0 N--CA 1.448 -0.529 0 N-CA-C 109.529 -0.545 . . . . 0.0 109.529 175.949 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 155' ' ' ARG . . . . . . . . . . . . . 12.0 tpp180 -77.01 121.6 23.75 Favored 'General case' 0 C--N 1.32 -0.675 0 CA-C-N 115.853 -0.612 . . . . 0.0 109.891 -178.982 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 156' ' ' ILE . . . . . . . . . . . . . 48.5 mm -90.0 120.2 69.31 Favored Pre-proline 0 C--N 1.325 -0.499 0 CA-C-N 116.272 -0.422 . . . . 0.0 110.213 179.932 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 157' ' ' PRO . . . . . . . . . . . . . 55.5 Cg_endo -70.32 138.18 35.47 Favored 'Trans proline' 0 N--CA 1.461 -0.402 0 C-N-CA 122.349 2.033 . . . . 0.0 111.819 178.372 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 158' ' ' LYS . . . . . . . . . . . . . 33.6 mtmt -103.44 4.91 36.64 Favored 'General case' 0 C--N 1.321 -0.651 0 CA-C-O 121.111 0.481 . . . . 0.0 110.799 -179.796 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 159' ' ' ILE . . . . . . . . . . . . . 2.7 mp 72.54 -60.29 0.28 Allowed 'Isoleucine or valine' 0 N--CA 1.463 0.208 0 CA-C-N 114.907 -1.042 . . . . 0.0 112.229 171.359 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 160' ' ' ALA . . . . . . . . . . . . . . . -131.36 175.08 9.44 Favored 'General case' 0 C--N 1.317 -0.84 0 N-CA-C 111.616 0.228 . . . . 0.0 111.616 -170.883 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 161' ' ' LEU . . . . . . . . . . . . . 89.2 mt 60.9 36.17 18.98 Favored 'General case' 0 C--O 1.234 0.263 0 O-C-N 123.791 0.682 . . . . 0.0 110.563 -177.031 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 162' ' ' GLU . . . . . . . . . . . . . 12.5 pt-20 -67.89 167.95 12.62 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 115.541 -0.754 . . . . 0.0 110.241 179.159 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 163' ' ' HIS . . . . . . . . . . . . . 9.2 t-160 -119.29 51.66 1.13 Allowed 'General case' 0 C--N 1.323 -0.562 0 C-N-CA 120.695 -0.402 . . . . 0.0 110.23 -176.276 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 164' ' ' HIS . . . . . . . . . . . . . 0.9 OUTLIER 166.41 60.8 0.0 OUTLIER 'General case' 0 N--CA 1.471 0.608 0 O-C-N 124.353 1.033 . . . . 0.0 109.752 177.958 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 165' ' ' HIS . . . . . . . . . . . . . 70.0 t60 -73.49 -45.98 50.79 Favored 'General case' 0 C--N 1.327 -0.413 0 C-N-CA 120.561 -0.456 . . . . 0.0 110.63 -174.995 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 166' ' ' HIS . . . . . . . . . . . . . 1.9 p-80 -85.37 114.6 22.56 Favored 'General case' 0 C--N 1.325 -0.496 0 CA-C-O 121.221 0.534 . . . . 0.0 109.822 173.103 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 167' ' ' HIS . . . . . . . . . . . . . 4.5 p-80 -155.15 157.9 38.13 Favored 'General case' 0 C--N 1.324 -0.522 0 CA-C-N 116.263 -0.426 . . . . 0.0 111.442 -173.27 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 168' ' ' HIS . . . . . . . . . . . . . 24.5 m80 . . . . . 0 C--O 1.246 0.885 0 CA-C-O 118.561 -0.733 . . . . 0.0 109.491 170.678 . . . . . . . . 0 0 . 1 . 004 nuclear orig full ' A' A ' 61' ' ' ARG . . . . . . . . . . . . . 18.2 mtt180 . . . . . 0 N--CA 1.48 1.062 0 CA-C-O 120.807 0.336 . . . . 0.0 111.148 . . . . . . . . . 0 0 . 1 . 004 nuclear orig full ' A' A ' 62' ' ' ASP . . . . . . . . . . . . . 19.6 m-20 -79.69 -176.03 5.15 Favored 'General case' 0 C--O 1.235 0.327 0 CA-C-O 121.708 0.766 . . . . 0.0 112.6 -171.07 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 63' ' ' SER . . . . . . . . . . . . . 36.5 t -116.89 150.32 38.66 Favored 'General case' 0 C--N 1.324 -0.508 0 CA-C-N 114.774 -1.103 . . . . 0.0 109.744 179.224 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 64' ' ' PHE . . . . . 0.445 ' HB3' ' O ' ' A' ' 99' ' ' LEU . 87.4 t80 -59.07 -38.61 79.85 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-N 116.207 -0.451 . . . . 0.0 110.357 179.753 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 65' ' ' GLY . . . . . . . . . . . . . . . -65.38 -32.32 83.21 Favored Glycine 0 N--CA 1.45 -0.38 0 C-N-CA 120.91 -0.662 . . . . 0.0 112.745 179.99 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 66' ' ' ASP . . . . . . . . . . . . . 20.3 t70 -68.33 -41.45 80.78 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-O 121.043 0.449 . . . . 0.0 110.154 -179.645 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 67' ' ' TRP . . . . . . . . . . . . . 80.4 m95 -74.84 -31.56 61.69 Favored 'General case' 0 C--N 1.327 -0.399 0 CA-C-N 116.027 -0.533 . . . . 0.0 110.979 178.061 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 68' ' ' ALA . . . . . . . . . . . . . . . -62.07 -41.66 98.39 Favored 'General case' 0 C--N 1.33 -0.243 0 N-CA-C 109.874 -0.417 . . . . 0.0 109.874 174.342 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 69' ' ' GLU . . . . . . . . . . . . . 3.3 tm-20 -54.32 -51.09 65.79 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 115.607 -0.724 . . . . 0.0 110.246 175.034 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 70' ' ' LYS . . . . . . . . . . . . . 48.3 mttp -72.81 -25.44 61.14 Favored 'General case' 0 C--N 1.324 -0.531 0 CA-C-N 115.904 -0.589 . . . . 0.0 111.828 -176.688 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 71' ' ' PHE . . . . . . . . . . . . . 69.5 t80 -70.36 -49.38 49.78 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-O 120.876 0.37 . . . . 0.0 110.29 175.337 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 72' ' ' LEU . . . . . 0.434 HD11 ' HA ' ' A' ' 72' ' ' LEU . 4.0 mm? -65.42 -34.71 78.93 Favored 'General case' 0 C--N 1.326 -0.446 0 CA-C-O 120.882 0.373 . . . . 0.0 110.222 177.065 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 73' ' ' LYS . . . . . . . . . . . . . 3.9 tppp? -64.05 -45.9 86.77 Favored 'General case' 0 C--N 1.325 -0.469 0 CA-C-N 115.84 -0.618 . . . . 0.0 110.513 178.43 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 74' ' ' SER . . . . . 0.42 ' O ' ' HB2' ' A' ' 78' ' ' ASP . 13.1 p -70.33 -27.73 64.6 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 116.333 -0.394 . . . . 0.0 111.037 -179.023 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 75' ' ' LYS . . . . . 0.452 ' HD3' ' HA ' ' A' ' 75' ' ' LYS . 67.9 mmtt -74.83 -34.18 62.28 Favored 'General case' 0 C--O 1.236 0.346 0 CA-C-O 120.929 0.395 . . . . 0.0 110.842 174.462 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 76' ' ' GLU . . . . . . . . . . . . . 7.5 tp10 -63.06 -41.54 99.49 Favored 'General case' 0 C--N 1.324 -0.526 0 CA-C-O 121.369 0.604 . . . . 0.0 109.608 173.842 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 77' ' ' ALA . . . . . . . . . . . . . . . -81.18 -10.09 59.69 Favored 'General case' 0 C--N 1.327 -0.404 0 CA-C-N 115.755 -0.657 . . . . 0.0 110.92 177.033 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 78' ' ' ASP . . . . . 0.42 ' HB2' ' O ' ' A' ' 74' ' ' SER . 17.9 t70 -77.23 -49.48 15.0 Favored 'General case' 0 C--N 1.327 -0.4 0 CA-C-N 115.999 -0.546 . . . . 0.0 110.101 178.824 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 79' ' ' GLY . . . . . . . . . . . . . . . 121.43 25.54 2.17 Favored Glycine 0 N--CA 1.449 -0.489 0 C-N-CA 120.573 -0.822 . . . . 0.0 113.052 177.227 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 80' ' ' VAL . . . . . . . . . . . . . 15.9 m -67.67 157.39 6.24 Favored 'Isoleucine or valine' 0 C--O 1.234 0.262 0 CA-C-N 117.088 0.444 . . . . 0.0 110.559 176.734 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 81' ' ' SER . . . . . . . . . . . . . 28.7 t -58.67 138.39 57.02 Favored 'General case' 0 N--CA 1.451 -0.418 0 CA-C-N 115.985 -0.552 . . . . 0.0 109.755 174.812 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 82' ' ' VAL . . . . . . . . . . . . . 14.0 p -58.39 -34.07 49.49 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.583 0 CA-C-O 120.732 0.301 . . . . 0.0 110.786 -179.44 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 83' ' ' SER . . . . . . . . . . . . . 23.3 t -69.38 -43.16 74.09 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-O 121.17 0.509 . . . . 0.0 109.861 177.715 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 84' ' ' GLN . . . . . . . . . . . . . 24.6 tp60 -64.58 -37.62 88.17 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 115.757 -0.656 . . . . 0.0 110.085 178.008 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 85' ' ' LEU . . . . . . . . . . . . . 41.1 tp -66.02 -43.07 88.73 Favored 'General case' 0 C--N 1.327 -0.403 0 CA-C-N 115.646 -0.706 . . . . 0.0 110.564 177.781 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 86' ' ' ASN . . . . . . . . . . . . . 12.3 m-80 -59.6 -38.66 81.86 Favored 'General case' 0 N--CA 1.463 0.189 0 CA-C-N 116.452 -0.34 . . . . 0.0 110.405 176.469 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 87' ' ' SER . . . . . . . . . . . . . 33.1 t -60.62 -48.22 82.75 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 115.903 -0.589 . . . . 0.0 110.4 177.341 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 88' ' ' TYR . . . . . . . . . . . . . 21.8 m-85 -61.58 -45.16 95.32 Favored 'General case' 0 C--O 1.234 0.28 0 CA-C-O 120.786 0.327 . . . . 0.0 110.745 178.311 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 89' ' ' LYS . . . . . . . . . . . . . 97.4 mttt -61.27 -39.33 90.0 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 116.127 -0.488 . . . . 0.0 111.066 179.328 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 90' ' ' ASN . . . . . . . . . . . . . 8.7 t30 -65.26 -41.95 93.73 Favored 'General case' 0 C--N 1.327 -0.37 0 CA-C-O 120.762 0.315 . . . . 0.0 110.578 -179.399 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 91' ' ' TYR . . . . . . . . . . . . . 21.4 m-30 -64.63 -43.22 94.42 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.392 -0.367 . . . . 0.0 111.221 179.93 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 92' ' ' CYS . . . . . 0.519 ' HA ' HD11 ' A' ' 96' ' ' LEU . 58.4 m -76.37 -42.89 43.05 Favored 'General case' 0 C--N 1.323 -0.564 0 CA-C-N 116.5 -0.318 . . . . 0.0 111.844 -175.846 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 93' ' ' ARG . . . . . . . . . . . . . 63.8 ttt180 -79.25 -36.4 39.98 Favored 'General case' 0 C--N 1.326 -0.426 0 CA-C-O 120.669 0.271 . . . . 0.0 111.478 -174.46 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 94' ' ' ASN . . . . . . . . . . . . . 4.1 m-20 -101.03 -49.96 3.95 Favored 'General case' 0 C--N 1.328 -0.337 0 N-CA-C 111.997 0.369 . . . . 0.0 111.997 -174.509 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 95' ' ' HIS . . . . . . . . . . . . . 0.6 OUTLIER -82.25 -32.53 29.63 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-O 120.943 0.402 . . . . 0.0 111.248 -174.0 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 96' ' ' LEU . . . . . 0.555 HD22 ' NH2' ' A' ' 130' ' ' ARG . 93.3 mt -98.68 22.48 9.92 Favored 'General case' 0 C--N 1.324 -0.524 0 CA-C-N 116.115 -0.493 . . . . 0.0 110.741 179.746 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 97' ' ' SER . . . . . 0.543 ' OG ' ' HD3' ' A' ' 98' ' ' PRO . 2.5 p -53.86 -45.1 99.01 Favored Pre-proline 0 CA--C 1.544 0.742 0 N-CA-C 113.29 0.848 . . . . 0.0 113.29 -177.98 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 98' ' ' PRO . . . . . 0.543 ' HD3' ' OG ' ' A' ' 97' ' ' SER . 33.8 Cg_exo -60.3 -43.77 32.59 Favored 'Trans proline' 0 C--N 1.361 1.224 0 C-N-CA 121.593 1.528 . . . . 0.0 111.938 178.454 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 99' ' ' LEU . . . . . 0.445 ' O ' ' HB3' ' A' ' 64' ' ' PHE . 61.1 mt -76.29 -32.45 58.78 Favored 'General case' 0 C--N 1.326 -0.456 0 CA-C-N 115.818 -0.628 . . . . 0.0 110.592 -176.399 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 100' ' ' TYR . . . . . . . . . . . . . 42.8 t80 -57.84 -33.22 68.4 Favored 'General case' 0 C--N 1.326 -0.433 0 CA-C-N 115.73 -0.668 . . . . 0.0 110.801 -179.652 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 101' ' ' MET . . . . . . . . . . . . . 65.8 mtt -102.32 14.29 32.35 Favored 'General case' 0 C--N 1.324 -0.508 0 CA-C-N 116.206 -0.452 . . . . 0.0 110.889 -178.244 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 102' ' ' LYS . . . . . 0.442 ' HG3' ' O ' ' A' ' 98' ' ' PRO . 64.6 mttt -99.05 163.14 12.7 Favored 'General case' 0 C--N 1.326 -0.444 0 CA-C-O 121.24 0.543 . . . . 0.0 111.162 179.104 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 103' ' ' SER . . . . . . . . . . . . . 20.3 m -80.3 137.06 36.54 Favored 'General case' 0 N--CA 1.446 -0.662 0 CA-C-N 115.307 -0.86 . . . . 0.0 109.134 173.533 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 104' ' ' LEU . . . . . 0.557 ' HG ' HD13 ' A' ' 146' ' ' ILE . 50.3 tp -55.07 -43.82 74.25 Favored 'General case' 0 C--N 1.327 -0.409 0 N-CA-C 112.65 0.611 . . . . 0.0 112.65 -171.293 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 105' ' ' SER . . . . . . . . . . . . . 15.5 m -84.01 -9.72 58.44 Favored 'General case' 0 C--N 1.321 -0.665 0 N-CA-C 112.702 0.631 . . . . 0.0 112.702 -171.171 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 106' ' ' GLU . . . . . . . . . . . . . 0.2 OUTLIER -86.95 -22.12 25.8 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-O 120.871 0.367 . . . . 0.0 110.229 -177.082 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 107' ' ' ILE . . . . . . . . . . . . . 62.9 mt -60.66 126.25 18.2 Favored 'Isoleucine or valine' 0 C--O 1.236 0.35 0 CA-C-N 115.747 -0.66 . . . . 0.0 111.491 -174.939 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 108' ' ' LEU . . . . . 0.432 HD11 ' HB1' ' A' ' 110' ' ' ALA . 1.4 pt? -112.25 149.32 40.81 Favored Pre-proline 0 C--N 1.325 -0.488 0 CA-C-N 115.432 -0.804 . . . . 0.0 110.31 -179.541 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 109' ' ' PRO . . . . . . . . . . . . . 50.9 Cg_exo -55.01 -39.77 89.25 Favored 'Trans proline' 0 C--N 1.344 0.324 0 C-N-CA 122.952 2.435 . . . . 0.0 112.906 179.674 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 110' ' ' ALA . . . . . 0.432 ' HB1' HD11 ' A' ' 108' ' ' LEU . . . -58.85 -38.67 79.28 Favored 'General case' 0 N--CA 1.464 0.243 0 N-CA-C 111.779 0.289 . . . . 0.0 111.779 -178.209 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 111' ' ' ASP . . . . . . . . . . . . . 28.2 t70 -66.49 -45.91 78.05 Favored 'General case' 0 C--N 1.327 -0.379 0 CA-C-O 121.246 0.546 . . . . 0.0 110.155 -178.172 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 112' ' ' ILE . . . . . 0.503 HD11 ' HB2' ' A' ' 150' ' ' PRO . 58.4 mt -65.74 -38.6 82.63 Favored 'Isoleucine or valine' 0 C--O 1.239 0.519 0 CA-C-N 115.564 -0.744 . . . . 0.0 110.581 177.486 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 113' ' ' GLN . . . . . . . . . . . . . 27.1 tp60 -61.91 -40.57 95.93 Favored 'General case' 0 C--N 1.327 -0.384 0 CA-C-N 115.266 -0.879 . . . . 0.0 110.348 179.597 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 114' ' ' SER . . . . . . . . . . . . . 19.0 t -60.18 -43.95 95.45 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 116.088 -0.506 . . . . 0.0 110.152 177.687 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 115' ' ' ILE . . . . . . . . . . . . . 69.0 mt -54.88 -39.52 48.93 Favored 'Isoleucine or valine' 0 CA--C 1.53 0.195 0 CA-C-O 120.8 0.333 . . . . 0.0 110.677 178.491 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 116' ' ' ILE . . . . . 0.486 HG12 HH11 ' A' ' 130' ' ' ARG . 23.3 mm -70.02 -40.0 77.99 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.238 0 CA-C-N 116.425 -0.352 . . . . 0.0 111.332 177.905 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 117' ' ' ASN . . . . . . . . . . . . . 6.4 t30 -67.39 -32.82 73.98 Favored 'General case' 0 C--N 1.324 -0.51 0 CA-C-O 120.948 0.404 . . . . 0.0 110.501 -178.772 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 118' ' ' GLU . . . . . . . . . . . . . 36.9 mt-10 -83.7 -30.61 26.63 Favored 'General case' 0 C--N 1.327 -0.391 0 CA-C-N 115.808 -0.633 . . . . 0.0 111.564 -178.848 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 119' ' ' THR . . . . . . . . . . . . . 97.9 m -83.77 121.06 26.79 Favored 'General case' 0 C--N 1.325 -0.467 0 CA-C-O 120.977 0.417 . . . . 0.0 111.399 -177.584 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 120' ' ' LYS . . . . . . . . . . . . . 74.6 mmtt -109.09 86.11 2.22 Favored 'General case' 0 C--N 1.321 -0.666 0 CA-C-O 121.293 0.568 . . . . 0.0 110.868 176.716 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 121' ' ' LEU . . . . . . . . . . . . . 85.8 mt -120.52 -175.2 2.97 Favored 'General case' 0 C--N 1.319 -0.755 0 CA-C-N 115.235 -0.893 . . . . 0.0 108.841 174.727 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 122' ' ' ALA . . . . . . . . . . . . . . . -58.5 139.42 55.69 Favored 'General case' 0 C--N 1.324 -0.529 0 N-CA-C 109.325 -0.62 . . . . 0.0 109.325 173.871 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 123' ' ' LYS . . . . . . . . . . . . . 91.6 mttt -62.33 -33.04 73.93 Favored 'General case' 0 C--N 1.322 -0.618 0 CA-C-O 121.141 0.495 . . . . 0.0 110.832 -174.432 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 124' ' ' ASN . . . . . . . . . . . . . 42.9 m-80 -65.56 -39.07 91.26 Favored 'General case' 0 C--N 1.325 -0.49 0 CA-C-N 115.666 -0.697 . . . . 0.0 110.312 175.09 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 125' ' ' THR . . . . . 0.474 ' O ' HG13 ' A' ' 129' ' ' ILE . 17.3 m -69.75 -37.39 76.42 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 116.001 -0.545 . . . . 0.0 110.691 179.48 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 126' ' ' LEU . . . . . . . . . . . . . 98.2 mt -56.8 -51.45 68.88 Favored 'General case' 0 C--O 1.237 0.442 0 CA-C-N 116.27 -0.423 . . . . 0.0 110.949 179.364 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 127' ' ' LYS . . . . . 0.532 ' HB3' HG23 ' A' ' 156' ' ' ILE . 12.7 ptmm? -71.29 -21.29 62.1 Favored 'General case' 0 C--N 1.327 -0.41 0 CA-C-N 116.269 -0.423 . . . . 0.0 111.254 179.593 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 128' ' ' ALA . . . . . . . . . . . . . . . -69.08 -43.02 75.4 Favored 'General case' 0 C--N 1.331 -0.222 0 CA-C-O 120.859 0.362 . . . . 0.0 110.654 175.353 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 129' ' ' ILE . . . . . 0.474 HG13 ' O ' ' A' ' 125' ' ' THR . 51.9 mt -66.07 -29.45 46.83 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.235 0 CA-C-O 121.177 0.513 . . . . 0.0 110.03 177.779 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 130' ' ' ARG . . . . . 0.844 ' HA ' ' HE ' ' A' ' 130' ' ' ARG . 0.4 OUTLIER -76.09 -43.31 44.06 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.397 -0.365 . . . . 0.0 110.932 175.69 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' A' A ' 131' ' ' ASN . . . . . 0.566 ' O ' ' HG2' ' A' ' 135' ' ' GLN . 27.2 t-20 -55.86 -51.51 67.29 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-O 120.889 0.376 . . . . 0.0 110.259 177.649 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 132' ' ' THR . . . . . . . . . . . . . 28.5 m -54.81 -48.57 72.61 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 115.569 -0.741 . . . . 0.0 110.966 178.454 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 133' ' ' ALA . . . . . . . . . . . . . . . -63.15 -39.27 94.18 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.122 -0.49 . . . . 0.0 111.04 179.654 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 134' ' ' SER . . . . . . . . . . . . . 11.1 t -63.98 -38.56 91.53 Favored 'General case' 0 C--N 1.327 -0.406 0 CA-C-N 116.372 -0.376 . . . . 0.0 110.429 -179.613 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 135' ' ' GLN . . . . . 0.566 ' HG2' ' O ' ' A' ' 131' ' ' ASN . 78.1 mm-40 -61.04 -37.81 83.92 Favored 'General case' 0 C--N 1.331 -0.229 0 CA-C-O 121.016 0.436 . . . . 0.0 110.198 177.474 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 136' ' ' ILE . . . . . . . . . . . . . 69.9 mt -64.57 -46.62 92.02 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.357 0 CA-C-N 115.71 -0.677 . . . . 0.0 110.683 177.998 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 137' ' ' PHE . . . . . 0.471 ' O ' HG13 ' A' ' 141' ' ' ILE . 53.4 m-85 -61.0 -42.27 98.11 Favored 'General case' 0 N--CA 1.462 0.14 0 CA-C-O 120.908 0.385 . . . . 0.0 110.548 176.192 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 138' ' ' ARG . . . . . 0.515 ' O ' ' HG3' ' A' ' 142' ' ' GLU . 25.9 mtp180 -57.88 -47.11 83.73 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 115.895 -0.593 . . . . 0.0 111.207 177.699 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 139' ' ' LEU . . . . . . . . . . . . . 61.7 tp -56.55 -37.34 70.38 Favored 'General case' 0 C--N 1.327 -0.392 0 CA-C-O 121.28 0.562 . . . . 0.0 110.637 178.67 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 140' ' ' ALA . . . . . 0.504 ' HB1' HD23 ' A' ' 104' ' ' LEU . . . -68.92 -43.09 75.85 Favored 'General case' 0 C--N 1.324 -0.511 0 CA-C-N 115.775 -0.648 . . . . 0.0 110.551 176.955 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 141' ' ' ILE . . . . . 0.471 HG13 ' O ' ' A' ' 137' ' ' PHE . 81.7 mt -60.3 -39.11 79.85 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.254 0 CA-C-N 116.109 -0.496 . . . . 0.0 110.911 177.094 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 142' ' ' GLU . . . . . 0.515 ' HG3' ' O ' ' A' ' 138' ' ' ARG . 42.5 mt-10 -61.5 -32.58 72.61 Favored 'General case' 0 C--N 1.33 -0.243 0 CA-C-N 116.419 -0.355 . . . . 0.0 111.16 179.624 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 143' ' ' ASN . . . . . . . . . . . . . 44.9 m-80 -95.34 6.58 48.63 Favored 'General case' 0 C--N 1.326 -0.42 0 CA-C-N 116.365 -0.38 . . . . 0.0 110.477 178.58 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 144' ' ' ARG . . . . . . . . . . . . . 47.7 mtp85 59.81 30.67 20.23 Favored 'General case' 0 N--CA 1.466 0.333 0 CA-C-N 115.525 -0.761 . . . . 0.0 111.426 179.309 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 145' ' ' ALA . . . . . . . . . . . . . . . -85.5 -9.43 57.43 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 115.897 -0.592 . . . . 0.0 110.237 177.703 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 146' ' ' ILE . . . . . 0.557 HD13 ' HG ' ' A' ' 104' ' ' LEU . 14.8 tt -160.08 150.4 6.0 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.454 0 CA-C-N 115.545 -0.752 . . . . 0.0 109.069 174.992 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 147' ' ' ASP . . . . . . . . . . . . . 21.2 t70 -116.76 19.83 14.28 Favored 'General case' 0 C--N 1.326 -0.447 0 CA-C-O 121.864 0.84 . . . . 0.0 109.469 -177.81 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 148' ' ' PHE . . . . . . . . . . . . . 61.4 t80 -141.93 134.26 27.92 Favored 'General case' 0 C--N 1.321 -0.653 0 CA-C-N 115.321 -0.854 . . . . 0.0 109.985 -171.532 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 149' ' ' ASN . . . . . . . . . . . . . 54.7 t-20 -117.19 95.96 48.25 Favored Pre-proline 0 C--N 1.324 -0.539 0 N-CA-C 109.64 -0.504 . . . . 0.0 109.64 176.816 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 150' ' ' PRO . . . . . 0.503 ' HB2' HD11 ' A' ' 112' ' ' ILE . 23.3 Cg_exo -63.54 -32.26 70.26 Favored 'Trans proline' 0 CA--C 1.528 0.191 0 C-N-CA 122.604 2.202 . . . . 0.0 112.324 -177.692 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 151' ' ' ALA . . . . . . . . . . . . . . . -71.91 -20.09 61.83 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.114 -0.494 . . . . 0.0 111.163 -177.073 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 152' ' ' ASP . . . . . . . . . . . . . 31.9 t70 -68.85 -25.48 64.67 Favored 'General case' 0 C--N 1.326 -0.422 0 CA-C-N 116.196 -0.457 . . . . 0.0 110.854 -179.63 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 153' ' ' TYR . . . . . . . . . . . . . 78.8 m-85 -93.5 -7.29 44.74 Favored 'General case' 0 C--N 1.327 -0.373 0 CA-C-N 115.981 -0.554 . . . . 0.0 111.203 -176.857 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 154' ' ' VAL . . . . . . . . . . . . . 99.3 t -76.33 117.31 20.79 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.42 0 CA-C-O 121.033 0.444 . . . . 0.0 111.346 -175.284 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 155' ' ' ARG . . . . . . . . . . . . . 32.7 ptt85 -80.43 144.05 32.94 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 115.882 -0.599 . . . . 0.0 110.112 177.912 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 156' ' ' ILE . . . . . 0.562 HD11 ' HG3' ' A' ' 130' ' ' ARG . 24.3 mm -115.55 131.89 23.41 Favored Pre-proline 0 C--N 1.323 -0.546 0 CA-C-N 116.133 -0.485 . . . . 0.0 110.653 -179.024 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 157' ' ' PRO . . . . . . . . . . . . . 55.7 Cg_endo -71.13 130.07 17.1 Favored 'Trans proline' 0 N--CA 1.459 -0.5 0 C-N-CA 122.186 1.924 . . . . 0.0 111.278 174.068 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 158' ' ' LYS . . . . . . . . . . . . . 22.9 pttm -150.17 25.13 0.81 Allowed 'General case' 0 C--N 1.32 -0.677 0 CA-C-O 121.519 0.676 . . . . 0.0 110.138 -178.348 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 159' ' ' ILE . . . . . . . . . . . . . 60.1 mt -84.12 122.06 37.35 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.467 0 CA-C-N 115.041 -0.981 . . . . 0.0 109.899 -178.216 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 160' ' ' ALA . . . . . . . . . . . . . . . -132.22 148.26 52.45 Favored 'General case' 0 C--N 1.319 -0.724 0 CA-C-N 116.456 -0.338 . . . . 0.0 110.621 -178.583 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 161' ' ' LEU . . . . . . . . . . . . . 81.7 mt -102.03 7.72 41.15 Favored 'General case' 0 C--N 1.324 -0.501 0 CA-C-O 121.701 0.762 . . . . 0.0 109.485 177.801 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 162' ' ' GLU . . . . . . . . . . . . . 4.3 mp0 -93.09 179.8 5.32 Favored 'General case' 0 C--N 1.319 -0.743 0 CA-C-N 114.783 -1.099 . . . . 0.0 109.636 178.338 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 163' ' ' HIS . . . . . . . . . . . . . 8.5 p80 -67.16 93.44 0.3 Allowed 'General case' 0 C--N 1.324 -0.528 0 CA-C-O 121.5 0.667 . . . . 0.0 110.828 175.308 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 164' ' ' HIS . . . . . . . . . . . . . 81.2 t60 -98.78 -0.95 41.6 Favored 'General case' 0 C--N 1.325 -0.469 0 CA-C-N 115.804 -0.635 . . . . 0.0 110.344 -177.07 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 165' ' ' HIS . . . . . . . . . . . . . 62.3 m-70 -86.54 160.18 19.04 Favored 'General case' 0 C--N 1.327 -0.402 0 N-CA-C 109.179 -0.674 . . . . 0.0 109.179 174.759 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 166' ' ' HIS . . . . . . . . . . . . . 9.1 p80 -139.93 169.9 16.85 Favored 'General case' 0 C--N 1.321 -0.632 0 CA-C-O 120.709 0.29 . . . . 0.0 110.401 178.978 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 167' ' ' HIS . . . . . . . . . . . . . 74.0 m-70 -77.99 149.52 34.07 Favored 'General case' 0 C--N 1.322 -0.596 0 CA-C-O 121.438 0.637 . . . . 0.0 111.489 -176.854 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 168' ' ' HIS . . . . . . . . . . . . . 60.2 m-70 . . . . . 0 C--O 1.249 1.034 0 CA-C-O 118.194 -0.907 . . . . 0.0 108.835 174.195 . . . . . . . . 0 0 . 1 . 005 nuclear orig full ' A' A ' 61' ' ' ARG . . . . . . . . . . . . . 45.3 ttt180 . . . . . 0 N--CA 1.479 0.981 0 CA-C-O 120.72 0.295 . . . . 0.0 111.014 . . . . . . . . . 0 0 . 1 . 005 nuclear orig full ' A' A ' 62' ' ' ASP . . . . . . . . . . . . . 0.0 OUTLIER -91.81 173.85 7.65 Favored 'General case' 0 C--N 1.327 -0.371 0 CA-C-N 116.161 -0.472 . . . . 0.0 110.79 -177.067 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 63' ' ' SER . . . . . . . . . . . . . 93.9 p -106.01 169.53 8.44 Favored 'General case' 0 C--N 1.327 -0.385 0 CA-C-N 116.335 -0.393 . . . . 0.0 110.258 179.197 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 64' ' ' PHE . . . . . 0.462 ' HB2' HD13 ' A' ' 107' ' ' ILE . 64.0 t80 -64.78 -29.91 70.9 Favored 'General case' 0 C--N 1.327 -0.382 0 N-CA-C 109.634 -0.506 . . . . 0.0 109.634 178.587 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 65' ' ' GLY . . . . . . . . . . . . . . . -61.4 -39.37 97.18 Favored Glycine 0 C--N 1.332 0.342 0 CA-C-N 115.885 -0.598 . . . . 0.0 112.133 176.664 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 66' ' ' ASP . . . . . . . . . . . . . 20.5 m-20 -62.57 -51.68 66.39 Favored 'General case' 0 N--CA 1.463 0.187 0 CA-C-O 121.106 0.479 . . . . 0.0 110.162 178.263 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 67' ' ' TRP . . . . . . . . . . . . . 95.7 m95 -68.78 -29.32 67.66 Favored 'General case' 0 C--N 1.326 -0.451 0 CA-C-N 115.577 -0.738 . . . . 0.0 111.937 -177.777 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 68' ' ' ALA . . . . . 0.63 ' HB3' ' SG ' ' A' ' 92' ' ' CYS . . . -61.23 -48.78 79.9 Favored 'General case' 0 C--N 1.324 -0.517 0 CA-C-O 121.086 0.469 . . . . 0.0 110.282 175.725 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 69' ' ' GLU . . . . . . . . . . . . . 5.1 mm-40 -59.71 -44.14 93.82 Favored 'General case' 0 C--N 1.326 -0.416 0 CA-C-N 115.525 -0.761 . . . . 0.0 111.055 176.218 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 70' ' ' LYS . . . . . . . . . . . . . 57.0 mtpt -66.28 -33.97 76.95 Favored 'General case' 0 C--N 1.327 -0.388 0 CA-C-N 115.936 -0.575 . . . . 0.0 110.825 -179.872 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 71' ' ' PHE . . . . . 0.541 ' CE1' ' HB3' ' A' ' 135' ' ' GLN . 65.9 t80 -66.91 -49.35 65.84 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-O 120.843 0.354 . . . . 0.0 110.657 176.683 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 72' ' ' LEU . . . . . 0.441 ' HG ' ' O ' ' A' ' 68' ' ' ALA . 89.9 mt -59.89 -40.58 89.22 Favored 'General case' 0 C--N 1.324 -0.526 0 CA-C-N 116.238 -0.437 . . . . 0.0 110.681 -179.047 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 73' ' ' LYS . . . . . 0.711 ' HA ' ' HG2' ' A' ' 76' ' ' GLU . 28.1 tttp -78.34 -27.0 46.97 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.412 -0.358 . . . . 0.0 111.549 -175.989 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 74' ' ' SER . . . . . . . . . . . . . 22.1 p -75.89 -26.08 56.67 Favored 'General case' 0 C--N 1.321 -0.64 0 C-N-CA 120.197 -0.601 . . . . 0.0 110.226 176.355 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 75' ' ' LYS . . . . . 0.43 ' HG2' ' O ' ' A' ' 71' ' ' PHE . 28.8 mmmt -77.52 -43.25 32.69 Favored 'General case' 0 C--O 1.234 0.251 0 CA-C-N 116.554 -0.293 . . . . 0.0 110.835 177.368 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 76' ' ' GLU . . . . . 0.711 ' HG2' ' HA ' ' A' ' 73' ' ' LYS . 12.2 pt-20 -62.05 -35.39 78.48 Favored 'General case' 0 N--CA 1.462 0.167 0 CA-C-O 120.84 0.353 . . . . 0.0 110.223 176.709 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 77' ' ' ALA . . . . . . . . . . . . . . . -73.8 -32.7 63.88 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.21 -0.45 . . . . 0.0 110.85 176.987 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 78' ' ' ASP . . . . . . . . . . . . . 19.3 t70 -61.68 -54.77 38.26 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.099 -0.5 . . . . 0.0 110.787 178.47 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 79' ' ' GLY . . . . . . . . . . . . . . . 145.89 50.43 0.03 OUTLIER Glycine 0 N--CA 1.45 -0.427 0 C-N-CA 120.275 -0.964 . . . . 0.0 113.068 177.076 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 80' ' ' VAL . . . . . 0.443 HG21 HD22 ' A' ' 85' ' ' LEU . 31.0 m -106.56 155.48 7.34 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.514 0 O-C-N 122.652 -0.322 . . . . 0.0 110.334 177.055 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 81' ' ' SER . . . . . . . . . . . . . 13.0 m -70.73 150.55 45.8 Favored 'General case' 0 C--N 1.32 -0.682 0 CA-C-N 116.137 -0.483 . . . . 0.0 109.789 175.162 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 82' ' ' VAL . . . . . . . . . . . . . 14.1 p -60.75 -35.61 65.37 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.402 0 CA-C-O 120.597 0.237 . . . . 0.0 110.556 179.274 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 83' ' ' SER . . . . . . . . . . . . . 8.5 m -65.29 -37.49 87.31 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-O 121.081 0.467 . . . . 0.0 110.57 177.419 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 84' ' ' GLN . . . . . . . . . . . . . 6.1 tp-100 -68.42 -40.08 81.35 Favored 'General case' 0 C--N 1.332 -0.179 0 CA-C-N 115.971 -0.559 . . . . 0.0 109.609 177.031 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 85' ' ' LEU . . . . . 0.443 HD22 HG21 ' A' ' 80' ' ' VAL . 0.7 OUTLIER -65.12 -36.73 85.2 Favored 'General case' 0 C--N 1.327 -0.385 0 CA-C-N 115.59 -0.732 . . . . 0.0 109.486 177.35 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' A' A ' 86' ' ' ASN . . . . . . . . . . . . . 11.6 m120 -57.64 -39.47 77.06 Favored 'General case' 0 CA--C 1.519 -0.221 0 CA-C-N 116.046 -0.524 . . . . 0.0 110.622 175.261 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 87' ' ' SER . . . . . . . . . . . . . 49.0 m -65.23 -46.3 81.17 Favored 'General case' 0 C--N 1.326 -0.42 0 CA-C-N 116.407 -0.36 . . . . 0.0 110.547 178.588 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 88' ' ' TYR . . . . . . . . . . . . . 49.2 m-85 -57.5 -46.45 83.75 Favored 'General case' 0 N--CA 1.463 0.198 0 CA-C-O 121.01 0.433 . . . . 0.0 110.404 175.495 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 89' ' ' LYS . . . . . . . . . . . . . 38.4 ttmt -66.44 -35.6 80.69 Favored 'General case' 0 C--N 1.324 -0.528 0 CA-C-N 115.652 -0.704 . . . . 0.0 110.734 -178.951 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 90' ' ' ASN . . . . . . . . . . . . . 25.9 t-20 -62.29 -47.86 82.46 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-O 120.943 0.401 . . . . 0.0 110.207 178.553 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 91' ' ' TYR . . . . . . . . . . . . . 31.0 m-85 -62.3 -50.94 69.65 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.085 -0.507 . . . . 0.0 110.185 177.361 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 92' ' ' CYS . . . . . 0.63 ' SG ' ' HB3' ' A' ' 68' ' ' ALA . 42.0 t -63.96 -48.56 76.0 Favored 'General case' 0 C--N 1.323 -0.579 0 N-CA-C 112.368 0.507 . . . . 0.0 112.368 -175.262 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 93' ' ' ARG . . . . . . . . . . . . . 72.5 ttt180 -70.93 -38.5 72.91 Favored 'General case' 0 C--N 1.324 -0.504 0 N-CA-C 111.914 0.338 . . . . 0.0 111.914 -173.293 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 94' ' ' ASN . . . . . . . . . . . . . 73.1 m-20 -102.96 -58.12 1.93 Allowed 'General case' 0 C--N 1.324 -0.527 0 C-N-CA 120.912 -0.315 . . . . 0.0 111.718 -172.437 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 95' ' ' HIS . . . . . . . . . . . . . 78.0 m-70 -74.05 -42.7 59.84 Favored 'General case' 0 C--N 1.326 -0.425 0 CA-C-O 120.73 0.3 . . . . 0.0 111.086 -174.572 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 96' ' ' LEU . . . . . 0.541 ' HB2' ' HA ' ' A' ' 92' ' ' CYS . 96.0 mt -93.16 16.88 11.98 Favored 'General case' 0 C--N 1.325 -0.471 0 CA-C-N 116.475 -0.329 . . . . 0.0 110.63 179.414 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 97' ' ' SER . . . . . 0.571 ' N ' ' HD2' ' A' ' 98' ' ' PRO . 18.6 t -54.37 -47.55 97.28 Favored Pre-proline 0 CA--C 1.537 0.476 0 CA-C-N 115.811 -0.632 . . . . 0.0 111.427 178.665 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 98' ' ' PRO . . . . . 0.583 ' O ' ' HG3' ' A' ' 102' ' ' LYS . 10.3 Cg_endo -53.56 -32.38 63.6 Favored 'Trans proline' 0 C--N 1.36 1.143 0 C-N-CA 122.329 2.019 . . . . 0.0 112.758 175.554 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 99' ' ' LEU . . . . . 0.504 HD23 HG12 ' A' ' 112' ' ' ILE . 10.7 mp -81.22 -39.76 24.87 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-O 120.766 0.317 . . . . 0.0 110.865 178.243 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 100' ' ' TYR . . . . . . . . . . . . . 33.4 t80 -54.03 -33.69 57.98 Favored 'General case' 0 C--N 1.331 -0.225 0 CA-C-N 115.642 -0.708 . . . . 0.0 110.531 179.062 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 101' ' ' MET . . . . . . . . . . . . . 65.0 mtt -91.15 6.41 45.16 Favored 'General case' 0 C--N 1.327 -0.401 0 CA-C-N 115.539 -0.755 . . . . 0.0 111.652 -177.586 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 102' ' ' LYS . . . . . 0.583 ' HG3' ' O ' ' A' ' 98' ' ' PRO . 59.3 mttp -108.92 166.52 10.76 Favored 'General case' 0 C--N 1.326 -0.456 0 CA-C-O 121.555 0.693 . . . . 0.0 111.148 178.942 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 103' ' ' SER . . . . . 0.485 ' O ' HG13 ' A' ' 107' ' ' ILE . 28.6 t -96.93 160.38 14.38 Favored 'General case' 0 C--N 1.32 -0.703 0 CA-C-N 115.199 -0.909 . . . . 0.0 109.312 174.218 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 104' ' ' LEU . . . . . 0.5 ' HB3' HD12 ' A' ' 146' ' ' ILE . 84.9 mt -50.21 -59.57 3.81 Favored 'General case' 0 N--CA 1.468 0.469 0 N-CA-C 113.407 0.891 . . . . 0.0 113.407 -171.087 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 105' ' ' SER . . . . . . . . . . . . . 29.4 t -81.02 -0.47 39.85 Favored 'General case' 0 C--N 1.325 -0.483 0 CA-C-O 121.061 0.457 . . . . 0.0 111.046 -174.115 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 106' ' ' GLU . . . . . . . . . . . . . 3.4 mp0 -99.46 -1.8 37.62 Favored 'General case' 0 C--N 1.325 -0.481 0 CA-C-N 116.131 -0.486 . . . . 0.0 110.702 -175.962 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 107' ' ' ILE . . . . . 0.485 HG13 ' O ' ' A' ' 103' ' ' SER . 76.0 mt -87.13 129.0 39.31 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.455 0 CA-C-N 115.889 -0.596 . . . . 0.0 110.596 179.83 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 108' ' ' LEU . . . . . . . . . . . . . 91.9 mt -97.44 136.63 21.25 Favored Pre-proline 0 C--N 1.321 -0.636 0 CA-C-N 116.093 -0.503 . . . . 0.0 110.206 178.311 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 109' ' ' PRO . . . . . . . . . . . . . 32.5 Cg_exo -59.03 -32.94 98.42 Favored 'Trans proline' 0 CA--C 1.528 0.215 0 C-N-CA 122.738 2.292 . . . . 0.0 111.892 177.06 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 110' ' ' ALA . . . . . . . . . . . . . . . -67.04 -30.72 70.87 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 115.77 -0.65 . . . . 0.0 110.988 178.651 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 111' ' ' ASP . . . . . 0.428 ' O ' HG13 ' A' ' 115' ' ' ILE . 32.5 t70 -65.92 -39.61 90.7 Favored 'General case' 0 C--N 1.331 -0.218 0 N-CA-C 109.448 -0.575 . . . . 0.0 109.448 179.975 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 112' ' ' ILE . . . . . 0.504 HG12 HD23 ' A' ' 99' ' ' LEU . 15.6 mt -68.39 -40.95 83.09 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.308 0 CA-C-N 115.358 -0.837 . . . . 0.0 110.238 177.474 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 113' ' ' GLN . . . . . 0.493 ' HA ' HG22 ' A' ' 154' ' ' VAL . 0.0 OUTLIER -63.14 -40.63 98.13 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 115.911 -0.586 . . . . 0.0 109.988 -179.514 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' A' A ' 114' ' ' SER . . . . . . . . . . . . . 58.2 m -59.59 -41.47 90.36 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 116.358 -0.383 . . . . 0.0 110.862 176.921 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 115' ' ' ILE . . . . . 0.487 HD11 ' HG2' ' A' ' 98' ' ' PRO . 78.1 mt -57.65 -50.38 77.56 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.211 0 CA-C-O 120.81 0.338 . . . . 0.0 110.52 176.547 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 116' ' ' ILE . . . . . 0.4 HG21 ' HB3' ' A' ' 126' ' ' LEU . 49.5 mm -60.56 -43.2 94.0 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.343 0 CA-C-N 115.897 -0.592 . . . . 0.0 111.017 179.784 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 117' ' ' ASN . . . . . . . . . . . . . 55.1 t30 -67.18 -36.55 82.02 Favored 'General case' 0 C--N 1.324 -0.503 0 CA-C-N 115.925 -0.579 . . . . 0.0 111.492 -177.492 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 118' ' ' GLU . . . . . . . . . . . . . 43.2 mt-10 -84.19 -19.89 33.27 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 116.496 -0.32 . . . . 0.0 111.813 -177.43 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 119' ' ' THR . . . . . . . . . . . . . 96.1 m -70.82 126.29 29.18 Favored 'General case' 0 C--N 1.323 -0.563 0 N-CA-C 109.817 -0.438 . . . . 0.0 109.817 176.202 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 120' ' ' LYS . . . . . . . . . . . . . 21.8 mtpp -102.44 35.75 2.35 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-O 120.862 0.363 . . . . 0.0 111.591 -174.659 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 121' ' ' LEU . . . . . . . . . . . . . 3.9 mm? -100.92 -175.92 3.02 Favored 'General case' 0 C--N 1.323 -0.574 0 CA-C-N 116.215 -0.448 . . . . 0.0 109.919 177.105 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 122' ' ' ALA . . . . . 0.411 ' O ' ' HG ' ' A' ' 126' ' ' LEU . . . -69.65 162.68 27.2 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-O 121.072 0.463 . . . . 0.0 111.67 -177.228 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 123' ' ' LYS . . . . . . . . . . . . . 53.2 mtmt -62.84 -34.2 76.82 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 115.764 -0.653 . . . . 0.0 111.073 -179.043 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 124' ' ' ASN . . . . . 0.715 ' HA ' ' HE3' ' A' ' 127' ' ' LYS . 65.2 t30 -64.4 -39.45 93.88 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-O 121.06 0.457 . . . . 0.0 109.911 176.937 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 125' ' ' THR . . . . . 0.433 ' O ' HG13 ' A' ' 129' ' ' ILE . 3.5 m -65.98 -39.0 89.97 Favored 'General case' 0 C--N 1.327 -0.399 0 CA-C-N 115.665 -0.698 . . . . 0.0 110.29 178.6 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 126' ' ' LEU . . . . . 0.411 ' HG ' ' O ' ' A' ' 122' ' ' ALA . 85.0 mt -62.33 -43.16 99.47 Favored 'General case' 0 C--O 1.234 0.26 0 CA-C-N 115.862 -0.608 . . . . 0.0 110.563 177.151 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 127' ' ' LYS . . . . . 0.715 ' HE3' ' HA ' ' A' ' 124' ' ' ASN . 27.0 mtmt -59.92 -41.35 91.54 Favored 'General case' 0 C--N 1.331 -0.237 0 CA-C-N 116.132 -0.486 . . . . 0.0 110.766 177.328 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 128' ' ' ALA . . . . . . . . . . . . . . . -60.99 -34.78 75.32 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.148 -0.478 . . . . 0.0 111.327 -179.308 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 129' ' ' ILE . . . . . 0.433 HG13 ' O ' ' A' ' 125' ' ' THR . 64.6 mt -65.69 -50.55 70.51 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.304 0 CA-C-N 116.519 -0.31 . . . . 0.0 110.397 178.424 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 130' ' ' ARG . . . . . . . . . . . . . 24.5 ttt180 -60.68 -42.85 97.93 Favored 'General case' 0 N--CA 1.462 0.14 0 CA-C-N 116.455 -0.339 . . . . 0.0 110.336 176.23 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 131' ' ' ASN . . . . . . . . . . . . . 7.7 t30 -55.91 -52.31 64.56 Favored 'General case' 0 C--N 1.327 -0.384 0 CA-C-N 115.816 -0.629 . . . . 0.0 110.519 -179.768 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 132' ' ' THR . . . . . 0.568 ' O ' HG13 ' A' ' 136' ' ' ILE . 37.7 m -57.43 -48.88 77.95 Favored 'General case' 0 C--N 1.326 -0.442 0 CA-C-N 115.714 -0.675 . . . . 0.0 110.814 178.898 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 133' ' ' ALA . . . . . . . . . . . . . . . -63.3 -46.99 84.14 Favored 'General case' 0 C--N 1.331 -0.213 0 CA-C-N 116.109 -0.496 . . . . 0.0 111.601 -177.859 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 134' ' ' SER . . . . . . . . . . . . . 9.5 t -62.98 -38.78 92.53 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-O 120.73 0.3 . . . . 0.0 110.519 -177.596 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 135' ' ' GLN . . . . . 0.541 ' HB3' ' CE1' ' A' ' 71' ' ' PHE . 0.8 OUTLIER -61.73 -39.97 93.44 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.255 -0.43 . . . . 0.0 110.967 176.67 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' A' A ' 136' ' ' ILE . . . . . 0.568 HG13 ' O ' ' A' ' 132' ' ' THR . 66.3 mt -65.7 -48.52 82.11 Favored 'Isoleucine or valine' 0 C--O 1.233 0.213 0 CA-C-N 116.344 -0.389 . . . . 0.0 110.635 178.336 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 137' ' ' PHE . . . . . 0.458 ' O ' HG13 ' A' ' 141' ' ' ILE . 40.6 m-85 -58.19 -43.92 87.81 Favored 'General case' 0 CA--C 1.521 -0.143 0 CA-C-N 116.179 -0.464 . . . . 0.0 110.748 178.321 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 138' ' ' ARG . . . . . 0.59 ' O ' ' HG3' ' A' ' 142' ' ' GLU . 62.3 mtt85 -59.51 -42.3 91.88 Favored 'General case' 0 C--O 1.222 -0.354 0 CA-C-N 116.278 -0.419 . . . . 0.0 111.163 178.673 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 139' ' ' LEU . . . . . . . . . . . . . 57.4 tp -56.95 -41.89 79.1 Favored 'General case' 0 C--N 1.326 -0.456 0 CA-C-O 120.942 0.401 . . . . 0.0 110.398 178.301 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 140' ' ' ALA . . . . . . . . . . . . . . . -66.84 -40.46 87.96 Favored 'General case' 0 C--N 1.327 -0.389 0 CA-C-N 116.144 -0.48 . . . . 0.0 110.475 176.693 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 141' ' ' ILE . . . . . 0.458 HG13 ' O ' ' A' ' 137' ' ' PHE . 80.1 mt -63.3 -40.5 89.28 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.301 0 CA-C-N 116.207 -0.451 . . . . 0.0 110.831 178.428 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 142' ' ' GLU . . . . . 0.59 ' HG3' ' O ' ' A' ' 138' ' ' ARG . 50.2 mt-10 -63.47 -29.99 71.19 Favored 'General case' 0 C--N 1.331 -0.228 0 CA-C-O 120.812 0.339 . . . . 0.0 111.049 179.971 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 143' ' ' ASN . . . . . 0.447 ' N ' HD21 ' A' ' 143' ' ' ASN . 0.9 OUTLIER -92.98 6.18 48.82 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-O 120.95 0.405 . . . . 0.0 110.32 176.927 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' A' A ' 144' ' ' ARG . . . . . 0.418 ' HD3' ' HA ' ' A' ' 144' ' ' ARG . 3.8 mmt180 59.52 28.33 17.7 Favored 'General case' 0 N--CA 1.464 0.26 0 CA-C-N 115.545 -0.752 . . . . 0.0 112.096 179.087 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 145' ' ' ALA . . . . . . . . . . . . . . . -78.51 -31.25 47.56 Favored 'General case' 0 C--N 1.327 -0.395 0 CA-C-O 121.074 0.464 . . . . 0.0 109.965 176.874 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 146' ' ' ILE . . . . . 0.5 HD12 ' HB3' ' A' ' 104' ' ' LEU . 14.8 tt -141.75 142.48 28.37 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.464 0 CA-C-N 115.641 -0.708 . . . . 0.0 109.165 175.503 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 147' ' ' ASP . . . . . . . . . . . . . 33.1 t70 -108.28 25.66 11.37 Favored 'General case' 0 C--N 1.322 -0.626 0 CA-C-O 121.681 0.753 . . . . 0.0 110.394 -175.999 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 148' ' ' PHE . . . . . . . . . . . . . 80.7 t80 -148.81 141.96 24.98 Favored 'General case' 0 C--N 1.325 -0.498 0 CA-C-N 115.909 -0.587 . . . . 0.0 110.498 -177.393 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 149' ' ' ASN . . . . . . . . . . . . . 47.3 t-20 -116.73 99.61 52.95 Favored Pre-proline 0 C--N 1.326 -0.427 0 N-CA-C 110.111 -0.329 . . . . 0.0 110.111 177.83 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 150' ' ' PRO . . . . . . . . . . . . . 24.1 Cg_exo -64.54 -21.69 65.68 Favored 'Trans proline' 0 C--N 1.342 0.229 0 C-N-CA 122.892 2.395 . . . . 0.0 112.757 -178.593 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 151' ' ' ALA . . . . . 0.453 ' O ' HG12 ' A' ' 154' ' ' VAL . . . -73.62 -14.35 61.16 Favored 'General case' 0 C--N 1.327 -0.39 0 CA-C-O 120.875 0.369 . . . . 0.0 111.322 -176.719 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 152' ' ' ASP . . . . . . . . . . . . . 24.1 t70 -64.87 -27.89 69.17 Favored 'General case' 0 C--N 1.324 -0.54 0 CA-C-O 121.044 0.45 . . . . 0.0 110.395 178.201 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 153' ' ' TYR . . . . . . . . . . . . . 63.2 m-85 -97.26 0.81 48.78 Favored 'General case' 0 C--N 1.328 -0.343 0 N-CA-C 112.787 0.662 . . . . 0.0 112.787 -175.275 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 154' ' ' VAL . . . . . 0.493 HG22 ' HA ' ' A' ' 113' ' ' GLN . 6.3 p -94.21 106.7 18.39 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.384 0 C-N-CA 119.667 -0.813 . . . . 0.0 110.224 177.146 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 155' ' ' ARG . . . . . . . . . . . . . 18.2 ptt180 -93.04 144.55 25.15 Favored 'General case' 0 C--N 1.322 -0.622 0 CA-C-N 115.666 -0.697 . . . . 0.0 111.015 -177.249 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 156' ' ' ILE . . . . . . . . . . . . . 44.4 mm -89.25 116.82 67.34 Favored Pre-proline 0 C--N 1.323 -0.555 0 CA-C-N 115.655 -0.702 . . . . 0.0 109.803 179.616 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 157' ' ' PRO . . . . . . . . . . . . . 13.0 Cg_exo -70.01 130.75 19.57 Favored 'Trans proline' 0 N--CA 1.464 -0.264 0 C-N-CA 122.613 2.209 . . . . 0.0 111.867 -179.613 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 158' ' ' LYS . . . . . . . . . . . . . 9.9 mtmp? -93.34 67.64 4.11 Favored 'General case' 0 C--N 1.322 -0.629 0 CA-C-N 116.051 -0.522 . . . . 0.0 110.138 179.441 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 159' ' ' ILE . . . . . . . . . . . . . 64.4 mt -89.11 108.45 19.08 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.55 0 CA-C-N 115.651 -0.704 . . . . 0.0 111.198 -178.075 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 160' ' ' ALA . . . . . . . . . . . . . . . -126.27 22.76 7.12 Favored 'General case' 0 C--N 1.325 -0.488 0 CA-C-O 121.817 0.817 . . . . 0.0 109.667 175.883 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 161' ' ' LEU . . . . . . . . . . . . . 67.2 mt -79.58 -36.82 37.57 Favored 'General case' 0 C--N 1.318 -0.799 0 CA-C-N 114.584 -1.189 . . . . 0.0 111.726 -175.172 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 162' ' ' GLU . . . . . . . . . . . . . 0.2 OUTLIER -85.51 -63.4 1.33 Allowed 'General case' 0 C--N 1.327 -0.408 0 CA-C-N 116.415 -0.357 . . . . 0.0 110.526 -176.098 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 163' ' ' HIS . . . . . . . . . . . . . 0.6 OUTLIER -67.11 118.31 10.36 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-O 121.085 0.469 . . . . 0.0 110.871 -178.834 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 164' ' ' HIS . . . . . . . . . . . . . 32.6 m170 -82.12 -162.62 0.57 Allowed 'General case' 0 C--N 1.325 -0.479 0 CA-C-N 115.423 -0.808 . . . . 0.0 110.904 -177.946 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 165' ' ' HIS . . . . . . . . . . . . . 7.1 p80 -68.56 -0.23 4.87 Favored 'General case' 0 N--CA 1.472 0.643 0 N-CA-C 113.286 0.847 . . . . 0.0 113.286 -170.316 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 166' ' ' HIS . . . . . . . . . . . . . 57.8 t-80 -91.25 110.64 21.93 Favored 'General case' 0 C--N 1.325 -0.47 0 O-C-N 121.982 -0.449 . . . . 0.0 109.921 177.182 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 167' ' ' HIS . . . . . . . . . . . . . 65.0 t-80 -104.03 132.97 49.75 Favored 'General case' 0 C--N 1.325 -0.49 0 CA-C-N 116.179 -0.464 . . . . 0.0 110.736 -175.892 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 168' ' ' HIS . . . . . . . . . . . . . 51.5 t-80 . . . . . 0 C--O 1.249 1.032 0 CA-C-O 118.442 -0.789 . . . . 0.0 109.083 173.302 . . . . . . . . 0 0 . 1 . 006 nuclear orig full ' A' A ' 61' ' ' ARG . . . . . . . . . . . . . 98.9 mtt180 . . . . . 0 N--CA 1.482 1.146 0 CA-C-O 120.566 0.222 . . . . 0.0 110.418 . . . . . . . . . 0 0 . 1 . 006 nuclear orig full ' A' A ' 62' ' ' ASP . . . . . 0.469 ' HB3' ' NE1' ' A' ' 67' ' ' TRP . 6.9 m-20 67.8 88.7 0.11 Allowed 'General case' 0 C--O 1.235 0.297 0 CA-C-N 115.529 -0.76 . . . . 0.0 111.238 178.763 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 63' ' ' SER . . . . . 0.5 ' HA ' ' HA ' ' A' ' 103' ' ' SER . 10.7 p -84.26 160.37 20.77 Favored 'General case' 0 C--N 1.322 -0.608 0 CA-C-N 115.528 -0.76 . . . . 0.0 110.259 177.131 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 64' ' ' PHE . . . . . 0.503 ' HB2' HD11 ' A' ' 107' ' ' ILE . 86.6 t80 -60.99 -34.55 74.96 Favored 'General case' 0 C--N 1.33 -0.249 0 N-CA-C 109.933 -0.395 . . . . 0.0 109.933 179.693 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 65' ' ' GLY . . . . . . . . . . . . . . . -58.5 -44.82 95.19 Favored Glycine 0 N--CA 1.447 -0.6 0 CA-C-N 115.901 -0.59 . . . . 0.0 112.256 176.326 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 66' ' ' ASP . . . . . . . . . . . . . 36.9 t70 -65.08 -40.98 95.42 Favored 'General case' 0 C--N 1.327 -0.393 0 CA-C-O 120.819 0.342 . . . . 0.0 110.324 178.273 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 67' ' ' TRP . . . . . 0.469 ' NE1' ' HB3' ' A' ' 62' ' ' ASP . 87.0 m95 -62.36 -42.02 99.07 Favored 'General case' 0 C--N 1.332 -0.18 0 CA-C-N 116.278 -0.419 . . . . 0.0 110.967 177.011 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 68' ' ' ALA . . . . . 0.503 ' O ' ' HG ' ' A' ' 72' ' ' LEU . . . -59.73 -44.69 93.65 Favored 'General case' 0 C--N 1.327 -0.373 0 CA-C-N 116.287 -0.415 . . . . 0.0 110.669 177.8 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 69' ' ' GLU . . . . . . . . . . . . . 80.6 mt-10 -61.57 -42.85 99.44 Favored 'General case' 0 C--N 1.325 -0.461 0 CA-C-N 116.242 -0.436 . . . . 0.0 111.177 178.51 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 70' ' ' LYS . . . . . . . . . . . . . 43.2 mtmt -69.63 -28.64 66.09 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.272 -0.422 . . . . 0.0 110.731 179.639 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 71' ' ' PHE . . . . . . . . . . . . . 87.8 t80 -74.53 -40.12 61.94 Favored 'General case' 0 C--N 1.325 -0.488 0 CA-C-N 116.07 -0.514 . . . . 0.0 110.216 176.371 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 72' ' ' LEU . . . . . 0.503 ' HG ' ' O ' ' A' ' 68' ' ' ALA . 91.1 mt -65.93 -36.48 83.48 Favored 'General case' 0 C--N 1.327 -0.37 0 CA-C-O 120.883 0.373 . . . . 0.0 110.307 176.773 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 73' ' ' LYS . . . . . . . . . . . . . 39.4 ttmt -63.11 -45.8 90.31 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 115.943 -0.571 . . . . 0.0 110.642 178.472 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 74' ' ' SER . . . . . . . . . . . . . 6.4 p -73.75 -39.8 63.97 Favored 'General case' 0 C--N 1.326 -0.456 0 CA-C-N 115.847 -0.615 . . . . 0.0 111.323 -178.023 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 75' ' ' LYS . . . . . 0.476 ' O ' ' HB3' ' A' ' 78' ' ' ASP . 10.8 tptp -69.61 -21.93 63.54 Favored 'General case' 0 N--CA 1.454 -0.268 0 CA-C-O 120.811 0.338 . . . . 0.0 111.074 179.29 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 76' ' ' GLU . . . . . . . . . . . . . 31.1 tt0 -73.15 -43.5 61.44 Favored 'General case' 0 C--N 1.324 -0.532 0 N-CA-C 109.304 -0.628 . . . . 0.0 109.304 174.183 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 77' ' ' ALA . . . . . . . . . . . . . . . -65.65 -27.18 68.19 Favored 'General case' 0 C--N 1.331 -0.213 0 CA-C-N 115.668 -0.696 . . . . 0.0 110.672 175.714 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 78' ' ' ASP . . . . . 0.476 ' HB3' ' O ' ' A' ' 75' ' ' LYS . 18.5 t0 -51.98 -44.1 63.87 Favored 'General case' 0 C--O 1.235 0.295 0 CA-C-N 115.555 -0.748 . . . . 0.0 109.605 173.712 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 79' ' ' GLY . . . . . . . . . . . . . . . 107.31 29.06 4.65 Favored Glycine 0 N--CA 1.448 -0.521 0 CA-C-N 115.44 -0.8 . . . . 0.0 112.141 -179.315 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 80' ' ' VAL . . . . . . . . . . . . . 33.1 m -69.63 150.35 10.34 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.347 0 CA-C-O 120.956 0.407 . . . . 0.0 110.675 179.758 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 81' ' ' SER . . . . . . . . . . . . . 14.0 m -72.92 168.34 19.16 Favored 'General case' 0 C--N 1.324 -0.518 0 CA-C-N 115.849 -0.614 . . . . 0.0 111.016 -179.383 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 82' ' ' VAL . . . . . . . . . . . . . 48.9 t -57.44 -52.37 57.88 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.187 0 CA-C-N 116.259 -0.428 . . . . 0.0 111.425 -176.523 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 83' ' ' SER . . . . . . . . . . . . . 59.8 m -62.42 -27.6 69.21 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-O 120.891 0.377 . . . . 0.0 111.113 -179.095 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 84' ' ' GLN . . . . . . . . . . . . . 51.5 tp60 -69.18 -54.55 14.25 Favored 'General case' 0 C--N 1.327 -0.396 0 CA-C-N 116.152 -0.476 . . . . 0.0 109.812 -179.74 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 85' ' ' LEU . . . . . . . . . . . . . 31.7 tp -69.17 -30.33 68.53 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.22 -0.446 . . . . 0.0 110.216 179.835 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 86' ' ' ASN . . . . . . . . . . . . . 27.2 t-20 -58.03 -44.65 87.45 Favored 'General case' 0 C--O 1.235 0.3 0 CA-C-N 116.094 -0.503 . . . . 0.0 110.195 176.018 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 87' ' ' SER . . . . . . . . . . . . . 8.7 t -66.83 -39.24 87.58 Favored 'General case' 0 N--CA 1.452 -0.327 0 CA-C-N 115.66 -0.7 . . . . 0.0 110.1 178.821 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 88' ' ' TYR . . . . . . . . . . . . . 30.9 m-85 -59.17 -46.32 88.71 Favored 'General case' 0 C--O 1.231 0.101 0 CA-C-N 116.321 -0.399 . . . . 0.0 111.106 177.053 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 89' ' ' LYS . . . . . . . . . . . . . 88.3 mttt -62.82 -44.38 96.3 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.5 -0.318 . . . . 0.0 110.45 179.09 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 90' ' ' ASN . . . . . . . . . . . . . 27.1 t-20 -57.98 -50.35 73.71 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.095 -0.502 . . . . 0.0 110.913 -179.5 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 91' ' ' TYR . . . . . . . . . . . . . 22.3 m-30 -58.68 -52.1 67.11 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.321 -0.4 . . . . 0.0 110.909 -179.492 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 92' ' ' CYS . . . . . 0.45 ' HA ' ' HB2' ' A' ' 96' ' ' LEU . 61.5 m -67.52 -44.9 77.26 Favored 'General case' 0 C--N 1.325 -0.461 0 CA-C-N 116.173 -0.467 . . . . 0.0 112.117 -173.771 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 93' ' ' ARG . . . . . . . . . . . . . 23.9 mmm-85 -81.08 -28.97 35.07 Favored 'General case' 0 C--N 1.329 -0.318 0 N-CA-C 112.194 0.442 . . . . 0.0 112.194 -173.123 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 94' ' ' ASN . . . . . . . . . . . . . 0.9 OUTLIER -105.54 -61.95 1.42 Allowed 'General case' 0 C--N 1.328 -0.366 0 C-N-CA 120.407 -0.517 . . . . 0.0 112.115 -176.409 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 95' ' ' HIS . . . . . . . . . . . . . 38.9 t-80 -75.84 -26.21 56.95 Favored 'General case' 0 C--N 1.326 -0.416 0 CA-C-O 120.826 0.346 . . . . 0.0 111.148 -172.37 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 96' ' ' LEU . . . . . 0.455 HD21 HD12 ' A' ' 99' ' ' LEU . 86.7 mt -108.37 14.95 24.4 Favored 'General case' 0 C--N 1.324 -0.504 0 CA-C-N 116.334 -0.394 . . . . 0.0 110.69 -179.793 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 97' ' ' SER . . . . . 0.58 ' N ' ' HD2' ' A' ' 98' ' ' PRO . 8.1 t -57.76 -46.03 99.77 Favored Pre-proline 0 CA--C 1.541 0.632 0 CA-C-N 116.342 -0.39 . . . . 0.0 111.897 -179.249 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 98' ' ' PRO . . . . . 0.58 ' HD2' ' N ' ' A' ' 97' ' ' SER . 10.2 Cg_endo -55.13 -28.19 59.65 Favored 'Trans proline' 0 C--N 1.357 0.992 0 C-N-CA 122.306 2.004 . . . . 0.0 112.591 175.604 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 99' ' ' LEU . . . . . 0.464 HD13 HG12 ' A' ' 112' ' ' ILE . 72.8 mt -89.29 -30.48 18.44 Favored 'General case' 0 C--N 1.326 -0.413 0 CA-C-N 116.251 -0.431 . . . . 0.0 110.219 -179.895 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 100' ' ' TYR . . . . . . . . . . . . . 16.4 t80 -57.11 -39.84 75.88 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 115.473 -0.785 . . . . 0.0 110.577 -179.519 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 101' ' ' MET . . . . . . . . . . . . . 24.7 ttt -76.47 -23.23 53.83 Favored 'General case' 0 C--O 1.233 0.222 0 CA-C-N 115.764 -0.653 . . . . 0.0 110.751 179.706 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 102' ' ' LYS . . . . . . . . . . . . . 50.0 mttm -75.72 146.46 40.1 Favored 'General case' 0 C--N 1.323 -0.573 0 CA-C-O 121.298 0.57 . . . . 0.0 111.63 -177.945 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 103' ' ' SER . . . . . 0.5 ' HA ' ' HA ' ' A' ' 63' ' ' SER . 7.4 m -76.4 160.73 29.29 Favored 'General case' 0 N--CA 1.445 -0.698 0 N-CA-C 108.109 -1.071 . . . . 0.0 108.109 169.788 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 104' ' ' LEU . . . . . 0.532 ' HG ' HD13 ' A' ' 146' ' ' ILE . 18.0 tp -56.5 -33.48 66.03 Favored 'General case' 0 C--N 1.323 -0.568 0 N-CA-C 111.914 0.339 . . . . 0.0 111.914 -174.007 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 105' ' ' SER . . . . . . . . . . . . . 12.1 p -87.77 -2.11 58.4 Favored 'General case' 0 CA--C 1.536 0.437 0 N-CA-C 112.416 0.524 . . . . 0.0 112.416 -177.698 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 106' ' ' GLU . . . . . 0.412 ' HG3' ' HB2' ' A' ' 103' ' ' SER . 43.3 mt-10 -94.41 -6.11 44.82 Favored 'General case' 0 C--O 1.234 0.268 0 CA-C-O 120.93 0.395 . . . . 0.0 111.17 -178.519 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 107' ' ' ILE . . . . . 0.503 HD11 ' HB2' ' A' ' 64' ' ' PHE . 74.8 mt -95.19 120.13 44.19 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.685 0 CA-C-N 116.147 -0.479 . . . . 0.0 111.456 -173.341 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 108' ' ' LEU . . . . . . . . . . . . . 85.7 mt -101.47 152.47 38.02 Favored Pre-proline 0 C--N 1.323 -0.549 0 CA-C-N 115.726 -0.67 . . . . 0.0 109.618 176.744 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 109' ' ' PRO . . . . . . . . . . . . . 18.4 Cg_endo -61.77 -24.39 77.38 Favored 'Trans proline' 0 C--O 1.233 0.235 0 C-N-CA 122.235 1.957 . . . . 0.0 111.516 176.446 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 110' ' ' ALA . . . . . . . . . . . . . . . -69.42 -38.44 77.9 Favored 'General case' 0 N--CA 1.452 -0.354 0 CA-C-N 115.612 -0.722 . . . . 0.0 111.011 179.761 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 111' ' ' ASP . . . . . 0.42 ' O ' HG13 ' A' ' 115' ' ' ILE . 54.6 m-20 -57.7 -52.94 63.37 Favored 'General case' 0 N--CA 1.464 0.228 0 CA-C-O 121.129 0.49 . . . . 0.0 110.437 -179.508 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 112' ' ' ILE . . . . . 0.464 HG12 HD13 ' A' ' 99' ' ' LEU . 28.4 mt -62.58 -47.39 93.16 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.51 0 CA-C-N 115.388 -0.824 . . . . 0.0 111.015 -177.745 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 113' ' ' GLN . . . . . . . . . . . . . 12.2 tm0? -64.97 -40.11 94.5 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.166 -0.47 . . . . 0.0 110.653 -176.2 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 114' ' ' SER . . . . . . . . . . . . . 27.9 t -57.11 -49.47 75.8 Favored 'General case' 0 C--O 1.237 0.438 0 CA-C-O 120.842 0.354 . . . . 0.0 110.477 179.034 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 115' ' ' ILE . . . . . 0.42 HG13 ' O ' ' A' ' 111' ' ' ASP . 60.9 mt -59.4 -49.34 83.89 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.179 0 CA-C-N 115.943 -0.571 . . . . 0.0 109.969 179.015 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 116' ' ' ILE . . . . . 0.436 HG23 HD12 ' A' ' 156' ' ' ILE . 33.4 mm -56.16 -44.29 78.59 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.227 0 CA-C-N 116.033 -0.531 . . . . 0.0 111.024 178.462 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 117' ' ' ASN . . . . . . . . . . . . . 10.1 t30 -55.62 -40.73 72.51 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 115.826 -0.624 . . . . 0.0 112.207 -177.494 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 118' ' ' GLU . . . . . . . . . . . . . 10.9 pt-20 -92.29 -9.22 42.79 Favored 'General case' 0 C--N 1.325 -0.462 0 N-CA-C 112.308 0.484 . . . . 0.0 112.308 -178.572 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 119' ' ' THR . . . . . . . . . . . . . 84.4 m -76.25 132.73 40.04 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-O 120.731 0.301 . . . . 0.0 110.844 178.91 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 120' ' ' LYS . . . . . 0.449 ' HE3' ' HB2' ' A' ' 120' ' ' LYS . 39.3 mtmt -106.91 89.55 3.04 Favored 'General case' 0 C--N 1.328 -0.364 0 N-CA-C 110.247 -0.279 . . . . 0.0 110.247 179.619 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 121' ' ' LEU . . . . . . . . . . . . . 86.8 mt -135.44 173.23 11.95 Favored 'General case' 0 C--N 1.322 -0.598 0 CA-C-N 116.565 -0.289 . . . . 0.0 110.265 178.27 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 122' ' ' ALA . . . . . . . . . . . . . . . -68.4 157.19 36.3 Favored 'General case' 0 C--N 1.327 -0.384 0 CA-C-N 116.359 -0.382 . . . . 0.0 110.543 178.906 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 123' ' ' LYS . . . . . . . . . . . . . 59.2 pttt -57.56 -36.41 71.63 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.2 -0.454 . . . . 0.0 110.83 -179.556 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 124' ' ' ASN . . . . . . . . . . . . . 52.9 t30 -64.82 -46.25 82.76 Favored 'General case' 0 C--N 1.332 -0.161 0 CA-C-N 116.235 -0.439 . . . . 0.0 110.405 177.591 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 125' ' ' THR . . . . . 0.475 ' O ' HG13 ' A' ' 129' ' ' ILE . 2.3 m -66.39 -45.31 80.46 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 115.573 -0.739 . . . . 0.0 111.187 -176.246 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 126' ' ' LEU . . . . . 0.635 ' HB3' HD13 ' A' ' 156' ' ' ILE . 83.8 mt -61.84 -48.01 82.48 Favored 'General case' 0 C--O 1.234 0.246 0 CA-C-N 116.286 -0.415 . . . . 0.0 111.248 -179.144 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 127' ' ' LYS . . . . . . . . . . . . . 98.1 mttt -63.56 -35.11 79.4 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.378 -0.374 . . . . 0.0 110.782 177.81 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 128' ' ' ALA . . . . . . . . . . . . . . . -62.18 -43.28 99.18 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-N 116.57 -0.286 . . . . 0.0 110.969 179.517 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 129' ' ' ILE . . . . . 0.475 HG13 ' O ' ' A' ' 125' ' ' THR . 68.4 mt -61.28 -47.52 93.13 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.33 0 CA-C-O 120.878 0.37 . . . . 0.0 110.499 178.491 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 130' ' ' ARG . . . . . 0.464 ' HD2' ' HB ' ' A' ' 154' ' ' VAL . 9.7 ttt180 -65.31 -45.89 82.52 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.258 -0.428 . . . . 0.0 111.213 -179.666 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 131' ' ' ASN . . . . . . . . . . . . . 92.9 m-20 -63.94 -33.39 75.61 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-O 120.65 0.262 . . . . 0.0 111.094 -179.755 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 132' ' ' THR . . . . . . . . . . . . . 98.0 m -65.53 -45.35 83.81 Favored 'General case' 0 C--N 1.325 -0.493 0 CA-C-O 120.887 0.375 . . . . 0.0 110.331 174.823 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 133' ' ' ALA . . . . . . . . . . . . . . . -64.4 -43.88 93.04 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 115.923 -0.58 . . . . 0.0 111.111 -179.386 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 134' ' ' SER . . . . . 0.534 ' O ' ' HG3' ' A' ' 138' ' ' ARG . 23.6 p -64.3 -35.51 81.1 Favored 'General case' 0 C--N 1.331 -0.196 0 CA-C-N 116.667 -0.242 . . . . 0.0 110.797 -179.373 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 135' ' ' GLN . . . . . . . . . . . . . 13.1 mm100 -59.63 -42.06 91.88 Favored 'General case' 0 C--N 1.331 -0.236 0 CA-C-O 120.803 0.335 . . . . 0.0 110.794 175.034 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 136' ' ' ILE . . . . . . . . . . . . . 69.3 mt -65.07 -42.98 95.89 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.365 0 CA-C-N 115.938 -0.573 . . . . 0.0 110.508 178.045 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 137' ' ' PHE . . . . . 0.437 ' O ' HG13 ' A' ' 141' ' ' ILE . 35.3 m-85 -66.92 -37.83 85.06 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.213 -0.449 . . . . 0.0 110.927 178.207 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 138' ' ' ARG . . . . . 0.534 ' HG3' ' O ' ' A' ' 134' ' ' SER . 54.1 mtp180 -59.32 -43.33 92.69 Favored 'General case' 0 CA--C 1.517 -0.324 0 N-CA-C 110.022 -0.362 . . . . 0.0 110.022 174.92 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 139' ' ' LEU . . . . . . . . . . . . . 49.9 tp -58.87 -41.18 86.47 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 115.75 -0.659 . . . . 0.0 110.075 178.205 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 140' ' ' ALA . . . . . 0.436 ' HB1' HD22 ' A' ' 104' ' ' LEU . . . -64.99 -41.63 95.23 Favored 'General case' 0 C--N 1.327 -0.391 0 CA-C-N 116.086 -0.506 . . . . 0.0 110.62 177.16 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 141' ' ' ILE . . . . . 0.437 HG13 ' O ' ' A' ' 137' ' ' PHE . 74.7 mt -61.81 -46.11 97.23 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.374 0 CA-C-N 116.14 -0.482 . . . . 0.0 110.902 176.299 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 142' ' ' GLU . . . . . 0.4 ' HG3' ' O ' ' A' ' 138' ' ' ARG . 44.5 mt-10 -60.61 -36.77 79.41 Favored 'General case' 0 N--CA 1.465 0.282 0 CA-C-O 120.79 0.329 . . . . 0.0 111.012 178.548 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 143' ' ' ASN . . . . . . . . . . . . . 40.4 m-80 -88.23 10.44 19.56 Favored 'General case' 0 C--N 1.331 -0.225 0 CA-C-N 116.154 -0.475 . . . . 0.0 110.719 178.934 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 144' ' ' ARG . . . . . . . . . . . . . 61.6 mtt-85 64.23 21.71 12.61 Favored 'General case' 0 N--CA 1.466 0.334 0 CA-C-N 115.621 -0.718 . . . . 0.0 112.389 171.246 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 145' ' ' ALA . . . . . . . . . . . . . . . -85.26 -27.6 25.91 Favored 'General case' 0 C--N 1.323 -0.552 0 CA-C-O 120.806 0.336 . . . . 0.0 111.595 -176.678 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 146' ' ' ILE . . . . . 0.532 HD13 ' HG ' ' A' ' 104' ' ' LEU . 13.8 tt -143.88 149.58 17.72 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.536 0 CA-C-O 120.906 0.384 . . . . 0.0 110.452 -179.79 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 147' ' ' ASP . . . . . . . . . . . . . 0.9 OUTLIER -114.92 25.03 11.24 Favored 'General case' 0 C--N 1.325 -0.46 0 CA-C-O 121.254 0.549 . . . . 0.0 110.249 179.524 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 148' ' ' PHE . . . . . . . . . . . . . 60.1 t80 -144.29 134.01 23.67 Favored 'General case' 0 C--N 1.323 -0.582 0 CA-C-N 115.581 -0.736 . . . . 0.0 109.589 -174.434 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 149' ' ' ASN . . . . . . . . . . . . . 53.6 t-20 -115.19 95.66 43.05 Favored Pre-proline 0 C--N 1.324 -0.525 0 N-CA-C 109.987 -0.375 . . . . 0.0 109.987 178.5 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 150' ' ' PRO . . . . . . . . . . . . . 32.9 Cg_exo -58.62 -33.18 98.01 Favored 'Trans proline' 0 C--N 1.342 0.225 0 C-N-CA 122.937 2.425 . . . . 0.0 112.769 -178.575 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 151' ' ' ALA . . . . . 0.478 ' HA ' HG23 ' A' ' 154' ' ' VAL . . . -73.38 -20.73 60.69 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 116.442 -0.345 . . . . 0.0 111.502 -176.327 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 152' ' ' ASP . . . . . . . . . . . . . 29.9 t70 -70.15 -23.72 63.05 Favored 'General case' 0 C--N 1.325 -0.5 0 CA-C-O 121.123 0.487 . . . . 0.0 110.62 178.942 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 153' ' ' TYR . . . . . . . . . . . . . 77.0 m-85 -96.59 -2.88 43.97 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.114 -0.493 . . . . 0.0 110.763 -178.571 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 154' ' ' VAL . . . . . 0.478 HG23 ' HA ' ' A' ' 151' ' ' ALA . 61.0 t -77.64 117.66 23.15 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.391 0 CA-C-N 116.384 -0.371 . . . . 0.0 110.374 179.19 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 155' ' ' ARG . . . . . . . . . . . . . 51.1 mtp85 -92.12 141.9 28.09 Favored 'General case' 0 C--N 1.318 -0.802 0 CA-C-O 120.972 0.415 . . . . 0.0 110.514 176.32 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 156' ' ' ILE . . . . . 0.635 HD13 ' HB3' ' A' ' 126' ' ' LEU . 2.9 tp -106.97 129.31 24.55 Favored Pre-proline 0 C--N 1.318 -0.789 0 CA-C-N 115.456 -0.793 . . . . 0.0 109.609 -176.889 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 157' ' ' PRO . . . . . . . . . . . . . 86.1 Cg_endo -89.51 140.79 3.78 Favored 'Trans proline' 0 N--CA 1.454 -0.8 0 C-N-CA 122.631 2.221 . . . . 0.0 113.08 -179.426 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 158' ' ' LYS . . . . . . . . . . . . . 39.8 mtmt -105.77 3.05 28.41 Favored 'General case' 0 C--N 1.327 -0.398 0 N-CA-C 109.156 -0.683 . . . . 0.0 109.156 171.817 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 159' ' ' ILE . . . . . . . . . . . . . 66.6 mt -82.06 94.78 2.89 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.446 0 CA-C-N 115.296 -0.865 . . . . 0.0 111.134 -172.707 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 160' ' ' ALA . . . . . . . . . . . . . . . -89.11 170.87 10.26 Favored 'General case' 0 C--N 1.319 -0.719 0 CA-C-N 115.555 -0.748 . . . . 0.0 109.288 172.379 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 161' ' ' LEU . . . . . 0.569 HD21 ' HB3' ' A' ' 167' ' ' HIS . 5.6 mp -66.44 109.63 2.81 Favored 'General case' 0 C--N 1.322 -0.617 0 CA-C-O 120.995 0.426 . . . . 0.0 110.601 -176.484 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 162' ' ' GLU . . . . . . . . . . . . . 42.7 tt0 -70.45 -51.59 28.22 Favored 'General case' 0 C--N 1.325 -0.482 0 CA-C-N 115.84 -0.618 . . . . 0.0 109.993 179.214 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 163' ' ' HIS . . . . . . . . . . . . . 15.0 m-70 -85.62 173.55 10.07 Favored 'General case' 0 C--N 1.323 -0.579 0 CA-C-N 115.901 -0.59 . . . . 0.0 110.513 177.923 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 164' ' ' HIS . . . . . . . . . . . . . 41.8 m-70 -100.52 154.28 18.68 Favored 'General case' 0 C--N 1.322 -0.627 0 CA-C-N 116.069 -0.514 . . . . 0.0 110.715 -176.95 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 165' ' ' HIS . . . . . . . . . . . . . 90.6 m-70 47.79 79.34 0.07 Allowed 'General case' 0 N--CA 1.467 0.392 0 O-C-N 124.066 0.854 . . . . 0.0 112.732 173.756 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 166' ' ' HIS . . . . . . . . . . . . . 28.5 m80 -141.23 -41.01 0.38 Allowed 'General case' 0 C--N 1.319 -0.742 0 CA-C-N 115.448 -0.796 . . . . 0.0 109.355 174.564 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 167' ' ' HIS . . . . . 0.569 ' HB3' HD21 ' A' ' 161' ' ' LEU . 33.2 t60 -123.27 85.35 2.41 Favored 'General case' 0 C--N 1.32 -0.678 0 N-CA-C 107.438 -1.319 . . . . 0.0 107.438 172.236 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 168' ' ' HIS . . . . . 0.429 ' HB2' ' O ' ' A' ' 167' ' ' HIS . 5.9 m80 . . . . . 0 C--O 1.249 1.037 0 O-C-N 123.911 0.757 . . . . 0.0 109.865 -166.541 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 61' ' ' ARG . . . . . . . . . . . . . 23.6 mtm180 . . . . . 0 N--CA 1.477 0.903 0 N-CA-C 109.517 -0.549 . . . . 0.0 109.517 . . . . . . . . . 0 0 . 1 . 007 nuclear orig full ' A' A ' 62' ' ' ASP . . . . . . . . . . . . . 30.8 m-20 -77.14 -176.92 4.26 Favored 'General case' 0 C--N 1.326 -0.452 0 CA-C-O 121.185 0.517 . . . . 0.0 110.849 -179.192 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 63' ' ' SER . . . . . 0.592 ' HA ' ' HA ' ' A' ' 103' ' ' SER . 47.0 m -114.71 159.68 20.26 Favored 'General case' 0 N--CA 1.444 -0.77 0 CA-C-N 115.824 -0.625 . . . . 0.0 110.54 -178.825 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 64' ' ' PHE . . . . . 0.49 ' HB3' ' O ' ' A' ' 99' ' ' LEU . 80.6 t80 -58.47 -34.4 70.84 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 115.865 -0.607 . . . . 0.0 111.145 -176.171 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 65' ' ' GLY . . . . . . . . . . . . . . . -61.68 -40.78 99.23 Favored Glycine 0 N--CA 1.453 -0.224 0 C-N-CA 120.898 -0.668 . . . . 0.0 112.636 179.901 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 66' ' ' ASP . . . . . . . . . . . . . 24.7 t70 -61.11 -52.16 66.08 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-O 120.936 0.398 . . . . 0.0 110.163 177.635 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 67' ' ' TRP . . . . . . . . . . . . . 98.7 m95 -65.51 -34.47 78.33 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-N 115.58 -0.737 . . . . 0.0 111.403 -179.204 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 68' ' ' ALA . . . . . 0.58 ' O ' ' HG ' ' A' ' 72' ' ' LEU . . . -61.96 -50.85 70.46 Favored 'General case' 0 C--N 1.327 -0.377 0 CA-C-O 120.665 0.269 . . . . 0.0 110.827 178.598 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 69' ' ' GLU . . . . . . . . . . . . . 33.3 tt0 -69.87 -34.37 73.48 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-O 120.769 0.319 . . . . 0.0 110.213 -179.791 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 70' ' ' LYS . . . . . . . . . . . . . 48.9 tttm -61.72 -42.93 99.6 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-O 121.298 0.57 . . . . 0.0 109.556 176.264 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 71' ' ' PHE . . . . . . . . . . . . . 71.4 t80 -64.31 -45.15 89.17 Favored 'General case' 0 C--N 1.326 -0.423 0 CA-C-N 115.244 -0.889 . . . . 0.0 111.056 176.82 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 72' ' ' LEU . . . . . 0.58 ' HG ' ' O ' ' A' ' 68' ' ' ALA . 89.2 mt -61.44 -42.41 98.72 Favored 'General case' 0 C--N 1.327 -0.396 0 CA-C-O 121.017 0.436 . . . . 0.0 110.38 178.706 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 73' ' ' LYS . . . . . 0.499 ' HD2' ' HA ' ' A' ' 73' ' ' LYS . 18.2 tptt -70.0 -38.22 75.91 Favored 'General case' 0 C--N 1.326 -0.434 0 CA-C-N 115.842 -0.617 . . . . 0.0 111.15 -176.023 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 74' ' ' SER . . . . . . . . . . . . . 8.1 p -70.06 -32.4 70.48 Favored 'General case' 0 C--N 1.327 -0.376 0 C-N-CA 121.077 -0.249 . . . . 0.0 110.877 179.987 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 75' ' ' LYS . . . . . . . . . . . . . 30.8 mmtp -73.09 -37.28 66.81 Favored 'General case' 0 C--O 1.234 0.273 0 CA-C-O 120.775 0.322 . . . . 0.0 110.478 174.634 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 76' ' ' GLU . . . . . . . . . . . . . 42.0 tt0 -61.84 -46.12 90.83 Favored 'General case' 0 C--N 1.327 -0.379 0 CA-C-N 116.053 -0.521 . . . . 0.0 110.251 177.474 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 77' ' ' ALA . . . . . . . . . . . . . . . -70.54 -33.41 71.12 Favored 'General case' 0 C--N 1.325 -0.466 0 CA-C-N 115.816 -0.629 . . . . 0.0 111.072 177.644 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 78' ' ' ASP . . . . . . . . . . . . . 20.1 t70 -57.9 -47.05 83.95 Favored 'General case' 0 CA--C 1.518 -0.286 0 CA-C-N 116.142 -0.481 . . . . 0.0 110.431 177.449 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 79' ' ' GLY . . . . . . . . . . . . . . . 114.98 41.17 0.85 Allowed Glycine 0 N--CA 1.443 -0.835 0 C-N-CA 120.436 -0.887 . . . . 0.0 112.966 176.288 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 80' ' ' VAL . . . . . . . . . . . . . 29.0 m -77.33 157.53 5.29 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.442 0 N-CA-C 110.137 -0.319 . . . . 0.0 110.137 174.649 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 81' ' ' SER . . . . . . . . . . . . . 18.4 m -62.07 150.3 38.7 Favored 'General case' 0 C--N 1.324 -0.534 0 N-CA-C 110.239 -0.282 . . . . 0.0 110.239 177.925 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 82' ' ' VAL . . . . . . . . . . . . . 55.4 t -58.97 -42.82 87.24 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.495 0 CA-C-N 116.356 -0.384 . . . . 0.0 110.453 -177.348 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 83' ' ' SER . . . . . . . . . . . . . 13.4 m -59.44 -39.19 82.76 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 116.311 -0.404 . . . . 0.0 111.131 179.054 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 84' ' ' GLN . . . . . . . . . . . . . 7.7 tp-100 -63.32 -45.03 93.2 Favored 'General case' 0 C--O 1.234 0.274 0 CA-C-O 121.107 0.48 . . . . 0.0 110.298 177.407 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 85' ' ' LEU . . . . . . . . . . . . . 46.8 tp -67.88 -36.18 79.79 Favored 'General case' 0 C--N 1.327 -0.408 0 CA-C-N 115.936 -0.575 . . . . 0.0 110.428 179.455 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 86' ' ' ASN . . . . . . . . . . . . . 11.8 m120 -60.83 -47.2 87.45 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.233 -0.44 . . . . 0.0 110.563 178.215 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 87' ' ' SER . . . . . . . . . . . . . 3.5 p -63.36 -36.32 83.3 Favored 'General case' 0 CA--C 1.531 0.243 0 C-N-CA 121.038 -0.265 . . . . 0.0 111.319 179.396 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 88' ' ' TYR . . . . . . . . . . . . . 6.6 m-85 -59.62 -54.49 45.86 Favored 'General case' 0 C--O 1.233 0.232 0 CA-C-O 121.707 0.765 . . . . 0.0 110.167 174.236 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 89' ' ' LYS . . . . . 0.404 ' HE3' ' HB2' ' A' ' 89' ' ' LYS . 34.6 ttmt -65.59 -32.97 74.84 Favored 'General case' 0 C--N 1.325 -0.467 0 CA-C-N 114.597 -1.183 . . . . 0.0 110.88 -175.741 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 90' ' ' ASN . . . . . . . . . . . . . 27.6 t-20 -64.43 -52.18 59.41 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 116.02 -0.536 . . . . 0.0 111.324 179.708 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 91' ' ' TYR . . . . . . . . . . . . . 22.3 m-85 -61.06 -39.72 90.91 Favored 'General case' 0 C--O 1.234 0.259 0 CA-C-O 121.033 0.444 . . . . 0.0 110.233 179.756 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 92' ' ' CYS . . . . . 0.582 ' HA ' ' HB2' ' A' ' 96' ' ' LEU . 42.7 t -64.63 -49.57 70.56 Favored 'General case' 0 C--N 1.325 -0.474 0 CA-C-N 115.31 -0.859 . . . . 0.0 111.094 -178.09 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 93' ' ' ARG . . . . . . . . . . . . . 28.9 mmt180 -73.09 -6.56 46.47 Favored 'General case' 0 C--N 1.328 -0.35 0 N-CA-C 112.94 0.718 . . . . 0.0 112.94 -175.099 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 94' ' ' ASN . . . . . . . . . . . . . 52.7 m-80 -118.9 -64.66 1.25 Allowed 'General case' 0 C--N 1.327 -0.403 0 C-N-CA 119.537 -0.865 . . . . 0.0 112.721 -179.402 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 95' ' ' HIS . . . . . . . . . . . . . 82.7 m-70 -88.98 -20.49 24.39 Favored 'General case' 0 C--N 1.325 -0.469 0 N-CA-C 112.617 0.599 . . . . 0.0 112.617 -173.838 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 96' ' ' LEU . . . . . 0.582 ' HB2' ' HA ' ' A' ' 92' ' ' CYS . 83.4 mt -99.05 7.14 46.22 Favored 'General case' 0 C--N 1.325 -0.463 0 C-N-CA 120.946 -0.302 . . . . 0.0 111.065 -178.751 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 97' ' ' SER . . . . . 0.541 ' N ' ' HD2' ' A' ' 98' ' ' PRO . 50.2 m -57.63 -49.26 94.78 Favored Pre-proline 0 CA--C 1.537 0.453 0 CA-C-N 116.383 -0.371 . . . . 0.0 111.896 178.907 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 98' ' ' PRO . . . . . 0.541 ' HD2' ' N ' ' A' ' 97' ' ' SER . 9.5 Cg_endo -53.9 -40.07 82.13 Favored 'Trans proline' 0 C--N 1.358 1.037 0 C-N-CA 122.047 1.831 . . . . 0.0 112.458 176.727 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 99' ' ' LEU . . . . . 0.517 HD21 ' HD2' ' A' ' 102' ' ' LYS . 90.6 mt -75.28 -29.53 60.16 Favored 'General case' 0 C--N 1.332 -0.188 0 CA-C-N 116.255 -0.43 . . . . 0.0 111.107 -178.736 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 100' ' ' TYR . . . . . . . . . . . . . 23.4 t80 -55.74 -29.82 60.19 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 115.759 -0.655 . . . . 0.0 111.701 -174.318 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 101' ' ' MET . . . . . . . . . . . . . 65.2 mtt -106.77 10.75 30.72 Favored 'General case' 0 C--N 1.326 -0.44 0 CA-C-O 120.663 0.268 . . . . 0.0 111.571 -178.16 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 102' ' ' LYS . . . . . 0.523 ' HE3' ' OD2' ' A' ' 111' ' ' ASP . 68.3 mttm -97.03 134.41 40.42 Favored 'General case' 0 C--N 1.326 -0.424 0 N-CA-C 110.217 -0.29 . . . . 0.0 110.217 177.628 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 103' ' ' SER . . . . . 0.592 ' HA ' ' HA ' ' A' ' 63' ' ' SER . 68.0 m -73.52 152.28 40.72 Favored 'General case' 0 C--N 1.323 -0.568 0 N-CA-C 109.298 -0.631 . . . . 0.0 109.298 172.823 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 104' ' ' LEU . . . . . 0.407 ' HA ' HD11 ' A' ' 107' ' ' ILE . 82.2 mt -53.51 -35.9 61.16 Favored 'General case' 0 C--N 1.33 -0.276 0 N-CA-C 112.265 0.469 . . . . 0.0 112.265 -174.64 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 105' ' ' SER . . . . . . . . . . . . . 2.7 p -79.55 -6.81 57.79 Favored 'General case' 0 C--N 1.325 -0.474 0 N-CA-C 111.95 0.352 . . . . 0.0 111.95 -177.748 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 106' ' ' GLU . . . . . 0.528 ' OE1' ' HB2' ' A' ' 103' ' ' SER . 1.9 mp0 -112.21 7.21 19.4 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-O 120.746 0.308 . . . . 0.0 110.974 178.704 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 107' ' ' ILE . . . . . 0.504 HG13 ' O ' ' A' ' 103' ' ' SER . 81.8 mt -88.99 117.02 31.54 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.46 0 CA-C-O 121.106 0.479 . . . . 0.0 110.464 179.553 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 108' ' ' LEU . . . . . . . . . . . . . 85.6 mt -95.25 134.34 24.69 Favored Pre-proline 0 C--N 1.322 -0.609 0 CA-C-N 115.877 -0.601 . . . . 0.0 110.273 -179.868 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 109' ' ' PRO . . . . . . . . . . . . . 40.1 Cg_exo -58.79 -34.4 98.98 Favored 'Trans proline' 0 C--N 1.343 0.264 0 C-N-CA 122.643 2.229 . . . . 0.0 111.735 176.771 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 110' ' ' ALA . . . . . . . . . . . . . . . -70.64 -23.4 62.53 Favored 'General case' 0 C--N 1.33 -0.243 0 CA-C-N 115.624 -0.716 . . . . 0.0 111.106 178.702 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 111' ' ' ASP . . . . . 0.523 ' OD2' ' HE3' ' A' ' 102' ' ' LYS . 31.1 t70 -71.86 -42.97 66.25 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-O 121.181 0.515 . . . . 0.0 109.631 -179.932 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 112' ' ' ILE . . . . . 0.439 HD11 ' HB2' ' A' ' 150' ' ' PRO . 37.4 mt -67.89 -39.7 82.21 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.437 0 CA-C-N 115.69 -0.686 . . . . 0.0 110.186 176.689 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 113' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -59.86 -47.19 86.76 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 115.607 -0.724 . . . . 0.0 110.055 179.081 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 114' ' ' SER . . . . . . . . . . . . . 13.1 p -65.91 -27.56 68.28 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 116.261 -0.427 . . . . 0.0 111.148 -179.261 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 115' ' ' ILE . . . . . 0.518 HG13 ' O ' ' A' ' 111' ' ' ASP . 76.7 mt -61.19 -43.33 96.19 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.231 0 CA-C-O 121.198 0.523 . . . . 0.0 110.399 173.515 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 116' ' ' ILE . . . . . . . . . . . . . 50.7 mm -63.18 -33.35 60.42 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.599 0 CA-C-O 121.22 0.534 . . . . 0.0 110.17 177.228 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 117' ' ' ASN . . . . . . . . . . . . . 0.2 OUTLIER -75.56 -29.18 59.27 Favored 'General case' 0 C--N 1.326 -0.429 0 CA-C-N 115.799 -0.637 . . . . 0.0 110.77 -179.151 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 118' ' ' GLU . . . . . 0.477 ' HG3' ' HA ' ' A' ' 115' ' ' ILE . 3.1 pp20? -87.81 -8.99 55.19 Favored 'General case' 0 C--N 1.33 -0.245 0 C-N-CA 120.599 -0.441 . . . . 0.0 110.887 179.587 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 119' ' ' THR . . . . . . . . . . . . . 34.6 m -80.83 117.77 21.77 Favored 'General case' 0 N--CA 1.449 -0.5 0 N-CA-C 109.472 -0.566 . . . . 0.0 109.472 174.307 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 120' ' ' LYS . . . . . . . . . . . . . 67.3 mttm -98.29 32.14 2.57 Favored 'General case' 0 C--N 1.324 -0.534 0 CA-C-O 121.37 0.605 . . . . 0.0 110.77 -175.734 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 121' ' ' LEU . . . . . 0.406 HD22 HG22 ' A' ' 125' ' ' THR . 10.8 mp -100.86 -175.57 2.92 Favored 'General case' 0 C--N 1.322 -0.619 0 CA-C-N 115.642 -0.708 . . . . 0.0 110.266 178.998 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 122' ' ' ALA . . . . . 0.52 ' O ' ' HG ' ' A' ' 126' ' ' LEU . . . -75.03 164.56 26.41 Favored 'General case' 0 C--N 1.325 -0.495 0 CA-C-O 121.142 0.496 . . . . 0.0 111.888 -175.462 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 123' ' ' LYS . . . . . . . . . . . . . 64.6 tttp -59.86 -42.16 93.06 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 115.28 -0.873 . . . . 0.0 111.879 -175.784 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 124' ' ' ASN . . . . . . . . . . . . . 26.8 p-10 -63.29 -34.3 77.39 Favored 'General case' 0 C--N 1.326 -0.436 0 CA-C-O 120.822 0.344 . . . . 0.0 110.988 179.947 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 125' ' ' THR . . . . . 0.406 HG22 HD22 ' A' ' 121' ' ' LEU . 17.2 m -73.1 -38.02 66.51 Favored 'General case' 0 C--N 1.326 -0.428 0 CA-C-O 120.794 0.33 . . . . 0.0 110.358 177.989 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 126' ' ' LEU . . . . . 0.52 ' HG ' ' O ' ' A' ' 122' ' ' ALA . 89.5 mt -58.96 -49.01 79.49 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-O 121.146 0.498 . . . . 0.0 110.686 178.556 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 127' ' ' LYS . . . . . 0.515 ' HA ' ' HB3' ' A' ' 130' ' ' ARG . 16.4 ptmt -74.91 -20.25 59.79 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-N 116.072 -0.513 . . . . 0.0 110.93 -177.089 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 128' ' ' ALA . . . . . . . . . . . . . . . -66.57 -41.76 88.08 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-O 120.757 0.313 . . . . 0.0 110.62 174.822 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 129' ' ' ILE . . . . . . . . . . . . . 46.9 mt -64.86 -40.28 88.53 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.24 0 N-CA-C 109.192 -0.67 . . . . 0.0 109.192 175.057 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 130' ' ' ARG . . . . . 0.515 ' HB3' ' HA ' ' A' ' 127' ' ' LYS . 13.5 tpt85 -55.02 -45.41 75.16 Favored 'General case' 0 CA--C 1.533 0.314 0 CA-C-N 115.13 -0.941 . . . . 0.0 111.092 173.427 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 131' ' ' ASN . . . . . . . . . . . . . 12.9 m-80 -66.84 -47.04 73.2 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.366 -0.379 . . . . 0.0 111.251 178.637 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 132' ' ' THR . . . . . . . . . . . . . 40.3 m -57.9 -53.18 61.1 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.28 -0.418 . . . . 0.0 111.201 -178.786 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 133' ' ' ALA . . . . . . . . . . . . . . . -60.67 -36.25 78.27 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.234 -0.439 . . . . 0.0 111.034 -178.82 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 134' ' ' SER . . . . . 0.522 ' O ' ' HG3' ' A' ' 138' ' ' ARG . 39.0 t -60.31 -50.0 75.38 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.252 -0.431 . . . . 0.0 110.798 179.925 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 135' ' ' GLN . . . . . . . . . . . . . 75.4 mt-30 -59.47 -37.28 77.78 Favored 'General case' 0 C--N 1.331 -0.216 0 CA-C-N 116.384 -0.371 . . . . 0.0 110.832 -177.993 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 136' ' ' ILE . . . . . . . . . . . . . 71.0 mt -64.55 -47.35 89.49 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.386 0 CA-C-N 116.034 -0.53 . . . . 0.0 110.769 178.879 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 137' ' ' PHE . . . . . 0.453 ' O ' HG13 ' A' ' 141' ' ' ILE . 41.7 m-85 -65.98 -35.08 79.6 Favored 'General case' 0 C--N 1.331 -0.224 0 CA-C-N 116.544 -0.298 . . . . 0.0 111.41 179.543 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 138' ' ' ARG . . . . . 0.522 ' HG3' ' O ' ' A' ' 134' ' ' SER . 45.0 mtp-105 -61.9 -38.84 89.87 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-O 120.888 0.375 . . . . 0.0 110.492 178.157 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 139' ' ' LEU . . . . . . . . . . . . . 50.2 tp -60.55 -36.88 79.54 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-N 115.878 -0.601 . . . . 0.0 110.355 178.072 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 140' ' ' ALA . . . . . . . . . . . . . . . -69.6 -37.75 77.03 Favored 'General case' 0 C--N 1.327 -0.37 0 CA-C-N 115.961 -0.563 . . . . 0.0 110.365 177.353 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 141' ' ' ILE . . . . . 0.453 HG13 ' O ' ' A' ' 137' ' ' PHE . 70.2 mt -63.26 -44.46 99.21 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.277 0 CA-C-N 116.061 -0.518 . . . . 0.0 110.403 175.955 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 142' ' ' GLU . . . . . . . . . . . . . 51.8 mt-10 -62.14 -27.99 69.33 Favored 'General case' 0 C--N 1.331 -0.224 0 CA-C-N 116.129 -0.487 . . . . 0.0 111.59 178.632 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 143' ' ' ASN . . . . . 0.514 ' C ' ' HD2' ' A' ' 144' ' ' ARG . 34.9 m-80 -97.26 21.18 10.33 Favored 'General case' 0 C--N 1.324 -0.511 0 CA-C-N 116.143 -0.481 . . . . 0.0 110.783 178.439 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 144' ' ' ARG . . . . . 0.514 ' HD2' ' C ' ' A' ' 143' ' ' ASN . 0.0 OUTLIER 38.48 39.18 0.29 Allowed 'General case' 0 N--CA 1.472 0.648 0 C-N-CA 124.347 1.059 . . . . 0.0 112.496 -177.497 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' A' A ' 145' ' ' ALA . . . . . . . . . . . . . . . -88.33 -32.88 18.2 Favored 'General case' 0 C--N 1.325 -0.466 0 CA-C-N 115.808 -0.633 . . . . 0.0 109.613 176.983 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 146' ' ' ILE . . . . . 0.423 ' O ' ' HA ' ' A' ' 141' ' ' ILE . 16.6 tt -149.47 133.56 8.69 Favored 'Isoleucine or valine' 0 N--CA 1.449 -0.514 0 CA-C-N 115.283 -0.871 . . . . 0.0 109.439 177.506 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 147' ' ' ASP . . . . . . . . . . . . . 35.2 t70 -102.56 24.18 10.83 Favored 'General case' 0 C--N 1.325 -0.496 0 CA-C-O 122.09 0.948 . . . . 0.0 109.484 179.636 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 148' ' ' PHE . . . . . 0.406 ' H ' HG12 ' A' ' 146' ' ' ILE . 68.7 t80 -132.7 133.26 43.31 Favored 'General case' 0 C--N 1.319 -0.718 0 CA-C-N 114.927 -1.033 . . . . 0.0 109.64 -174.312 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 149' ' ' ASN . . . . . . . . . . . . . 18.5 t-20 -116.16 99.57 52.78 Favored Pre-proline 0 C--N 1.323 -0.571 0 N-CA-C 110.283 -0.266 . . . . 0.0 110.283 -179.84 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 150' ' ' PRO . . . . . 0.439 ' HB2' HD11 ' A' ' 112' ' ' ILE . 22.0 Cg_exo -65.67 -26.08 53.75 Favored 'Trans proline' 0 C--O 1.23 0.124 0 C-N-CA 122.68 2.253 . . . . 0.0 112.283 -178.818 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 151' ' ' ALA . . . . . . . . . . . . . . . -69.92 -20.89 63.33 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 115.995 -0.548 . . . . 0.0 111.333 -177.469 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 152' ' ' ASP . . . . . . . . . . . . . 25.2 t70 -64.15 -29.79 70.89 Favored 'General case' 0 C--O 1.234 0.253 0 CA-C-N 116.122 -0.49 . . . . 0.0 110.863 179.807 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 153' ' ' TYR . . . . . . . . . . . . . 78.7 m-85 -87.73 -5.19 58.78 Favored 'General case' 0 C--N 1.327 -0.383 0 CA-C-N 115.709 -0.678 . . . . 0.0 111.17 -176.175 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 154' ' ' VAL . . . . . . . . . . . . . 66.0 t -79.5 107.42 11.91 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.445 0 CA-C-O 120.929 0.395 . . . . 0.0 110.214 -179.399 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 155' ' ' ARG . . . . . . . . . . . . . 89.4 mtt180 -91.09 133.75 35.08 Favored 'General case' 0 C--N 1.323 -0.585 0 CA-C-N 116.104 -0.498 . . . . 0.0 110.54 -178.432 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 156' ' ' ILE . . . . . . . . . . . . . 50.6 mm -91.94 116.49 66.56 Favored Pre-proline 0 C--N 1.325 -0.495 0 CA-C-N 116.114 -0.494 . . . . 0.0 110.491 -176.951 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 157' ' ' PRO . . . . . . . . . . . . . 31.9 Cg_endo -64.0 159.11 44.01 Favored 'Trans proline' 0 C--O 1.235 0.355 0 C-N-CA 122.97 2.447 . . . . 0.0 113.219 -175.86 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 158' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -126.14 -7.13 6.54 Favored 'General case' 0 C--N 1.326 -0.427 0 CA-C-N 115.448 -0.797 . . . . 0.0 109.761 179.002 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 159' ' ' ILE . . . . . . . . . . . . . 4.4 mp -123.74 141.56 43.56 Favored 'Isoleucine or valine' 0 N--CA 1.438 -1.025 0 N-CA-C 108.326 -0.99 . . . . 0.0 108.326 -170.39 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 160' ' ' ALA . . . . . . . . . . . . . . . -58.44 114.96 2.69 Favored 'General case' 0 C--N 1.305 -1.331 0 CA-C-N 115.582 -0.736 . . . . 0.0 110.642 175.226 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 161' ' ' LEU . . . . . 0.403 ' O ' ' HB2' ' A' ' 162' ' ' GLU . 80.7 mt -90.79 -137.34 0.14 Allowed 'General case' 0 C--N 1.322 -0.59 0 CA-C-N 115.792 -0.64 . . . . 0.0 109.846 -177.627 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 162' ' ' GLU . . . . . 0.403 ' HB2' ' O ' ' A' ' 161' ' ' LEU . 28.4 mt-10 73.17 11.97 4.99 Favored 'General case' 0 C--O 1.234 0.268 0 CA-C-O 121.095 0.474 . . . . 0.0 111.053 175.202 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 163' ' ' HIS . . . . . . . . . . . . . 51.9 t-80 -94.78 96.86 9.64 Favored 'General case' 0 C--N 1.323 -0.546 0 N-CA-C 108.42 -0.956 . . . . 0.0 108.42 174.837 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 164' ' ' HIS . . . . . . . . . . . . . 25.8 t60 -100.7 98.65 9.17 Favored 'General case' 0 C--N 1.321 -0.662 0 CA-C-N 115.954 -0.566 . . . . 0.0 111.527 -169.224 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 165' ' ' HIS . . . . . . . . . . . . . 21.3 t60 66.72 -85.15 0.03 OUTLIER 'General case' 0 N--CA 1.468 0.433 0 O-C-N 123.691 0.62 . . . . 0.0 111.328 175.379 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 166' ' ' HIS . . . . . . . . . . . . . 23.6 t-80 167.05 111.1 0.01 OUTLIER 'General case' 0 C--N 1.325 -0.499 0 N-CA-C 107.561 -1.274 . . . . 0.0 107.561 -175.525 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 167' ' ' HIS . . . . . . . . . . . . . 1.3 t-80 -71.79 105.61 3.83 Favored 'General case' 0 C--N 1.322 -0.61 0 CA-C-O 120.981 0.42 . . . . 0.0 111.187 -172.311 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 168' ' ' HIS . . . . . . . . . . . . . 46.2 t-80 . . . . . 0 C--N 1.318 -0.78 0 CA-C-O 118.218 -0.896 . . . . 0.0 109.154 176.694 . . . . . . . . 0 0 . 1 . 008 nuclear orig full ' A' A ' 61' ' ' ARG . . . . . . . . . . . . . 85.9 mtt180 . . . . . 0 N--CA 1.481 1.108 0 CA-C-O 121.196 0.522 . . . . 0.0 109.796 . . . . . . . . . 0 0 . 1 . 008 nuclear orig full ' A' A ' 62' ' ' ASP . . . . . . . . . . . . . 2.5 p-10 -69.83 128.58 36.9 Favored 'General case' 0 C--N 1.325 -0.472 0 CA-C-N 115.49 -0.777 . . . . 0.0 110.87 178.535 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 63' ' ' SER . . . . . . . . . . . . . 72.4 p -110.64 -179.14 3.67 Favored 'General case' 0 C--N 1.317 -0.814 0 CA-C-N 115.627 -0.715 . . . . 0.0 109.565 176.975 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 64' ' ' PHE . . . . . 0.463 ' HB2' HD11 ' A' ' 107' ' ' ILE . 87.1 t80 -60.25 -35.71 76.12 Favored 'General case' 0 C--N 1.329 -0.299 0 N-CA-C 109.896 -0.409 . . . . 0.0 109.896 176.642 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 65' ' ' GLY . . . . . . . . . . . . . . . -62.01 -39.32 97.42 Favored Glycine 0 N--CA 1.452 -0.267 0 C-N-CA 121.13 -0.557 . . . . 0.0 112.106 176.964 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 66' ' ' ASP . . . . . 0.405 ' O ' ' HG3' ' A' ' 70' ' ' LYS . 8.6 m-20 -63.39 -52.08 63.14 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-O 120.908 0.385 . . . . 0.0 110.445 177.958 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 67' ' ' TRP . . . . . . . . . . . . . 95.9 m95 -67.19 -35.3 79.33 Favored 'General case' 0 C--N 1.326 -0.433 0 CA-C-N 115.921 -0.582 . . . . 0.0 111.37 -178.011 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 68' ' ' ALA . . . . . 0.659 ' O ' ' HG ' ' A' ' 72' ' ' LEU . . . -61.07 -51.09 70.62 Favored 'General case' 0 C--N 1.326 -0.449 0 N-CA-C 110.065 -0.346 . . . . 0.0 110.065 175.806 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 69' ' ' GLU . . . . . . . . . . . . . 11.9 tp10 -61.29 -37.86 84.72 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.099 -0.5 . . . . 0.0 110.665 -179.379 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 70' ' ' LYS . . . . . 0.405 ' HG3' ' O ' ' A' ' 66' ' ' ASP . 57.2 mtpt -66.57 -45.8 78.11 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.465 -0.334 . . . . 0.0 110.79 176.956 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 71' ' ' PHE . . . . . . . . . . . . . 89.9 t80 -61.77 -42.29 98.79 Favored 'General case' 0 C--N 1.327 -0.381 0 CA-C-N 116.241 -0.436 . . . . 0.0 110.384 179.215 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 72' ' ' LEU . . . . . 0.659 ' HG ' ' O ' ' A' ' 68' ' ' ALA . 91.7 mt -62.82 -44.23 96.7 Favored 'General case' 0 C--N 1.326 -0.439 0 CA-C-N 115.978 -0.555 . . . . 0.0 110.751 178.335 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 73' ' ' LYS . . . . . . . . . . . . . 22.7 tptp -65.67 -37.16 85.72 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-O 121.137 0.494 . . . . 0.0 110.057 179.794 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 74' ' ' SER . . . . . . . . . . . . . 9.8 t -65.44 -44.57 86.88 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 115.688 -0.687 . . . . 0.0 110.183 177.766 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 75' ' ' LYS . . . . . . . . . . . . . 20.6 mmtt -68.17 -31.55 71.18 Favored 'General case' 0 C--N 1.331 -0.204 0 CA-C-N 116.371 -0.377 . . . . 0.0 110.983 178.796 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 76' ' ' GLU . . . . . . . . . . . . . 38.9 tt0 -57.64 -49.13 77.47 Favored 'General case' 0 C--N 1.324 -0.51 0 CA-C-N 115.92 -0.582 . . . . 0.0 110.097 174.947 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 77' ' ' ALA . . . . . . . . . . . . . . . -74.69 -29.13 61.11 Favored 'General case' 0 C--N 1.327 -0.382 0 CA-C-N 115.705 -0.68 . . . . 0.0 111.34 178.824 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 78' ' ' ASP . . . . . . . . . . . . . 19.8 t70 -55.34 -45.45 76.42 Favored 'General case' 0 N--CA 1.465 0.32 0 CA-C-N 116.098 -0.501 . . . . 0.0 110.564 177.058 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 79' ' ' GLY . . . . . . . . . . . . . . . 128.41 62.46 0.12 Allowed Glycine 0 N--CA 1.446 -0.697 0 C-N-CA 120.679 -0.772 . . . . 0.0 112.308 176.906 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 80' ' ' VAL . . . . . . . . . . . . . 34.4 m -115.66 155.17 17.02 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.589 0 CA-C-O 120.677 0.275 . . . . 0.0 110.562 177.403 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 81' ' ' SER . . . . . . . . . . . . . 31.0 t -65.06 153.75 39.82 Favored 'General case' 0 C--N 1.324 -0.532 0 CA-C-N 115.817 -0.629 . . . . 0.0 110.261 175.818 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 82' ' ' VAL . . . . . . . . . . . . . 10.2 p -60.03 -36.83 69.79 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.318 0 CA-C-O 120.818 0.342 . . . . 0.0 110.325 177.453 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 83' ' ' SER . . . . . . . . . . . . . 34.2 t -69.43 -34.48 74.51 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-O 121.185 0.517 . . . . 0.0 109.973 178.254 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 84' ' ' GLN . . . . . . . . . . . . . 8.0 tp-100 -65.97 -40.63 91.41 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 115.825 -0.625 . . . . 0.0 109.852 178.23 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 85' ' ' LEU . . . . . 0.406 HD12 ' HB3' ' A' ' 72' ' ' LEU . 54.4 tp -70.41 -43.65 69.53 Favored 'General case' 0 C--N 1.326 -0.42 0 CA-C-N 115.987 -0.551 . . . . 0.0 110.831 178.229 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 86' ' ' ASN . . . . . . . . . . . . . 97.3 m-20 -60.45 -44.34 95.96 Favored 'General case' 0 C--N 1.332 -0.16 0 CA-C-N 116.437 -0.347 . . . . 0.0 110.922 179.498 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 87' ' ' SER . . . . . . . . . . . . . 8.4 p -61.58 -38.2 86.66 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.669 -0.241 . . . . 0.0 110.798 -179.735 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 88' ' ' TYR . . . . . 0.4 ' HA ' ' CD2' ' A' ' 91' ' ' TYR . 18.0 m-30 -57.89 -46.05 85.5 Favored 'General case' 0 C--O 1.231 0.1 0 CA-C-O 120.983 0.421 . . . . 0.0 110.32 173.81 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 89' ' ' LYS . . . . . 0.587 ' HA ' ' SG ' ' A' ' 92' ' ' CYS . 60.0 mttm -63.24 -38.1 89.85 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 115.681 -0.69 . . . . 0.0 110.872 179.264 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 90' ' ' ASN . . . . . . . . . . . . . 9.4 m120 -60.02 -32.49 70.94 Favored 'General case' 0 C--N 1.327 -0.401 0 CA-C-O 120.753 0.311 . . . . 0.0 111.085 177.408 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 91' ' ' TYR . . . . . 0.4 ' CD2' ' HA ' ' A' ' 88' ' ' TYR . 21.1 m-85 -70.38 -52.6 21.27 Favored 'General case' 0 C--O 1.235 0.327 0 CA-C-O 120.735 0.302 . . . . 0.0 110.619 178.17 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 92' ' ' CYS . . . . . 0.671 ' HA ' ' HB2' ' A' ' 96' ' ' LEU . 21.2 p -75.79 -39.18 57.4 Favored 'General case' 0 C--N 1.33 -0.253 0 N-CA-C 112.256 0.465 . . . . 0.0 112.256 -172.903 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 93' ' ' ARG . . . . . . . . . . . . . 43.8 ttt-85 -69.87 -47.92 60.72 Favored 'General case' 0 C--N 1.324 -0.51 0 CA-C-O 120.866 0.365 . . . . 0.0 111.502 -176.902 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 94' ' ' ASN . . . . . . . . . . . . . 17.7 m120 -87.54 -57.63 2.88 Favored 'General case' 0 C--N 1.325 -0.469 0 N-CA-C 112.205 0.446 . . . . 0.0 112.205 -173.282 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 95' ' ' HIS . . . . . . . . . . . . . 8.5 m80 -86.46 -40.57 15.19 Favored 'General case' 0 C--N 1.327 -0.389 0 N-CA-C 113.263 0.838 . . . . 0.0 113.263 -173.292 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 96' ' ' LEU . . . . . 0.671 ' HB2' ' HA ' ' A' ' 92' ' ' CYS . 76.6 mt -87.0 21.45 2.3 Favored 'General case' 0 C--N 1.325 -0.459 0 C-N-CA 120.704 -0.398 . . . . 0.0 110.69 -179.276 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 97' ' ' SER . . . . . 0.55 ' OG ' ' HD3' ' A' ' 98' ' ' PRO . 1.8 p -55.65 -45.29 99.9 Favored Pre-proline 0 CA--C 1.54 0.56 0 N-CA-C 113.003 0.742 . . . . 0.0 113.003 -179.006 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 98' ' ' PRO . . . . . 0.55 ' HD3' ' OG ' ' A' ' 97' ' ' SER . 32.2 Cg_exo -58.28 -38.23 91.75 Favored 'Trans proline' 0 C--N 1.36 1.18 0 C-N-CA 121.581 1.521 . . . . 0.0 111.688 177.488 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 99' ' ' LEU . . . . . 0.476 HD12 HD23 ' A' ' 96' ' ' LEU . 34.9 mt -77.44 -34.34 54.57 Favored 'General case' 0 C--N 1.325 -0.459 0 CA-C-N 115.809 -0.632 . . . . 0.0 110.34 -178.055 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 100' ' ' TYR . . . . . . . . . . . . . 5.7 t80 -55.5 -30.55 60.86 Favored 'General case' 0 C--N 1.326 -0.436 0 CA-C-N 115.279 -0.873 . . . . 0.0 111.226 -175.922 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 101' ' ' MET . . . . . . . . . . . . . 21.6 mmt -100.69 4.2 42.99 Favored 'General case' 0 C--N 1.326 -0.438 0 CA-C-N 116.346 -0.388 . . . . 0.0 111.403 -177.044 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 102' ' ' LYS . . . . . 0.491 ' HG3' ' O ' ' A' ' 98' ' ' PRO . 99.0 mttt -107.39 160.88 15.3 Favored 'General case' 0 C--N 1.325 -0.49 0 CA-C-O 121.055 0.455 . . . . 0.0 111.193 -178.309 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 103' ' ' SER . . . . . 0.41 ' O ' HG13 ' A' ' 107' ' ' ILE . 27.9 t -88.55 162.51 16.35 Favored 'General case' 0 C--N 1.325 -0.48 0 CA-C-N 115.862 -0.608 . . . . 0.0 109.998 176.531 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 104' ' ' LEU . . . . . 0.445 ' HB3' HD13 ' A' ' 146' ' ' ILE . 67.0 mt -61.61 -29.72 70.23 Favored 'General case' 0 C--N 1.326 -0.421 0 CA-C-N 116.039 -0.528 . . . . 0.0 111.81 -174.646 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 105' ' ' SER . . . . . . . . . . . . . 19.9 p -84.84 -15.86 43.31 Favored 'General case' 0 C--N 1.325 -0.462 0 CA-C-N 116.38 -0.373 . . . . 0.0 111.332 -178.318 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 106' ' ' GLU . . . . . . . . . . . . . 47.5 mt-10 -94.97 -24.23 17.04 Favored 'General case' 0 C--N 1.327 -0.393 0 CA-C-O 121.09 0.471 . . . . 0.0 110.719 -176.319 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 107' ' ' ILE . . . . . 0.474 HG22 HD23 ' A' ' 99' ' ' LEU . 82.4 mt -71.2 113.97 8.55 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.58 0 CA-C-N 115.624 -0.716 . . . . 0.0 110.695 -179.917 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 108' ' ' LEU . . . . . . . . . . . . . 88.5 mt -96.49 147.74 33.41 Favored Pre-proline 0 C--N 1.321 -0.646 0 CA-C-N 115.573 -0.739 . . . . 0.0 110.434 -179.985 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 109' ' ' PRO . . . . . 0.702 ' HB3' ' HB3' ' A' ' 153' ' ' TYR . 15.8 Cg_endo -58.55 -35.73 98.28 Favored 'Trans proline' 0 C--N 1.343 0.24 0 C-N-CA 122.653 2.236 . . . . 0.0 112.068 178.514 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 110' ' ' ALA . . . . . . . . . . . . . . . -68.51 -31.45 70.71 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 116.041 -0.527 . . . . 0.0 110.892 179.829 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 111' ' ' ASP . . . . . . . . . . . . . 24.6 t70 -68.9 -46.98 66.96 Favored 'General case' 0 C--N 1.327 -0.396 0 CA-C-O 121.22 0.533 . . . . 0.0 109.631 179.534 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 112' ' ' ILE . . . . . . . . . . . . . 30.7 mt -62.34 -41.17 90.6 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.291 0 CA-C-N 115.633 -0.712 . . . . 0.0 109.926 175.505 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 113' ' ' GLN . . . . . . . . . . . . . 24.3 tp60 -57.09 -42.8 81.42 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-N 115.524 -0.762 . . . . 0.0 110.207 178.002 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 114' ' ' SER . . . . . . . . . . . . . 36.5 m -59.19 -38.79 80.71 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 115.971 -0.559 . . . . 0.0 110.778 179.342 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 115' ' ' ILE . . . . . . . . . . . . . 73.3 mt -64.08 -47.99 87.83 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.358 0 CA-C-N 116.238 -0.437 . . . . 0.0 110.759 176.938 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 116' ' ' ILE . . . . . . . . . . . . . 48.1 mm -59.99 -41.72 87.13 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.442 0 CA-C-O 121.001 0.429 . . . . 0.0 110.79 179.78 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 117' ' ' ASN . . . . . . . . . . . . . 9.2 m-20 -65.82 -38.96 90.32 Favored 'General case' 0 C--N 1.327 -0.408 0 CA-C-N 115.707 -0.679 . . . . 0.0 112.111 -177.321 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 118' ' ' GLU . . . . . . . . . . . . . 10.8 pt-20 -80.74 -22.09 40.55 Favored 'General case' 0 C--O 1.234 0.285 0 C-N-CA 120.973 -0.291 . . . . 0.0 111.649 -176.454 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 119' ' ' THR . . . . . . . . . . . . . 86.9 m -68.0 112.76 5.18 Favored 'General case' 0 C--N 1.325 -0.459 0 CA-C-O 121.137 0.494 . . . . 0.0 110.788 -177.95 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 120' ' ' LYS . . . . . . . . . . . . . 21.5 ptmt -91.08 26.46 2.14 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 115.896 -0.593 . . . . 0.0 111.263 -177.236 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 121' ' ' LEU . . . . . . . . . . . . . 85.7 mt -90.28 173.4 8.16 Favored 'General case' 0 C--N 1.32 -0.712 0 N-CA-C 109.571 -0.529 . . . . 0.0 109.571 179.307 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 122' ' ' ALA . . . . . . . . . . . . . . . -61.29 151.25 32.44 Favored 'General case' 0 C--N 1.326 -0.439 0 CA-C-O 120.78 0.324 . . . . 0.0 111.125 -178.015 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 123' ' ' LYS . . . . . . . . . . . . . 85.9 tttt -57.26 -36.5 71.07 Favored 'General case' 0 C--N 1.327 -0.41 0 CA-C-N 115.999 -0.546 . . . . 0.0 111.215 -178.932 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 124' ' ' ASN . . . . . . . . . . . . . 31.3 p30 -64.87 -25.21 67.8 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-O 121.084 0.468 . . . . 0.0 111.092 177.38 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 125' ' ' THR . . . . . 0.451 ' O ' HG13 ' A' ' 129' ' ' ILE . 16.6 m -81.92 -36.99 27.48 Favored 'General case' 0 N--CA 1.45 -0.464 0 CA-C-N 116.061 -0.518 . . . . 0.0 109.814 178.681 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 126' ' ' LEU . . . . . . . . . . . . . 94.2 mt -58.79 -45.89 88.82 Favored 'General case' 0 C--N 1.33 -0.246 0 CA-C-N 116.002 -0.545 . . . . 0.0 109.622 174.083 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 127' ' ' LYS . . . . . . . . . . . . . 50.1 mttm -62.16 -35.08 77.72 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-N 115.382 -0.827 . . . . 0.0 111.219 176.785 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 128' ' ' ALA . . . . . . . . . . . . . . . -65.72 -47.8 74.11 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.367 -0.379 . . . . 0.0 110.806 178.554 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 129' ' ' ILE . . . . . 0.451 HG13 ' O ' ' A' ' 125' ' ' THR . 58.3 mt -62.02 -45.68 98.17 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.226 0 CA-C-N 116.289 -0.414 . . . . 0.0 109.92 178.032 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 130' ' ' ARG . . . . . . . . . . . . . 8.9 tpt85 -55.95 -54.27 46.74 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-N 115.512 -0.767 . . . . 0.0 111.19 177.057 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 131' ' ' ASN . . . . . . . . . . . . . 8.8 t30 -57.71 -47.41 82.47 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 116.478 -0.328 . . . . 0.0 111.289 -177.312 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 132' ' ' THR . . . . . 0.485 ' O ' HG13 ' A' ' 136' ' ' ILE . 30.8 m -57.77 -51.79 68.12 Favored 'General case' 0 C--N 1.324 -0.517 0 CA-C-N 115.971 -0.559 . . . . 0.0 110.855 -178.993 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 133' ' ' ALA . . . . . . . . . . . . . . . -61.96 -41.07 97.59 Favored 'General case' 0 C--N 1.331 -0.206 0 CA-C-N 116.183 -0.462 . . . . 0.0 111.103 -179.96 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 134' ' ' SER . . . . . 0.614 ' O ' ' HG3' ' A' ' 138' ' ' ARG . 50.0 m -58.24 -49.59 76.55 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.022 -0.536 . . . . 0.0 111.284 -178.327 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 135' ' ' GLN . . . . . . . . . . . . . 22.0 mt-30 -66.62 -32.25 73.46 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.517 -0.31 . . . . 0.0 111.205 -177.162 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 136' ' ' ILE . . . . . 0.485 HG13 ' O ' ' A' ' 132' ' ' THR . 82.9 mt -61.57 -47.11 94.89 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.231 0 CA-C-O 120.799 0.333 . . . . 0.0 110.518 177.155 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 137' ' ' PHE . . . . . . . . . . . . . 54.3 m-85 -64.99 -39.74 93.93 Favored 'General case' 0 C--N 1.327 -0.401 0 CA-C-N 116.325 -0.398 . . . . 0.0 111.432 178.53 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 138' ' ' ARG . . . . . 0.614 ' HG3' ' O ' ' A' ' 134' ' ' SER . 41.0 mtp180 -67.67 -31.25 71.09 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-O 120.779 0.323 . . . . 0.0 110.409 -179.761 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 139' ' ' LEU . . . . . . . . . . . . . 60.8 tp -62.8 -40.73 98.27 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-O 121.245 0.545 . . . . 0.0 109.852 174.994 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 140' ' ' ALA . . . . . . . . . . . . . . . -64.34 -35.28 80.36 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-N 115.652 -0.704 . . . . 0.0 110.682 177.637 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 141' ' ' ILE . . . . . 0.535 ' HA ' ' O ' ' A' ' 146' ' ' ILE . 70.4 mt -63.3 -44.04 98.92 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.224 0 CA-C-O 120.858 0.361 . . . . 0.0 110.462 175.126 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 142' ' ' GLU . . . . . . . . . . . . . 19.1 mm-40 -67.57 -25.47 65.8 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.148 -0.478 . . . . 0.0 111.538 179.796 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 143' ' ' ASN . . . . . 0.45 HD21 ' N ' ' A' ' 143' ' ' ASN . 0.9 OUTLIER -94.12 5.04 52.99 Favored 'General case' 0 C--N 1.323 -0.58 0 CA-C-N 116.278 -0.419 . . . . 0.0 110.446 176.423 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' A' A ' 144' ' ' ARG . . . . . . . . . . . . . 57.5 mtp85 64.62 25.22 13.1 Favored 'General case' 0 N--CA 1.465 0.313 0 CA-C-N 115.517 -0.765 . . . . 0.0 112.787 174.001 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 145' ' ' ALA . . . . . . . . . . . . . . . -83.43 -27.52 29.48 Favored 'General case' 0 C--N 1.325 -0.46 0 CA-C-O 121.294 0.569 . . . . 0.0 109.993 176.384 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 146' ' ' ILE . . . . . 0.535 ' O ' ' HA ' ' A' ' 141' ' ' ILE . 18.1 tt -145.91 154.56 13.05 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.461 0 CA-C-N 115.653 -0.703 . . . . 0.0 109.185 178.728 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 147' ' ' ASP . . . . . . . . . . . . . 4.9 p-10 -103.44 -5.2 23.11 Favored 'General case' 0 N--CA 1.467 0.393 0 N-CA-C 111.963 0.357 . . . . 0.0 111.963 -174.455 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 148' ' ' PHE . . . . . . . . . . . . . 76.2 t80 -155.66 145.23 21.11 Favored 'General case' 0 C--N 1.324 -0.513 0 N-CA-C 110.166 -0.309 . . . . 0.0 110.166 -176.7 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 149' ' ' ASN . . . . . . . . . . . . . 20.0 p-10 -107.28 112.27 62.87 Favored Pre-proline 0 C--N 1.323 -0.563 0 CA-C-O 121.053 0.454 . . . . 0.0 110.943 178.99 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 150' ' ' PRO . . . . . . . . . . . . . 35.6 Cg_endo -65.34 -11.0 28.17 Favored 'Trans proline' 0 N--CA 1.473 0.323 0 C-N-CA 122.969 2.446 . . . . 0.0 112.291 179.31 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 151' ' ' ALA . . . . . . . . . . . . . . . -67.5 -31.85 72.26 Favored 'General case' 0 C--N 1.327 -0.387 0 CA-C-N 115.968 -0.56 . . . . 0.0 110.775 178.088 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 152' ' ' ASP . . . . . . . . . . . . . 25.9 t70 -72.91 -15.77 61.57 Favored 'General case' 0 N--CA 1.464 0.262 0 CA-C-O 121.589 0.709 . . . . 0.0 110.04 179.594 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 153' ' ' TYR . . . . . 0.702 ' HB3' ' HB3' ' A' ' 109' ' ' PRO . 3.1 t80 -84.26 -20.82 31.56 Favored 'General case' 0 C--N 1.325 -0.48 0 CA-C-N 115.234 -0.894 . . . . 0.0 109.458 179.444 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 154' ' ' VAL . . . . . . . . . . . . . 59.1 t -72.85 129.54 35.92 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.423 0 CA-C-N 115.726 -0.67 . . . . 0.0 110.812 -178.768 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 155' ' ' ARG . . . . . . . . . . . . . 59.2 mtm180 -86.6 146.99 26.12 Favored 'General case' 0 C--N 1.324 -0.538 0 CA-C-N 116.218 -0.446 . . . . 0.0 110.675 -178.3 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 156' ' ' ILE . . . . . . . . . . . . . 37.8 mm -108.36 113.49 60.27 Favored Pre-proline 0 C--N 1.317 -0.823 0 CA-C-N 115.669 -0.696 . . . . 0.0 109.517 172.754 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 157' ' ' PRO . . . . . . . . . . . . . 51.1 Cg_exo -54.47 130.35 39.58 Favored 'Trans proline' 0 C--N 1.344 0.325 0 C-N-CA 122.542 2.162 . . . . 0.0 111.62 -179.982 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 158' ' ' LYS . . . . . . . . . . . . . 51.2 mttp -94.25 -47.89 6.42 Favored 'General case' 0 C--N 1.319 -0.742 0 CA-C-N 115.906 -0.588 . . . . 0.0 109.42 -176.434 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 159' ' ' ILE . . . . . . . . . . . . . 51.8 mm 71.48 -59.22 0.28 Allowed 'Isoleucine or valine' 0 N--CA 1.465 0.309 0 O-C-N 124.223 0.952 . . . . 0.0 111.883 173.887 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 160' ' ' ALA . . . . . . . . . . . . . . . -70.47 107.09 3.67 Favored 'General case' 0 C--N 1.323 -0.55 0 CA-C-N 116.433 -0.349 . . . . 0.0 111.021 -178.239 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 161' ' ' LEU . . . . . . . . . . . . . 69.1 mt 60.11 31.7 20.67 Favored 'General case' 0 C--O 1.233 0.229 0 CA-C-N 115.718 -0.674 . . . . 0.0 111.102 178.715 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 162' ' ' GLU . . . . . . . . . . . . . 32.8 tt0 -77.6 91.26 3.98 Favored 'General case' 0 C--N 1.324 -0.514 0 N-CA-C 109.744 -0.465 . . . . 0.0 109.744 178.418 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 163' ' ' HIS . . . . . . . . . . . . . 97.1 m-70 -92.75 126.58 37.9 Favored 'General case' 0 C--N 1.322 -0.6 0 CA-C-N 116.219 -0.446 . . . . 0.0 110.07 -178.374 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 164' ' ' HIS . . . . . . . . . . . . . 36.0 m80 -88.31 -51.25 5.85 Favored 'General case' 0 C--N 1.322 -0.598 0 N-CA-C 109.533 -0.543 . . . . 0.0 109.533 -179.895 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 165' ' ' HIS . . . . . . . . . . . . . 48.8 t-80 65.67 8.87 5.49 Favored 'General case' 0 N--CA 1.471 0.597 0 N-CA-C 112.445 0.535 . . . . 0.0 112.445 166.787 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 166' ' ' HIS . . . . . . . . . . . . . 66.4 m80 59.6 88.87 0.07 Allowed 'General case' 0 C--O 1.234 0.279 0 CA-C-O 121.506 0.67 . . . . 0.0 110.337 -172.324 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 167' ' ' HIS . . . . . . . . . . . . . 27.1 t-80 -80.15 118.47 21.87 Favored 'General case' 0 C--N 1.321 -0.65 0 CA-C-N 115.237 -0.892 . . . . 0.0 111.063 -175.822 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 168' ' ' HIS . . . . . . . . . . . . . 64.3 m-70 . . . . . 0 C--O 1.245 0.823 0 CA-C-O 118.305 -0.855 . . . . 0.0 110.172 177.493 . . . . . . . . 0 0 . 1 . 009 nuclear orig full ' A' A ' 61' ' ' ARG . . . . . . . . . . . . . 87.9 mtt180 . . . . . 0 N--CA 1.478 0.962 0 N-CA-C 109.802 -0.444 . . . . 0.0 109.802 . . . . . . . . . 0 0 . 1 . 009 nuclear orig full ' A' A ' 62' ' ' ASP . . . . . 0.774 ' HA ' ' HE1' ' A' ' 67' ' ' TRP . 37.0 m-20 65.6 22.48 11.72 Favored 'General case' 0 N--CA 1.47 0.531 0 CA-C-N 115.94 -0.573 . . . . 0.0 110.916 -179.934 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 63' ' ' SER . . . . . 0.53 ' HA ' ' HA ' ' A' ' 103' ' ' SER . 1.3 m -95.43 152.25 18.57 Favored 'General case' 0 C--N 1.32 -0.695 0 N-CA-C 109.366 -0.605 . . . . 0.0 109.366 179.772 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 64' ' ' PHE . . . . . 0.54 ' HB2' HD13 ' A' ' 107' ' ' ILE . 56.0 t80 -63.44 -44.58 94.15 Favored 'General case' 0 C--N 1.324 -0.504 0 C-N-CA 120.959 -0.297 . . . . 0.0 110.434 -179.319 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 65' ' ' GLY . . . . . . . . . . . . . . . -65.35 -29.76 76.02 Favored Glycine 0 C--N 1.331 0.289 0 C-N-CA 120.845 -0.693 . . . . 0.0 112.062 177.654 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 66' ' ' ASP . . . . . . . . . . . . . 12.2 t0 -65.89 -54.16 30.21 Favored 'General case' 0 C--O 1.24 0.579 0 CA-C-O 121.475 0.655 . . . . 0.0 110.209 177.91 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 67' ' ' TRP . . . . . 0.774 ' HE1' ' HA ' ' A' ' 62' ' ' ASP . 96.3 m95 -70.62 -23.78 62.61 Favored 'General case' 0 C--N 1.325 -0.463 0 CA-C-N 115.802 -0.635 . . . . 0.0 110.91 178.162 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 68' ' ' ALA . . . . . . . . . . . . . . . -62.61 -48.81 77.77 Favored 'General case' 0 C--O 1.225 -0.208 0 CA-C-N 116.406 -0.361 . . . . 0.0 110.671 176.419 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 69' ' ' GLU . . . . . . . . . . . . . 43.6 tt0 -59.05 -44.57 91.82 Favored 'General case' 0 C--O 1.234 0.281 0 C-N-CA 120.856 -0.338 . . . . 0.0 110.114 177.382 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 70' ' ' LYS . . . . . . . . . . . . . 24.5 ttmm -58.91 -43.02 91.0 Favored 'General case' 0 CA--C 1.535 0.399 0 CA-C-N 116.105 -0.498 . . . . 0.0 110.955 179.151 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 71' ' ' PHE . . . . . . . . . . . . . 82.3 t80 -72.11 -44.56 62.99 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-O 120.88 0.371 . . . . 0.0 111.332 -179.626 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 72' ' ' LEU . . . . . 0.455 HD22 ' HG2' ' A' ' 89' ' ' LYS . 7.3 mp -61.38 -39.44 90.67 Favored 'General case' 0 C--N 1.325 -0.472 0 CA-C-N 116.332 -0.395 . . . . 0.0 111.32 -178.297 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 73' ' ' LYS . . . . . 0.474 ' O ' ' HB3' ' A' ' 76' ' ' GLU . 57.3 tttp -77.21 -33.32 56.27 Favored 'General case' 0 C--N 1.326 -0.429 0 C-N-CA 120.644 -0.422 . . . . 0.0 111.416 -178.403 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 74' ' ' SER . . . . . . . . . . . . . 12.3 p -68.76 -29.34 67.71 Favored 'General case' 0 C--N 1.324 -0.513 0 C-N-CA 120.268 -0.573 . . . . 0.0 109.847 176.679 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 75' ' ' LYS . . . . . 0.509 ' O ' HG23 ' A' ' 80' ' ' VAL . 43.3 mmtt -77.39 -34.73 54.84 Favored 'General case' 0 C--N 1.331 -0.217 0 CA-C-N 116.267 -0.424 . . . . 0.0 110.529 173.14 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 76' ' ' GLU . . . . . 0.474 ' HB3' ' O ' ' A' ' 73' ' ' LYS . 34.6 tt0 -51.75 -47.61 64.03 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 116.018 -0.537 . . . . 0.0 110.057 172.444 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 77' ' ' ALA . . . . . . . . . . . . . . . -84.56 -12.65 53.71 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 115.677 -0.692 . . . . 0.0 111.751 178.847 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 78' ' ' ASP . . . . . . . . . . . . . 29.5 t70 -65.99 -35.85 81.7 Favored 'General case' 0 N--CA 1.467 0.386 0 CA-C-O 120.876 0.369 . . . . 0.0 110.473 178.773 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 79' ' ' GLY . . . . . . . . . . . . . . . 133.76 2.07 3.61 Favored Glycine 0 N--CA 1.447 -0.567 0 C-N-CA 120.073 -1.06 . . . . 0.0 113.447 176.047 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 80' ' ' VAL . . . . . 0.509 HG23 ' O ' ' A' ' 75' ' ' LYS . 28.4 m -70.15 136.96 25.0 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.339 0 CA-C-N 117.324 0.562 . . . . 0.0 110.377 179.499 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 81' ' ' SER . . . . . . . . . . . . . 23.3 t -72.62 164.7 26.07 Favored 'General case' 0 C--N 1.322 -0.607 0 CA-C-O 121.147 0.498 . . . . 0.0 110.224 179.947 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 82' ' ' VAL . . . . . . . . . . . . . 28.8 m -57.08 -29.69 32.35 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.609 0 CA-C-N 115.305 -0.861 . . . . 0.0 111.7 -177.177 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 83' ' ' SER . . . . . . . . . . . . . 5.9 p -62.71 -48.01 81.13 Favored 'General case' 0 C--N 1.326 -0.432 0 CA-C-O 121.173 0.511 . . . . 0.0 110.701 177.337 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 84' ' ' GLN . . . . . . . . . . . . . 6.8 tp-100 -73.83 -37.13 64.94 Favored 'General case' 0 C--N 1.325 -0.484 0 CA-C-N 115.793 -0.64 . . . . 0.0 110.074 -179.954 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 85' ' ' LEU . . . . . . . . . . . . . 43.5 tp -62.49 -44.79 95.54 Favored 'General case' 0 C--N 1.326 -0.442 0 CA-C-N 115.836 -0.62 . . . . 0.0 110.655 178.734 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 86' ' ' ASN . . . . . . . . . . . . . 83.5 m-20 -61.52 -37.02 82.18 Favored 'General case' 0 CA--C 1.519 -0.214 0 CA-C-N 116.487 -0.324 . . . . 0.0 110.377 176.265 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 87' ' ' SER . . . . . . . . . . . . . 27.2 t -56.1 -49.34 74.14 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 116.176 -0.466 . . . . 0.0 110.284 178.753 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 88' ' ' TYR . . . . . . . . . . . . . 32.3 m-85 -58.47 -41.28 84.85 Favored 'General case' 0 C--O 1.233 0.188 0 CA-C-O 120.87 0.366 . . . . 0.0 110.895 178.908 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 89' ' ' LYS . . . . . 0.555 ' HA ' ' SG ' ' A' ' 92' ' ' CYS . 85.1 mttt -70.76 -31.65 68.53 Favored 'General case' 0 C--N 1.327 -0.386 0 CA-C-N 116.197 -0.456 . . . . 0.0 111.294 -177.675 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 90' ' ' ASN . . . . . . . . . . . . . 27.6 m-80 -64.55 -36.17 83.36 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-O 120.97 0.414 . . . . 0.0 110.384 175.61 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 91' ' ' TYR . . . . . . . . . . . . . 42.4 m-85 -67.01 -48.9 66.97 Favored 'General case' 0 C--N 1.326 -0.415 0 CA-C-N 116.279 -0.419 . . . . 0.0 111.306 179.43 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 92' ' ' CYS . . . . . 0.586 ' HA ' ' HB2' ' A' ' 96' ' ' LEU . 26.1 p -72.56 -32.99 66.49 Favored 'General case' 0 C--N 1.331 -0.238 0 N-CA-C 111.849 0.315 . . . . 0.0 111.849 -175.63 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 93' ' ' ARG . . . . . . . . . . . . . 99.7 mtt180 -78.53 -38.99 39.23 Favored 'General case' 0 C--N 1.328 -0.365 0 N-CA-C 112.022 0.378 . . . . 0.0 112.022 -178.358 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 94' ' ' ASN . . . . . . . . . . . . . 17.4 m120 -99.62 -60.4 1.54 Allowed 'General case' 0 C--N 1.327 -0.384 0 N-CA-C 112.539 0.57 . . . . 0.0 112.539 -175.19 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 95' ' ' HIS . . . . . . . . . . . . . 6.1 m80 -78.79 -47.73 16.17 Favored 'General case' 0 C--N 1.325 -0.463 0 N-CA-C 112.502 0.556 . . . . 0.0 112.502 -172.4 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 96' ' ' LEU . . . . . 0.586 ' HB2' ' HA ' ' A' ' 92' ' ' CYS . 86.6 mt -91.59 21.53 4.6 Favored 'General case' 0 C--N 1.32 -0.698 0 CA-C-N 116.718 -0.219 . . . . 0.0 111.188 -175.386 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 97' ' ' SER . . . . . 0.523 ' N ' ' HD2' ' A' ' 98' ' ' PRO . 3.1 p -59.94 -43.22 94.06 Favored Pre-proline 0 CA--C 1.544 0.739 0 N-CA-C 112.667 0.617 . . . . 0.0 112.667 -179.719 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 98' ' ' PRO . . . . . 0.523 ' HD2' ' N ' ' A' ' 97' ' ' SER . 22.9 Cg_endo -63.41 -32.03 71.97 Favored 'Trans proline' 0 C--N 1.362 1.241 0 C-N-CA 121.59 1.527 . . . . 0.0 112.195 175.951 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 99' ' ' LEU . . . . . 0.631 ' HA ' ' HD2' ' A' ' 102' ' ' LYS . 10.8 mp -80.1 -31.45 39.2 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.407 -0.36 . . . . 0.0 110.51 179.682 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 100' ' ' TYR . . . . . . . . . . . . . 36.1 t80 -54.39 -34.63 61.66 Favored 'General case' 0 C--N 1.327 -0.374 0 CA-C-N 115.673 -0.694 . . . . 0.0 111.193 -178.258 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 101' ' ' MET . . . . . . . . . . . . . 22.5 mmt -91.83 -4.29 55.04 Favored 'General case' 0 C--N 1.331 -0.228 0 CA-C-N 115.791 -0.64 . . . . 0.0 111.06 -176.661 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 102' ' ' LYS . . . . . 0.631 ' HD2' ' HA ' ' A' ' 99' ' ' LEU . 51.8 mttm -87.93 150.01 23.73 Favored 'General case' 0 C--N 1.323 -0.566 0 CA-C-N 116.132 -0.485 . . . . 0.0 110.71 179.662 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 103' ' ' SER . . . . . 0.53 ' HA ' ' HA ' ' A' ' 63' ' ' SER . 8.7 m -82.52 162.98 21.83 Favored 'General case' 0 C--N 1.322 -0.597 0 N-CA-C 107.972 -1.121 . . . . 0.0 107.972 167.622 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 104' ' ' LEU . . . . . . . . . . . . . 95.2 mt -52.54 -39.31 61.28 Favored 'General case' 0 C--N 1.324 -0.535 0 N-CA-C 111.983 0.364 . . . . 0.0 111.983 -177.53 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 105' ' ' SER . . . . . . . . . . . . . 9.0 m -83.65 0.24 47.76 Favored 'General case' 0 C--N 1.326 -0.446 0 N-CA-C 111.933 0.345 . . . . 0.0 111.933 -177.641 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 106' ' ' GLU . . . . . . . . . . . . . 44.9 mt-10 -102.92 -3.24 26.44 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-O 121.026 0.441 . . . . 0.0 110.253 178.4 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 107' ' ' ILE . . . . . 0.596 HG21 ' HZ ' ' A' ' 137' ' ' PHE . 62.0 mt -94.13 112.57 27.15 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.645 0 CA-C-N 115.998 -0.547 . . . . 0.0 110.5 -177.741 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 108' ' ' LEU . . . . . . . . . . . . . 64.5 mt -96.09 146.15 30.81 Favored Pre-proline 0 C--N 1.318 -0.769 0 CA-C-N 115.887 -0.597 . . . . 0.0 110.004 179.856 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 109' ' ' PRO . . . . . . . . . . . . . 42.0 Cg_exo -57.91 -28.39 82.56 Favored 'Trans proline' 0 N--CA 1.464 -0.245 0 C-N-CA 122.317 2.011 . . . . 0.0 111.33 175.437 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 110' ' ' ALA . . . . . . . . . . . . . . . -65.6 -34.73 78.92 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-N 115.724 -0.671 . . . . 0.0 110.983 177.083 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 111' ' ' ASP . . . . . 0.456 ' O ' HG13 ' A' ' 115' ' ' ILE . 70.6 m-20 -61.6 -46.24 90.68 Favored 'General case' 0 CA--C 1.516 -0.354 0 CA-C-O 121.027 0.441 . . . . 0.0 109.814 178.864 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 112' ' ' ILE . . . . . 0.525 ' O ' HG12 ' A' ' 116' ' ' ILE . 46.0 mt -69.73 -45.16 78.3 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.585 0 CA-C-N 115.892 -0.595 . . . . 0.0 110.293 179.67 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 113' ' ' GLN . . . . . . . . . . . . . 7.0 tp-100 -57.81 -43.45 85.71 Favored 'General case' 0 C--N 1.332 -0.18 0 CA-C-N 116.374 -0.376 . . . . 0.0 111.143 179.721 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 114' ' ' SER . . . . . 0.501 ' O ' ' HG2' ' A' ' 118' ' ' GLU . 13.5 p -66.33 -37.56 85.64 Favored 'General case' 0 C--N 1.327 -0.399 0 C-N-CA 120.903 -0.319 . . . . 0.0 110.814 -179.906 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 115' ' ' ILE . . . . . 0.456 HG13 ' O ' ' A' ' 111' ' ' ASP . 69.0 mt -63.47 -41.92 94.39 Favored 'Isoleucine or valine' 0 N--CA 1.465 0.288 0 CA-C-O 120.731 0.301 . . . . 0.0 110.548 176.184 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 116' ' ' ILE . . . . . 0.525 HG12 ' O ' ' A' ' 112' ' ' ILE . 50.0 mm -65.01 -26.33 39.76 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.323 0 CA-C-O 121.307 0.575 . . . . 0.0 110.439 178.005 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 117' ' ' ASN . . . . . . . . . . . . . 8.8 t30 -86.63 -37.17 18.31 Favored 'General case' 0 C--N 1.325 -0.499 0 CA-C-N 115.759 -0.655 . . . . 0.0 111.435 -179.916 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 118' ' ' GLU . . . . . 0.501 ' HG2' ' O ' ' A' ' 114' ' ' SER . 33.9 mm-40 -79.78 -29.21 40.31 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-N 116.514 -0.312 . . . . 0.0 111.388 -176.212 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 119' ' ' THR . . . . . 0.475 ' HB ' HD22 ' A' ' 126' ' ' LEU . 62.0 m -76.03 111.31 11.3 Favored 'General case' 0 C--N 1.323 -0.573 0 CA-C-O 121.415 0.626 . . . . 0.0 109.752 176.83 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 120' ' ' LYS . . . . . . . . . . . . . 45.4 mtmt -96.11 31.59 2.13 Favored 'General case' 0 C--N 1.322 -0.599 0 CA-C-N 115.499 -0.773 . . . . 0.0 110.766 -174.157 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 121' ' ' LEU . . . . . 0.413 HD12 HG21 ' A' ' 119' ' ' THR . 11.2 mp -90.09 -174.93 4.39 Favored 'General case' 0 C--N 1.321 -0.641 0 CA-C-N 115.296 -0.865 . . . . 0.0 110.235 178.11 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 122' ' ' ALA . . . . . . . . . . . . . . . -62.33 152.62 33.31 Favored 'General case' 0 C--N 1.326 -0.439 0 CA-C-N 115.955 -0.566 . . . . 0.0 111.581 -177.301 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 123' ' ' LYS . . . . . 0.761 ' HE3' ' HA ' ' A' ' 123' ' ' LYS . 1.0 OUTLIER -56.88 -39.65 74.75 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 115.508 -0.769 . . . . 0.0 110.791 -177.784 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' A' A ' 124' ' ' ASN . . . . . . . . . . . . . 17.7 m120 -55.85 -47.33 77.47 Favored 'General case' 0 C--N 1.331 -0.217 0 CA-C-N 116.056 -0.52 . . . . 0.0 111.156 179.594 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 125' ' ' THR . . . . . 0.552 ' O ' HG13 ' A' ' 129' ' ' ILE . 19.0 m -59.41 -44.94 92.75 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.054 -0.521 . . . . 0.0 110.715 -178.955 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 126' ' ' LEU . . . . . 0.475 HD22 ' HB ' ' A' ' 119' ' ' THR . 97.5 mt -61.53 -41.68 97.7 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 115.932 -0.576 . . . . 0.0 111.033 179.553 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 127' ' ' LYS . . . . . 0.464 ' HG3' ' O ' ' A' ' 123' ' ' LYS . 51.5 mtpt -66.35 -37.53 85.53 Favored 'General case' 0 C--N 1.326 -0.437 0 CA-C-N 115.872 -0.604 . . . . 0.0 110.359 179.626 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 128' ' ' ALA . . . . . . . . . . . . . . . -67.3 -36.14 80.91 Favored 'General case' 0 C--N 1.326 -0.428 0 CA-C-N 116.055 -0.52 . . . . 0.0 111.149 179.442 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 129' ' ' ILE . . . . . 0.552 HG13 ' O ' ' A' ' 125' ' ' THR . 80.2 mt -58.86 -51.96 66.04 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.277 0 CA-C-O 120.851 0.358 . . . . 0.0 110.432 177.355 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 130' ' ' ARG . . . . . . . . . . . . . 39.8 ttt-85 -62.94 -44.07 97.07 Favored 'General case' 0 C--N 1.331 -0.203 0 CA-C-N 116.045 -0.525 . . . . 0.0 110.602 178.606 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 131' ' ' ASN . . . . . . . . . . . . . 47.5 t30 -57.5 -47.0 83.1 Favored 'General case' 0 N--CA 1.465 0.278 0 CA-C-N 116.111 -0.495 . . . . 0.0 111.277 -179.297 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 132' ' ' THR . . . . . . . . . . . . . 34.6 m -61.31 -49.17 78.11 Favored 'General case' 0 C--N 1.326 -0.413 0 CA-C-N 116.34 -0.391 . . . . 0.0 110.816 -179.748 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 133' ' ' ALA . . . . . . . . . . . . . . . -62.75 -41.72 99.34 Favored 'General case' 0 C--N 1.331 -0.211 0 CA-C-N 116.274 -0.421 . . . . 0.0 111.126 -179.173 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 134' ' ' SER . . . . . . . . . . . . . 32.7 t -60.04 -42.41 94.39 Favored 'General case' 0 C--N 1.327 -0.402 0 CA-C-N 116.182 -0.463 . . . . 0.0 110.993 -178.189 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 135' ' ' GLN . . . . . . . . . . . . . 49.8 mt-30 -65.13 -35.68 81.89 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-N 116.382 -0.372 . . . . 0.0 110.709 179.953 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 136' ' ' ILE . . . . . . . . . . . . . 74.4 mt -65.32 -44.37 94.8 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.272 0 CA-C-N 116.338 -0.392 . . . . 0.0 110.44 177.143 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 137' ' ' PHE . . . . . 0.596 ' HZ ' HG21 ' A' ' 107' ' ' ILE . 50.1 m-85 -62.02 -39.47 92.38 Favored 'General case' 0 N--CA 1.461 0.119 0 CA-C-N 116.3 -0.409 . . . . 0.0 110.675 177.243 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 138' ' ' ARG . . . . . 0.592 ' O ' ' HG2' ' A' ' 142' ' ' GLU . 73.9 mtp180 -58.64 -44.8 90.16 Favored 'General case' 0 C--N 1.33 -0.242 0 CA-C-N 116.395 -0.366 . . . . 0.0 110.768 177.645 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 139' ' ' LEU . . . . . . . . . . . . . 53.9 tp -59.13 -36.93 76.05 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-O 121.061 0.457 . . . . 0.0 110.686 179.232 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 140' ' ' ALA . . . . . . . . . . . . . . . -67.97 -41.0 83.06 Favored 'General case' 0 C--N 1.326 -0.417 0 CA-C-N 116.096 -0.502 . . . . 0.0 110.515 176.792 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 141' ' ' ILE . . . . . 0.561 ' HA ' ' O ' ' A' ' 146' ' ' ILE . 72.2 mt -61.12 -44.33 98.09 Favored 'Isoleucine or valine' 0 C--O 1.234 0.239 0 CA-C-N 116.254 -0.43 . . . . 0.0 110.482 176.482 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 142' ' ' GLU . . . . . 0.592 ' HG2' ' O ' ' A' ' 138' ' ' ARG . 24.8 mm-40 -54.57 -43.99 72.54 Favored 'General case' 0 C--N 1.33 -0.241 0 CA-C-N 115.993 -0.549 . . . . 0.0 110.862 178.458 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 143' ' ' ASN . . . . . . . . . . . . . 42.5 m-80 -90.0 14.05 13.22 Favored 'General case' 0 C--N 1.325 -0.496 0 CA-C-N 115.695 -0.684 . . . . 0.0 111.558 -176.718 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 144' ' ' ARG . . . . . . . . . . . . . 92.6 mtt180 61.98 32.14 17.82 Favored 'General case' 0 N--CA 1.467 0.419 0 N-CA-C 112.144 0.424 . . . . 0.0 112.144 174.367 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 145' ' ' ALA . . . . . . . . . . . . . . . -89.8 -29.95 18.3 Favored 'General case' 0 C--N 1.324 -0.513 0 CA-C-O 121.219 0.533 . . . . 0.0 110.416 177.047 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 146' ' ' ILE . . . . . 0.561 ' O ' ' HA ' ' A' ' 141' ' ' ILE . 16.4 tt -147.32 155.94 10.58 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.69 0 N-CA-C 108.457 -0.942 . . . . 0.0 108.457 177.941 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 147' ' ' ASP . . . . . . . . . . . . . 16.9 t70 -122.34 18.72 10.61 Favored 'General case' 0 C--N 1.323 -0.57 0 CA-C-O 121.122 0.486 . . . . 0.0 111.569 -176.446 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 148' ' ' PHE . . . . . . . . . . . . . 49.7 p90 -149.29 154.77 39.51 Favored 'General case' 0 C--N 1.321 -0.635 0 N-CA-C 110.147 -0.316 . . . . 0.0 110.147 176.797 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 149' ' ' ASN . . . . . . . . . . . . . 57.3 t-20 -118.72 96.84 50.42 Favored Pre-proline 0 C--N 1.324 -0.51 0 CA-C-N 116.271 -0.422 . . . . 0.0 110.427 -176.696 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 150' ' ' PRO . . . . . . . . . . . . . 31.9 Cg_exo -59.33 -33.63 97.72 Favored 'Trans proline' 0 C--N 1.342 0.188 0 C-N-CA 122.897 2.398 . . . . 0.0 111.939 179.312 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 151' ' ' ALA . . . . . . . . . . . . . . . -69.37 -32.06 70.86 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.12 -0.491 . . . . 0.0 110.68 -179.555 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 152' ' ' ASP . . . . . . . . . . . . . 30.6 t70 -70.84 -22.72 62.28 Favored 'General case' 0 C--N 1.326 -0.421 0 CA-C-O 121.226 0.536 . . . . 0.0 109.91 178.624 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 153' ' ' TYR . . . . . . . . . . . . . 75.5 t80 -82.85 -16.08 49.05 Favored 'General case' 0 C--N 1.324 -0.512 0 CA-C-N 115.518 -0.765 . . . . 0.0 110.213 -179.04 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 154' ' ' VAL . . . . . . . . . . . . . 24.2 t -68.98 132.44 33.04 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.304 0 CA-C-N 116.25 -0.432 . . . . 0.0 110.298 176.145 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 155' ' ' ARG . . . . . . . . . . . . . 17.3 tpp180 -109.41 119.49 39.62 Favored 'General case' 0 C--N 1.318 -0.79 0 N-CA-C 109.816 -0.438 . . . . 0.0 109.816 173.897 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 156' ' ' ILE . . . . . . . . . . . . . 33.1 mm -66.02 124.48 87.87 Favored Pre-proline 0 C--N 1.327 -0.396 0 CA-C-N 115.658 -0.701 . . . . 0.0 109.731 174.121 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 157' ' ' PRO . . . . . . . . . . . . . 14.7 Cg_exo -69.67 144.7 55.38 Favored 'Trans proline' 0 N--CA 1.455 -0.748 0 C-N-CA 121.92 1.747 . . . . 0.0 110.91 173.41 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 158' ' ' LYS . . . . . . . . . . . . . 75.5 mttt 76.29 -43.5 0.47 Allowed 'General case' 0 N--CA 1.467 0.41 0 C-N-CA 123.72 0.808 . . . . 0.0 111.398 176.821 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 159' ' ' ILE . . . . . . . . . . . . . 4.3 mp 69.97 -56.26 0.28 Allowed 'Isoleucine or valine' 0 N--CA 1.47 0.549 0 C-N-CA 123.463 0.705 . . . . 0.0 112.326 174.117 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 160' ' ' ALA . . . . . . . . . . . . . . . -77.09 164.66 25.5 Favored 'General case' 0 C--N 1.326 -0.43 0 CA-C-O 121.32 0.581 . . . . 0.0 111.979 -174.114 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 161' ' ' LEU . . . . . . . . . . . . . 1.2 pp -118.41 15.25 13.85 Favored 'General case' 0 C--N 1.327 -0.398 0 CA-C-N 115.468 -0.787 . . . . 0.0 111.23 -178.925 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 162' ' ' GLU . . . . . . . . . . . . . 34.5 tt0 -85.04 106.02 16.22 Favored 'General case' 0 C--N 1.327 -0.393 0 CA-C-O 120.988 0.423 . . . . 0.0 110.069 179.408 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 163' ' ' HIS . . . . . . . . . . . . . 57.0 t-80 -107.92 109.87 21.48 Favored 'General case' 0 C--N 1.322 -0.604 0 CA-C-O 121.078 0.466 . . . . 0.0 110.914 -179.041 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 164' ' ' HIS . . . . . . . . . . . . . 31.5 t-80 -125.77 -67.3 0.89 Allowed 'General case' 0 C--N 1.321 -0.635 0 N-CA-C 108.591 -0.892 . . . . 0.0 108.591 170.943 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 165' ' ' HIS . . . . . . . . . . . . . 5.1 t60 69.34 144.66 0.05 Allowed 'General case' 0 CA--C 1.531 0.249 0 O-C-N 124.269 0.981 . . . . 0.0 110.896 174.516 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 166' ' ' HIS . . . . . . . . . . . . . 53.4 t-80 -96.7 70.3 2.54 Favored 'General case' 0 C--N 1.322 -0.6 0 C-N-CA 120.224 -0.59 . . . . 0.0 110.833 -179.023 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 167' ' ' HIS . . . . . . . . . . . . . 11.5 m170 -144.33 77.99 1.56 Allowed 'General case' 0 C--N 1.324 -0.521 0 CA-C-N 115.772 -0.649 . . . . 0.0 109.31 170.395 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 168' ' ' HIS . . . . . . . . . . . . . 0.5 OUTLIER . . . . . 0 C--O 1.244 0.814 0 CA-C-N 114.823 -1.08 . . . . 0.0 108.908 -178.883 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 61' ' ' ARG . . . . . . . . . . . . . 48.1 mtt180 . . . . . 0 N--CA 1.481 1.1 0 N-CA-C 109.772 -0.455 . . . . 0.0 109.772 . . . . . . . . . 0 0 . 1 . 010 nuclear orig full ' A' A ' 62' ' ' ASP . . . . . . . . . . . . . 0.7 OUTLIER -150.32 155.03 38.88 Favored 'General case' 0 C--N 1.322 -0.62 0 CA-C-O 121.502 0.668 . . . . 0.0 111.481 -178.518 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 63' ' ' SER . . . . . . . . . . . . . 29.1 t -118.69 161.21 20.47 Favored 'General case' 0 C--N 1.322 -0.603 0 CA-C-N 115.063 -0.971 . . . . 0.0 109.703 -177.658 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 64' ' ' PHE . . . . . 0.498 ' HB2' HD12 ' A' ' 107' ' ' ILE . 73.4 t80 -60.11 -30.04 69.0 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-O 120.76 0.314 . . . . 0.0 110.427 179.194 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 65' ' ' GLY . . . . . 0.442 ' HA2' ' CD1' ' A' ' 100' ' ' TYR . . . -61.11 -41.04 99.34 Favored Glycine 0 N--CA 1.449 -0.472 0 C-N-CA 121.08 -0.581 . . . . 0.0 112.217 176.675 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 66' ' ' ASP . . . . . 0.491 ' O ' ' HG2' ' A' ' 70' ' ' LYS . 33.9 t70 -66.69 -42.58 86.23 Favored 'General case' 0 C--N 1.325 -0.463 0 N-CA-C 109.767 -0.457 . . . . 0.0 109.767 178.185 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 67' ' ' TRP . . . . . . . . . . . . . 93.8 m95 -67.72 -27.82 67.13 Favored 'General case' 0 C--N 1.331 -0.23 0 CA-C-N 115.827 -0.624 . . . . 0.0 111.54 -179.961 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 68' ' ' ALA . . . . . 0.471 ' O ' ' HG ' ' A' ' 72' ' ' LEU . . . -62.22 -49.55 75.3 Favored 'General case' 0 C--N 1.328 -0.355 0 N-CA-C 109.779 -0.452 . . . . 0.0 109.779 174.291 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 69' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER -61.83 -37.64 85.19 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.087 -0.506 . . . . 0.0 110.65 175.262 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 70' ' ' LYS . . . . . 0.491 ' HG2' ' O ' ' A' ' 66' ' ' ASP . 27.0 mmmt -57.58 -52.09 66.83 Favored 'General case' 0 N--CA 1.464 0.254 0 CA-C-N 116.356 -0.384 . . . . 0.0 110.47 176.364 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 71' ' ' PHE . . . . . . . . . . . . . 92.0 t80 -62.12 -40.3 95.44 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 115.998 -0.546 . . . . 0.0 110.829 -179.669 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 72' ' ' LEU . . . . . 0.471 ' HG ' ' O ' ' A' ' 68' ' ' ALA . 79.5 mt -61.74 -51.65 67.48 Favored 'General case' 0 C--N 1.326 -0.456 0 CA-C-N 116.223 -0.444 . . . . 0.0 111.097 179.496 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 73' ' ' LYS . . . . . 0.436 ' HA ' ' HB3' ' A' ' 76' ' ' GLU . 55.0 tttp -71.44 -24.06 61.95 Favored 'General case' 0 C--N 1.326 -0.441 0 C-N-CA 120.216 -0.594 . . . . 0.0 110.59 -179.165 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 74' ' ' SER . . . . . . . . . . . . . 33.5 t -60.26 -45.47 93.19 Favored 'General case' 0 C--N 1.328 -0.358 0 N-CA-C 109.795 -0.446 . . . . 0.0 109.795 173.745 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 75' ' ' LYS . . . . . . . . . . . . . 27.5 mmtm -76.11 -30.35 58.2 Favored 'General case' 0 C--N 1.327 -0.399 0 CA-C-N 116.384 -0.371 . . . . 0.0 110.855 177.605 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 76' ' ' GLU . . . . . 0.436 ' HB3' ' HA ' ' A' ' 73' ' ' LYS . 2.7 tm-20 -58.08 -53.43 58.38 Favored 'General case' 0 C--N 1.327 -0.379 0 CA-C-N 116.092 -0.504 . . . . 0.0 109.722 173.969 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 77' ' ' ALA . . . . . . . . . . . . . . . -71.33 -27.04 63.09 Favored 'General case' 0 C--N 1.325 -0.473 0 CA-C-N 115.721 -0.672 . . . . 0.0 111.229 179.322 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 78' ' ' ASP . . . . . . . . . . . . . 17.4 t70 -64.08 -49.09 73.62 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.114 -0.494 . . . . 0.0 110.528 178.117 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 79' ' ' GLY . . . . . . . . . . . . . . . 131.32 55.15 0.09 OUTLIER Glycine 0 N--CA 1.448 -0.555 0 C-N-CA 120.633 -0.794 . . . . 0.0 112.975 177.084 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 80' ' ' VAL . . . . . 0.646 HG22 ' HG ' ' A' ' 85' ' ' LEU . 22.8 m -112.16 168.91 4.69 Favored 'Isoleucine or valine' 0 C--O 1.237 0.431 0 O-C-N 122.462 -0.434 . . . . 0.0 110.732 175.328 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 81' ' ' SER . . . . . . . . . . . . . 74.9 p -83.08 169.31 16.03 Favored 'General case' 0 C--N 1.322 -0.612 0 CA-C-N 115.929 -0.578 . . . . 0.0 110.944 -178.721 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 82' ' ' VAL . . . . . . . . . . . . . 94.3 t -64.33 -37.83 80.98 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.431 0 N-CA-C 109.379 -0.601 . . . . 0.0 109.379 173.817 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 83' ' ' SER . . . . . . . . . . . . . 13.6 t -60.38 -47.65 85.13 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 115.758 -0.655 . . . . 0.0 110.536 178.657 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 84' ' ' GLN . . . . . . . . . . . . . 6.7 tp-100 -63.71 -45.1 91.51 Favored 'General case' 0 C--N 1.332 -0.157 0 CA-C-N 116.369 -0.378 . . . . 0.0 110.396 179.704 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 85' ' ' LEU . . . . . 0.646 ' HG ' HG22 ' A' ' 80' ' ' VAL . 19.1 mt -62.46 -36.07 81.28 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.225 -0.443 . . . . 0.0 111.266 177.418 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 86' ' ' ASN . . . . . . . . . . . . . 53.7 t30 -72.77 -29.95 63.72 Favored 'General case' 0 C--N 1.322 -0.621 0 CA-C-N 115.837 -0.62 . . . . 0.0 109.856 -177.9 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 87' ' ' SER . . . . . 0.412 ' O ' ' HD1' ' A' ' 91' ' ' TYR . 42.4 t -64.27 -49.94 69.87 Favored 'General case' 0 N--CA 1.452 -0.363 0 CA-C-N 115.655 -0.702 . . . . 0.0 109.682 172.877 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 88' ' ' TYR . . . . . . . . . . . . . 25.7 m-85 -59.86 -38.72 82.95 Favored 'General case' 0 C--N 1.331 -0.234 0 CA-C-N 116.208 -0.451 . . . . 0.0 111.265 179.733 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 89' ' ' LYS . . . . . 0.466 ' HG3' ' O ' ' A' ' 85' ' ' LEU . 64.6 mttp -57.92 -44.58 86.94 Favored 'General case' 0 C--N 1.333 -0.115 0 CA-C-O 120.801 0.334 . . . . 0.0 110.89 177.625 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 90' ' ' ASN . . . . . . . . . . . . . 20.7 t-20 -64.49 -42.9 95.57 Favored 'General case' 0 C--N 1.325 -0.487 0 CA-C-N 116.038 -0.528 . . . . 0.0 111.048 -177.295 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 91' ' ' TYR . . . . . 0.412 ' HD1' ' O ' ' A' ' 87' ' ' SER . 11.8 m-85 -66.54 -46.65 75.41 Favored 'General case' 0 C--N 1.324 -0.524 0 N-CA-C 111.719 0.266 . . . . 0.0 111.719 -177.926 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 92' ' ' CYS . . . . . 0.493 ' HA ' HD13 ' A' ' 96' ' ' LEU . 24.5 p -75.98 -25.68 56.04 Favored 'General case' 0 C--N 1.327 -0.391 0 N-CA-C 111.883 0.327 . . . . 0.0 111.883 -175.122 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 93' ' ' ARG . . . . . 0.503 ' NH2' ' HH ' ' A' ' 100' ' ' TYR . 51.3 mtt85 -98.12 -31.87 11.89 Favored 'General case' 0 C--N 1.325 -0.494 0 N-CA-C 112.912 0.708 . . . . 0.0 112.912 -176.116 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 94' ' ' ASN . . . . . . . . . . . . . 16.7 m120 -95.31 -45.26 7.22 Favored 'General case' 0 C--N 1.325 -0.469 0 C-N-CA 120.581 -0.448 . . . . 0.0 111.608 -179.285 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 95' ' ' HIS . . . . . . . . . . . . . 77.4 m-70 -84.96 -44.46 13.09 Favored 'General case' 0 C--N 1.327 -0.39 0 CA-C-O 120.881 0.372 . . . . 0.0 110.501 -177.611 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 96' ' ' LEU . . . . . 0.493 HD13 ' HA ' ' A' ' 92' ' ' CYS . 79.8 mt -91.72 26.8 2.24 Favored 'General case' 0 C--N 1.324 -0.534 0 CA-C-N 116.107 -0.497 . . . . 0.0 110.061 179.854 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 97' ' ' SER . . . . . 0.576 ' OG ' ' HD3' ' A' ' 98' ' ' PRO . 1.4 p -54.43 -48.04 95.97 Favored Pre-proline 0 CA--C 1.542 0.657 0 N-CA-C 113.276 0.843 . . . . 0.0 113.276 -176.841 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 98' ' ' PRO . . . . . 0.576 ' HD3' ' OG ' ' A' ' 97' ' ' SER . 13.1 Cg_exo -69.18 -13.96 37.07 Favored 'Trans proline' 0 C--N 1.356 0.934 0 C-N-CA 121.873 1.715 . . . . 0.0 112.233 -178.837 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 99' ' ' LEU . . . . . 0.464 HD12 HD22 ' A' ' 96' ' ' LEU . 61.2 mt -95.02 -30.84 13.89 Favored 'General case' 0 C--N 1.324 -0.516 0 CA-C-N 116.353 -0.385 . . . . 0.0 110.418 -178.519 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 100' ' ' TYR . . . . . 0.503 ' HH ' ' NH2' ' A' ' 93' ' ' ARG . 84.4 t80 -56.5 -32.77 65.35 Favored 'General case' 0 C--N 1.331 -0.203 0 CA-C-N 115.855 -0.612 . . . . 0.0 111.716 -176.458 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 101' ' ' MET . . . . . . . . . . . . . 25.6 ttt -98.92 1.19 45.41 Favored 'General case' 0 C--N 1.323 -0.575 0 CA-C-O 120.871 0.367 . . . . 0.0 111.406 -176.051 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 102' ' ' LYS . . . . . 0.477 ' HG3' ' O ' ' A' ' 98' ' ' PRO . 77.8 mttt -90.42 145.65 24.76 Favored 'General case' 0 C--N 1.322 -0.595 0 CA-C-O 121.482 0.658 . . . . 0.0 111.813 -178.561 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 103' ' ' SER . . . . . 0.412 ' O ' HG13 ' A' ' 107' ' ' ILE . 44.8 t -66.88 145.02 55.91 Favored 'General case' 0 C--N 1.323 -0.576 0 CA-C-N 115.236 -0.893 . . . . 0.0 109.183 173.0 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 104' ' ' LEU . . . . . . . . . . . . . 41.9 tp -56.85 -51.19 69.98 Favored 'General case' 0 C--N 1.328 -0.353 0 N-CA-C 112.536 0.569 . . . . 0.0 112.536 -170.043 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 105' ' ' SER . . . . . . . . . . . . . 4.8 m -74.29 -11.35 60.24 Favored 'General case' 0 C--N 1.327 -0.382 0 CA-C-O 121.001 0.429 . . . . 0.0 111.388 -175.966 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 106' ' ' GLU . . . . . . . . . . . . . 2.1 mp0 -96.84 5.64 50.17 Favored 'General case' 0 C--N 1.326 -0.416 0 CA-C-N 116.071 -0.513 . . . . 0.0 111.434 -174.688 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 107' ' ' ILE . . . . . 0.498 HD12 ' HB2' ' A' ' 64' ' ' PHE . 70.2 mt -89.57 137.6 21.02 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.455 0 CA-C-O 120.992 0.425 . . . . 0.0 111.0 -179.695 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 108' ' ' LEU . . . . . 0.428 HD21 ' N ' ' A' ' 108' ' ' LEU . 2.1 mm? -108.66 148.32 37.51 Favored Pre-proline 0 C--N 1.325 -0.482 0 CA-C-N 115.777 -0.647 . . . . 0.0 110.294 -179.863 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 109' ' ' PRO . . . . . . . . . . . . . 27.5 Cg_endo -63.59 -22.52 70.44 Favored 'Trans proline' 0 C--N 1.343 0.239 0 C-N-CA 122.182 1.921 . . . . 0.0 111.031 174.296 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 110' ' ' ALA . . . . . . . . . . . . . . . -63.76 -41.81 97.92 Favored 'General case' 0 N--CA 1.454 -0.255 0 CA-C-N 115.464 -0.789 . . . . 0.0 111.16 -179.641 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 111' ' ' ASP . . . . . 0.486 ' O ' HG13 ' A' ' 115' ' ' ILE . 20.2 m-20 -58.33 -44.43 88.68 Favored 'General case' 0 N--CA 1.465 0.288 0 CA-C-O 121.189 0.519 . . . . 0.0 110.897 178.837 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 112' ' ' ILE . . . . . 0.561 HG22 HH22 ' A' ' 130' ' ' ARG . 12.7 mt -72.09 -33.89 48.49 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.59 0 CA-C-N 115.863 -0.608 . . . . 0.0 110.652 -176.373 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 113' ' ' GLN . . . . . . . . . . . . . 25.1 tp60 -64.92 -40.55 95.23 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 115.996 -0.547 . . . . 0.0 110.626 -179.619 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 114' ' ' SER . . . . . . . . . . . . . 6.8 p -72.52 -36.13 68.26 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 116.46 -0.336 . . . . 0.0 110.935 179.616 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 115' ' ' ILE . . . . . 0.486 HG13 ' O ' ' A' ' 111' ' ' ASP . 77.5 mt -56.4 -46.78 82.1 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.158 0 CA-C-O 120.896 0.379 . . . . 0.0 110.292 175.729 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 116' ' ' ILE . . . . . . . . . . . . . 49.1 mm -67.22 -35.59 74.47 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.316 0 CA-C-N 116.094 -0.503 . . . . 0.0 110.686 178.661 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 117' ' ' ASN . . . . . . . . . . . . . 50.8 t30 -66.05 -40.93 91.34 Favored 'General case' 0 C--N 1.327 -0.398 0 CA-C-N 116.158 -0.473 . . . . 0.0 111.171 -179.735 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 118' ' ' GLU . . . . . . . . . . . . . 43.0 mt-10 -84.91 -19.3 32.47 Favored 'General case' 0 C--N 1.326 -0.444 0 CA-C-N 116.169 -0.468 . . . . 0.0 111.787 -176.605 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 119' ' ' THR . . . . . . . . . . . . . 69.6 m -84.04 112.94 20.65 Favored 'General case' 0 C--N 1.326 -0.444 0 CA-C-O 121.209 0.528 . . . . 0.0 109.763 175.042 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 120' ' ' LYS . . . . . 0.402 ' HB3' ' HE2' ' A' ' 120' ' ' LYS . 11.4 ptpt -110.34 86.29 2.28 Favored 'General case' 0 C--N 1.32 -0.696 0 CA-C-O 121.817 0.818 . . . . 0.0 110.887 -177.614 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 121' ' ' LEU . . . . . . . . . . . . . 96.0 mt -133.16 -175.04 3.66 Favored 'General case' 0 C--N 1.322 -0.622 0 CA-C-N 114.65 -1.159 . . . . 0.0 109.122 179.29 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 122' ' ' ALA . . . . . . . . . . . . . . . -58.52 145.58 38.55 Favored 'General case' 0 C--N 1.326 -0.419 0 O-C-N 123.123 0.264 . . . . 0.0 110.644 178.009 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 123' ' ' LYS . . . . . . . . . . . . . 21.4 ptmt -60.75 -33.93 73.67 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.662 -0.244 . . . . 0.0 111.537 -175.563 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 124' ' ' ASN . . . . . . . . . . . . . 1.9 p-10 -68.66 -27.15 65.74 Favored 'General case' 0 N--CA 1.463 0.208 0 CA-C-O 121.127 0.489 . . . . 0.0 110.036 178.925 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 125' ' ' THR . . . . . . . . . . . . . 20.7 m -78.22 -34.63 49.19 Favored 'General case' 0 N--CA 1.452 -0.356 0 CA-C-N 115.932 -0.576 . . . . 0.0 109.828 178.877 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 126' ' ' LEU . . . . . . . . . . . . . 91.8 mt -67.42 -38.14 84.15 Favored 'General case' 0 C--N 1.327 -0.407 0 CA-C-N 115.809 -0.632 . . . . 0.0 109.879 175.723 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 127' ' ' LYS . . . . . 0.503 ' HG2' HG23 ' A' ' 156' ' ' ILE . 50.2 mtpt -70.4 -26.61 63.77 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.009 -0.541 . . . . 0.0 110.706 176.184 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 128' ' ' ALA . . . . . . . . . . . . . . . -67.09 -41.19 86.73 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-O 120.845 0.355 . . . . 0.0 110.132 174.97 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 129' ' ' ILE . . . . . . . . . . . . . 62.6 mt -65.29 -43.33 95.15 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.289 0 CA-C-N 116.017 -0.538 . . . . 0.0 109.791 175.628 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 130' ' ' ARG . . . . . 0.655 ' CZ ' ' HA ' ' A' ' 130' ' ' ARG . 0.5 OUTLIER -58.39 -49.92 75.53 Favored 'General case' 0 C--N 1.331 -0.229 0 CA-C-N 115.562 -0.745 . . . . 0.0 110.435 176.721 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' A' A ' 131' ' ' ASN . . . . . . . . . . . . . 5.4 t30 -55.96 -55.86 27.6 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 115.677 -0.692 . . . . 0.0 111.233 178.041 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 132' ' ' THR . . . . . 0.495 ' O ' HG13 ' A' ' 136' ' ' ILE . 37.3 m -56.12 -53.56 55.62 Favored 'General case' 0 C--N 1.327 -0.373 0 CA-C-N 116.055 -0.52 . . . . 0.0 111.488 -175.16 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 133' ' ' ALA . . . . . . . . . . . . . . . -63.2 -37.57 87.74 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.52 -0.309 . . . . 0.0 111.133 -177.858 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 134' ' ' SER . . . . . 0.468 ' O ' ' HG3' ' A' ' 138' ' ' ARG . 8.3 t -66.26 -44.3 84.02 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.433 -0.349 . . . . 0.0 110.512 -177.486 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 135' ' ' GLN . . . . . . . . . . . . . 44.5 mt-30 -62.93 -33.53 75.53 Favored 'General case' 0 C--O 1.233 0.199 0 CA-C-O 120.669 0.271 . . . . 0.0 110.914 -179.078 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 136' ' ' ILE . . . . . 0.495 HG13 ' O ' ' A' ' 132' ' ' THR . 66.3 mt -63.61 -48.44 86.75 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.218 0 CA-C-N 116.347 -0.388 . . . . 0.0 110.696 176.95 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 137' ' ' PHE . . . . . 0.415 ' O ' HG13 ' A' ' 141' ' ' ILE . 56.4 m-85 -66.25 -37.53 85.71 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-N 116.635 -0.257 . . . . 0.0 110.879 178.579 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 138' ' ' ARG . . . . . 0.468 ' HG3' ' O ' ' A' ' 134' ' ' SER . 41.4 mtp-105 -60.03 -40.3 88.85 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-N 116.449 -0.342 . . . . 0.0 110.454 176.871 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 139' ' ' LEU . . . . . . . . . . . . . 62.1 tp -62.73 -38.56 90.97 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 115.947 -0.569 . . . . 0.0 110.225 177.35 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 140' ' ' ALA . . . . . . . . . . . . . . . -63.94 -41.55 97.58 Favored 'General case' 0 C--N 1.326 -0.427 0 CA-C-N 115.942 -0.572 . . . . 0.0 110.522 176.408 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 141' ' ' ILE . . . . . 0.415 HG13 ' O ' ' A' ' 137' ' ' PHE . 58.9 mt -63.62 -39.04 83.88 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.267 0 CA-C-N 116.565 -0.289 . . . . 0.0 111.021 174.76 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 142' ' ' GLU . . . . . 0.446 ' HG3' ' O ' ' A' ' 138' ' ' ARG . 48.8 mt-10 -60.87 -39.29 88.65 Favored 'General case' 0 N--CA 1.462 0.157 0 CA-C-O 120.858 0.361 . . . . 0.0 110.626 177.169 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 143' ' ' ASN . . . . . 0.43 ' N ' HD21 ' A' ' 143' ' ' ASN . 0.9 OUTLIER -84.87 0.94 49.25 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.204 -0.453 . . . . 0.0 110.189 177.074 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' A' A ' 144' ' ' ARG . . . . . . . . . . . . . 99.5 mtt180 55.15 44.7 27.41 Favored 'General case' 0 C--O 1.232 0.139 0 CA-C-N 115.341 -0.845 . . . . 0.0 111.713 179.222 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 145' ' ' ALA . . . . . . . . . . . . . . . -88.21 -55.59 3.68 Favored 'General case' 0 C--N 1.327 -0.4 0 CA-C-N 115.44 -0.8 . . . . 0.0 109.632 173.897 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 146' ' ' ILE . . . . . . . . . . . . . 18.3 tt -104.85 147.49 10.68 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.44 0 N-CA-C 109.359 -0.608 . . . . 0.0 109.359 175.966 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 147' ' ' ASP . . . . . . . . . . . . . 27.2 t70 -87.7 -6.3 58.28 Favored 'General case' 0 C--N 1.324 -0.52 0 CA-C-N 116.4 -0.364 . . . . 0.0 111.891 -172.593 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 148' ' ' PHE . . . . . . . . . . . . . 33.0 p90 -155.33 168.7 26.23 Favored 'General case' 0 C--N 1.325 -0.458 0 CA-C-O 120.885 0.374 . . . . 0.0 111.023 -174.003 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 149' ' ' ASN . . . . . . . . . . . . . 29.6 t30 -115.15 102.16 54.63 Favored Pre-proline 0 C--N 1.324 -0.527 0 CA-C-N 115.857 -0.611 . . . . 0.0 110.163 178.303 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 150' ' ' PRO . . . . . . . . . . . . . 40.7 Cg_endo -68.04 -17.96 46.0 Favored 'Trans proline' 0 C--N 1.343 0.254 0 C-N-CA 122.787 2.324 . . . . 0.0 112.48 -178.367 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 151' ' ' ALA . . . . . 0.448 ' HB2' HH21 ' A' ' 130' ' ' ARG . . . -71.54 -20.35 62.04 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 116.269 -0.423 . . . . 0.0 110.942 -179.453 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 152' ' ' ASP . . . . . . . . . . . . . 36.7 t70 -72.92 -15.39 61.58 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 115.821 -0.627 . . . . 0.0 110.822 -178.301 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 153' ' ' TYR . . . . . . . . . . . . . 88.4 m-85 -92.21 2.51 56.56 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.061 -0.518 . . . . 0.0 111.255 -177.922 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 154' ' ' VAL . . . . . . . . . . . . . 81.1 t -90.99 121.86 41.8 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.449 0 CA-C-O 120.752 0.31 . . . . 0.0 111.107 -177.505 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 155' ' ' ARG . . . . . . . . . . . . . 12.4 ttm180 -80.97 134.12 35.64 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 116.155 -0.475 . . . . 0.0 110.03 177.865 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 156' ' ' ILE . . . . . 0.503 HG23 ' HG2' ' A' ' 127' ' ' LYS . 46.1 mm -105.95 130.26 23.28 Favored Pre-proline 0 C--N 1.325 -0.484 0 CA-C-N 116.174 -0.466 . . . . 0.0 109.765 176.613 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 157' ' ' PRO . . . . . . . . . . . . . 18.4 Cg_endo -60.33 130.72 35.13 Favored 'Trans proline' 0 C--N 1.344 0.335 0 C-N-CA 122.343 2.029 . . . . 0.0 111.912 179.323 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 158' ' ' LYS . . . . . . . . . . . . . 93.5 mttt -102.46 -12.27 17.96 Favored 'General case' 0 C--N 1.322 -0.605 0 CA-C-N 115.851 -0.613 . . . . 0.0 111.031 -174.858 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 159' ' ' ILE . . . . . 0.427 ' N ' HD12 ' A' ' 159' ' ' ILE . 4.3 mp -110.49 103.04 14.84 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.489 0 CA-C-N 116.19 -0.459 . . . . 0.0 110.051 -178.53 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 160' ' ' ALA . . . . . . . . . . . . . . . -148.66 115.64 6.06 Favored 'General case' 0 C--N 1.324 -0.543 0 CA-C-N 116.551 -0.295 . . . . 0.0 111.031 -179.575 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 161' ' ' LEU . . . . . . . . . . . . . 93.3 mt 63.7 -157.12 0.32 Allowed 'General case' 0 C--O 1.234 0.259 0 CA-C-N 115.724 -0.671 . . . . 0.0 111.149 175.345 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 162' ' ' GLU . . . . . . . . . . . . . 10.1 pt-20 -79.31 149.32 31.8 Favored 'General case' 0 C--N 1.326 -0.446 0 CA-C-O 121.118 0.485 . . . . 0.0 111.063 -179.901 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 163' ' ' HIS . . . . . . . . . . . . . 6.1 p80 -112.09 63.67 0.62 Allowed 'General case' 0 C--N 1.32 -0.687 0 CA-C-O 121.798 0.809 . . . . 0.0 109.54 177.788 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 164' ' ' HIS . . . . . . . . . . . . . 17.6 t-160 -87.44 17.42 4.52 Favored 'General case' 0 C--N 1.326 -0.426 0 CA-C-N 114.919 -1.037 . . . . 0.0 110.658 -174.687 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 165' ' ' HIS . . . . . . . . . . . . . 94.5 m-70 -135.79 133.74 38.21 Favored 'General case' 0 C--N 1.322 -0.622 0 CA-C-N 116.114 -0.494 . . . . 0.0 109.924 177.832 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 166' ' ' HIS . . . . . . . . . . . . . 26.8 p80 -159.15 148.52 18.64 Favored 'General case' 0 C--N 1.326 -0.423 0 N-CA-C 110.16 -0.311 . . . . 0.0 110.16 176.751 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 167' ' ' HIS . . . . . . . . . . . . . 6.4 p80 -82.36 171.78 13.81 Favored 'General case' 0 C--N 1.323 -0.552 0 N-CA-C 110.13 -0.322 . . . . 0.0 110.13 177.72 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 168' ' ' HIS . . . . . . . . . . . . . 4.1 t-160 . . . . . 0 C--O 1.242 0.695 0 CA-C-O 118.573 -0.727 . . . . 0.0 109.09 174.074 . . . . . . . . 0 0 . 1 . 011 nuclear orig full ' A' A ' 61' ' ' ARG . . . . . . . . . . . . . 1.3 ptm180 . . . . . 0 N--CA 1.481 1.105 0 CA-C-O 120.918 0.389 . . . . 0.0 111.094 . . . . . . . . . 0 0 . 1 . 011 nuclear orig full ' A' A ' 62' ' ' ASP . . . . . . . . . . . . . 5.4 p-10 -177.92 149.84 0.6 Allowed 'General case' 0 C--O 1.233 0.188 0 CA-C-N 116.259 -0.428 . . . . 0.0 110.914 -177.673 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 63' ' ' SER . . . . . 0.5 ' HA ' ' HA ' ' A' ' 103' ' ' SER . 97.7 p -119.64 158.78 25.71 Favored 'General case' 0 C--N 1.326 -0.436 0 N-CA-C 109.556 -0.535 . . . . 0.0 109.556 169.54 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 64' ' ' PHE . . . . . . . . . . . . . 82.4 t80 -62.02 -28.74 69.79 Favored 'General case' 0 C--N 1.324 -0.542 0 CA-C-O 120.994 0.426 . . . . 0.0 109.987 178.021 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 65' ' ' GLY . . . . . . . . . . . . . . . -63.8 -37.57 94.87 Favored Glycine 0 N--CA 1.449 -0.497 0 CA-C-N 115.941 -0.572 . . . . 0.0 112.144 176.711 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 66' ' ' ASP . . . . . . . . . . . . . 56.1 m-20 -65.31 -43.77 90.02 Favored 'General case' 0 C--O 1.234 0.243 0 CA-C-O 120.958 0.408 . . . . 0.0 109.957 178.308 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 67' ' ' TRP . . . . . . . . . . . . . 99.4 m95 -69.6 -36.74 76.5 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 115.787 -0.642 . . . . 0.0 111.059 178.371 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 68' ' ' ALA . . . . . 0.457 ' O ' ' HG ' ' A' ' 72' ' ' LEU . . . -59.13 -43.4 92.0 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-O 120.868 0.366 . . . . 0.0 110.544 176.998 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 69' ' ' GLU . . . . . 0.46 ' O ' ' HG2' ' A' ' 73' ' ' LYS . 36.6 tt0 -62.4 -44.77 95.66 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.229 -0.442 . . . . 0.0 110.166 175.506 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 70' ' ' LYS . . . . . 0.457 ' HG2' HD21 ' A' ' 139' ' ' LEU . 64.2 tttp -59.42 -39.99 85.27 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 115.886 -0.597 . . . . 0.0 110.66 -179.963 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 71' ' ' PHE . . . . . . . . . . . . . 68.7 t80 -63.62 -44.42 93.98 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.207 -0.451 . . . . 0.0 110.142 176.619 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 72' ' ' LEU . . . . . 0.457 ' HG ' ' O ' ' A' ' 68' ' ' ALA . 82.8 mt -64.62 -36.65 84.92 Favored 'General case' 0 C--N 1.325 -0.486 0 CA-C-N 116.177 -0.465 . . . . 0.0 110.982 -179.913 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 73' ' ' LYS . . . . . 0.46 ' HG2' ' O ' ' A' ' 69' ' ' GLU . 33.3 mmtp -70.6 -40.84 72.97 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-O 120.681 0.277 . . . . 0.0 111.268 -179.912 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 74' ' ' SER . . . . . . . . . . . . . 8.1 p -71.97 -34.56 69.05 Favored 'General case' 0 C--N 1.324 -0.535 0 CA-C-O 120.829 0.347 . . . . 0.0 110.513 179.169 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 75' ' ' LYS . . . . . 0.514 ' HE3' HG13 ' A' ' 80' ' ' VAL . 46.1 tptt -74.02 -30.24 62.34 Favored 'General case' 0 N--CA 1.444 -0.752 0 CA-C-O 120.928 0.394 . . . . 0.0 110.065 177.087 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 76' ' ' GLU . . . . . . . . . . . . . 33.9 tt0 -59.48 -50.24 74.69 Favored 'General case' 0 C--N 1.327 -0.403 0 CA-C-O 121.183 0.516 . . . . 0.0 109.628 171.291 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 77' ' ' ALA . . . . . . . . . . . . . . . -72.69 -10.96 60.41 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-N 115.332 -0.849 . . . . 0.0 111.06 179.131 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 78' ' ' ASP . . . . . 0.49 ' HB3' ' O ' ' A' ' 75' ' ' LYS . 27.9 t70 -73.54 -15.83 61.29 Favored 'General case' 0 C--N 1.326 -0.439 0 CA-C-N 115.844 -0.616 . . . . 0.0 109.983 175.649 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 79' ' ' GLY . . . . . . . . . . . . . . . 91.87 60.42 1.27 Allowed Glycine 0 N--CA 1.446 -0.655 0 CA-C-N 115.762 -0.654 . . . . 0.0 112.06 177.354 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 80' ' ' VAL . . . . . 0.514 HG13 ' HE3' ' A' ' 75' ' ' LYS . 34.9 m -115.79 152.42 17.47 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.433 0 CA-C-O 120.87 0.367 . . . . 0.0 110.74 178.76 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 81' ' ' SER . . . . . . . . . . . . . 31.2 t -64.45 153.01 40.09 Favored 'General case' 0 C--N 1.322 -0.627 0 CA-C-N 115.732 -0.667 . . . . 0.0 109.829 175.668 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 82' ' ' VAL . . . . . . . . . . . . . 59.2 t -62.56 -43.53 98.51 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.336 0 CA-C-O 120.874 0.369 . . . . 0.0 110.575 -179.203 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 83' ' ' SER . . . . . . . . . . . . . 18.0 t -64.48 -30.71 71.74 Favored 'General case' 0 C--N 1.326 -0.428 0 CA-C-N 116.135 -0.484 . . . . 0.0 110.421 177.509 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 84' ' ' GLN . . . . . . . . . . . . . 47.9 tp60 -71.86 -38.79 70.01 Favored 'General case' 0 C--N 1.332 -0.187 0 CA-C-N 116.076 -0.511 . . . . 0.0 109.738 176.961 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 85' ' ' LEU . . . . . . . . . . . . . 40.1 tp -66.56 -38.76 87.77 Favored 'General case' 0 C--N 1.327 -0.389 0 CA-C-N 115.878 -0.601 . . . . 0.0 110.217 176.226 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 86' ' ' ASN . . . . . . . . . . . . . 86.0 m-20 -64.47 -26.87 68.63 Favored 'General case' 0 C--O 1.233 0.201 0 CA-C-N 116.129 -0.487 . . . . 0.0 110.716 176.382 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 87' ' ' SER . . . . . . . . . . . . . 13.0 t -65.71 -48.54 71.65 Favored 'General case' 0 C--N 1.324 -0.501 0 N-CA-C 109.711 -0.477 . . . . 0.0 109.711 175.771 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 88' ' ' TYR . . . . . . . . . . . . . 77.7 m-85 -62.45 -35.5 79.49 Favored 'General case' 0 N--CA 1.464 0.25 0 CA-C-O 121.084 0.468 . . . . 0.0 110.38 175.638 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 89' ' ' LYS . . . . . . . . . . . . . 39.1 ttmt -61.2 -37.17 82.01 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-N 115.709 -0.678 . . . . 0.0 110.154 178.809 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 90' ' ' ASN . . . . . 0.471 ' O ' ' HB3' ' A' ' 94' ' ' ASN . 26.6 t-20 -65.49 -39.2 91.63 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 115.79 -0.641 . . . . 0.0 110.414 177.66 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 91' ' ' TYR . . . . . . . . . . . . . 56.5 m-85 -63.91 -59.75 4.13 Favored 'General case' 0 C--N 1.327 -0.409 0 CA-C-N 116.363 -0.38 . . . . 0.0 110.879 176.96 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 92' ' ' CYS . . . . . 0.487 ' HA ' HD11 ' A' ' 96' ' ' LEU . 58.3 m -63.55 -46.71 84.71 Favored 'General case' 0 C--N 1.326 -0.456 0 N-CA-C 112.594 0.59 . . . . 0.0 112.594 -173.485 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 93' ' ' ARG . . . . . . . . . . . . . 40.8 ttm180 -86.13 -39.98 16.15 Favored 'General case' 0 C--N 1.327 -0.405 0 N-CA-C 112.355 0.502 . . . . 0.0 112.355 -172.71 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 94' ' ' ASN . . . . . 0.471 ' HB3' ' O ' ' A' ' 90' ' ' ASN . 49.8 t30 -92.78 -52.81 4.44 Favored 'General case' 0 C--N 1.328 -0.368 0 C-N-CA 120.726 -0.39 . . . . 0.0 111.842 -173.876 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 95' ' ' HIS . . . . . . . . . . . . . 8.8 m80 -77.71 -36.17 51.27 Favored 'General case' 0 C--N 1.326 -0.427 0 C-N-CA 120.789 -0.364 . . . . 0.0 111.57 -176.204 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 96' ' ' LEU . . . . . 0.487 HD11 ' HA ' ' A' ' 92' ' ' CYS . 84.3 mt -98.16 27.05 4.83 Favored 'General case' 0 C--N 1.321 -0.65 0 CA-C-N 116.441 -0.345 . . . . 0.0 110.37 178.678 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 97' ' ' SER . . . . . 0.502 ' N ' ' HD2' ' A' ' 98' ' ' PRO . 1.8 p -53.01 -46.72 97.47 Favored Pre-proline 0 CA--C 1.543 0.686 0 N-CA-C 113.444 0.905 . . . . 0.0 113.444 -175.884 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 98' ' ' PRO . . . . . 0.502 ' HD2' ' N ' ' A' ' 97' ' ' SER . 18.3 Cg_endo -60.43 -34.24 93.32 Favored 'Trans proline' 0 C--N 1.359 1.091 0 C-N-CA 121.771 1.647 . . . . 0.0 112.106 178.301 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 99' ' ' LEU . . . . . 0.46 HD22 HG23 ' A' ' 107' ' ' ILE . 41.1 mt -83.81 -28.78 27.85 Favored 'General case' 0 C--N 1.325 -0.475 0 CA-C-O 121.071 0.462 . . . . 0.0 110.366 -177.668 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 100' ' ' TYR . . . . . . . . . . . . . 44.1 t80 -59.38 -25.79 64.55 Favored 'General case' 0 C--N 1.325 -0.497 0 CA-C-N 115.218 -0.901 . . . . 0.0 111.603 -176.802 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 101' ' ' MET . . . . . . . . . . . . . 22.5 ptp -104.17 5.18 34.76 Favored 'General case' 0 C--N 1.327 -0.385 0 CA-C-N 116.347 -0.388 . . . . 0.0 111.24 -178.867 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 102' ' ' LYS . . . . . 0.526 ' HB3' ' HB3' ' A' ' 106' ' ' GLU . 64.0 mttm -105.43 166.96 10.06 Favored 'General case' 0 C--N 1.324 -0.501 0 CA-C-N 116.55 -0.295 . . . . 0.0 110.521 -179.561 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 103' ' ' SER . . . . . 0.5 ' HA ' ' HA ' ' A' ' 63' ' ' SER . 50.9 p -94.97 170.8 9.17 Favored 'General case' 0 C--N 1.32 -0.688 0 N-CA-C 109.613 -0.514 . . . . 0.0 109.613 173.806 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 104' ' ' LEU . . . . . . . . . . . . . 96.5 mt -58.69 -31.04 67.86 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-O 120.747 0.308 . . . . 0.0 111.028 179.222 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 105' ' ' SER . . . . . . . . . . . . . 14.0 m -86.91 -20.99 26.57 Favored 'General case' 0 C--N 1.327 -0.391 0 CA-C-N 116.344 -0.389 . . . . 0.0 111.112 -179.109 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 106' ' ' GLU . . . . . 0.526 ' HB3' ' HB3' ' A' ' 102' ' ' LYS . 0.6 OUTLIER -83.04 -25.23 32.31 Favored 'General case' 0 C--N 1.326 -0.433 0 CA-C-O 121.219 0.533 . . . . 0.0 110.443 -176.901 . . . . . . . . 3 3 . 1 . 011 nuclear orig full ' A' A ' 107' ' ' ILE . . . . . 0.46 HG23 HD22 ' A' ' 99' ' ' LEU . 78.9 mt -70.84 127.11 32.36 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.571 0 CA-C-N 115.929 -0.578 . . . . 0.0 111.329 -179.004 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 108' ' ' LEU . . . . . 0.4 ' HA ' ' HD3' ' A' ' 109' ' ' PRO . 93.5 mt -100.44 137.89 20.05 Favored Pre-proline 0 C--N 1.326 -0.452 0 CA-C-N 115.691 -0.686 . . . . 0.0 110.457 176.669 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 109' ' ' PRO . . . . . 0.4 ' HD3' ' HA ' ' A' ' 108' ' ' LEU . 44.2 Cg_exo -56.62 -44.04 49.32 Favored 'Trans proline' 0 CA--C 1.53 0.315 0 C-N-CA 122.709 2.273 . . . . 0.0 112.528 178.97 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 110' ' ' ALA . . . . . . . . . . . . . . . -65.78 -27.99 68.69 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-O 120.818 0.342 . . . . 0.0 111.469 -178.502 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 111' ' ' ASP . . . . . 0.535 ' O ' HG13 ' A' ' 115' ' ' ILE . 10.3 t70 -68.68 -39.82 80.37 Favored 'General case' 0 C--N 1.325 -0.486 0 CA-C-O 121.383 0.611 . . . . 0.0 109.703 179.996 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 112' ' ' ILE . . . . . 0.498 ' HB ' HG23 ' A' ' 154' ' ' VAL . 40.5 mt -67.62 -38.25 80.14 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.39 0 CA-C-N 115.583 -0.735 . . . . 0.0 109.829 175.178 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 113' ' ' GLN . . . . . 0.43 ' HA ' HG12 ' A' ' 154' ' ' VAL . 25.2 tp60 -62.88 -41.23 99.33 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-N 115.466 -0.788 . . . . 0.0 110.794 -179.012 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 114' ' ' SER . . . . . . . . . . . . . 41.3 p -70.1 -30.66 67.93 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.761 -0.2 . . . . 0.0 111.024 -179.516 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 115' ' ' ILE . . . . . 0.535 HG13 ' O ' ' A' ' 111' ' ' ASP . 83.6 mt -56.55 -55.32 20.03 Favored 'Isoleucine or valine' 0 N--CA 1.463 0.193 0 CA-C-O 120.951 0.405 . . . . 0.0 110.045 174.442 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 116' ' ' ILE . . . . . 0.41 HG23 ' HB3' ' A' ' 126' ' ' LEU . 45.2 mm -64.71 -30.04 49.12 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.378 0 CA-C-N 115.815 -0.63 . . . . 0.0 110.432 179.569 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 117' ' ' ASN . . . . . . . . . . . . . 8.1 t30 -66.37 -43.25 86.49 Favored 'General case' 0 C--N 1.324 -0.505 0 CA-C-N 115.564 -0.744 . . . . 0.0 111.524 -178.587 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 118' ' ' GLU . . . . . . . . . . . . . 39.3 mt-10 -91.61 -30.46 16.35 Favored 'General case' 0 C--N 1.327 -0.39 0 N-CA-C 112.41 0.522 . . . . 0.0 112.41 -175.897 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 119' ' ' THR . . . . . . . . . . . . . 63.4 m -64.99 111.9 3.07 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-O 120.96 0.409 . . . . 0.0 110.356 -178.68 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 120' ' ' LYS . . . . . . . . . . . . . 91.2 mttt -92.93 79.58 4.63 Favored 'General case' 0 C--N 1.326 -0.42 0 CA-C-O 121.309 0.576 . . . . 0.0 110.734 -176.896 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 121' ' ' LEU . . . . . . . . . . . . . 76.5 mt -126.97 -175.66 3.48 Favored 'General case' 0 C--N 1.321 -0.658 0 CA-C-N 115.5 -0.773 . . . . 0.0 109.612 177.559 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 122' ' ' ALA . . . . . . . . . . . . . . . -65.53 152.28 44.42 Favored 'General case' 0 C--N 1.325 -0.495 0 CA-C-N 116.497 -0.319 . . . . 0.0 110.328 178.812 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 123' ' ' LYS . . . . . . . . . . . . . 0.4 OUTLIER -63.56 -35.66 81.22 Favored 'General case' 0 C--N 1.325 -0.491 0 CA-C-N 116.273 -0.421 . . . . 0.0 110.238 -176.043 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 124' ' ' ASN . . . . . 0.764 ' HA ' ' HE3' ' A' ' 127' ' ' LYS . 11.6 t30 -69.61 -35.69 75.5 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 116.176 -0.465 . . . . 0.0 110.246 177.979 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 125' ' ' THR . . . . . 0.539 ' O ' HG13 ' A' ' 129' ' ' ILE . 8.6 m -65.43 -44.25 87.92 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.226 -0.443 . . . . 0.0 110.274 177.015 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 126' ' ' LEU . . . . . 0.41 ' HB3' HG23 ' A' ' 116' ' ' ILE . 98.6 mt -61.55 -43.27 99.16 Favored 'General case' 0 C--N 1.33 -0.246 0 CA-C-N 115.911 -0.586 . . . . 0.0 110.57 178.665 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 127' ' ' LYS . . . . . 0.764 ' HE3' ' HA ' ' A' ' 124' ' ' ASN . 44.9 mtmt -60.87 -40.06 91.53 Favored 'General case' 0 C--N 1.331 -0.219 0 CA-C-N 116.118 -0.492 . . . . 0.0 110.519 175.824 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 128' ' ' ALA . . . . . . . . . . . . . . . -64.47 -34.38 78.06 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 116.086 -0.506 . . . . 0.0 110.995 179.48 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 129' ' ' ILE . . . . . 0.539 HG13 ' O ' ' A' ' 125' ' ' THR . 71.3 mt -63.26 -53.42 46.04 Favored 'Isoleucine or valine' 0 C--O 1.234 0.244 0 CA-C-N 116.565 -0.289 . . . . 0.0 110.347 177.196 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 130' ' ' ARG . . . . . . . . . . . . . 40.4 ttp180 -62.85 -40.69 98.23 Favored 'General case' 0 CA--C 1.521 -0.154 0 CA-C-O 120.793 0.33 . . . . 0.0 110.126 178.455 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 131' ' ' ASN . . . . . 0.629 ' O ' ' HG2' ' A' ' 135' ' ' GLN . 7.5 t30 -54.98 -55.91 25.55 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-N 115.777 -0.647 . . . . 0.0 110.832 178.538 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 132' ' ' THR . . . . . 0.464 ' O ' HG13 ' A' ' 136' ' ' ILE . 32.0 m -57.04 -45.6 83.04 Favored 'General case' 0 C--N 1.326 -0.433 0 CA-C-N 116.295 -0.412 . . . . 0.0 110.79 -178.705 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 133' ' ' ALA . . . . . . . . . . . . . . . -63.34 -48.67 77.03 Favored 'General case' 0 C--N 1.332 -0.193 0 CA-C-N 116.325 -0.398 . . . . 0.0 111.56 179.796 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 134' ' ' SER . . . . . 0.574 ' O ' ' HG3' ' A' ' 138' ' ' ARG . 26.9 p -66.53 -32.0 73.08 Favored 'General case' 0 C--N 1.327 -0.39 0 CA-C-N 116.633 -0.258 . . . . 0.0 111.27 -177.108 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 135' ' ' GLN . . . . . 0.629 ' HG2' ' O ' ' A' ' 131' ' ' ASN . 11.0 mm100 -65.53 -38.24 89.08 Favored 'General case' 0 C--N 1.331 -0.205 0 C-N-CA 120.967 -0.293 . . . . 0.0 110.36 176.777 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 136' ' ' ILE . . . . . 0.464 HG13 ' O ' ' A' ' 132' ' ' THR . 76.3 mt -64.0 -39.9 87.11 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.262 0 CA-C-N 116.285 -0.416 . . . . 0.0 109.986 176.699 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 137' ' ' PHE . . . . . 0.514 ' O ' HG13 ' A' ' 141' ' ' ILE . 44.2 m-85 -62.86 -42.89 99.92 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.183 -0.462 . . . . 0.0 110.638 175.435 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 138' ' ' ARG . . . . . 0.574 ' HG3' ' O ' ' A' ' 134' ' ' SER . 42.4 mtt180 -60.84 -38.56 85.91 Favored 'General case' 0 N--CA 1.465 0.283 0 CA-C-O 120.804 0.335 . . . . 0.0 110.537 178.559 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 139' ' ' LEU . . . . . 0.457 HD21 ' HG2' ' A' ' 70' ' ' LYS . 65.5 tp -56.45 -38.65 71.92 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 115.821 -0.627 . . . . 0.0 110.519 177.071 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 140' ' ' ALA . . . . . . . . . . . . . . . -74.87 -33.27 62.07 Favored 'General case' 0 C--N 1.325 -0.47 0 CA-C-N 115.872 -0.604 . . . . 0.0 110.706 177.43 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 141' ' ' ILE . . . . . 0.641 ' HA ' ' O ' ' A' ' 146' ' ' ILE . 73.6 mt -64.35 -43.59 97.12 Favored 'Isoleucine or valine' 0 C--O 1.233 0.228 0 CA-C-N 116.08 -0.509 . . . . 0.0 111.01 177.983 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 142' ' ' GLU . . . . . 0.477 ' HG3' ' O ' ' A' ' 138' ' ' ARG . 48.4 mt-10 -60.69 -39.33 88.08 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.113 -0.494 . . . . 0.0 110.657 178.976 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 143' ' ' ASN . . . . . . . . . . . . . 43.7 m-80 -83.97 3.09 35.77 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 115.782 -0.645 . . . . 0.0 110.622 179.555 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 144' ' ' ARG . . . . . . . . . . . . . 99.5 mtt180 60.87 28.66 18.42 Favored 'General case' 0 C--O 1.234 0.267 0 CA-C-N 115.423 -0.808 . . . . 0.0 111.762 174.014 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 145' ' ' ALA . . . . . . . . . . . . . . . -78.25 -37.77 44.43 Favored 'General case' 0 C--N 1.326 -0.428 0 CA-C-N 115.672 -0.694 . . . . 0.0 109.224 174.276 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 146' ' ' ILE . . . . . 0.641 ' O ' ' HA ' ' A' ' 141' ' ' ILE . 13.8 tt -144.73 140.26 23.47 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.626 0 CA-C-N 115.011 -0.995 . . . . 0.0 108.847 175.961 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 147' ' ' ASP . . . . . . . . . . . . . 31.6 t70 -117.1 46.12 1.74 Allowed 'General case' 0 C--N 1.318 -0.791 0 N-CA-C 108.75 -0.833 . . . . 0.0 108.75 178.53 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 148' ' ' PHE . . . . . . . . . . . . . 70.5 t80 -151.42 123.9 8.39 Favored 'General case' 0 C--N 1.322 -0.603 0 CA-C-N 114.851 -1.068 . . . . 0.0 109.321 -177.105 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 149' ' ' ASN . . . . . . . . . . . . . 49.0 t-20 -110.74 98.12 36.26 Favored Pre-proline 0 C--N 1.321 -0.634 0 N-CA-C 110.119 -0.326 . . . . 0.0 110.119 -179.354 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 150' ' ' PRO . . . . . . . . . . . . . 26.6 Cg_exo -62.37 -33.2 80.64 Favored 'Trans proline' 0 C--O 1.232 0.181 0 C-N-CA 122.689 2.259 . . . . 0.0 111.98 -179.335 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 151' ' ' ALA . . . . . . . . . . . . . . . -73.46 -18.11 61.16 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 115.988 -0.551 . . . . 0.0 111.386 -176.51 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 152' ' ' ASP . . . . . . . . . . . . . 34.6 t70 -72.49 -24.3 61.15 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-O 121.288 0.566 . . . . 0.0 110.234 179.216 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 153' ' ' TYR . . . . . . . . . . . . . 62.5 m-85 -89.91 -4.41 57.54 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-N 115.954 -0.567 . . . . 0.0 110.138 179.916 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 154' ' ' VAL . . . . . 0.498 HG23 ' HB ' ' A' ' 112' ' ' ILE . 60.3 t -89.67 139.11 18.01 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.544 0 CA-C-N 115.531 -0.759 . . . . 0.0 109.495 176.437 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 155' ' ' ARG . . . . . . . . . . . . . 15.9 ptt180 -124.58 155.55 38.9 Favored 'General case' 0 C--N 1.321 -0.648 0 C-N-CA 120.554 -0.458 . . . . 0.0 110.963 179.855 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 156' ' ' ILE . . . . . 0.426 ' HA ' ' HD3' ' A' ' 157' ' ' PRO . 2.4 mp -96.43 116.29 66.07 Favored Pre-proline 0 C--N 1.324 -0.51 0 CA-C-N 115.843 -0.617 . . . . 0.0 109.986 179.734 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 157' ' ' PRO . . . . . 0.426 ' HD3' ' HA ' ' A' ' 156' ' ' ILE . 14.2 Cg_exo -69.32 131.27 21.48 Favored 'Trans proline' 0 N--CA 1.456 -0.685 0 C-N-CA 122.591 2.194 . . . . 0.0 111.181 177.191 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 158' ' ' LYS . . . . . . . . . . . . . 64.5 mttp -80.36 -6.19 57.6 Favored 'General case' 0 C--N 1.325 -0.474 0 CA-C-N 116.513 -0.312 . . . . 0.0 110.334 179.681 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 159' ' ' ILE . . . . . . . . . . . . . 47.3 mm 72.46 -56.46 0.28 Allowed 'Isoleucine or valine' 0 N--CA 1.465 0.302 0 CA-C-N 115.556 -0.747 . . . . 0.0 111.295 -179.79 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 160' ' ' ALA . . . . . . . . . . . . . . . -76.73 84.41 3.35 Favored 'General case' 0 C--N 1.323 -0.582 0 CA-C-O 121.502 0.667 . . . . 0.0 110.761 179.083 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 161' ' ' LEU . . . . . . . . . . . . . 92.7 mt -105.99 -7.74 17.94 Favored 'General case' 0 C--N 1.312 -1.056 0 CA-C-N 114.825 -1.08 . . . . 0.0 109.349 175.854 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 162' ' ' GLU . . . . . . . . . . . . . 41.1 mt-10 66.41 173.38 0.24 Allowed 'General case' 0 C--O 1.236 0.379 0 CA-C-N 114.55 -1.205 . . . . 0.0 111.998 178.188 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 163' ' ' HIS . . . . . . . . . . . . . 32.2 m170 -108.19 128.17 54.48 Favored 'General case' 0 C--N 1.321 -0.634 0 CA-C-N 115.793 -0.64 . . . . 0.0 110.018 178.788 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 164' ' ' HIS . . . . . . . . . . . . . 30.1 m80 -94.7 118.28 31.48 Favored 'General case' 0 C--N 1.322 -0.615 0 CA-C-N 115.954 -0.566 . . . . 0.0 109.959 -176.712 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 165' ' ' HIS . . . . . . . . . . . . . 48.1 m80 -113.66 -54.79 2.58 Favored 'General case' 0 C--N 1.323 -0.58 0 CA-C-O 121.04 0.448 . . . . 0.0 110.257 -176.948 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 166' ' ' HIS . . . . . . . . . . . . . 32.6 m80 -100.92 -157.81 0.63 Allowed 'General case' 0 C--N 1.324 -0.518 0 CA-C-N 115.632 -0.713 . . . . 0.0 109.369 179.143 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 167' ' ' HIS . . . . . . . . . . . . . 33.3 m80 -74.55 78.6 1.96 Allowed 'General case' 0 C--N 1.327 -0.392 0 N-CA-C 109.23 -0.655 . . . . 0.0 109.23 175.31 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 168' ' ' HIS . . . . . . . . . . . . . 58.9 t-80 . . . . . 0 C--O 1.251 1.17 0 CA-C-O 118.29 -0.862 . . . . 0.0 109.202 -177.961 . . . . . . . . 0 0 . 1 . 012 nuclear orig full ' A' A ' 61' ' ' ARG . . . . . . . . . . . . . 59.5 mtp180 . . . . . 0 N--CA 1.48 1.025 0 CA-C-O 121.217 0.532 . . . . 0.0 110.801 . . . . . . . . . 0 0 . 1 . 012 nuclear orig full ' A' A ' 62' ' ' ASP . . . . . . . . . . . . . 5.2 p-10 -136.59 111.51 8.87 Favored 'General case' 0 C--N 1.321 -0.663 0 N-CA-C 108.593 -0.892 . . . . 0.0 108.593 171.041 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 63' ' ' SER . . . . . 0.568 ' HB2' ' HB2' ' A' ' 66' ' ' ASP . 5.5 m -119.45 149.49 41.78 Favored 'General case' 0 C--N 1.318 -0.803 0 N-CA-C 109.784 -0.451 . . . . 0.0 109.784 -179.448 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 64' ' ' PHE . . . . . 0.464 ' HB2' HD12 ' A' ' 107' ' ' ILE . 80.0 t80 -64.23 -50.37 68.28 Favored 'General case' 0 C--N 1.328 -0.365 0 N-CA-C 109.989 -0.374 . . . . 0.0 109.989 178.588 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 65' ' ' GLY . . . . . . . . . . . . . . . -62.87 -27.67 70.58 Favored Glycine 0 C--N 1.33 0.247 0 C-N-CA 120.816 -0.707 . . . . 0.0 112.193 177.378 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 66' ' ' ASP . . . . . 0.568 ' HB2' ' HB2' ' A' ' 63' ' ' SER . 8.1 t70 -62.68 -53.28 56.88 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-O 121.107 0.479 . . . . 0.0 110.34 177.692 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 67' ' ' TRP . . . . . . . . . . . . . 90.8 m95 -75.22 -27.26 59.47 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 115.788 -0.642 . . . . 0.0 111.256 -179.922 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 68' ' ' ALA . . . . . 0.545 ' O ' ' HG ' ' A' ' 72' ' ' LEU . . . -60.34 -48.54 81.33 Favored 'General case' 0 C--N 1.326 -0.419 0 N-CA-C 110.025 -0.361 . . . . 0.0 110.025 174.995 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 69' ' ' GLU . . . . . . . . . . . . . 17.8 tp10 -56.68 -44.06 81.07 Favored 'General case' 0 C--O 1.233 0.236 0 CA-C-N 115.885 -0.598 . . . . 0.0 110.527 175.358 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 70' ' ' LYS . . . . . . . . . . . . . 59.2 mttp -61.27 -45.1 95.91 Favored 'General case' 0 C--N 1.326 -0.416 0 CA-C-N 116.07 -0.514 . . . . 0.0 110.832 177.597 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 71' ' ' PHE . . . . . . . . . . . . . 69.8 t80 -66.04 -42.79 89.12 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.352 -0.385 . . . . 0.0 111.058 -178.974 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 72' ' ' LEU . . . . . 0.545 ' HG ' ' O ' ' A' ' 68' ' ' ALA . 88.6 mt -63.74 -49.94 71.05 Favored 'General case' 0 C--N 1.326 -0.417 0 CA-C-O 120.857 0.361 . . . . 0.0 110.667 179.805 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 73' ' ' LYS . . . . . 0.517 ' HZ1' ' HB3' ' A' ' 73' ' ' LYS . 5.7 ttpm? -69.32 -32.32 71.36 Favored 'General case' 0 C--N 1.323 -0.548 0 CA-C-N 116.173 -0.467 . . . . 0.0 111.406 -175.653 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 74' ' ' SER . . . . . . . . . . . . . 37.9 p -71.04 -32.25 68.94 Favored 'General case' 0 C--N 1.328 -0.327 0 C-N-CA 120.628 -0.429 . . . . 0.0 110.216 175.955 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 75' ' ' LYS . . . . . 0.407 ' O ' HG23 ' A' ' 80' ' ' VAL . 39.5 mmtt -70.59 -35.92 73.27 Favored 'General case' 0 C--O 1.233 0.203 0 CA-C-O 120.801 0.334 . . . . 0.0 110.687 174.082 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 76' ' ' GLU . . . . . . . . . . . . . 33.9 tt0 -56.22 -44.8 79.9 Favored 'General case' 0 C--N 1.327 -0.403 0 CA-C-N 116.011 -0.54 . . . . 0.0 110.175 176.083 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 77' ' ' ALA . . . . . . . . . . . . . . . -80.96 -24.1 38.32 Favored 'General case' 0 C--N 1.326 -0.423 0 CA-C-N 115.818 -0.628 . . . . 0.0 111.276 177.417 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 78' ' ' ASP . . . . . . . . . . . . . 15.6 t70 -57.35 -54.6 45.03 Favored 'General case' 0 N--CA 1.466 0.343 0 CA-C-N 116.108 -0.496 . . . . 0.0 110.735 179.192 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 79' ' ' GLY . . . . . . . . . . . . . . . 146.52 56.37 0.02 OUTLIER Glycine 0 N--CA 1.443 -0.884 0 C-N-CA 120.335 -0.936 . . . . 0.0 112.656 178.2 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 80' ' ' VAL . . . . . 0.594 ' HB ' ' HB2' ' A' ' 84' ' ' GLN . 32.9 m -121.2 148.88 24.27 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.642 0 CA-C-O 120.763 0.316 . . . . 0.0 110.223 176.67 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 81' ' ' SER . . . . . . . . . . . . . 13.1 p -81.94 172.78 12.88 Favored 'General case' 0 C--N 1.319 -0.733 0 CA-C-N 116.146 -0.479 . . . . 0.0 110.076 176.789 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 82' ' ' VAL . . . . . . . . . . . . . 7.9 p -58.7 -40.08 78.38 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.47 0 CA-C-N 116.49 -0.323 . . . . 0.0 111.463 -176.178 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 83' ' ' SER . . . . . . . . . . . . . 13.7 t -62.86 -33.43 75.25 Favored 'General case' 0 C--N 1.331 -0.206 0 CA-C-O 120.623 0.249 . . . . 0.0 110.734 -178.631 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 84' ' ' GLN . . . . . 0.594 ' HB2' ' HB ' ' A' ' 80' ' ' VAL . 17.1 mm100 -68.35 -57.49 5.83 Favored 'General case' 0 C--N 1.332 -0.191 0 N-CA-C 109.896 -0.409 . . . . 0.0 109.896 177.464 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 85' ' ' LEU . . . . . 0.48 HD23 ' O ' ' A' ' 72' ' ' LEU . 0.2 OUTLIER -58.93 -39.87 82.86 Favored 'General case' 0 C--N 1.325 -0.462 0 CA-C-N 116.051 -0.522 . . . . 0.0 110.507 -176.618 . . . . . . . . 3 3 . 1 . 012 nuclear orig full ' A' A ' 86' ' ' ASN . . . . . . . . . . . . . 62.7 t30 -63.83 -35.67 81.38 Favored 'General case' 0 C--N 1.326 -0.453 0 CA-C-N 115.865 -0.607 . . . . 0.0 110.832 -179.486 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 87' ' ' SER . . . . . . . . . . . . . 75.9 p -78.55 -36.85 44.08 Favored 'General case' 0 CA--C 1.531 0.239 0 C-N-CA 121.033 -0.267 . . . . 0.0 111.143 178.448 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 88' ' ' TYR . . . . . . . . . . . . . 29.8 m-85 -56.6 -47.69 79.05 Favored 'General case' 0 N--CA 1.463 0.182 0 CA-C-O 121.381 0.61 . . . . 0.0 109.728 173.791 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 89' ' ' LYS . . . . . . . . . . . . . 21.9 ttmm -64.64 -41.81 95.9 Favored 'General case' 0 C--N 1.327 -0.392 0 CA-C-N 115.173 -0.921 . . . . 0.0 110.554 178.859 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 90' ' ' ASN . . . . . . . . . . . . . 20.3 t30 -53.41 -50.02 66.04 Favored 'General case' 0 C--O 1.237 0.427 0 CA-C-O 120.945 0.402 . . . . 0.0 111.094 177.831 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 91' ' ' TYR . . . . . 0.415 ' O ' ' HB2' ' A' ' 95' ' ' HIS . 34.0 m-85 -60.39 -48.97 79.46 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.335 -0.393 . . . . 0.0 111.112 179.599 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 92' ' ' CYS . . . . . 0.537 ' HA ' ' HB2' ' A' ' 96' ' ' LEU . 51.2 t -71.14 -24.99 62.37 Favored 'General case' 0 C--N 1.324 -0.532 0 CA-C-O 120.878 0.37 . . . . 0.0 111.609 -176.299 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 93' ' ' ARG . . . . . 0.404 ' O ' ' HB3' ' A' ' 97' ' ' SER . 37.5 ttt180 -77.31 -52.24 9.52 Favored 'General case' 0 C--N 1.324 -0.512 0 CA-C-N 116.371 -0.377 . . . . 0.0 111.844 -174.951 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 94' ' ' ASN . . . . . . . . . . . . . 3.5 t-20 -103.65 -36.45 7.9 Favored 'General case' 0 C--N 1.33 -0.269 0 C-N-CA 120.937 -0.305 . . . . 0.0 111.812 -175.211 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 95' ' ' HIS . . . . . 0.415 ' HB2' ' O ' ' A' ' 91' ' ' TYR . 42.6 m80 -85.71 -21.14 28.44 Favored 'General case' 0 C--N 1.322 -0.605 0 C-N-CA 120.688 -0.405 . . . . 0.0 111.344 -175.544 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 96' ' ' LEU . . . . . 0.537 ' HB2' ' HA ' ' A' ' 92' ' ' CYS . 89.7 mt -117.66 24.52 11.02 Favored 'General case' 0 C--N 1.324 -0.511 0 CA-C-O 121.124 0.487 . . . . 0.0 110.173 177.123 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 97' ' ' SER . . . . . 0.581 ' OG ' ' HD3' ' A' ' 98' ' ' PRO . 8.1 p -61.16 -43.12 89.37 Favored Pre-proline 0 CA--C 1.541 0.63 0 N-CA-C 113.272 0.841 . . . . 0.0 113.272 -177.548 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 98' ' ' PRO . . . . . 0.581 ' HD3' ' OG ' ' A' ' 97' ' ' SER . 17.5 Cg_exo -66.9 -15.06 46.02 Favored 'Trans proline' 0 C--N 1.361 1.208 0 C-N-CA 121.711 1.607 . . . . 0.0 112.028 -179.924 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 99' ' ' LEU . . . . . . . . . . . . . 49.9 mt -98.33 -33.69 10.97 Favored 'General case' 0 C--N 1.324 -0.501 0 CA-C-N 115.942 -0.572 . . . . 0.0 110.575 -178.835 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 100' ' ' TYR . . . . . . . . . . . . . 45.0 t80 -53.94 -43.44 69.81 Favored 'General case' 0 N--CA 1.465 0.279 0 CA-C-N 115.931 -0.577 . . . . 0.0 111.956 -175.434 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 101' ' ' MET . . . . . . . . . . . . . 0.7 OUTLIER -80.18 -16.13 55.51 Favored 'General case' 0 C--N 1.328 -0.335 0 N-CA-C 112.175 0.435 . . . . 0.0 112.175 -176.601 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 102' ' ' LYS . . . . . . . . . . . . . 95.4 mttt -88.95 153.64 20.87 Favored 'General case' 0 C--N 1.325 -0.5 0 CA-C-O 121.204 0.526 . . . . 0.0 110.975 -176.731 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 103' ' ' SER . . . . . 0.596 ' HB2' ' CG ' ' A' ' 106' ' ' GLU . 3.1 m -69.69 148.09 49.71 Favored 'General case' 0 C--N 1.324 -0.521 0 CA-C-N 115.651 -0.704 . . . . 0.0 109.174 175.003 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 104' ' ' LEU . . . . . . . . . . . . . 25.1 tp -59.87 -55.37 34.99 Favored 'General case' 0 C--N 1.323 -0.548 0 CA-C-O 120.803 0.335 . . . . 0.0 111.582 -171.466 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 105' ' ' SER . . . . . . . . . . . . . 34.4 t -73.09 -11.87 60.7 Favored 'General case' 0 C--N 1.325 -0.465 0 CA-C-N 116.212 -0.449 . . . . 0.0 111.45 -176.741 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 106' ' ' GLU . . . . . 0.596 ' CG ' ' HB2' ' A' ' 103' ' ' SER . 6.6 mm-40 -88.29 -15.55 35.48 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-O 120.686 0.279 . . . . 0.0 110.657 -178.465 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 107' ' ' ILE . . . . . 0.52 HG13 ' O ' ' A' ' 103' ' ' SER . 81.5 mt -69.78 129.27 34.05 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.376 0 CA-C-N 116.246 -0.433 . . . . 0.0 110.691 -179.49 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 108' ' ' LEU . . . . . . . . . . . . . 65.6 mt -88.3 146.01 37.04 Favored Pre-proline 0 C--N 1.322 -0.618 0 CA-C-N 115.916 -0.583 . . . . 0.0 109.871 178.267 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 109' ' ' PRO . . . . . . . . . . . . . 52.6 Cg_exo -55.38 -31.05 75.79 Favored 'Trans proline' 0 N--CA 1.463 -0.318 0 C-N-CA 122.184 1.923 . . . . 0.0 111.123 173.387 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 110' ' ' ALA . . . . . . . . . . . . . . . -60.98 -37.93 84.21 Favored 'General case' 0 N--CA 1.453 -0.287 0 CA-C-N 115.342 -0.844 . . . . 0.0 111.434 178.319 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 111' ' ' ASP . . . . . 0.431 ' O ' HG13 ' A' ' 115' ' ' ILE . 5.9 m-20 -58.46 -56.58 20.24 Favored 'General case' 0 N--CA 1.466 0.329 0 CA-C-O 120.9 0.381 . . . . 0.0 110.999 -179.247 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 112' ' ' ILE . . . . . . . . . . . . . 18.6 mt -65.43 -43.35 94.66 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.514 0 CA-C-N 115.578 -0.737 . . . . 0.0 110.684 -176.332 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 113' ' ' GLN . . . . . 0.467 ' HA ' HG11 ' A' ' 154' ' ' VAL . 24.7 tp60 -61.96 -40.95 97.32 Favored 'General case' 0 C--N 1.332 -0.195 0 CA-C-N 116.227 -0.442 . . . . 0.0 110.524 -179.927 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 114' ' ' SER . . . . . 0.424 ' O ' ' HG2' ' A' ' 118' ' ' GLU . 48.3 t -59.42 -46.22 89.33 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.088 -0.505 . . . . 0.0 110.492 178.194 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 115' ' ' ILE . . . . . 0.431 HG13 ' O ' ' A' ' 111' ' ' ASP . 79.2 mt -58.87 -57.63 10.37 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.224 0 CA-C-N 116.162 -0.472 . . . . 0.0 110.683 179.812 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 116' ' ' ILE . . . . . . . . . . . . . 47.3 mm -57.86 -38.48 66.22 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.371 0 CA-C-N 116.196 -0.456 . . . . 0.0 111.55 -177.51 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 117' ' ' ASN . . . . . . . . . . . . . 7.8 t30 -65.93 -38.32 88.35 Favored 'General case' 0 C--N 1.327 -0.384 0 CA-C-N 116.457 -0.338 . . . . 0.0 111.707 -175.452 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 118' ' ' GLU . . . . . 0.424 ' HG2' ' O ' ' A' ' 114' ' ' SER . 11.0 pt-20 -96.43 -12.41 24.28 Favored 'General case' 0 C--N 1.33 -0.279 0 N-CA-C 112.239 0.459 . . . . 0.0 112.239 -176.255 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 119' ' ' THR . . . . . . . . . . . . . 90.3 m -68.95 113.7 6.59 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-O 121.259 0.552 . . . . 0.0 110.103 177.98 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 120' ' ' LYS . . . . . . . . . . . . . 47.9 mttp -93.8 81.28 4.22 Favored 'General case' 0 C--N 1.322 -0.618 0 CA-C-N 115.726 -0.67 . . . . 0.0 110.429 -174.924 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 121' ' ' LEU . . . . . . . . . . . . . 85.2 mt -133.86 -175.48 3.85 Favored 'General case' 0 C--N 1.325 -0.499 0 CA-C-N 115.308 -0.86 . . . . 0.0 109.695 179.825 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 122' ' ' ALA . . . . . . . . . . . . . . . -71.78 158.3 36.36 Favored 'General case' 0 C--N 1.325 -0.489 0 CA-C-O 120.83 0.348 . . . . 0.0 111.097 -179.045 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 123' ' ' LYS . . . . . . . . . . . . . 54.9 mtpt -60.04 -40.2 88.54 Favored 'General case' 0 C--N 1.33 -0.244 0 CA-C-N 115.858 -0.61 . . . . 0.0 111.3 -176.08 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 124' ' ' ASN . . . . . . . . . . . . . 20.4 p-10 -73.36 -30.52 63.36 Favored 'General case' 0 C--N 1.326 -0.442 0 CA-C-N 116.077 -0.51 . . . . 0.0 110.726 -179.76 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 125' ' ' THR . . . . . 0.403 ' O ' HG13 ' A' ' 129' ' ' ILE . 8.0 m -70.5 -41.17 73.02 Favored 'General case' 0 C--N 1.323 -0.578 0 CA-C-N 116.326 -0.397 . . . . 0.0 110.623 178.982 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 126' ' ' LEU . . . . . . . . . . . . . 91.1 mt -61.74 -44.02 97.71 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 116.105 -0.498 . . . . 0.0 110.675 178.348 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 127' ' ' LYS . . . . . 0.62 ' HG2' HG13 ' A' ' 156' ' ' ILE . 87.8 mttt -64.45 -39.0 92.99 Favored 'General case' 0 C--N 1.331 -0.213 0 CA-C-N 116.126 -0.488 . . . . 0.0 111.005 178.985 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 128' ' ' ALA . . . . . . . . . . . . . . . -58.32 -44.41 88.62 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.276 -0.42 . . . . 0.0 110.895 -179.874 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 129' ' ' ILE . . . . . 0.403 HG13 ' O ' ' A' ' 125' ' ' THR . 65.2 mt -61.97 -47.81 91.45 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.37 0 CA-C-N 115.86 -0.609 . . . . 0.0 110.446 179.024 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 130' ' ' ARG . . . . . . . . . . . . . 10.4 ttp180 -64.95 -43.82 91.46 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 115.864 -0.607 . . . . 0.0 110.952 -178.188 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 131' ' ' ASN . . . . . . . . . . . . . 9.9 t30 -62.12 -44.56 96.38 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.421 -0.354 . . . . 0.0 111.084 -179.317 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 132' ' ' THR . . . . . 0.483 ' O ' HG13 ' A' ' 136' ' ' ILE . 35.8 m -58.17 -48.22 80.98 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.268 -0.424 . . . . 0.0 110.292 178.844 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 133' ' ' ALA . . . . . . . . . . . . . . . -65.1 -38.83 91.98 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.131 -0.486 . . . . 0.0 110.991 178.905 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 134' ' ' SER . . . . . 0.434 ' HA ' ' HB3' ' A' ' 151' ' ' ALA . 18.5 t -61.76 -41.92 98.31 Favored 'General case' 0 C--N 1.327 -0.393 0 CA-C-N 116.048 -0.524 . . . . 0.0 110.622 -179.199 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 135' ' ' GLN . . . . . . . . . . . . . 49.7 mt-30 -66.8 -31.0 71.35 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 116.544 -0.298 . . . . 0.0 111.322 178.101 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 136' ' ' ILE . . . . . 0.483 HG13 ' O ' ' A' ' 132' ' ' THR . 76.1 mt -65.95 -50.93 66.44 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.225 0 CA-C-O 120.807 0.337 . . . . 0.0 110.202 176.761 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 137' ' ' PHE . . . . . 0.482 ' O ' HG13 ' A' ' 141' ' ' ILE . 66.0 m-85 -62.7 -37.46 86.57 Favored 'General case' 0 C--N 1.331 -0.213 0 CA-C-N 116.279 -0.418 . . . . 0.0 110.539 176.431 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 138' ' ' ARG . . . . . . . . . . . . . 26.5 ttp85 -60.1 -44.28 94.94 Favored 'General case' 0 N--CA 1.45 -0.469 0 CA-C-N 116.11 -0.496 . . . . 0.0 110.549 178.88 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 139' ' ' LEU . . . . . . . . . . . . . 65.9 tp -60.29 -34.92 74.44 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 115.678 -0.692 . . . . 0.0 110.562 177.87 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 140' ' ' ALA . . . . . 0.478 ' HB1' ' HB1' ' A' ' 145' ' ' ALA . . . -72.62 -34.65 67.48 Favored 'General case' 0 C--N 1.323 -0.579 0 CA-C-N 115.975 -0.557 . . . . 0.0 110.868 178.512 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 141' ' ' ILE . . . . . 0.55 ' HA ' ' O ' ' A' ' 146' ' ' ILE . 81.7 mt -60.31 -49.96 82.18 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.235 0 CA-C-N 116.708 -0.224 . . . . 0.0 111.281 176.982 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 142' ' ' GLU . . . . . . . . . . . . . 14.9 pt-20 -70.08 -18.78 63.28 Favored 'General case' 0 N--CA 1.464 0.252 0 CA-C-O 120.943 0.402 . . . . 0.0 111.298 -179.216 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 143' ' ' ASN . . . . . . . . . . . . . 20.8 m-80 -97.74 6.22 48.18 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.37 -0.377 . . . . 0.0 110.515 175.32 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 144' ' ' ARG . . . . . 0.4 HH11 ' HD3' ' A' ' 144' ' ' ARG . 44.7 mtt180 60.1 32.45 20.97 Favored 'General case' 0 N--CA 1.464 0.26 0 CA-C-N 115.65 -0.705 . . . . 0.0 112.037 173.966 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 145' ' ' ALA . . . . . 0.478 ' HB1' ' HB1' ' A' ' 140' ' ' ALA . . . -88.4 -32.09 18.51 Favored 'General case' 0 C--N 1.324 -0.524 0 CA-C-O 121.073 0.463 . . . . 0.0 109.754 175.009 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 146' ' ' ILE . . . . . 0.55 ' O ' ' HA ' ' A' ' 141' ' ' ILE . 16.5 tt -143.11 144.5 23.81 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.444 0 CA-C-N 115.32 -0.854 . . . . 0.0 108.882 176.293 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 147' ' ' ASP . . . . . . . . . . . . . 34.6 t70 -96.89 -0.45 47.67 Favored 'General case' 0 C--N 1.323 -0.551 0 CA-C-O 120.953 0.406 . . . . 0.0 111.887 -172.823 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 148' ' ' PHE . . . . . . . . . . . . . 46.7 p90 -144.43 163.28 34.27 Favored 'General case' 0 C--N 1.324 -0.52 0 O-C-N 122.026 -0.421 . . . . 0.0 111.07 -175.949 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 149' ' ' ASN . . . . . 0.491 ' HB2' HD13 ' A' ' 141' ' ' ILE . 47.1 t-20 -120.67 89.84 45.36 Favored Pre-proline 0 C--N 1.328 -0.365 0 CA-C-N 116.24 -0.436 . . . . 0.0 110.394 -177.492 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 150' ' ' PRO . . . . . . . . . . . . . 35.9 Cg_endo -66.15 -22.08 54.69 Favored 'Trans proline' 0 C--N 1.343 0.246 0 C-N-CA 122.59 2.193 . . . . 0.0 112.173 -178.223 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 151' ' ' ALA . . . . . 0.434 ' HB3' ' HA ' ' A' ' 134' ' ' SER . . . -70.75 -30.66 67.22 Favored 'General case' 0 C--N 1.327 -0.399 0 CA-C-N 116.269 -0.423 . . . . 0.0 110.553 179.694 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 152' ' ' ASP . . . . . . . . . . . . . 9.3 t70 -77.81 -15.29 59.19 Favored 'General case' 0 C--N 1.329 -0.306 0 N-CA-C 109.195 -0.669 . . . . 0.0 109.195 178.561 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 153' ' ' TYR . . . . . . . . . . . . . 73.3 t80 -83.18 -16.44 46.58 Favored 'General case' 0 C--N 1.327 -0.411 0 CA-C-N 115.656 -0.702 . . . . 0.0 109.453 177.396 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 154' ' ' VAL . . . . . 0.467 HG11 ' HA ' ' A' ' 113' ' ' GLN . 63.2 t -71.83 136.26 26.13 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.422 0 CA-C-N 115.724 -0.671 . . . . 0.0 110.006 177.474 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 155' ' ' ARG . . . . . 0.418 HH11 ' HD2' ' A' ' 155' ' ' ARG . 40.4 mtt180 -98.43 141.43 31.31 Favored 'General case' 0 C--N 1.322 -0.627 0 CA-C-N 115.838 -0.619 . . . . 0.0 111.167 -177.535 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 156' ' ' ILE . . . . . 0.62 HG13 ' HG2' ' A' ' 127' ' ' LYS . 46.8 mm -98.22 107.27 40.51 Favored Pre-proline 0 C--N 1.321 -0.672 0 N-CA-C 108.593 -0.891 . . . . 0.0 108.593 170.922 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 157' ' ' PRO . . . . . . . . . . . . . 58.8 Cg_endo -75.19 129.39 12.13 Favored 'Trans proline' 0 N--CA 1.451 -0.976 0 C-N-CA 121.281 1.321 . . . . 0.0 113.288 -173.754 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 158' ' ' LYS . . . . . . . . . . . . . 12.4 ptmm? -127.36 19.97 6.82 Favored 'General case' 0 C--N 1.319 -0.73 0 N-CA-C 107.179 -1.415 . . . . 0.0 107.179 171.054 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 159' ' ' ILE . . . . . . . . . . . . . 0.2 OUTLIER -105.62 -22.94 4.64 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.588 0 CA-C-N 112.959 -1.928 . . . . 0.0 110.18 -175.057 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 160' ' ' ALA . . . . . . . . . . . . . . . -78.5 -173.29 3.28 Favored 'General case' 0 C--N 1.326 -0.449 0 CA-C-N 115.549 -0.751 . . . . 0.0 111.475 -175.326 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 161' ' ' LEU . . . . . . . . . . . . . 92.0 mt -56.99 122.43 12.28 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 115.756 -0.657 . . . . 0.0 110.468 176.724 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 162' ' ' GLU . . . . . . . . . . . . . 46.2 mt-10 -81.42 169.87 16.66 Favored 'General case' 0 C--N 1.325 -0.499 0 CA-C-O 121.271 0.558 . . . . 0.0 111.043 -179.93 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 163' ' ' HIS . . . . . . . . . . . . . 26.4 p80 -70.92 168.17 17.5 Favored 'General case' 0 C--N 1.326 -0.428 0 CA-C-N 115.425 -0.807 . . . . 0.0 111.833 -176.131 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 164' ' ' HIS . . . . . 0.568 ' O ' ' HB2' ' A' ' 165' ' ' HIS . 6.3 p80 -55.91 136.32 51.69 Favored 'General case' 0 C--O 1.235 0.317 0 CA-C-N 115.789 -0.641 . . . . 0.0 109.469 170.897 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 165' ' ' HIS . . . . . 0.568 ' HB2' ' O ' ' A' ' 164' ' ' HIS . 20.3 m170 79.62 138.73 0.07 Allowed 'General case' 0 N--CA 1.47 0.567 0 O-C-N 124.223 0.952 . . . . 0.0 110.055 -172.537 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 166' ' ' HIS . . . . . . . . . . . . . 35.8 t-80 72.24 93.02 0.08 Allowed 'General case' 0 C--N 1.329 -0.314 0 O-C-N 124.1 0.875 . . . . 0.0 110.109 -172.403 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 167' ' ' HIS . . . . . . . . . . . . . 78.1 m-70 -89.99 120.55 31.3 Favored 'General case' 0 C--N 1.323 -0.556 0 CA-C-N 115.692 -0.685 . . . . 0.0 110.113 179.649 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 168' ' ' HIS . . . . . . . . . . . . . 17.0 t-80 . . . . . 0 C--O 1.246 0.92 0 CA-C-O 118.477 -0.773 . . . . 0.0 109.614 -176.303 . . . . . . . . 0 0 . 1 . 013 nuclear orig full ' A' A ' 61' ' ' ARG . . . . . . . . . . . . . 36.8 ttm180 . . . . . 0 N--CA 1.478 0.939 0 N-CA-C 109.83 -0.433 . . . . 0.0 109.83 . . . . . . . . . 0 0 . 1 . 013 nuclear orig full ' A' A ' 62' ' ' ASP . . . . . . . . . . . . . 8.3 m-20 -112.62 -175.92 2.79 Favored 'General case' 0 C--N 1.324 -0.517 0 CA-C-N 116.062 -0.517 . . . . 0.0 110.803 -177.643 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 63' ' ' SER . . . . . 0.584 ' HA ' ' HA ' ' A' ' 103' ' ' SER . 18.7 m -93.89 158.4 15.66 Favored 'General case' 0 C--O 1.242 0.693 0 CA-C-N 115.824 -0.625 . . . . 0.0 111.177 -177.461 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 64' ' ' PHE . . . . . 0.45 ' HB2' HD13 ' A' ' 107' ' ' ILE . 79.5 t80 -60.01 -37.18 78.97 Favored 'General case' 0 C--N 1.325 -0.484 0 CA-C-N 115.206 -0.906 . . . . 0.0 110.32 179.479 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 65' ' ' GLY . . . . . . . . . . . . . . . -58.19 -40.83 94.33 Favored Glycine 0 N--CA 1.451 -0.305 0 C-N-CA 121.145 -0.55 . . . . 0.0 112.692 177.606 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 66' ' ' ASP . . . . . . . . . . . . . 7.3 m-20 -59.9 -53.2 60.62 Favored 'General case' 0 C--O 1.236 0.357 0 CA-C-O 121.375 0.607 . . . . 0.0 110.756 179.04 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 67' ' ' TRP . . . . . 0.41 ' CE3' ' HD3' ' A' ' 70' ' ' LYS . 87.4 m95 -76.91 -23.25 52.52 Favored 'General case' 0 C--N 1.325 -0.494 0 CA-C-N 115.614 -0.721 . . . . 0.0 111.955 -175.804 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 68' ' ' ALA . . . . . 0.585 ' O ' ' HG ' ' A' ' 72' ' ' LEU . . . -63.51 -48.59 76.95 Favored 'General case' 0 C--N 1.325 -0.473 0 CA-C-O 120.837 0.351 . . . . 0.0 110.573 175.969 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 69' ' ' GLU . . . . . 0.528 ' HA ' HD11 ' A' ' 72' ' ' LEU . 26.4 mt-10 -74.2 -22.12 59.52 Favored 'General case' 0 C--N 1.327 -0.375 0 CA-C-N 116.469 -0.332 . . . . 0.0 110.939 -179.965 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 70' ' ' LYS . . . . . 0.41 ' HD3' ' CE3' ' A' ' 67' ' ' TRP . 60.9 tttp -68.19 -41.81 80.87 Favored 'General case' 0 C--N 1.326 -0.43 0 N-CA-C 109.568 -0.53 . . . . 0.0 109.568 172.637 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 71' ' ' PHE . . . . . . . . . . . . . 61.9 t80 -61.61 -44.09 97.65 Favored 'General case' 0 N--CA 1.454 -0.251 0 CA-C-N 116.038 -0.528 . . . . 0.0 109.935 174.2 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 72' ' ' LEU . . . . . 0.585 ' HG ' ' O ' ' A' ' 68' ' ' ALA . 87.3 mt -56.87 -43.96 81.74 Favored 'General case' 0 C--N 1.327 -0.38 0 CA-C-N 116.162 -0.472 . . . . 0.0 110.361 176.802 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 73' ' ' LYS . . . . . . . . . . . . . 24.8 ttmm -64.49 -37.08 86.29 Favored 'General case' 0 C--N 1.326 -0.422 0 CA-C-N 115.763 -0.653 . . . . 0.0 111.207 -179.358 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 74' ' ' SER . . . . . . . . . . . . . 96.8 p -68.89 -34.13 74.92 Favored 'General case' 0 C--O 1.226 -0.181 0 C-N-CA 120.588 -0.445 . . . . 0.0 110.458 179.288 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 75' ' ' LYS . . . . . 0.63 ' HE2' ' HA ' ' A' ' 75' ' ' LYS . 11.3 mmpt? -70.04 -39.47 75.72 Favored 'General case' 0 C--O 1.233 0.189 0 CA-C-O 121.117 0.484 . . . . 0.0 109.989 175.589 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 76' ' ' GLU . . . . . . . . . . . . . 33.2 tt0 -57.17 -46.05 83.13 Favored 'General case' 0 C--N 1.324 -0.517 0 CA-C-N 115.222 -0.899 . . . . 0.0 110.867 177.394 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 77' ' ' ALA . . . . . . . . . . . . . . . -80.31 -20.07 45.15 Favored 'General case' 0 C--N 1.323 -0.567 0 CA-C-N 115.762 -0.654 . . . . 0.0 111.518 179.638 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 78' ' ' ASP . . . . . . . . . . . . . 20.6 t70 -68.22 -53.22 26.3 Favored 'General case' 0 C--N 1.327 -0.384 0 CA-C-O 121.003 0.43 . . . . 0.0 110.604 -179.894 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 79' ' ' GLY . . . . . . . . . . . . . . . 137.51 65.77 0.05 OUTLIER Glycine 0 N--CA 1.447 -0.595 0 C-N-CA 120.518 -0.848 . . . . 0.0 112.42 179.539 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 80' ' ' VAL . . . . . . . . . . . . . 35.0 m -121.69 150.19 24.94 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.558 0 CA-C-O 120.737 0.303 . . . . 0.0 110.407 177.253 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 81' ' ' SER . . . . . . . . . . . . . 45.9 t -76.09 168.57 19.8 Favored 'General case' 0 C--N 1.324 -0.501 0 CA-C-N 116.398 -0.365 . . . . 0.0 110.252 179.02 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 82' ' ' VAL . . . . . . . . . . . . . 67.4 t -56.87 -51.07 72.54 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.215 0 CA-C-N 116.381 -0.372 . . . . 0.0 110.782 -178.657 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 83' ' ' SER . . . . . . . . . . . . . 14.9 m -59.73 -28.07 67.03 Favored 'General case' 0 C--N 1.327 -0.381 0 CA-C-N 116.361 -0.381 . . . . 0.0 111.358 -178.912 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 84' ' ' GLN . . . . . . . . . . . . . 6.5 tp-100 -80.48 -48.18 13.19 Favored 'General case' 0 C--N 1.327 -0.38 0 CA-C-O 120.824 0.345 . . . . 0.0 110.458 -179.328 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 85' ' ' LEU . . . . . . . . . . . . . 51.2 tp -64.55 -42.36 95.75 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-O 121.105 0.479 . . . . 0.0 110.229 178.738 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 86' ' ' ASN . . . . . . . . . . . . . 50.2 t30 -63.42 -33.9 76.56 Favored 'General case' 0 C--N 1.325 -0.457 0 CA-C-N 115.626 -0.715 . . . . 0.0 110.062 177.627 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 87' ' ' SER . . . . . . . . . . . . . 9.1 t -63.31 -45.19 92.46 Favored 'General case' 0 C--N 1.329 -0.283 0 N-CA-C 109.634 -0.506 . . . . 0.0 109.634 175.7 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 88' ' ' TYR . . . . . . . . . . . . . 18.5 m-85 -58.88 -43.61 90.96 Favored 'General case' 0 C--O 1.234 0.289 0 CA-C-N 116.465 -0.334 . . . . 0.0 110.531 176.708 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 89' ' ' LYS . . . . . 0.518 ' HG2' HD13 ' A' ' 72' ' ' LEU . 67.5 mttm -60.59 -42.35 96.57 Favored 'General case' 0 C--N 1.332 -0.163 0 CA-C-N 116.138 -0.483 . . . . 0.0 110.398 176.983 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 90' ' ' ASN . . . . . . . . . . . . . 26.3 t30 -56.95 -44.84 82.98 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.002 -0.545 . . . . 0.0 111.17 178.144 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 91' ' ' TYR . . . . . . . . . . . . . 63.3 m-85 -63.52 -49.2 74.47 Favored 'General case' 0 C--N 1.325 -0.458 0 C-N-CA 120.891 -0.323 . . . . 0.0 111.094 179.384 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 92' ' ' CYS . . . . . 0.458 ' HA ' HD12 ' A' ' 96' ' ' LEU . 58.6 m -65.88 -42.54 90.21 Favored 'General case' 0 C--N 1.326 -0.443 0 CA-C-O 121.064 0.459 . . . . 0.0 111.574 -177.308 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 93' ' ' ARG . . . . . . . . . . . . . 10.0 ttt180 -82.35 -51.06 8.24 Favored 'General case' 0 C--N 1.323 -0.553 0 N-CA-C 112.434 0.531 . . . . 0.0 112.434 -174.353 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 94' ' ' ASN . . . . . . . . . . . . . 31.9 t30 -89.53 -40.5 12.6 Favored 'General case' 0 C--N 1.325 -0.475 0 N-CA-C 112.121 0.415 . . . . 0.0 112.121 -172.04 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 95' ' ' HIS . . . . . . . . . . . . . 82.4 m-70 -85.46 -34.38 21.66 Favored 'General case' 0 C--N 1.322 -0.629 0 O-C-N 122.056 -0.402 . . . . 0.0 111.435 -176.755 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 96' ' ' LEU . . . . . 0.458 HD12 ' HA ' ' A' ' 92' ' ' CYS . 86.9 mt -106.46 27.07 9.13 Favored 'General case' 0 C--N 1.323 -0.574 0 CA-C-N 116.374 -0.376 . . . . 0.0 111.164 -176.647 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 97' ' ' SER . . . . . 0.43 ' N ' ' HD2' ' A' ' 98' ' ' PRO . 15.3 m -46.92 -53.05 29.04 Favored Pre-proline 0 CA--C 1.541 0.608 0 N-CA-C 112.715 0.635 . . . . 0.0 112.715 -178.985 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 98' ' ' PRO . . . . . 0.43 ' HD2' ' N ' ' A' ' 97' ' ' SER . 38.0 Cg_endo -66.44 -20.82 54.24 Favored 'Trans proline' 0 C--N 1.356 0.954 0 C-N-CA 121.936 1.757 . . . . 0.0 113.285 -178.185 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 99' ' ' LEU . . . . . 0.538 HD23 HG12 ' A' ' 112' ' ' ILE . 11.2 mp -88.89 -27.79 20.76 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-O 120.903 0.383 . . . . 0.0 110.476 -179.559 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 100' ' ' TYR . . . . . . . . . . . . . 5.9 t80 -57.76 -31.75 66.8 Favored 'General case' 0 C--N 1.325 -0.472 0 CA-C-N 115.541 -0.754 . . . . 0.0 111.394 -174.962 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 101' ' ' MET . . . . . . . . . . . . . 66.3 mtt -102.17 14.05 33.01 Favored 'General case' 0 C--N 1.327 -0.394 0 CA-C-N 116.217 -0.447 . . . . 0.0 111.334 -178.447 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 102' ' ' LYS . . . . . . . . . . . . . 96.5 mttt -103.26 151.11 23.05 Favored 'General case' 0 C--N 1.326 -0.422 0 N-CA-C 110.136 -0.32 . . . . 0.0 110.136 176.825 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 103' ' ' SER . . . . . 0.584 ' HA ' ' HA ' ' A' ' 63' ' ' SER . 46.6 t -75.85 161.41 29.02 Favored 'General case' 0 C--N 1.322 -0.588 0 N-CA-C 109.084 -0.71 . . . . 0.0 109.084 171.296 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 104' ' ' LEU . . . . . 0.406 ' HB3' HD12 ' A' ' 146' ' ' ILE . 90.3 mt -58.91 -28.93 66.66 Favored 'General case' 0 C--N 1.323 -0.56 0 CA-C-O 121.041 0.448 . . . . 0.0 110.613 179.208 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 105' ' ' SER . . . . . . . . . . . . . 26.4 t -87.97 -7.57 56.91 Favored 'General case' 0 CA--C 1.534 0.357 0 CA-C-N 115.98 -0.555 . . . . 0.0 111.472 -179.269 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 106' ' ' GLU . . . . . 0.521 ' HG3' ' HB3' ' A' ' 103' ' ' SER . 45.2 mt-10 -96.67 -6.38 36.68 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-O 120.792 0.33 . . . . 0.0 111.049 -177.553 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 107' ' ' ILE . . . . . 0.45 HD13 ' HB2' ' A' ' 64' ' ' PHE . 72.4 mt -93.89 122.23 45.2 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.594 0 CA-C-O 120.972 0.415 . . . . 0.0 110.778 -176.963 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 108' ' ' LEU . . . . . . . . . . . . . 86.4 mt -96.72 143.79 26.72 Favored Pre-proline 0 C--N 1.326 -0.445 0 CA-C-N 115.944 -0.571 . . . . 0.0 110.641 -178.88 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 109' ' ' PRO . . . . . 0.568 ' HB3' ' HB2' ' A' ' 153' ' ' TYR . 50.2 Cg_exo -55.31 -45.33 40.95 Favored 'Trans proline' 0 CA--C 1.531 0.374 0 C-N-CA 122.81 2.34 . . . . 0.0 112.378 176.823 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 110' ' ' ALA . . . . . . . . . . . . . . . -69.34 -25.11 64.04 Favored 'General case' 0 C--N 1.332 -0.186 0 CA-C-N 116.497 -0.32 . . . . 0.0 111.134 -179.46 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 111' ' ' ASP . . . . . . . . . . . . . 38.2 t70 -65.99 -45.14 82.7 Favored 'General case' 0 C--N 1.326 -0.437 0 CA-C-O 121.131 0.491 . . . . 0.0 109.785 179.309 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 112' ' ' ILE . . . . . 0.538 HG12 HD23 ' A' ' 99' ' ' LEU . 19.2 mt -69.14 -39.95 79.98 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.295 0 CA-C-N 115.752 -0.658 . . . . 0.0 110.071 176.557 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 113' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -58.18 -43.22 87.4 Favored 'General case' 0 C--N 1.331 -0.215 0 CA-C-N 115.892 -0.595 . . . . 0.0 109.89 178.877 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 114' ' ' SER . . . . . . . . . . . . . 40.8 t -56.12 -50.25 71.63 Favored 'General case' 0 C--N 1.331 -0.231 0 CA-C-N 116.039 -0.528 . . . . 0.0 110.226 177.052 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 115' ' ' ILE . . . . . . . . . . . . . 67.1 mt -58.15 -44.44 87.59 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.193 0 CA-C-N 116.372 -0.376 . . . . 0.0 111.002 179.309 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 116' ' ' ILE . . . . . . . . . . . . . 47.3 mm -62.81 -41.35 92.17 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.326 0 CA-C-O 120.821 0.343 . . . . 0.0 111.1 -179.93 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 117' ' ' ASN . . . . . . . . . . . . . 8.4 t30 -69.98 -33.67 72.37 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-N 116.391 -0.368 . . . . 0.0 111.165 -179.251 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 118' ' ' GLU . . . . . . . . . . . . . 28.3 mm-40 -80.1 -21.94 42.74 Favored 'General case' 0 C--N 1.327 -0.396 0 CA-C-N 116.251 -0.431 . . . . 0.0 110.846 179.48 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 119' ' ' THR . . . . . . . . . . . . . 61.7 m -78.38 111.04 13.98 Favored 'General case' 0 N--CA 1.448 -0.526 0 N-CA-C 108.937 -0.764 . . . . 0.0 108.937 173.897 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 120' ' ' LYS . . . . . 0.463 ' C ' HD13 ' A' ' 121' ' ' LEU . 96.2 mttt -111.61 78.22 1.1 Allowed 'General case' 0 C--N 1.32 -0.693 0 CA-C-O 121.992 0.901 . . . . 0.0 110.993 -173.001 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 121' ' ' LEU . . . . . 0.463 HD13 ' C ' ' A' ' 120' ' ' LYS . 8.0 mp -131.61 -174.44 3.41 Favored 'General case' 0 C--N 1.326 -0.426 0 CA-C-N 114.093 -1.412 . . . . 0.0 108.825 178.462 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 122' ' ' ALA . . . . . . . . . . . . . . . -59.88 148.54 34.49 Favored 'General case' 0 C--N 1.326 -0.431 0 CA-C-O 120.611 0.243 . . . . 0.0 110.568 177.296 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 123' ' ' LYS . . . . . . . . . . . . . 56.0 mtmt -60.79 -29.46 69.46 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-N 116.332 -0.395 . . . . 0.0 111.241 -176.719 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 124' ' ' ASN . . . . . . . . . . . . . 0.2 OUTLIER -59.93 -37.97 81.02 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.193 -0.458 . . . . 0.0 109.882 176.959 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 125' ' ' THR . . . . . 0.435 HG21 HD22 ' A' ' 121' ' ' LEU . 17.7 m -71.82 -39.63 69.67 Favored 'General case' 0 C--N 1.327 -0.394 0 CA-C-N 115.921 -0.582 . . . . 0.0 110.361 179.512 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 126' ' ' LEU . . . . . . . . . . . . . 93.3 mt -61.72 -40.91 96.73 Favored 'General case' 0 C--N 1.327 -0.383 0 CA-C-N 116.051 -0.522 . . . . 0.0 110.345 177.802 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 127' ' ' LYS . . . . . . . . . . . . . 90.6 mttt -66.18 -31.83 72.9 Favored 'General case' 0 C--N 1.327 -0.377 0 CA-C-N 116.025 -0.534 . . . . 0.0 111.399 177.961 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 128' ' ' ALA . . . . . . . . . . . . . . . -62.25 -43.96 97.64 Favored 'General case' 0 C--N 1.325 -0.457 0 CA-C-O 120.766 0.317 . . . . 0.0 110.602 178.923 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 129' ' ' ILE . . . . . . . . . . . . . 35.4 mt -67.16 -43.67 88.37 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.313 0 CA-C-N 116.145 -0.479 . . . . 0.0 109.736 177.264 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 130' ' ' ARG . . . . . 0.533 ' HB2' HD11 ' A' ' 156' ' ' ILE . 16.4 tpt85 -55.8 -51.74 66.39 Favored 'General case' 0 C--N 1.331 -0.219 0 CA-C-N 115.35 -0.841 . . . . 0.0 111.005 178.159 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 131' ' ' ASN . . . . . . . . . . . . . 14.4 m-80 -58.59 -54.41 47.42 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.202 -0.454 . . . . 0.0 111.109 179.986 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 132' ' ' THR . . . . . 0.421 ' O ' HG13 ' A' ' 136' ' ' ILE . 33.6 m -52.9 -50.7 63.38 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-N 116.136 -0.483 . . . . 0.0 111.255 -178.519 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 133' ' ' ALA . . . . . . . . . . . . . . . -61.45 -48.46 81.06 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.301 -0.409 . . . . 0.0 111.39 -178.266 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 134' ' ' SER . . . . . 0.504 ' O ' ' HG2' ' A' ' 138' ' ' ARG . 52.9 p -62.44 -36.35 82.15 Favored 'General case' 0 C--N 1.331 -0.214 0 CA-C-N 116.569 -0.287 . . . . 0.0 111.157 -177.918 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 135' ' ' GLN . . . . . 0.416 ' HA ' ' HG2' ' A' ' 138' ' ' ARG . 14.7 mm100 -66.37 -36.26 82.43 Favored 'General case' 0 C--N 1.333 -0.138 0 CA-C-N 116.576 -0.284 . . . . 0.0 111.266 -178.723 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 136' ' ' ILE . . . . . 0.421 HG13 ' O ' ' A' ' 132' ' ' THR . 79.5 mt -66.75 -45.68 87.42 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.505 0 CA-C-O 120.786 0.327 . . . . 0.0 110.73 179.624 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 137' ' ' PHE . . . . . 0.479 ' O ' HG13 ' A' ' 141' ' ' ILE . 58.5 m-85 -67.47 -45.21 76.6 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.373 -0.376 . . . . 0.0 111.566 -178.962 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 138' ' ' ARG . . . . . 0.504 ' HG2' ' O ' ' A' ' 134' ' ' SER . 13.3 ptm180 -65.17 -33.02 75.02 Favored 'General case' 0 N--CA 1.463 0.19 0 C-N-CA 120.796 -0.362 . . . . 0.0 110.77 -179.327 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 139' ' ' LEU . . . . . . . . . . . . . 54.6 tp -63.93 -41.19 97.71 Favored 'General case' 0 C--N 1.33 -0.239 0 CA-C-O 121.014 0.435 . . . . 0.0 109.901 176.608 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 140' ' ' ALA . . . . . . . . . . . . . . . -64.62 -37.67 88.37 Favored 'General case' 0 C--N 1.326 -0.42 0 CA-C-N 116.033 -0.531 . . . . 0.0 110.499 176.629 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 141' ' ' ILE . . . . . 0.479 HG13 ' O ' ' A' ' 137' ' ' PHE . 78.4 mt -63.7 -42.86 97.43 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.299 0 CA-C-N 116.22 -0.445 . . . . 0.0 110.469 177.138 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 142' ' ' GLU . . . . . 0.459 ' HG3' ' O ' ' A' ' 138' ' ' ARG . 43.5 mt-10 -69.07 -8.9 49.44 Favored 'General case' 0 N--CA 1.463 0.219 0 CA-C-N 116.248 -0.433 . . . . 0.0 111.558 179.758 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 143' ' ' ASN . . . . . . . . . . . . . 43.2 m-80 -114.38 14.52 17.95 Favored 'General case' 0 C--N 1.327 -0.378 0 CA-C-N 116.656 -0.247 . . . . 0.0 111.425 177.617 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 144' ' ' ARG . . . . . . . . . . . . . 99.4 mtt180 62.12 26.24 15.76 Favored 'General case' 0 N--CA 1.471 0.59 0 O-C-N 123.434 0.459 . . . . 0.0 112.063 176.738 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 145' ' ' ALA . . . . . . . . . . . . . . . -90.48 -23.52 20.94 Favored 'General case' 0 C--N 1.324 -0.537 0 CA-C-O 120.823 0.344 . . . . 0.0 110.924 -179.35 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 146' ' ' ILE . . . . . 0.457 ' O ' ' HA ' ' A' ' 141' ' ' ILE . 13.3 tt -159.95 157.62 2.83 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.596 0 N-CA-C 109.231 -0.655 . . . . 0.0 109.231 178.131 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 147' ' ' ASP . . . . . . . . . . . . . 31.2 t70 -126.62 27.54 6.08 Favored 'General case' 0 C--N 1.322 -0.598 0 CA-C-O 121.849 0.833 . . . . 0.0 110.188 -179.436 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 148' ' ' PHE . . . . . . . . . . . . . 78.2 t80 -141.26 132.73 26.85 Favored 'General case' 0 C--N 1.319 -0.732 0 CA-C-N 115.579 -0.737 . . . . 0.0 109.589 -179.906 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 149' ' ' ASN . . . . . . . . . . . . . 48.6 t-20 -114.93 92.6 31.14 Favored Pre-proline 0 C--N 1.322 -0.607 0 CA-C-N 116.488 -0.324 . . . . 0.0 110.322 -179.657 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 150' ' ' PRO . . . . . . . . . . . . . 23.7 Cg_exo -64.71 -27.9 60.21 Favored 'Trans proline' 0 C--N 1.344 0.297 0 C-N-CA 122.803 2.335 . . . . 0.0 112.243 -178.714 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 151' ' ' ALA . . . . . 0.409 ' HA ' HG22 ' A' ' 154' ' ' VAL . . . -73.5 -21.32 60.44 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.087 -0.506 . . . . 0.0 111.219 -177.063 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 152' ' ' ASP . . . . . . . . . . . . . 3.9 t70 -76.58 -17.08 59.4 Favored 'General case' 0 C--N 1.326 -0.455 0 CA-C-O 121.357 0.599 . . . . 0.0 109.865 -179.877 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 153' ' ' TYR . . . . . 0.568 ' HB2' ' HB3' ' A' ' 109' ' ' PRO . 47.3 m-85 -93.45 2.45 56.47 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-N 115.737 -0.665 . . . . 0.0 110.799 179.133 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 154' ' ' VAL . . . . . 0.409 HG22 ' HA ' ' A' ' 151' ' ' ALA . 98.6 t -83.31 115.92 26.53 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.485 0 CA-C-N 116.299 -0.41 . . . . 0.0 110.639 -178.92 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 155' ' ' ARG . . . . . . . . . . . . . 39.8 ttm-85 -77.88 132.94 38.18 Favored 'General case' 0 C--N 1.322 -0.626 0 CA-C-N 115.802 -0.635 . . . . 0.0 110.526 179.406 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 156' ' ' ILE . . . . . 0.533 HD11 ' HB2' ' A' ' 130' ' ' ARG . 45.1 mm -96.85 120.7 61.2 Favored Pre-proline 0 C--N 1.322 -0.59 0 N-CA-C 109.458 -0.571 . . . . 0.0 109.458 174.729 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 157' ' ' PRO . . . . . 0.429 ' HD3' ' HA ' ' A' ' 156' ' ' ILE . 35.7 Cg_exo -59.82 132.51 45.57 Favored 'Trans proline' 0 N--CA 1.463 -0.313 0 C-N-CA 122.655 2.237 . . . . 0.0 112.588 -178.034 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 158' ' ' LYS . . . . . . . . . . . . . 63.1 mttm -92.13 18.79 7.59 Favored 'General case' 0 C--N 1.325 -0.478 0 CA-C-O 121.605 0.717 . . . . 0.0 109.084 175.855 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 159' ' ' ILE . . . . . . . . . . . . . 63.9 mt -79.98 107.68 12.64 Favored 'Isoleucine or valine' 0 N--CA 1.446 -0.644 0 CA-C-N 114.881 -1.054 . . . . 0.0 110.57 -173.955 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 160' ' ' ALA . . . . . . . . . . . . . . . -98.01 146.35 25.61 Favored 'General case' 0 C--N 1.314 -0.941 0 CA-C-N 115.789 -0.641 . . . . 0.0 109.572 174.619 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 161' ' ' LEU . . . . . . . . . . . . . 90.1 mt -85.07 13.22 6.4 Favored 'General case' 0 C--N 1.322 -0.614 0 CA-C-N 116.344 -0.389 . . . . 0.0 110.647 -177.815 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 162' ' ' GLU . . . . . 0.493 ' HG3' ' H ' ' A' ' 163' ' ' HIS . 7.8 tp10 64.92 -176.03 0.17 Allowed 'General case' 0 C--O 1.235 0.328 0 O-C-N 123.816 0.698 . . . . 0.0 110.057 178.411 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 163' ' ' HIS . . . . . 0.493 ' H ' ' HG3' ' A' ' 162' ' ' GLU . 74.5 m80 -80.19 54.62 2.0 Allowed 'General case' 0 C--N 1.323 -0.574 0 CA-C-O 120.904 0.383 . . . . 0.0 110.046 178.518 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 164' ' ' HIS . . . . . . . . . . . . . 29.7 t60 -82.52 -51.92 7.34 Favored 'General case' 0 C--N 1.325 -0.475 0 N-CA-C 109.419 -0.585 . . . . 0.0 109.419 179.346 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 165' ' ' HIS . . . . . . . . . . . . . 1.7 t-80 -129.35 127.03 40.22 Favored 'General case' 0 C--N 1.325 -0.472 0 N-CA-C 109.357 -0.608 . . . . 0.0 109.357 173.916 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 166' ' ' HIS . . . . . 0.461 ' CD2' ' HB3' ' A' ' 168' ' ' HIS . 82.0 t60 -85.38 98.84 10.79 Favored 'General case' 0 C--N 1.321 -0.651 0 CA-C-O 121.09 0.472 . . . . 0.0 111.706 -172.577 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 167' ' ' HIS . . . . . . . . . . . . . 72.4 t60 -77.85 110.08 12.42 Favored 'General case' 0 C--N 1.322 -0.596 0 N-CA-C 109.233 -0.654 . . . . 0.0 109.233 171.666 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 168' ' ' HIS . . . . . 0.461 ' HB3' ' CD2' ' A' ' 166' ' ' HIS . 7.4 p80 . . . . . 0 C--O 1.244 0.775 0 CA-C-O 118.081 -0.962 . . . . 0.0 110.075 -177.665 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 61' ' ' ARG . . . . . . . . . . . . . 13.4 ttm180 . . . . . 0 N--CA 1.481 1.098 0 N-CA-C 110.083 -0.34 . . . . 0.0 110.083 . . . . . . . . . 0 0 . 1 . 014 nuclear orig full ' A' A ' 62' ' ' ASP . . . . . . . . . . . . . 5.8 m-20 -134.63 26.0 3.71 Favored 'General case' 0 CA--C 1.516 -0.328 0 N-CA-C 109.264 -0.643 . . . . 0.0 109.264 175.297 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 63' ' ' SER . . . . . 0.555 ' HA ' ' HA ' ' A' ' 103' ' ' SER . 87.5 p -79.69 163.22 24.7 Favored 'General case' 0 C--N 1.321 -0.655 0 CA-C-N 115.974 -0.557 . . . . 0.0 110.428 -176.055 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 64' ' ' PHE . . . . . 0.548 ' HB2' HD12 ' A' ' 107' ' ' ILE . 64.9 t80 -60.84 -31.82 71.24 Favored 'General case' 0 C--N 1.323 -0.573 0 N-CA-C 109.229 -0.656 . . . . 0.0 109.229 175.647 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 65' ' ' GLY . . . . . . . . . . . . . . . -61.03 -32.67 81.13 Favored Glycine 0 N--CA 1.451 -0.363 0 CA-C-N 115.969 -0.56 . . . . 0.0 112.505 176.934 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 66' ' ' ASP . . . . . . . . . . . . . 24.9 m-20 -68.9 -55.3 11.48 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-O 121.208 0.527 . . . . 0.0 110.18 177.195 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 67' ' ' TRP . . . . . . . . . . . . . 99.4 m95 -68.18 -32.32 72.48 Favored 'General case' 0 C--N 1.326 -0.431 0 CA-C-N 115.705 -0.68 . . . . 0.0 111.869 -176.813 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 68' ' ' ALA . . . . . 0.601 ' O ' ' HG ' ' A' ' 72' ' ' LEU . . . -64.21 -47.43 79.77 Favored 'General case' 0 C--N 1.326 -0.432 0 N-CA-C 110.17 -0.308 . . . . 0.0 110.17 176.706 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 69' ' ' GLU . . . . . . . . . . . . . 7.5 tp10 -63.3 -40.08 96.35 Favored 'General case' 0 C--N 1.329 -0.297 0 N-CA-C 109.497 -0.557 . . . . 0.0 109.497 177.838 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 70' ' ' LYS . . . . . . . . . . . . . 10.7 tppt? -56.12 -49.6 73.43 Favored 'General case' 0 C--N 1.331 -0.223 0 CA-C-N 115.622 -0.717 . . . . 0.0 110.36 174.519 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 71' ' ' PHE . . . . . . . . . . . . . 80.3 t80 -64.71 -46.68 81.29 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 116.123 -0.49 . . . . 0.0 111.477 -179.08 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 72' ' ' LEU . . . . . 0.601 ' HG ' ' O ' ' A' ' 68' ' ' ALA . 85.7 mt -61.02 -43.63 98.61 Favored 'General case' 0 C--N 1.327 -0.396 0 CA-C-O 121.01 0.433 . . . . 0.0 110.422 179.776 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 73' ' ' LYS . . . . . . . . . . . . . 58.3 tttm -67.43 -26.53 66.46 Favored 'General case' 0 C--N 1.326 -0.42 0 CA-C-O 121.192 0.52 . . . . 0.0 110.155 179.015 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 74' ' ' SER . . . . . . . . . . . . . 60.7 m -68.39 -37.8 80.73 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 116.122 -0.49 . . . . 0.0 110.01 174.716 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 75' ' ' LYS . . . . . . . . . . . . . 71.4 mmtt -69.67 -34.03 73.4 Favored 'General case' 0 C--O 1.233 0.19 0 CA-C-N 116.346 -0.388 . . . . 0.0 110.892 177.575 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 76' ' ' GLU . . . . . . . . . . . . . 6.8 tp10 -54.27 -49.55 69.31 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-O 121.095 0.474 . . . . 0.0 109.847 173.591 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 77' ' ' ALA . . . . . . . . . . . . . . . -80.26 -16.66 54.21 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 115.961 -0.563 . . . . 0.0 111.325 179.781 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 78' ' ' ASP . . . . . . . . . . . . . 19.9 t70 -69.57 -34.38 74.08 Favored 'General case' 0 N--CA 1.464 0.24 0 CA-C-O 121.016 0.436 . . . . 0.0 110.196 -179.15 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 79' ' ' GLY . . . . . . . . . . . . . . . 108.09 37.16 2.2 Favored Glycine 0 N--CA 1.449 -0.5 0 C-N-CA 120.497 -0.859 . . . . 0.0 113.375 174.159 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 80' ' ' VAL . . . . . 0.488 ' HB ' ' HB2' ' A' ' 84' ' ' GLN . 17.7 m -88.51 155.73 3.15 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.503 0 CA-C-N 116.973 0.387 . . . . 0.0 110.431 175.511 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 81' ' ' SER . . . . . . . . . . . . . 19.5 m -66.44 159.12 27.76 Favored 'General case' 0 C--N 1.325 -0.49 0 N-CA-C 109.943 -0.391 . . . . 0.0 109.943 177.402 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 82' ' ' VAL . . . . . . . . . . . . . 61.2 t -56.75 -36.71 50.12 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.27 0 CA-C-O 120.905 0.383 . . . . 0.0 110.538 -178.966 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 83' ' ' SER . . . . . . . . . . . . . 14.4 m -57.27 -42.09 80.94 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 115.962 -0.563 . . . . 0.0 110.969 177.352 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 84' ' ' GLN . . . . . 0.488 ' HB2' ' HB ' ' A' ' 80' ' ' VAL . 75.9 mm-40 -64.88 -56.61 12.36 Favored 'General case' 0 CA--C 1.518 -0.269 0 CA-C-N 116.718 -0.219 . . . . 0.0 110.44 -179.951 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 85' ' ' LEU . . . . . . . . . . . . . 53.7 tp -57.82 -39.13 76.9 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.131 -0.486 . . . . 0.0 110.866 -177.657 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 86' ' ' ASN . . . . . . . . . . . . . 24.4 t-20 -61.14 -47.65 85.26 Favored 'General case' 0 C--N 1.327 -0.37 0 CA-C-N 115.864 -0.607 . . . . 0.0 110.074 177.215 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 87' ' ' SER . . . . . . . . . . . . . 49.7 m -64.78 -42.01 95.41 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-N 116.384 -0.371 . . . . 0.0 111.101 179.051 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 88' ' ' TYR . . . . . . . . . . . . . 29.4 m-85 -57.53 -48.68 78.62 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-O 120.976 0.417 . . . . 0.0 110.835 178.683 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 89' ' ' LYS . . . . . . . . . . . . . 22.0 ttmm -72.36 -32.35 66.39 Favored 'General case' 0 C--N 1.326 -0.415 0 CA-C-N 116.131 -0.486 . . . . 0.0 110.82 179.599 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 90' ' ' ASN . . . . . . . . . . . . . 62.0 t30 -66.46 -46.4 76.51 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-O 121.124 0.488 . . . . 0.0 110.447 178.739 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 91' ' ' TYR . . . . . . . . . . . . . 5.1 m-85 -62.42 -37.99 87.96 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.043 -0.526 . . . . 0.0 110.442 177.813 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 92' ' ' CYS . . . . . 0.539 ' HA ' ' HB2' ' A' ' 96' ' ' LEU . 53.2 t -67.59 -36.73 81.45 Favored 'General case' 0 C--N 1.327 -0.412 0 CA-C-N 115.929 -0.578 . . . . 0.0 110.723 177.966 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 93' ' ' ARG . . . . . 0.502 ' O ' ' HB3' ' A' ' 97' ' ' SER . 39.3 ttt180 -71.51 -44.97 63.69 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-O 121.029 0.442 . . . . 0.0 110.815 179.758 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 94' ' ' ASN . . . . . . . . . . . . . 95.1 m-20 -81.19 -61.2 2.02 Favored 'General case' 0 C--N 1.325 -0.499 0 N-CA-C 112.219 0.452 . . . . 0.0 112.219 -175.414 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 95' ' ' HIS . . . . . . . . . . . . . 95.0 m-70 -85.52 -40.34 16.44 Favored 'General case' 0 C--N 1.327 -0.385 0 CA-C-O 120.704 0.288 . . . . 0.0 111.697 -170.272 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 96' ' ' LEU . . . . . 0.539 ' HB2' ' HA ' ' A' ' 92' ' ' CYS . 74.9 mt -91.87 16.99 9.78 Favored 'General case' 0 C--N 1.325 -0.48 0 CA-C-N 116.622 -0.263 . . . . 0.0 111.279 -174.074 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 97' ' ' SER . . . . . 0.576 ' OG ' ' HD3' ' A' ' 98' ' ' PRO . 3.5 p -61.16 -45.7 95.79 Favored Pre-proline 0 CA--C 1.544 0.741 0 N-CA-C 113.123 0.786 . . . . 0.0 113.123 -177.661 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 98' ' ' PRO . . . . . 0.576 ' HD3' ' OG ' ' A' ' 97' ' ' SER . 21.9 Cg_exo -63.6 -33.66 66.56 Favored 'Trans proline' 0 C--N 1.361 1.211 0 C-N-CA 121.657 1.572 . . . . 0.0 111.622 179.133 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 99' ' ' LEU . . . . . 0.437 ' O ' ' HB3' ' A' ' 64' ' ' PHE . 40.4 mt -74.27 -40.22 62.47 Favored 'General case' 0 C--N 1.323 -0.572 0 CA-C-N 115.523 -0.762 . . . . 0.0 109.759 179.849 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 100' ' ' TYR . . . . . . . . . . . . . 36.0 t80 -51.71 -40.89 60.97 Favored 'General case' 0 C--N 1.33 -0.248 0 CA-C-N 115.235 -0.893 . . . . 0.0 111.394 -178.3 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 101' ' ' MET . . . . . . . . . . . . . 24.8 mmt -91.34 11.56 23.3 Favored 'General case' 0 C--N 1.326 -0.425 0 CA-C-N 116.325 -0.398 . . . . 0.0 112.047 -177.13 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 102' ' ' LYS . . . . . . . . . . . . . 66.0 mttt -105.8 150.33 25.65 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-O 120.862 0.363 . . . . 0.0 110.916 176.807 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 103' ' ' SER . . . . . 0.555 ' HA ' ' HA ' ' A' ' 63' ' ' SER . 24.1 t -72.93 150.33 42.64 Favored 'General case' 0 C--N 1.324 -0.526 0 N-CA-C 109.224 -0.658 . . . . 0.0 109.224 171.816 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 104' ' ' LEU . . . . . . . . . . . . . 26.2 tp -56.69 -29.48 62.42 Favored 'General case' 0 C--N 1.324 -0.543 0 CA-C-O 120.933 0.397 . . . . 0.0 112.045 -175.399 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 105' ' ' SER . . . . . . . . . . . . . 40.3 t -83.65 -22.34 32.18 Favored 'General case' 0 C--N 1.326 -0.415 0 N-CA-C 112.211 0.448 . . . . 0.0 112.211 -175.545 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 106' ' ' GLU . . . . . . . . . . . . . 12.1 pt-20 -97.94 6.08 48.13 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-O 120.817 0.341 . . . . 0.0 111.22 -174.298 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 107' ' ' ILE . . . . . 0.59 HG22 ' HZ ' ' A' ' 137' ' ' PHE . 63.4 mt -83.5 121.5 36.34 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.575 0 CA-C-N 116.296 -0.411 . . . . 0.0 110.1 178.93 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 108' ' ' LEU . . . . . . . . . . . . . 84.8 mt -103.44 151.16 38.6 Favored Pre-proline 0 C--N 1.32 -0.698 0 CA-C-N 116.062 -0.517 . . . . 0.0 110.073 179.991 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 109' ' ' PRO . . . . . . . . . . . . . 31.3 Cg_exo -59.88 -27.9 85.97 Favored 'Trans proline' 0 C--N 1.343 0.266 0 C-N-CA 122.27 1.98 . . . . 0.0 111.042 174.47 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 110' ' ' ALA . . . . . . . . . . . . . . . -61.66 -41.14 97.12 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 115.244 -0.889 . . . . 0.0 111.003 178.576 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 111' ' ' ASP . . . . . . . . . . . . . 33.3 m-20 -52.9 -58.41 7.03 Favored 'General case' 0 C--O 1.236 0.351 0 CA-C-O 121.423 0.63 . . . . 0.0 110.547 178.842 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 112' ' ' ILE . . . . . 0.413 HG12 HD13 ' A' ' 99' ' ' LEU . 21.4 mt -66.23 -40.59 87.32 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.557 0 CA-C-N 114.871 -1.059 . . . . 0.0 111.141 -174.651 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 113' ' ' GLN . . . . . . . . . . . . . 17.3 tm0? -65.01 -39.43 93.43 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.404 -0.362 . . . . 0.0 110.401 -178.29 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 114' ' ' SER . . . . . . . . . . . . . 50.0 m -60.57 -38.29 84.08 Favored 'General case' 0 C--O 1.233 0.226 0 CA-C-O 121.041 0.448 . . . . 0.0 110.485 178.039 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 115' ' ' ILE . . . . . . . . . . . . . 78.3 mt -60.12 -46.14 94.84 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.239 0 CA-C-N 115.938 -0.573 . . . . 0.0 110.432 176.592 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 116' ' ' ILE . . . . . . . . . . . . . 51.2 mm -60.33 -37.06 72.72 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.277 0 CA-C-N 115.992 -0.549 . . . . 0.0 111.043 -179.984 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 117' ' ' ASN . . . . . . . . . . . . . 93.6 m-20 -60.79 -44.49 96.75 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.492 -0.322 . . . . 0.0 111.169 179.124 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 118' ' ' GLU . . . . . . . . . . . . . 48.9 mt-10 -80.95 -18.25 47.68 Favored 'General case' 0 C--N 1.327 -0.377 0 CA-C-N 116.292 -0.413 . . . . 0.0 111.506 -176.982 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 119' ' ' THR . . . . . . . . . . . . . 29.2 m -90.86 111.8 23.37 Favored 'General case' 0 C--N 1.324 -0.539 0 CA-C-O 121.054 0.454 . . . . 0.0 110.48 -178.807 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 120' ' ' LYS . . . . . 0.451 ' C ' HD12 ' A' ' 121' ' ' LEU . 48.7 mtpt -106.82 86.9 2.4 Favored 'General case' 0 C--N 1.327 -0.4 0 CA-C-O 120.991 0.424 . . . . 0.0 110.828 -178.491 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 121' ' ' LEU . . . . . 0.451 HD12 ' C ' ' A' ' 120' ' ' LYS . 7.8 mp -132.75 -174.87 3.59 Favored 'General case' 0 C--N 1.323 -0.554 0 CA-C-N 115.547 -0.751 . . . . 0.0 109.622 177.62 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 122' ' ' ALA . . . . . . . . . . . . . . . -65.37 152.69 43.25 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-O 120.629 0.252 . . . . 0.0 111.247 178.927 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 123' ' ' LYS . . . . . 0.827 ' HB2' ' HZ2' ' A' ' 123' ' ' LYS . 9.5 mtmp? -55.85 -43.17 76.79 Favored 'General case' 0 C--N 1.331 -0.235 0 CA-C-N 115.998 -0.546 . . . . 0.0 110.735 -178.428 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 124' ' ' ASN . . . . . . . . . . . . . 3.2 m-20 -61.19 -37.81 84.28 Favored 'General case' 0 C--N 1.327 -0.408 0 CA-C-N 115.362 -0.836 . . . . 0.0 110.774 -178.124 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 125' ' ' THR . . . . . 0.436 ' O ' HG13 ' A' ' 129' ' ' ILE . 10.8 m -69.96 -41.58 74.32 Favored 'General case' 0 C--N 1.325 -0.457 0 CA-C-N 116.201 -0.454 . . . . 0.0 110.532 178.64 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 126' ' ' LEU . . . . . . . . . . . . . 92.5 mt -61.96 -43.68 98.34 Favored 'General case' 0 C--O 1.235 0.292 0 CA-C-N 116.08 -0.509 . . . . 0.0 110.741 179.184 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 127' ' ' LYS . . . . . . . . . . . . . 52.3 mtpt -68.93 -30.99 69.56 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.27 -0.423 . . . . 0.0 110.756 179.133 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 128' ' ' ALA . . . . . . . . . . . . . . . -64.11 -45.74 87.29 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.321 -0.4 . . . . 0.0 110.57 176.94 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 129' ' ' ILE . . . . . 0.436 HG13 ' O ' ' A' ' 125' ' ' THR . 70.1 mt -59.25 -50.25 80.48 Favored 'Isoleucine or valine' 0 C--O 1.235 0.319 0 CA-C-N 116.103 -0.499 . . . . 0.0 110.414 177.865 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 130' ' ' ARG . . . . . . . . . . . . . 45.7 ttt-85 -61.88 -40.97 97.23 Favored 'General case' 0 C--N 1.327 -0.384 0 CA-C-N 115.758 -0.656 . . . . 0.0 111.039 179.427 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 131' ' ' ASN . . . . . . . . . . . . . 63.8 t30 -62.8 -44.81 95.18 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-O 120.648 0.261 . . . . 0.0 110.45 -179.314 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 132' ' ' THR . . . . . 0.483 ' O ' HG13 ' A' ' 136' ' ' ILE . 39.2 m -55.1 -52.7 62.43 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 115.774 -0.648 . . . . 0.0 110.482 178.695 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 133' ' ' ALA . . . . . . . . . . . . . . . -65.45 -38.98 91.47 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.219 -0.446 . . . . 0.0 110.803 179.098 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 134' ' ' SER . . . . . . . . . . . . . 26.9 t -60.28 -43.23 96.4 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 115.964 -0.562 . . . . 0.0 110.84 -179.45 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 135' ' ' GLN . . . . . 0.416 HE21 ' HB3' ' A' ' 135' ' ' GLN . 9.1 mt-30 -67.55 -30.66 70.35 Favored 'General case' 0 C--N 1.33 -0.28 0 C-N-CA 121.133 -0.227 . . . . 0.0 110.791 179.178 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 136' ' ' ILE . . . . . 0.483 HG13 ' O ' ' A' ' 132' ' ' THR . 86.8 mt -65.13 -45.21 94.8 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.333 0 CA-C-N 116.346 -0.388 . . . . 0.0 110.203 175.959 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 137' ' ' PHE . . . . . 0.59 ' HZ ' HG22 ' A' ' 107' ' ' ILE . 60.0 m-85 -65.35 -44.98 85.98 Favored 'General case' 0 C--N 1.331 -0.208 0 CA-C-N 116.292 -0.413 . . . . 0.0 110.353 175.603 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 138' ' ' ARG . . . . . 0.457 ' O ' ' HG3' ' A' ' 142' ' ' GLU . 29.0 mtp180 -55.39 -41.19 72.31 Favored 'General case' 0 C--O 1.223 -0.31 0 CA-C-N 116.029 -0.532 . . . . 0.0 111.092 177.053 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 139' ' ' LEU . . . . . . . . . . . . . 29.4 tp -59.36 -43.09 92.87 Favored 'General case' 0 C--N 1.321 -0.645 0 CA-C-N 115.999 -0.546 . . . . 0.0 110.525 179.829 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 140' ' ' ALA . . . . . . . . . . . . . . . -68.0 -31.47 71.19 Favored 'General case' 0 C--N 1.331 -0.217 0 CA-C-N 116.348 -0.387 . . . . 0.0 110.255 176.443 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 141' ' ' ILE . . . . . 0.646 ' HA ' ' O ' ' A' ' 146' ' ' ILE . 79.7 mt -66.54 -45.93 87.59 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.236 0 CA-C-N 116.275 -0.42 . . . . 0.0 110.465 175.585 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 142' ' ' GLU . . . . . 0.457 ' HG3' ' O ' ' A' ' 138' ' ' ARG . 43.3 mt-10 -67.73 -21.65 65.28 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-O 121.021 0.439 . . . . 0.0 110.774 -179.843 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 143' ' ' ASN . . . . . 0.428 ' N ' HD21 ' A' ' 143' ' ' ASN . 0.9 OUTLIER -94.83 1.42 55.37 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.138 -0.483 . . . . 0.0 110.643 175.991 . . . . . . . . 3 3 . 1 . 014 nuclear orig full ' A' A ' 144' ' ' ARG . . . . . 0.411 HH11 ' HD2' ' A' ' 144' ' ' ARG . 29.3 mtp85 59.58 36.91 22.82 Favored 'General case' 0 N--CA 1.465 0.304 0 CA-C-N 115.721 -0.672 . . . . 0.0 112.444 178.37 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 145' ' ' ALA . . . . . . . . . . . . . . . -90.4 -24.68 20.71 Favored 'General case' 0 C--N 1.323 -0.556 0 CA-C-O 121.547 0.689 . . . . 0.0 109.455 173.413 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 146' ' ' ILE . . . . . 0.646 ' O ' ' HA ' ' A' ' 141' ' ' ILE . 11.4 tt -156.84 157.96 3.48 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.569 0 N-CA-C 108.007 -1.108 . . . . 0.0 108.007 177.567 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 147' ' ' ASP . . . . . . . . . . . . . 7.3 p-10 -123.83 21.81 9.04 Favored 'General case' 0 C--N 1.322 -0.604 0 CA-C-O 121.1 0.476 . . . . 0.0 110.862 179.628 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 148' ' ' PHE . . . . . 0.425 ' H ' HG12 ' A' ' 146' ' ' ILE . 73.7 m-85 -121.6 151.06 40.81 Favored 'General case' 0 C--N 1.326 -0.433 0 CA-C-N 115.877 -0.601 . . . . 0.0 109.986 178.537 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 149' ' ' ASN . . . . . . . . . . . . . 53.7 t-20 -124.6 87.77 54.17 Favored Pre-proline 0 C--N 1.321 -0.658 0 N-CA-C 109.682 -0.488 . . . . 0.0 109.682 173.552 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 150' ' ' PRO . . . . . . . . . . . . . 77.6 Cg_exo -52.18 -34.64 59.72 Favored 'Trans proline' 0 C--N 1.344 0.329 0 C-N-CA 122.958 2.439 . . . . 0.0 112.925 177.408 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 151' ' ' ALA . . . . . . . . . . . . . . . -71.39 -26.06 62.62 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.321 -0.399 . . . . 0.0 110.982 -177.31 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 152' ' ' ASP . . . . . . . . . . . . . 39.0 t70 -74.98 -18.25 60.4 Favored 'General case' 0 C--N 1.325 -0.476 0 CA-C-O 120.815 0.341 . . . . 0.0 110.601 -179.59 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 153' ' ' TYR . . . . . . . . . . . . . 96.3 m-85 -83.81 -11.48 56.99 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.284 -0.416 . . . . 0.0 110.863 179.057 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 154' ' ' VAL . . . . . . . . . . . . . 57.4 t -64.63 123.83 18.25 Favored 'Isoleucine or valine' 0 C--O 1.235 0.336 0 CA-C-O 120.876 0.37 . . . . 0.0 111.364 -177.507 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 155' ' ' ARG . . . . . . . . . . . . . 88.7 mtt180 -73.04 117.72 15.11 Favored 'General case' 0 C--N 1.325 -0.488 0 CA-C-N 115.828 -0.624 . . . . 0.0 110.404 174.603 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 156' ' ' ILE . . . . . . . . . . . . . 37.2 mm -92.47 119.6 67.95 Favored Pre-proline 0 C--N 1.318 -0.778 0 N-CA-C 109.317 -0.623 . . . . 0.0 109.317 173.453 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 157' ' ' PRO . . . . . . . . . . . . . 42.1 Cg_endo -68.21 129.61 19.67 Favored 'Trans proline' 0 N--CA 1.457 -0.637 0 C-N-CA 122.107 1.871 . . . . 0.0 112.237 -178.851 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 158' ' ' LYS . . . . . . . . . . . . . 62.9 mttp -82.08 75.9 8.99 Favored 'General case' 0 C--N 1.321 -0.642 0 N-CA-C 108.573 -0.899 . . . . 0.0 108.573 173.45 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 159' ' ' ILE . . . . . . . . . . . . . 51.1 mm -52.78 102.3 0.04 OUTLIER 'Isoleucine or valine' 0 C--N 1.33 -0.263 0 CA-C-N 114.887 -1.052 . . . . 0.0 111.441 -178.892 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 160' ' ' ALA . . . . . . . . . . . . . . . -117.51 14.69 14.61 Favored 'General case' 0 C--N 1.32 -0.708 0 CA-C-N 115.327 -0.851 . . . . 0.0 109.849 177.509 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 161' ' ' LEU . . . . . . . . . . . . . 86.6 mt -71.24 96.4 1.4 Allowed 'General case' 0 C--N 1.322 -0.629 0 CA-C-N 114.59 -1.186 . . . . 0.0 109.585 177.646 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 162' ' ' GLU . . . . . . . . . . . . . 6.1 tp10 54.72 80.01 0.13 Allowed 'General case' 0 CA--C 1.533 0.313 0 CA-C-N 115.501 -0.772 . . . . 0.0 110.379 -172.241 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 163' ' ' HIS . . . . . . . . . . . . . 37.5 t-80 -131.89 128.45 38.62 Favored 'General case' 0 C--N 1.323 -0.569 0 N-CA-C 108.895 -0.78 . . . . 0.0 108.895 175.558 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 164' ' ' HIS . . . . . . . . . . . . . 34.4 m170 -96.03 -176.35 3.67 Favored 'General case' 0 C--N 1.319 -0.729 0 CA-C-N 116.254 -0.43 . . . . 0.0 111.35 -173.441 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 165' ' ' HIS . . . . . . . . . . . . . 59.4 m170 -64.66 139.48 58.77 Favored 'General case' 0 C--N 1.326 -0.416 0 CA-C-N 115.787 -0.642 . . . . 0.0 110.846 -177.572 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 166' ' ' HIS . . . . . . . . . . . . . 40.6 t-80 -71.24 -53.08 15.6 Favored 'General case' 0 C--N 1.322 -0.613 0 CA-C-N 115.714 -0.676 . . . . 0.0 110.307 178.998 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 167' ' ' HIS . . . . . . . . . . . . . 49.6 t-80 -157.19 145.66 19.55 Favored 'General case' 0 C--N 1.327 -0.38 0 CA-C-N 116.62 -0.264 . . . . 0.0 110.831 179.476 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 168' ' ' HIS . . . . . . . . . . . . . 45.3 t-80 . . . . . 0 C--O 1.25 1.1 0 CA-C-O 118.603 -0.713 . . . . 0.0 109.511 172.787 . . . . . . . . 0 0 . 1 . 015 nuclear orig full ' A' A ' 61' ' ' ARG . . . . . . . . . . . . . 18.2 mtm-85 . . . . . 0 N--CA 1.481 1.104 0 CA-C-O 120.489 0.185 . . . . 0.0 110.602 . . . . . . . . . 0 0 . 1 . 015 nuclear orig full ' A' A ' 62' ' ' ASP . . . . . . . . . . . . . 26.9 m-20 -94.03 157.84 15.9 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-O 120.626 0.25 . . . . 0.0 110.507 -175.905 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 63' ' ' SER . . . . . . . . . . . . . 36.1 t -84.9 144.37 28.42 Favored 'General case' 0 C--N 1.322 -0.591 0 CA-C-O 120.971 0.415 . . . . 0.0 110.522 178.264 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 64' ' ' PHE . . . . . . . . . . . . . 81.2 t80 -63.74 -30.12 71.26 Favored 'General case' 0 C--N 1.327 -0.411 0 CA-C-N 115.857 -0.61 . . . . 0.0 109.723 177.254 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 65' ' ' GLY . . . . . . . . . . . . . . . -62.93 -36.15 93.03 Favored Glycine 0 N--CA 1.448 -0.559 0 C-N-CA 120.862 -0.685 . . . . 0.0 112.157 178.205 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 66' ' ' ASP . . . . . . . . . . . . . 22.7 t70 -69.6 -43.19 73.27 Favored 'General case' 0 C--N 1.327 -0.398 0 CA-C-O 120.931 0.396 . . . . 0.0 110.371 179.515 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 67' ' ' TRP . . . . . . . . . . . . . 83.8 m95 -72.33 -28.02 62.8 Favored 'General case' 0 C--N 1.325 -0.488 0 CA-C-N 116.153 -0.476 . . . . 0.0 111.392 179.477 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 68' ' ' ALA . . . . . 0.476 ' O ' ' HG ' ' A' ' 72' ' ' LEU . . . -65.82 -44.87 84.28 Favored 'General case' 0 C--N 1.329 -0.302 0 N-CA-C 109.57 -0.53 . . . . 0.0 109.57 173.312 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 69' ' ' GLU . . . . . . . . . . . . . 10.3 tp10 -59.46 -46.39 88.92 Favored 'General case' 0 C--O 1.234 0.244 0 CA-C-N 115.605 -0.725 . . . . 0.0 109.998 175.17 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 70' ' ' LYS . . . . . . . . . . . . . 54.7 mttp -63.35 -34.54 77.94 Favored 'General case' 0 C--N 1.331 -0.228 0 CA-C-N 115.793 -0.639 . . . . 0.0 111.645 178.663 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 71' ' ' PHE . . . . . . . . . . . . . 62.7 t80 -67.17 -43.72 81.53 Favored 'General case' 0 C--N 1.326 -0.421 0 CA-C-O 120.887 0.375 . . . . 0.0 110.578 178.809 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 72' ' ' LEU . . . . . 0.476 ' HG ' ' O ' ' A' ' 68' ' ' ALA . 85.7 mt -62.21 -44.21 97.1 Favored 'General case' 0 C--N 1.324 -0.543 0 CA-C-N 116.111 -0.495 . . . . 0.0 110.397 178.355 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 73' ' ' LYS . . . . . . . . . . . . . 35.6 mttp -72.55 -36.37 68.24 Favored 'General case' 0 C--N 1.327 -0.377 0 CA-C-N 116.001 -0.545 . . . . 0.0 112.233 -178.695 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 74' ' ' SER . . . . . . . . . . . . . 35.1 p -66.27 -34.37 77.84 Favored 'General case' 0 C--N 1.328 -0.336 0 C-N-CA 120.725 -0.39 . . . . 0.0 110.31 178.022 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 75' ' ' LYS . . . . . . . . . . . . . 25.8 mmtp -75.07 -32.88 61.6 Favored 'General case' 0 C--N 1.332 -0.187 0 CA-C-O 120.894 0.378 . . . . 0.0 110.903 174.958 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 76' ' ' GLU . . . . . . . . . . . . . 43.1 tt0 -63.46 -38.94 93.06 Favored 'General case' 0 C--N 1.323 -0.56 0 CA-C-O 121.219 0.533 . . . . 0.0 110.098 175.198 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 77' ' ' ALA . . . . . . . . . . . . . . . -76.4 -28.99 56.92 Favored 'General case' 0 C--N 1.325 -0.487 0 CA-C-N 115.841 -0.618 . . . . 0.0 110.741 174.578 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 78' ' ' ASP . . . . . . . . . . . . . 16.4 t70 -65.37 -46.3 80.7 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 115.898 -0.592 . . . . 0.0 110.357 178.056 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 79' ' ' GLY . . . . . . . . . . . . . . . 121.77 58.28 0.22 Allowed Glycine 0 N--CA 1.445 -0.714 0 C-N-CA 120.858 -0.687 . . . . 0.0 112.378 177.827 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 80' ' ' VAL . . . . . . . . . . . . . 29.8 m -100.65 141.36 17.59 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.5 0 CA-C-O 120.714 0.292 . . . . 0.0 110.533 177.492 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 81' ' ' SER . . . . . . . . . . . . . 32.0 m -57.56 156.17 8.6 Favored 'General case' 0 C--N 1.326 -0.438 0 CA-C-N 115.815 -0.629 . . . . 0.0 110.932 178.645 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 82' ' ' VAL . . . . . . . . . . . . . 7.1 p -58.2 -44.59 88.13 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.281 0 CA-C-N 116.651 -0.249 . . . . 0.0 111.504 -175.506 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 83' ' ' SER . . . . . . . . . . . . . 22.3 m -66.01 -33.13 75.11 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-O 120.771 0.32 . . . . 0.0 110.258 179.041 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 84' ' ' GLN . . . . . . . . . . . . . 52.6 tp60 -68.47 -39.17 81.5 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 115.798 -0.637 . . . . 0.0 110.26 -179.177 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 85' ' ' LEU . . . . . . . . . . . . . 49.1 tp -68.24 -33.49 74.48 Favored 'General case' 0 C--N 1.325 -0.483 0 CA-C-N 116.12 -0.491 . . . . 0.0 110.2 177.166 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 86' ' ' ASN . . . . . . . . . . . . . 90.5 m-20 -76.76 -30.64 56.61 Favored 'General case' 0 C--N 1.327 -0.4 0 CA-C-N 116.111 -0.495 . . . . 0.0 111.144 -179.791 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 87' ' ' SER . . . . . . . . . . . . . 2.9 p -69.75 -38.89 76.96 Favored 'General case' 0 N--CA 1.453 -0.28 0 C-N-CA 120.535 -0.466 . . . . 0.0 109.959 175.25 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 88' ' ' TYR . . . . . . . . . . . . . 16.3 m-85 -60.5 -43.06 97.43 Favored 'General case' 0 C--O 1.232 0.183 0 N-CA-C 109.491 -0.559 . . . . 0.0 109.491 171.32 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 89' ' ' LYS . . . . . 0.412 ' HD3' HD13 ' A' ' 72' ' ' LEU . 1.5 tppp? -54.81 -43.87 73.3 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 115.01 -0.996 . . . . 0.0 110.004 177.392 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 90' ' ' ASN . . . . . . . . . . . . . 48.1 t30 -63.94 -57.18 10.53 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 115.07 -0.968 . . . . 0.0 111.307 -178.571 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 91' ' ' TYR . . . . . . . . . . . . . 31.3 m-85 -54.48 -45.42 73.19 Favored 'General case' 0 C--O 1.235 0.33 0 CA-C-O 120.614 0.245 . . . . 0.0 111.551 -176.411 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 92' ' ' CYS . . . . . 0.402 ' HA ' HD11 ' A' ' 96' ' ' LEU . 62.1 m -68.13 -42.35 80.32 Favored 'General case' 0 C--N 1.326 -0.416 0 N-CA-C 112.518 0.562 . . . . 0.0 112.518 -175.235 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 93' ' ' ARG . . . . . 0.436 ' O ' ' HB3' ' A' ' 97' ' ' SER . 52.0 ttt180 -94.89 -24.85 16.83 Favored 'General case' 0 C--N 1.326 -0.419 0 C-N-CA 120.158 -0.617 . . . . 0.0 112.133 -172.698 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 94' ' ' ASN . . . . . . . . . . . . . 49.8 t-20 -85.79 -61.64 1.71 Allowed 'General case' 0 C--N 1.324 -0.521 0 C-N-CA 120.816 -0.354 . . . . 0.0 110.709 -178.159 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 95' ' ' HIS . . . . . . . . . . . . . 14.3 m80 -86.94 -40.73 14.54 Favored 'General case' 0 C--N 1.326 -0.415 0 N-CA-C 112.387 0.514 . . . . 0.0 112.387 -176.558 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 96' ' ' LEU . . . . . 0.516 HD21 HD12 ' A' ' 99' ' ' LEU . 89.7 mt -88.31 20.91 3.05 Favored 'General case' 0 C--N 1.327 -0.393 0 CA-C-O 120.828 0.346 . . . . 0.0 111.141 -177.037 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 97' ' ' SER . . . . . 0.518 ' N ' ' HD2' ' A' ' 98' ' ' PRO . 1.6 p -58.51 -45.55 99.66 Favored Pre-proline 0 CA--C 1.543 0.681 0 N-CA-C 112.925 0.713 . . . . 0.0 112.925 -177.901 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 98' ' ' PRO . . . . . 0.518 ' HD2' ' N ' ' A' ' 97' ' ' SER . 18.1 Cg_endo -61.28 -34.44 87.9 Favored 'Trans proline' 0 C--N 1.361 1.186 0 C-N-CA 121.623 1.549 . . . . 0.0 112.215 178.091 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 99' ' ' LEU . . . . . 0.516 HD12 HD21 ' A' ' 96' ' ' LEU . 80.6 mt -74.1 -33.37 63.6 Favored 'General case' 0 C--N 1.326 -0.42 0 CA-C-O 120.968 0.413 . . . . 0.0 110.451 -179.288 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 100' ' ' TYR . . . . . . . . . . . . . 38.2 t80 -60.14 -26.29 66.16 Favored 'General case' 0 CA--C 1.532 0.272 0 CA-C-N 115.688 -0.687 . . . . 0.0 110.301 178.551 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 101' ' ' MET . . . . . . . . . . . . . 55.0 mtt -96.54 6.92 47.74 Favored 'General case' 0 C--O 1.236 0.361 0 CA-C-N 115.666 -0.697 . . . . 0.0 111.005 -178.439 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 102' ' ' LYS . . . . . 0.498 ' HE3' HG12 ' A' ' 107' ' ' ILE . 27.3 mtpp -109.15 166.7 10.65 Favored 'General case' 0 C--N 1.324 -0.518 0 CA-C-N 116.172 -0.467 . . . . 0.0 110.984 -179.068 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 103' ' ' SER . . . . . 0.53 ' HB3' ' HG2' ' A' ' 106' ' ' GLU . 20.0 t -94.13 149.12 21.53 Favored 'General case' 0 N--CA 1.449 -0.495 0 N-CA-C 108.743 -0.836 . . . . 0.0 108.743 176.796 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 104' ' ' LEU . . . . . 0.519 HD23 ' HB3' ' A' ' 140' ' ' ALA . 35.9 tp -52.54 -52.3 55.44 Favored 'General case' 0 C--N 1.322 -0.615 0 N-CA-C 112.78 0.659 . . . . 0.0 112.78 -170.147 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 105' ' ' SER . . . . . . . . . . . . . 38.4 m -82.91 -7.36 59.67 Favored 'General case' 0 C--N 1.322 -0.61 0 N-CA-C 112.905 0.706 . . . . 0.0 112.905 -172.828 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 106' ' ' GLU . . . . . 0.53 ' HG2' ' HB3' ' A' ' 103' ' ' SER . 1.1 pp20? -106.48 15.42 25.95 Favored 'General case' 0 C--O 1.233 0.196 0 CA-C-O 121.233 0.54 . . . . 0.0 111.19 -178.899 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 107' ' ' ILE . . . . . 0.498 HG12 ' HE3' ' A' ' 102' ' ' LYS . 80.0 mt -88.14 134.57 27.69 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.56 0 CA-C-N 115.866 -0.606 . . . . 0.0 109.664 173.061 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 108' ' ' LEU . . . . . . . . . . . . . 97.9 mt -105.21 150.21 38.58 Favored Pre-proline 0 C--N 1.327 -0.413 0 CA-C-N 116.465 -0.334 . . . . 0.0 110.479 178.505 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 109' ' ' PRO . . . . . . . . . . . . . 36.5 Cg_exo -60.88 -26.27 82.8 Favored 'Trans proline' 0 C--N 1.343 0.275 0 C-N-CA 122.491 2.127 . . . . 0.0 111.257 175.136 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 110' ' ' ALA . . . . . . . . . . . . . . . -64.77 -38.94 92.69 Favored 'General case' 0 C--N 1.331 -0.227 0 CA-C-N 115.495 -0.775 . . . . 0.0 110.958 178.786 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 111' ' ' ASP . . . . . . . . . . . . . 41.5 m-20 -61.88 -49.66 75.35 Favored 'General case' 0 CA--C 1.52 -0.209 0 CA-C-O 121.074 0.464 . . . . 0.0 109.935 177.759 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 112' ' ' ILE . . . . . 0.427 ' O ' HG12 ' A' ' 116' ' ' ILE . 39.2 mt -62.31 -43.46 98.08 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.249 0 CA-C-N 115.556 -0.747 . . . . 0.0 110.871 -179.193 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 113' ' ' GLN . . . . . . . . . . . . . 7.8 tp-100 -61.34 -38.61 87.56 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.364 -0.38 . . . . 0.0 110.642 178.908 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 114' ' ' SER . . . . . . . . . . . . . 48.2 m -62.72 -41.32 99.1 Favored 'General case' 0 C--N 1.326 -0.42 0 CA-C-N 116.137 -0.483 . . . . 0.0 110.253 177.14 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 115' ' ' ILE . . . . . . . . . . . . . 74.4 mt -62.53 -44.2 99.1 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.214 0 CA-C-N 116.338 -0.392 . . . . 0.0 110.454 176.982 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 116' ' ' ILE . . . . . 0.427 HG12 ' O ' ' A' ' 112' ' ' ILE . 45.4 mm -58.96 -46.88 91.24 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.337 0 CA-C-N 116.034 -0.53 . . . . 0.0 110.915 178.717 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 117' ' ' ASN . . . . . . . . . . . . . 28.7 t-20 -75.07 -23.16 58.0 Favored 'General case' 0 C--N 1.326 -0.442 0 CA-C-N 116.388 -0.369 . . . . 0.0 111.227 -178.189 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 118' ' ' GLU . . . . . . . . . . . . . 7.6 mm-40 -79.7 -20.71 45.9 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-O 120.755 0.312 . . . . 0.0 110.42 175.075 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 119' ' ' THR . . . . . . . . . . . . . 80.9 m -73.48 112.9 10.0 Favored 'General case' 0 N--CA 1.449 -0.488 0 N-CA-C 109.661 -0.496 . . . . 0.0 109.661 175.456 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 120' ' ' LYS . . . . . . . . . . . . . 6.5 ptmt -93.55 26.55 2.98 Favored 'General case' 0 C--N 1.321 -0.639 0 CA-C-N 115.863 -0.608 . . . . 0.0 111.364 -174.846 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 121' ' ' LEU . . . . . . . . . . . . . 3.8 mm? -95.95 -175.82 3.52 Favored 'General case' 0 C--N 1.327 -0.398 0 CA-C-N 115.763 -0.653 . . . . 0.0 110.374 178.879 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 122' ' ' ALA . . . . . . . . . . . . . . . -87.58 174.03 8.71 Favored 'General case' 0 C--N 1.327 -0.391 0 N-CA-C 112.38 0.511 . . . . 0.0 112.38 -173.521 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 123' ' ' LYS . . . . . . . . . . . . . 14.4 tttm -48.24 -48.22 35.38 Favored 'General case' 0 N--CA 1.467 0.382 0 CA-C-N 115.198 -0.91 . . . . 0.0 113.037 -178.122 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 124' ' ' ASN . . . . . . . . . . . . . 7.1 m-20 -63.52 -40.78 97.94 Favored 'General case' 0 C--N 1.326 -0.418 0 CA-C-O 120.533 0.206 . . . . 0.0 111.354 -176.204 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 125' ' ' THR . . . . . . . . . . . . . 13.3 m -66.77 -39.59 87.92 Favored 'General case' 0 C--N 1.325 -0.46 0 CA-C-O 120.739 0.304 . . . . 0.0 110.739 179.071 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 126' ' ' LEU . . . . . . . . . . . . . 94.1 mt -59.93 -45.81 91.39 Favored 'General case' 0 N--CA 1.462 0.165 0 CA-C-O 121.197 0.522 . . . . 0.0 110.644 179.239 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 127' ' ' LYS . . . . . . . . . . . . . 58.0 mttm -71.08 -29.68 65.61 Favored 'General case' 0 C--N 1.326 -0.453 0 CA-C-N 115.712 -0.677 . . . . 0.0 111.274 -178.926 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 128' ' ' ALA . . . . . . . . . . . . . . . -62.48 -47.06 85.64 Favored 'General case' 0 C--N 1.326 -0.444 0 CA-C-N 116.223 -0.444 . . . . 0.0 110.322 175.753 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 129' ' ' ILE . . . . . . . . . . . . . 57.9 mt -65.15 -41.07 90.82 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.332 0 CA-C-N 116.112 -0.494 . . . . 0.0 110.021 176.734 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 130' ' ' ARG . . . . . 0.713 HH12 ' HB2' ' A' ' 151' ' ' ALA . 3.8 tpm_? -57.08 -56.21 24.75 Favored 'General case' 0 C--N 1.33 -0.24 0 CA-C-N 115.57 -0.741 . . . . 0.0 111.102 178.796 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 131' ' ' ASN . . . . . 0.488 ' O ' ' HG2' ' A' ' 135' ' ' GLN . 58.1 t30 -59.22 -46.5 88.3 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.359 -0.382 . . . . 0.0 110.822 -178.174 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 132' ' ' THR . . . . . 0.419 ' O ' HG13 ' A' ' 136' ' ' ILE . 61.0 m -56.67 -53.58 56.0 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.314 -0.403 . . . . 0.0 111.224 -179.312 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 133' ' ' ALA . . . . . . . . . . . . . . . -62.48 -34.7 77.35 Favored 'General case' 0 C--N 1.331 -0.217 0 CA-C-O 121.093 0.473 . . . . 0.0 110.965 -179.808 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 134' ' ' SER . . . . . . . . . . . . . 14.0 t -63.27 -46.58 86.16 Favored 'General case' 0 C--N 1.327 -0.374 0 CA-C-N 115.891 -0.595 . . . . 0.0 110.198 179.534 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 135' ' ' GLN . . . . . 0.488 ' HG2' ' O ' ' A' ' 131' ' ' ASN . 82.6 mm-40 -60.2 -39.73 87.59 Favored 'General case' 0 C--N 1.332 -0.175 0 CA-C-N 116.19 -0.459 . . . . 0.0 111.246 -178.952 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 136' ' ' ILE . . . . . 0.419 HG13 ' O ' ' A' ' 132' ' ' THR . 62.8 mt -59.16 -49.73 82.32 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.253 0 CA-C-N 116.343 -0.39 . . . . 0.0 110.733 -179.881 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 137' ' ' PHE . . . . . 0.559 ' O ' HG13 ' A' ' 141' ' ' ILE . 52.8 m-85 -63.29 -41.69 98.99 Favored 'General case' 0 C--N 1.331 -0.217 0 CA-C-N 116.344 -0.389 . . . . 0.0 110.764 177.625 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 138' ' ' ARG . . . . . 0.442 ' O ' ' HG2' ' A' ' 142' ' ' GLU . 72.9 mtp180 -59.79 -42.98 94.58 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.067 -0.515 . . . . 0.0 111.137 179.571 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 139' ' ' LEU . . . . . . . . . . . . . 50.3 tp -60.21 -39.0 85.06 Favored 'General case' 0 C--N 1.325 -0.481 0 CA-C-N 116.091 -0.504 . . . . 0.0 110.685 178.069 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 140' ' ' ALA . . . . . 0.519 ' HB3' HD23 ' A' ' 104' ' ' LEU . . . -67.57 -39.73 84.88 Favored 'General case' 0 C--N 1.326 -0.434 0 CA-C-N 116.193 -0.458 . . . . 0.0 110.668 178.014 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 141' ' ' ILE . . . . . 0.559 HG13 ' O ' ' A' ' 137' ' ' PHE . 66.5 mt -62.96 -39.42 85.06 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.27 0 CA-C-N 116.064 -0.517 . . . . 0.0 110.662 177.007 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 142' ' ' GLU . . . . . 0.442 ' HG2' ' O ' ' A' ' 138' ' ' ARG . 35.8 mm-40 -54.5 -45.07 73.19 Favored 'General case' 0 N--CA 1.463 0.196 0 CA-C-O 121.161 0.505 . . . . 0.0 111.053 177.521 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 143' ' ' ASN . . . . . . . . . . . . . 41.0 m-80 -85.78 6.55 27.5 Favored 'General case' 0 C--N 1.327 -0.409 0 CA-C-N 115.683 -0.69 . . . . 0.0 110.676 -178.34 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 144' ' ' ARG . . . . . . . . . . . . . 41.1 mtp85 58.02 28.09 15.77 Favored 'General case' 0 N--CA 1.465 0.315 0 CA-C-N 115.706 -0.679 . . . . 0.0 112.106 179.54 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 145' ' ' ALA . . . . . . . . . . . . . . . -76.53 -23.01 53.63 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-O 121.739 0.78 . . . . 0.0 109.496 174.663 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 146' ' ' ILE . . . . . 0.539 ' O ' ' HA ' ' A' ' 141' ' ' ILE . 14.6 tt -149.77 144.01 17.77 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.713 0 CA-C-N 114.772 -1.103 . . . . 0.0 108.169 173.578 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 147' ' ' ASP . . . . . . . . . . . . . 30.4 t70 -116.55 27.3 9.28 Favored 'General case' 0 C--N 1.319 -0.755 0 CA-C-O 122.117 0.961 . . . . 0.0 109.158 -179.233 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 148' ' ' PHE . . . . . . . . . . . . . 69.8 t80 -137.39 136.97 38.35 Favored 'General case' 0 C--N 1.318 -0.786 0 CA-C-N 114.603 -1.18 . . . . 0.0 109.032 -175.755 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 149' ' ' ASN . . . . . . . . . . . . . 3.8 t-20 -120.19 90.06 44.11 Favored Pre-proline 0 C--N 1.322 -0.616 0 C-N-CA 120.89 -0.324 . . . . 0.0 110.74 -177.318 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 150' ' ' PRO . . . . . . . . . . . . . 21.7 Cg_exo -64.45 -22.85 65.32 Favored 'Trans proline' 0 C--N 1.345 0.35 0 C-N-CA 122.559 2.173 . . . . 0.0 111.108 178.542 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 151' ' ' ALA . . . . . 0.713 ' HB2' HH12 ' A' ' 130' ' ' ARG . . . -66.11 -27.45 68.06 Favored 'General case' 0 N--CA 1.45 -0.428 0 CA-C-N 115.062 -0.972 . . . . 0.0 111.514 -177.819 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 152' ' ' ASP . . . . . . . . . . . . . 14.6 t70 -71.69 -25.35 62.07 Favored 'General case' 0 C--N 1.327 -0.401 0 CA-C-O 121.07 0.462 . . . . 0.0 110.498 -177.354 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 153' ' ' TYR . . . . . . . . . . . . . 92.4 m-85 -87.41 0.15 55.93 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 115.893 -0.594 . . . . 0.0 110.977 -178.464 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 154' ' ' VAL . . . . . . . . . . . . . 55.9 t -88.34 107.24 17.38 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.416 0 N-CA-C 109.967 -0.383 . . . . 0.0 109.967 178.822 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 155' ' ' ARG . . . . . . . . . . . . . 10.4 tpt180 -89.49 130.44 35.83 Favored 'General case' 0 C--N 1.323 -0.554 0 CA-C-N 116.0 -0.545 . . . . 0.0 110.892 -177.374 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 156' ' ' ILE . . . . . 0.406 HD12 ' HB2' ' A' ' 130' ' ' ARG . 48.0 mm -96.81 115.61 65.76 Favored Pre-proline 0 C--N 1.323 -0.545 0 CA-C-N 116.116 -0.493 . . . . 0.0 110.052 175.021 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 157' ' ' PRO . . . . . . . . . . . . . 93.9 Cg_endo -83.86 142.7 10.2 Favored 'Trans proline' 0 N--CA 1.458 -0.57 0 C-N-CA 122.708 2.272 . . . . 0.0 112.318 176.933 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 158' ' ' LYS . . . . . 0.516 ' O ' ' HB ' ' A' ' 159' ' ' ILE . 41.2 mttp -86.84 20.96 2.39 Favored 'General case' 0 C--N 1.326 -0.445 0 CA-C-N 116.345 -0.389 . . . . 0.0 110.453 179.394 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 159' ' ' ILE . . . . . 0.516 ' HB ' ' O ' ' A' ' 158' ' ' LYS . 1.9 mp 76.24 -29.72 0.01 OUTLIER 'Isoleucine or valine' 0 CA--C 1.538 0.487 0 CA-C-N 115.924 -0.58 . . . . 0.0 110.819 -177.594 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 160' ' ' ALA . . . . . 0.452 ' H ' ' C ' ' A' ' 158' ' ' LYS . . . -72.9 166.94 22.02 Favored 'General case' 0 C--N 1.327 -0.4 0 CA-C-O 121.033 0.444 . . . . 0.0 111.17 178.511 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 161' ' ' LEU . . . . . . . . . . . . . 95.1 mt -83.73 53.82 2.68 Favored 'General case' 0 C--N 1.326 -0.44 0 CA-C-N 116.211 -0.45 . . . . 0.0 111.328 -178.058 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 162' ' ' GLU . . . . . . . . . . . . . 27.1 mt-10 -54.33 -43.11 70.94 Favored 'General case' 0 N--CA 1.464 0.261 0 CA-C-O 121.699 0.762 . . . . 0.0 110.16 177.642 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 163' ' ' HIS . . . . . . . . . . . . . 5.9 p80 -129.72 97.23 4.45 Favored 'General case' 0 C--N 1.32 -0.716 0 CA-C-N 114.771 -1.104 . . . . 0.0 109.721 179.153 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 164' ' ' HIS . . . . . . . . . . . . . 8.4 p-80 -93.73 79.22 4.23 Favored 'General case' 0 C--N 1.321 -0.667 0 CA-C-O 121.828 0.823 . . . . 0.0 109.631 178.338 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 165' ' ' HIS . . . . . . . . . . . . . 49.2 t-80 -161.35 78.23 0.57 Allowed 'General case' 0 C--N 1.321 -0.646 0 CA-C-N 114.471 -1.24 . . . . 0.0 108.408 -177.494 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 166' ' ' HIS . . . . . . . . . . . . . 47.4 t-80 -91.36 72.93 6.13 Favored 'General case' 0 C--N 1.324 -0.526 0 CA-C-N 116.18 -0.464 . . . . 0.0 111.497 -172.064 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 167' ' ' HIS . . . . . . . . . . . . . 3.1 m-70 -157.1 139.39 14.66 Favored 'General case' 0 C--N 1.324 -0.536 0 CA-C-N 116.074 -0.512 . . . . 0.0 110.699 173.269 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 168' ' ' HIS . . . . . . . . . . . . . 53.3 t60 . . . . . 0 C--O 1.247 0.972 0 CA-C-O 118.284 -0.865 . . . . 0.0 109.601 176.618 . . . . . . . . 0 0 . 1 . 016 nuclear orig full ' A' A ' 61' ' ' ARG . . . . . . . . . . . . . 77.7 mtp180 . . . . . 0 N--CA 1.483 1.184 0 CA-C-O 120.985 0.422 . . . . 0.0 110.295 . . . . . . . . . 0 0 . 1 . 016 nuclear orig full ' A' A ' 62' ' ' ASP . . . . . . . . . . . . . 2.4 m-20 -96.32 133.41 40.73 Favored 'General case' 0 C--N 1.324 -0.536 0 CA-C-N 116.07 -0.514 . . . . 0.0 111.088 -171.8 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 63' ' ' SER . . . . . . . . . . . . . 19.4 m -81.78 167.39 19.13 Favored 'General case' 0 C--N 1.325 -0.474 0 CA-C-N 115.862 -0.608 . . . . 0.0 110.152 177.018 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 64' ' ' PHE . . . . . . . . . . . . . 77.8 t80 -59.04 -33.01 70.27 Favored 'General case' 0 N--CA 1.464 0.236 0 CA-C-O 120.68 0.276 . . . . 0.0 110.578 -177.491 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 65' ' ' GLY . . . . . . . . . . . . . . . -57.87 -41.21 94.03 Favored Glycine 0 N--CA 1.448 -0.559 0 C-N-CA 120.856 -0.688 . . . . 0.0 112.366 176.495 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 66' ' ' ASP . . . . . 0.574 ' O ' ' HG3' ' A' ' 70' ' ' LYS . 6.8 t0 -72.66 -41.27 65.61 Favored 'General case' 0 C--N 1.327 -0.392 0 N-CA-C 109.618 -0.512 . . . . 0.0 109.618 179.78 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 67' ' ' TRP . . . . . . . . . . . . . 97.6 m95 -59.71 -38.33 81.32 Favored 'General case' 0 N--CA 1.464 0.268 0 CA-C-N 116.344 -0.389 . . . . 0.0 110.751 177.184 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 68' ' ' ALA . . . . . . . . . . . . . . . -61.23 -44.5 97.16 Favored 'General case' 0 C--N 1.326 -0.435 0 CA-C-N 116.293 -0.412 . . . . 0.0 110.081 176.314 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 69' ' ' GLU . . . . . . . . . . . . . 28.7 tt0 -62.26 -41.17 98.21 Favored 'General case' 0 CA--C 1.53 0.175 0 CA-C-N 116.116 -0.493 . . . . 0.0 110.024 176.943 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 70' ' ' LYS . . . . . 0.574 ' HG3' ' O ' ' A' ' 66' ' ' ASP . 51.8 mttm -57.34 -44.31 84.16 Favored 'General case' 0 C--O 1.232 0.158 0 CA-C-N 116.354 -0.385 . . . . 0.0 110.587 177.711 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 71' ' ' PHE . . . . . . . . . . . . . 89.2 t80 -60.4 -52.52 64.89 Favored 'General case' 0 C--N 1.331 -0.22 0 CA-C-N 115.905 -0.589 . . . . 0.0 110.63 -179.709 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 72' ' ' LEU . . . . . 0.435 HD12 HD13 ' A' ' 85' ' ' LEU . 4.2 mm? -59.65 -47.4 85.77 Favored 'General case' 0 C--N 1.331 -0.231 0 CA-C-N 116.292 -0.413 . . . . 0.0 110.755 178.856 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 73' ' ' LYS . . . . . 0.444 ' HB2' ' HE3' ' A' ' 73' ' ' LYS . 36.0 ttmt -56.43 -46.64 80.16 Favored 'General case' 0 C--N 1.325 -0.469 0 CA-C-N 115.556 -0.747 . . . . 0.0 110.547 179.774 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 74' ' ' SER . . . . . . . . . . . . . 42.0 m -68.15 -43.79 77.46 Favored 'General case' 0 C--N 1.327 -0.395 0 CA-C-N 115.778 -0.646 . . . . 0.0 111.186 -179.69 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 75' ' ' LYS . . . . . 0.444 ' O ' HG23 ' A' ' 80' ' ' VAL . 3.6 mmtm -69.18 -32.5 71.85 Favored 'General case' 0 C--N 1.331 -0.215 0 CA-C-N 116.701 -0.227 . . . . 0.0 111.423 -177.64 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 76' ' ' GLU . . . . . . . . . . . . . 39.3 tt0 -58.27 -50.68 72.74 Favored 'General case' 0 C--N 1.327 -0.413 0 CA-C-O 121.009 0.433 . . . . 0.0 109.978 173.975 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 77' ' ' ALA . . . . . . . . . . . . . . . -75.45 -10.06 59.12 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 115.689 -0.687 . . . . 0.0 111.108 179.137 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 78' ' ' ASP . . . . . . . . . . . . . 34.5 t70 -76.13 -11.81 60.0 Favored 'General case' 0 C--N 1.324 -0.502 0 CA-C-N 115.727 -0.67 . . . . 0.0 110.885 -177.925 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 79' ' ' GLY . . . . . . . . . . . . . . . 103.55 33.99 3.99 Favored Glycine 0 N--CA 1.451 -0.366 0 C-N-CA 120.632 -0.794 . . . . 0.0 113.332 174.012 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 80' ' ' VAL . . . . . 0.444 HG23 ' O ' ' A' ' 75' ' ' LYS . 31.4 m -101.09 159.53 3.93 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.411 0 CA-C-N 116.935 0.368 . . . . 0.0 110.549 176.653 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 81' ' ' SER . . . . . . . . . . . . . 7.1 p -81.78 174.95 10.84 Favored 'General case' 0 C--N 1.324 -0.54 0 CA-C-N 116.164 -0.471 . . . . 0.0 110.868 179.195 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 82' ' ' VAL . . . . . . . . . . . . . 61.0 t -68.29 -41.66 83.9 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.397 0 CA-C-N 116.341 -0.391 . . . . 0.0 110.615 -177.707 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 83' ' ' SER . . . . . . . . . . . . . 53.0 p -58.9 -39.19 80.74 Favored 'General case' 0 C--N 1.332 -0.188 0 CA-C-O 121.248 0.547 . . . . 0.0 110.507 177.964 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 84' ' ' GLN . . . . . . . . . . . . . 6.5 tp-100 -66.52 -47.98 71.21 Favored 'General case' 0 C--N 1.325 -0.465 0 CA-C-N 115.65 -0.705 . . . . 0.0 110.146 177.822 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 85' ' ' LEU . . . . . 0.435 HD13 HD12 ' A' ' 72' ' ' LEU . 0.6 OUTLIER -62.47 -43.43 98.84 Favored 'General case' 0 C--N 1.326 -0.432 0 CA-C-N 115.599 -0.728 . . . . 0.0 110.559 -178.364 . . . . . . . . 3 3 . 1 . 016 nuclear orig full ' A' A ' 86' ' ' ASN . . . . . . . . . . . . . 11.8 m120 -61.44 -38.85 88.68 Favored 'General case' 0 N--CA 1.465 0.297 0 CA-C-O 120.689 0.28 . . . . 0.0 111.005 179.409 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 87' ' ' SER . . . . . . . . . . . . . 49.6 m -60.2 -44.38 95.16 Favored 'General case' 0 C--N 1.327 -0.378 0 CA-C-N 116.32 -0.4 . . . . 0.0 110.772 -179.707 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 88' ' ' TYR . . . . . 0.405 ' HB2' HD13 ' A' ' 72' ' ' LEU . 25.8 m-85 -62.56 -37.97 88.23 Favored 'General case' 0 C--N 1.331 -0.235 0 CA-C-N 116.452 -0.34 . . . . 0.0 110.495 177.706 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 89' ' ' LYS . . . . . 0.613 ' HA ' ' SG ' ' A' ' 92' ' ' CYS . 56.3 mtpt -66.09 -36.74 83.99 Favored 'General case' 0 C--N 1.331 -0.226 0 CA-C-N 116.201 -0.454 . . . . 0.0 110.589 178.522 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 90' ' ' ASN . . . . . 0.51 ' O ' ' HB2' ' A' ' 94' ' ' ASN . 27.3 t-20 -60.98 -33.34 73.07 Favored 'General case' 0 C--N 1.327 -0.382 0 CA-C-O 121.347 0.594 . . . . 0.0 110.375 176.234 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 91' ' ' TYR . . . . . . . . . . . . . 24.1 m-85 -72.18 -50.58 26.57 Favored 'General case' 0 C--N 1.322 -0.616 0 CA-C-N 116.064 -0.516 . . . . 0.0 110.841 178.783 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 92' ' ' CYS . . . . . 0.613 ' SG ' ' HA ' ' A' ' 89' ' ' LYS . 24.9 p -76.81 -40.82 46.73 Favored 'General case' 0 C--N 1.328 -0.331 0 N-CA-C 112.226 0.454 . . . . 0.0 112.226 -174.593 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 93' ' ' ARG . . . . . . . . . . . . . 35.6 ttt180 -78.17 -52.75 8.23 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-O 120.812 0.339 . . . . 0.0 111.834 -176.68 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 94' ' ' ASN . . . . . 0.51 ' HB2' ' O ' ' A' ' 90' ' ' ASN . 3.9 m-20 -77.88 -50.21 12.7 Favored 'General case' 0 C--N 1.324 -0.508 0 CA-C-O 120.976 0.417 . . . . 0.0 111.161 -173.266 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 95' ' ' HIS . . . . . . . . . . . . . 76.0 m80 -86.9 -54.12 4.52 Favored 'General case' 0 C--N 1.323 -0.564 0 CA-C-N 116.193 -0.458 . . . . 0.0 112.101 -173.827 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 96' ' ' LEU . . . . . 0.535 ' HB2' ' HA ' ' A' ' 92' ' ' CYS . 81.8 mt -87.54 26.81 1.2 Allowed 'General case' 0 C--N 1.326 -0.415 0 N-CA-C 111.789 0.292 . . . . 0.0 111.789 -173.471 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 97' ' ' SER . . . . . 0.528 ' N ' ' HD2' ' A' ' 98' ' ' PRO . 0.0 OUTLIER -56.66 -48.05 97.91 Favored Pre-proline 0 CA--C 1.54 0.595 0 N-CA-C 112.595 0.591 . . . . 0.0 112.595 -179.16 . . . . . . . . 3 3 . 1 . 016 nuclear orig full ' A' A ' 98' ' ' PRO . . . . . 0.528 ' HD2' ' N ' ' A' ' 97' ' ' SER . 15.7 Cg_endo -58.62 -36.54 97.12 Favored 'Trans proline' 0 C--N 1.358 1.037 0 C-N-CA 122.032 1.821 . . . . 0.0 112.336 176.409 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 99' ' ' LEU . . . . . 0.409 HD22 HD21 ' A' ' 96' ' ' LEU . 8.1 mp -70.09 -33.65 72.15 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-N 116.304 -0.407 . . . . 0.0 110.503 -179.342 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 100' ' ' TYR . . . . . . . . . . . . . 62.9 t80 -57.42 -29.79 64.44 Favored 'General case' 0 C--N 1.327 -0.391 0 CA-C-N 115.541 -0.754 . . . . 0.0 110.926 179.272 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 101' ' ' MET . . . . . . . . . . . . . 47.4 ttm -86.6 -18.61 30.99 Favored 'General case' 0 C--N 1.325 -0.468 0 CA-C-N 116.008 -0.542 . . . . 0.0 110.88 -177.344 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 102' ' ' LYS . . . . . . . . . . . . . 89.2 mttt -91.02 165.2 13.66 Favored 'General case' 0 C--N 1.325 -0.495 0 CA-C-O 121.453 0.644 . . . . 0.0 111.944 -174.348 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 103' ' ' SER . . . . . 0.464 ' O ' HG13 ' A' ' 107' ' ' ILE . 18.1 t -95.02 172.2 8.29 Favored 'General case' 0 C--N 1.323 -0.582 0 CA-C-N 115.396 -0.82 . . . . 0.0 109.051 169.336 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 104' ' ' LEU . . . . . . . . . . . . . 89.0 mt -59.07 -43.72 91.8 Favored 'General case' 0 C--N 1.325 -0.458 0 N-CA-C 111.993 0.368 . . . . 0.0 111.993 -174.686 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 105' ' ' SER . . . . . . . . . . . . . 24.1 t -85.04 1.97 45.32 Favored 'General case' 0 C--N 1.326 -0.447 0 CA-C-O 121.099 0.476 . . . . 0.0 110.74 -177.315 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 106' ' ' GLU . . . . . . . . . . . . . 19.7 tp10 -102.36 -14.06 17.07 Favored 'General case' 0 C--N 1.322 -0.63 0 CA-C-O 121.268 0.556 . . . . 0.0 110.531 -178.128 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 107' ' ' ILE . . . . . 0.464 HG13 ' O ' ' A' ' 103' ' ' SER . 68.3 mt -83.81 140.38 16.27 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.45 0 CA-C-N 116.09 -0.504 . . . . 0.0 110.953 -178.626 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 108' ' ' LEU . . . . . . . . . . . . . 76.1 mt -110.81 151.22 42.76 Favored Pre-proline 0 C--N 1.324 -0.513 0 CA-C-N 116.023 -0.535 . . . . 0.0 109.71 178.161 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 109' ' ' PRO . . . . . . . . . . . . . 18.9 Cg_endo -61.08 -26.8 83.43 Favored 'Trans proline' 0 N--CA 1.464 -0.212 0 C-N-CA 121.979 1.786 . . . . 0.0 111.166 174.633 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 110' ' ' ALA . . . . . . . . . . . . . . . -71.48 -26.34 62.65 Favored 'General case' 0 N--CA 1.453 -0.288 0 CA-C-N 115.351 -0.841 . . . . 0.0 111.683 -178.78 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 111' ' ' ASP . . . . . 0.47 ' O ' HG13 ' A' ' 115' ' ' ILE . 29.7 m-20 -57.74 -57.15 14.02 Favored 'General case' 0 N--CA 1.463 0.223 0 CA-C-O 121.272 0.558 . . . . 0.0 109.648 176.426 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 112' ' ' ILE . . . . . . . . . . . . . 19.5 mt -67.23 -37.49 79.22 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.538 0 CA-C-N 115.449 -0.796 . . . . 0.0 110.337 -179.162 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 113' ' ' GLN . . . . . . . . . . . . . 23.4 tp60 -58.27 -50.12 74.71 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 115.864 -0.607 . . . . 0.0 111.446 179.651 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 114' ' ' SER . . . . . . . . . . . . . 31.6 p -64.7 -35.2 80.27 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 116.335 -0.393 . . . . 0.0 110.956 -177.963 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 115' ' ' ILE . . . . . 0.47 HG13 ' O ' ' A' ' 111' ' ' ASP . 92.7 mt -60.44 -53.3 50.69 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.299 0 CA-C-O 120.694 0.283 . . . . 0.0 110.359 175.979 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 116' ' ' ILE . . . . . . . . . . . . . 47.5 mm -60.16 -41.95 88.47 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.289 0 CA-C-N 116.121 -0.49 . . . . 0.0 110.924 -179.435 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 117' ' ' ASN . . . . . . . . . . . . . 27.9 t-20 -65.49 -32.67 74.41 Favored 'General case' 0 C--N 1.326 -0.447 0 CA-C-N 116.066 -0.515 . . . . 0.0 111.926 -176.896 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 118' ' ' GLU . . . . . . . . . . . . . 21.3 mt-10 -103.17 4.18 36.6 Favored 'General case' 0 C--N 1.329 -0.311 0 N-CA-C 112.176 0.436 . . . . 0.0 112.176 -177.663 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 119' ' ' THR . . . . . . . . . . . . . 96.7 m -97.85 112.06 24.12 Favored 'General case' 0 C--N 1.322 -0.596 0 CA-C-O 121.176 0.512 . . . . 0.0 110.239 173.636 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 120' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -93.86 88.62 5.82 Favored 'General case' 0 C--N 1.325 -0.458 0 CA-C-N 115.943 -0.571 . . . . 0.0 110.362 -177.869 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 121' ' ' LEU . . . . . . . . . . . . . 57.6 mt -138.69 -174.7 3.9 Favored 'General case' 0 C--N 1.32 -0.694 0 CA-C-N 115.392 -0.822 . . . . 0.0 110.025 179.541 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 122' ' ' ALA . . . . . . . . . . . . . . . -64.85 147.39 53.36 Favored 'General case' 0 C--N 1.322 -0.612 0 CA-C-N 116.277 -0.42 . . . . 0.0 110.465 178.439 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 123' ' ' LYS . . . . . 0.498 ' HE3' ' O ' ' A' ' 158' ' ' LYS . 52.6 mttp -55.94 -33.96 65.21 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 115.997 -0.547 . . . . 0.0 111.353 -179.345 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 124' ' ' ASN . . . . . . . . . . . . . 65.5 t30 -64.74 -38.49 91.17 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 115.978 -0.555 . . . . 0.0 110.413 -179.987 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 125' ' ' THR . . . . . 0.472 ' O ' HG13 ' A' ' 129' ' ' ILE . 7.3 m -68.25 -37.52 80.85 Favored 'General case' 0 C--N 1.326 -0.417 0 CA-C-N 115.774 -0.648 . . . . 0.0 110.801 -179.444 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 126' ' ' LEU . . . . . . . . . . . . . 88.5 mt -61.84 -41.8 98.26 Favored 'General case' 0 C--O 1.234 0.289 0 CA-C-O 121.144 0.497 . . . . 0.0 110.221 178.595 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 127' ' ' LYS . . . . . . . . . . . . . 93.5 mttt -63.49 -44.68 93.66 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 115.663 -0.698 . . . . 0.0 110.201 177.142 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 128' ' ' ALA . . . . . . . . . . . . . . . -57.57 -40.45 78.98 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 115.717 -0.674 . . . . 0.0 111.477 -178.404 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 129' ' ' ILE . . . . . 0.472 HG13 ' O ' ' A' ' 125' ' ' THR . 67.3 mt -62.63 -50.19 80.77 Favored 'Isoleucine or valine' 0 C--O 1.235 0.295 0 CA-C-N 116.478 -0.328 . . . . 0.0 110.687 178.809 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 130' ' ' ARG . . . . . . . . . . . . . 13.7 ttt180 -61.63 -45.68 93.02 Favored 'General case' 0 C--O 1.231 0.107 0 CA-C-N 116.467 -0.333 . . . . 0.0 110.782 178.106 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 131' ' ' ASN . . . . . . . . . . . . . 7.1 m-20 -58.29 -49.54 76.77 Favored 'General case' 0 C--N 1.325 -0.457 0 CA-C-N 116.36 -0.382 . . . . 0.0 111.49 -179.061 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 132' ' ' THR . . . . . 0.483 ' O ' HG13 ' A' ' 136' ' ' ILE . 52.9 m -54.76 -50.72 67.76 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 116.227 -0.442 . . . . 0.0 110.594 178.268 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 133' ' ' ALA . . . . . . . . . . . . . . . -61.06 -40.91 95.46 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.209 -0.451 . . . . 0.0 111.103 179.436 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 134' ' ' SER . . . . . 0.455 ' O ' ' HG3' ' A' ' 138' ' ' ARG . 58.7 m -59.29 -45.57 90.9 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.044 -0.526 . . . . 0.0 111.123 -179.884 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 135' ' ' GLN . . . . . . . . . . . . . 12.3 mm100 -66.0 -34.85 79.04 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.399 -0.364 . . . . 0.0 111.071 -177.716 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 136' ' ' ILE . . . . . 0.483 HG13 ' O ' ' A' ' 132' ' ' THR . 64.3 mt -64.68 -43.81 96.61 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.264 0 CA-C-O 120.843 0.354 . . . . 0.0 110.166 177.219 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 137' ' ' PHE . . . . . 0.527 ' O ' HG13 ' A' ' 141' ' ' ILE . 43.5 m-85 -63.9 -39.86 95.16 Favored 'General case' 0 C--N 1.332 -0.18 0 CA-C-N 116.179 -0.464 . . . . 0.0 110.671 176.346 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 138' ' ' ARG . . . . . 0.455 ' HG3' ' O ' ' A' ' 134' ' ' SER . 79.0 mtt180 -64.0 -36.38 83.8 Favored 'General case' 0 C--N 1.332 -0.185 0 CA-C-O 120.738 0.304 . . . . 0.0 110.634 178.605 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 139' ' ' LEU . . . . . . . . . . . . . 54.8 tp -59.22 -41.52 88.84 Favored 'General case' 0 C--N 1.326 -0.423 0 CA-C-N 116.056 -0.52 . . . . 0.0 110.043 176.13 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 140' ' ' ALA . . . . . . . . . . . . . . . -67.0 -36.3 81.86 Favored 'General case' 0 C--N 1.327 -0.385 0 CA-C-N 116.243 -0.435 . . . . 0.0 110.537 176.715 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 141' ' ' ILE . . . . . 0.594 ' HA ' ' O ' ' A' ' 146' ' ' ILE . 77.3 mt -63.51 -45.58 97.4 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.301 0 CA-C-N 116.083 -0.508 . . . . 0.0 110.582 176.776 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 142' ' ' GLU . . . . . . . . . . . . . 46.4 mt-10 -63.16 -27.66 69.52 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.015 -0.539 . . . . 0.0 111.159 179.534 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 143' ' ' ASN . . . . . . . . . . . . . 35.1 m-80 -95.97 11.85 32.48 Favored 'General case' 0 C--N 1.326 -0.421 0 CA-C-N 116.284 -0.416 . . . . 0.0 110.821 179.43 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 144' ' ' ARG . . . . . . . . . . . . . 81.5 mtm180 60.88 25.24 15.19 Favored 'General case' 0 N--CA 1.469 0.498 0 CA-C-N 115.7 -0.682 . . . . 0.0 112.553 174.589 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 145' ' ' ALA . . . . . . . . . . . . . . . -80.41 -42.35 22.92 Favored 'General case' 0 C--N 1.323 -0.553 0 CA-C-O 121.25 0.548 . . . . 0.0 110.309 177.835 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 146' ' ' ILE . . . . . 0.594 ' O ' ' HA ' ' A' ' 141' ' ' ILE . 13.7 tt -147.13 152.19 13.28 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.542 0 CA-C-N 115.677 -0.692 . . . . 0.0 109.336 179.412 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 147' ' ' ASP . . . . . . . . . . . . . 25.9 t70 -125.83 70.06 1.2 Allowed 'General case' 0 C--N 1.321 -0.634 0 N-CA-C 109.314 -0.625 . . . . 0.0 109.314 175.096 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 148' ' ' PHE . . . . . . . . . . . . . 61.5 t80 -169.48 133.8 1.37 Allowed 'General case' 0 C--N 1.324 -0.535 0 CA-C-N 115.618 -0.719 . . . . 0.0 109.647 -177.905 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 149' ' ' ASN . . . . . . . . . . . . . 4.5 t-20 -115.7 96.3 46.06 Favored Pre-proline 0 C--N 1.322 -0.591 0 CA-C-N 116.478 -0.328 . . . . 0.0 110.737 179.369 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 150' ' ' PRO . . . . . . . . . . . . . 17.3 Cg_exo -67.4 -21.47 47.03 Favored 'Trans proline' 0 C--N 1.344 0.311 0 C-N-CA 122.852 2.368 . . . . 0.0 112.07 179.682 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 151' ' ' ALA . . . . . . . . . . . . . . . -72.18 -15.8 61.96 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-N 115.972 -0.558 . . . . 0.0 111.246 -178.582 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 152' ' ' ASP . . . . . . . . . . . . . 25.2 t70 -72.01 -19.56 61.84 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-O 121.212 0.53 . . . . 0.0 110.568 179.997 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 153' ' ' TYR . . . . . . . . . . . . . 97.8 m-85 -93.38 1.52 56.87 Favored 'General case' 0 C--N 1.326 -0.435 0 CA-C-N 115.958 -0.565 . . . . 0.0 111.251 -177.573 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 154' ' ' VAL . . . . . . . . . . . . . 48.8 t -77.2 110.82 13.3 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.373 0 CA-C-N 116.374 -0.376 . . . . 0.0 110.334 179.615 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 155' ' ' ARG . . . . . . . . . . . . . 77.0 mtt-85 -77.22 135.39 38.48 Favored 'General case' 0 C--N 1.321 -0.637 0 CA-C-N 116.181 -0.463 . . . . 0.0 110.273 179.279 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 156' ' ' ILE . . . . . . . . . . . . . 49.8 mm -105.06 104.92 49.48 Favored Pre-proline 0 C--N 1.321 -0.646 0 CA-C-N 115.736 -0.665 . . . . 0.0 109.77 -179.113 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 157' ' ' PRO . . . . . . . . . . . . . 58.2 Cg_endo -73.08 131.69 17.08 Favored 'Trans proline' 0 N--CA 1.461 -0.394 0 C-N-CA 122.412 2.075 . . . . 0.0 112.227 -177.937 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 158' ' ' LYS . . . . . 0.498 ' O ' ' HE3' ' A' ' 123' ' ' LYS . 95.7 mttt -92.25 -48.69 6.56 Favored 'General case' 0 C--N 1.322 -0.625 0 CA-C-N 116.043 -0.526 . . . . 0.0 110.068 179.604 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 159' ' ' ILE . . . . . . . . . . . . . 62.8 mt 69.0 98.74 0.05 OUTLIER 'Isoleucine or valine' 0 N--CA 1.463 0.207 0 CA-C-N 115.769 -0.65 . . . . 0.0 111.486 176.622 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 160' ' ' ALA . . . . . . . . . . . . . . . -111.09 26.82 10.3 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-O 121.581 0.705 . . . . 0.0 110.134 178.687 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 161' ' ' LEU . . . . . 0.409 ' O ' ' HD2' ' A' ' 163' ' ' HIS . 0.6 OUTLIER -152.05 46.03 0.76 Allowed 'General case' 0 C--N 1.317 -0.84 0 CA-C-N 114.762 -1.108 . . . . 0.0 110.401 -177.094 . . . . . . . . 3 3 . 1 . 016 nuclear orig full ' A' A ' 162' ' ' GLU . . . . . . . . . . . . . 3.6 mp0 -52.18 113.55 1.06 Allowed 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 115.771 -0.65 . . . . 0.0 112.429 -174.762 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 163' ' ' HIS . . . . . 0.429 ' O ' ' HB3' ' A' ' 164' ' ' HIS . 8.0 p80 -131.48 -169.41 2.18 Favored 'General case' 0 C--N 1.325 -0.467 0 CA-C-N 115.248 -0.887 . . . . 0.0 109.136 176.356 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 164' ' ' HIS . . . . . 0.429 ' HB3' ' O ' ' A' ' 163' ' ' HIS . 74.2 t60 69.06 95.07 0.07 Allowed 'General case' 0 N--CA 1.466 0.351 0 N-CA-C 109.742 -0.466 . . . . 0.0 109.742 -176.816 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 165' ' ' HIS . . . . . . . . . . . . . 39.5 t60 62.13 29.84 17.63 Favored 'General case' 0 N--CA 1.466 0.346 0 CA-C-O 121.587 0.708 . . . . 0.0 109.521 -177.177 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 166' ' ' HIS . . . . . . . . . . . . . 26.7 m80 -129.94 116.76 19.09 Favored 'General case' 0 C--N 1.326 -0.45 0 CA-C-N 116.055 -0.52 . . . . 0.0 111.657 -177.319 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 167' ' ' HIS . . . . . . . . . . . . . 10.2 p80 -97.62 107.0 19.4 Favored 'General case' 0 C--N 1.322 -0.592 0 N-CA-C 108.084 -1.08 . . . . 0.0 108.084 168.111 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 168' ' ' HIS . . . . . . . . . . . . . 35.1 t-80 . . . . . 0 C--O 1.248 1.016 0 CA-C-O 118.563 -0.732 . . . . 0.0 110.417 -174.025 . . . . . . . . 0 0 . 1 . 017 nuclear orig full ' A' A ' 61' ' ' ARG . . . . . 0.456 ' HA ' ' NE ' ' A' ' 61' ' ' ARG . 4.1 mmp_? . . . . . 0 N--CA 1.479 0.991 0 N-CA-C 110.171 -0.307 . . . . 0.0 110.171 . . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 62' ' ' ASP . . . . . . . . . . . . . 16.3 m-20 -93.82 147.01 23.47 Favored 'General case' 0 C--N 1.32 -0.716 0 CA-C-O 120.964 0.411 . . . . 0.0 111.033 -176.897 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 63' ' ' SER . . . . . . . . . . . . . 21.9 p -118.8 148.18 43.12 Favored 'General case' 0 C--N 1.321 -0.637 0 CA-C-N 115.971 -0.559 . . . . 0.0 110.077 178.356 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 64' ' ' PHE . . . . . . . . . . . . . 83.0 t80 -61.84 -42.44 99.04 Favored 'General case' 0 C--N 1.326 -0.445 0 CA-C-N 116.448 -0.342 . . . . 0.0 110.746 -177.055 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 65' ' ' GLY . . . . . . . . . . . . . . . -63.46 -30.64 78.21 Favored Glycine 0 C--N 1.329 0.188 0 C-N-CA 120.898 -0.668 . . . . 0.0 113.019 -178.534 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 66' ' ' ASP . . . . . . . . . . . . . 23.7 t70 -71.31 -45.18 63.64 Favored 'General case' 0 C--N 1.326 -0.434 0 CA-C-O 121.067 0.46 . . . . 0.0 110.574 -179.525 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 67' ' ' TRP . . . . . 0.426 ' HA ' ' HE2' ' A' ' 70' ' ' LYS . 83.2 m95 -74.79 -28.89 60.92 Favored 'General case' 0 C--N 1.325 -0.493 0 CA-C-N 116.285 -0.416 . . . . 0.0 110.942 178.559 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 68' ' ' ALA . . . . . . . . . . . . . . . -64.28 -37.15 86.48 Favored 'General case' 0 C--N 1.331 -0.219 0 CA-C-O 121.008 0.432 . . . . 0.0 110.142 173.971 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 69' ' ' GLU . . . . . . . . . . . . . 43.4 tt0 -59.08 -48.64 80.85 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 115.661 -0.699 . . . . 0.0 109.964 175.661 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 70' ' ' LYS . . . . . 0.426 ' HE2' ' HA ' ' A' ' 67' ' ' TRP . 19.2 mtmm -62.45 -31.63 72.38 Favored 'General case' 0 C--N 1.328 -0.326 0 CA-C-N 115.665 -0.698 . . . . 0.0 111.427 177.428 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 71' ' ' PHE . . . . . . . . . . . . . 92.1 t80 -68.14 -45.13 74.44 Favored 'General case' 0 C--O 1.235 0.298 0 CA-C-O 120.578 0.228 . . . . 0.0 111.072 178.78 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 72' ' ' LEU . . . . . . . . . . . . . 8.0 mp -60.07 -42.5 94.69 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-O 121.09 0.471 . . . . 0.0 110.637 177.668 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 73' ' ' LYS . . . . . . . . . . . . . 58.2 mtpt -72.6 -24.6 61.1 Favored 'General case' 0 C--N 1.325 -0.457 0 CA-C-N 115.874 -0.603 . . . . 0.0 110.707 179.207 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 74' ' ' SER . . . . . . . . . . . . . 26.7 t -68.44 -51.32 44.97 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 115.89 -0.596 . . . . 0.0 110.277 177.634 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 75' ' ' LYS . . . . . 0.409 ' O ' HG22 ' A' ' 80' ' ' VAL . 5.2 mptp? -68.42 -27.93 66.62 Favored 'General case' 0 C--O 1.234 0.241 0 CA-C-O 120.865 0.364 . . . . 0.0 110.719 178.741 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 76' ' ' GLU . . . . . . . . . . . . . 36.0 tt0 -56.48 -47.84 78.39 Favored 'General case' 0 C--N 1.324 -0.534 0 CA-C-N 115.803 -0.635 . . . . 0.0 109.772 172.07 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 77' ' ' ALA . . . . . . . . . . . . . . . -75.06 -23.72 58.1 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 115.645 -0.707 . . . . 0.0 111.164 177.904 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 78' ' ' ASP . . . . . . . . . . . . . 20.2 t70 -63.58 -31.61 72.83 Favored 'General case' 0 N--CA 1.464 0.237 0 CA-C-O 121.194 0.521 . . . . 0.0 110.581 178.318 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 79' ' ' GLY . . . . . . . . . . . . . . . 105.14 21.06 9.17 Favored Glycine 0 N--CA 1.446 -0.656 0 C-N-CA 120.636 -0.792 . . . . 0.0 112.795 176.229 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 80' ' ' VAL . . . . . 0.409 HG22 ' O ' ' A' ' 75' ' ' LYS . 25.7 m -71.02 153.5 8.3 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.451 0 CA-C-O 120.838 0.352 . . . . 0.0 110.29 178.986 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 81' ' ' SER . . . . . . . . . . . . . 10.7 p -68.77 160.58 30.16 Favored 'General case' 0 C--N 1.323 -0.573 0 CA-C-N 116.131 -0.486 . . . . 0.0 110.67 179.476 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 82' ' ' VAL . . . . . . . . . . . . . 13.3 p -61.51 -34.35 61.13 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.393 0 CA-C-O 120.735 0.302 . . . . 0.0 110.514 179.6 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 83' ' ' SER . . . . . . . . . . . . . 4.0 p -66.79 -42.29 86.23 Favored 'General case' 0 C--O 1.236 0.387 0 CA-C-O 121.087 0.47 . . . . 0.0 110.282 177.497 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 84' ' ' GLN . . . . . . . . . . . . . 6.3 tp-100 -64.65 -43.87 92.25 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 115.809 -0.632 . . . . 0.0 110.019 176.936 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 85' ' ' LEU . . . . . 0.483 ' O ' ' HG3' ' A' ' 89' ' ' LYS . 52.7 tp -62.68 -45.15 94.12 Favored 'General case' 0 C--N 1.326 -0.431 0 CA-C-N 115.921 -0.581 . . . . 0.0 110.496 178.4 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 86' ' ' ASN . . . . . . . . . . . . . 78.1 m-20 -57.15 -35.49 69.59 Favored 'General case' 0 N--CA 1.464 0.233 0 CA-C-N 116.459 -0.337 . . . . 0.0 110.808 177.325 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 87' ' ' SER . . . . . . . . . . . . . 48.2 m -60.54 -45.36 94.17 Favored 'General case' 0 C--N 1.327 -0.393 0 CA-C-N 116.318 -0.401 . . . . 0.0 110.29 177.827 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 88' ' ' TYR . . . . . . . . . . . . . 54.1 m-85 -66.24 -38.85 88.86 Favored 'General case' 0 C--N 1.331 -0.229 0 CA-C-O 120.926 0.393 . . . . 0.0 110.842 179.126 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 89' ' ' LYS . . . . . 0.483 ' HG3' ' O ' ' A' ' 85' ' ' LEU . 51.7 mtpt -64.29 -40.96 97.02 Favored 'General case' 0 C--N 1.324 -0.504 0 CA-C-N 116.15 -0.477 . . . . 0.0 110.223 178.106 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 90' ' ' ASN . . . . . 0.494 ' O ' ' HB2' ' A' ' 94' ' ' ASN . 0.9 OUTLIER -66.2 -28.89 69.1 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.073 -0.512 . . . . 0.0 110.897 177.617 . . . . . . . . 3 3 . 1 . 017 nuclear orig full ' A' A ' 91' ' ' TYR . . . . . . . . . . . . . 19.7 m-85 -71.88 -50.21 31.31 Favored 'General case' 0 C--N 1.323 -0.574 0 N-CA-C 109.905 -0.405 . . . . 0.0 109.905 174.381 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 92' ' ' CYS . . . . . 0.496 ' HA ' ' HB2' ' A' ' 96' ' ' LEU . 40.5 t -67.25 -54.62 19.29 Favored 'General case' 0 C--N 1.325 -0.458 0 CA-C-N 116.093 -0.503 . . . . 0.0 112.324 -176.601 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 93' ' ' ARG . . . . . 0.516 ' O ' ' HB3' ' A' ' 97' ' ' SER . 7.8 mpt_? -71.33 -36.82 71.7 Favored 'General case' 0 C--N 1.328 -0.361 0 N-CA-C 112.542 0.571 . . . . 0.0 112.542 -172.539 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 94' ' ' ASN . . . . . 0.494 ' HB2' ' O ' ' A' ' 90' ' ' ASN . 3.4 m-20 -93.72 -55.94 3.07 Favored 'General case' 0 C--N 1.324 -0.525 0 CA-C-O 120.871 0.367 . . . . 0.0 111.73 -175.412 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 95' ' ' HIS . . . . . . . . . . . . . 79.6 m80 -84.92 -47.18 10.55 Favored 'General case' 0 C--N 1.323 -0.549 0 CA-C-N 116.212 -0.449 . . . . 0.0 111.515 -170.346 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 96' ' ' LEU . . . . . 0.496 ' HB2' ' HA ' ' A' ' 92' ' ' CYS . 88.6 mt -88.62 19.51 3.91 Favored 'General case' 0 C--N 1.324 -0.536 0 CA-C-N 116.388 -0.369 . . . . 0.0 111.035 -178.237 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 97' ' ' SER . . . . . 0.555 ' OG ' ' HD3' ' A' ' 98' ' ' PRO . 12.4 p -60.76 -42.09 85.79 Favored Pre-proline 0 CA--C 1.542 0.664 0 N-CA-C 113.102 0.778 . . . . 0.0 113.102 -177.986 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 98' ' ' PRO . . . . . 0.555 ' HD3' ' OG ' ' A' ' 97' ' ' SER . 17.3 Cg_exo -65.81 -33.57 43.07 Favored 'Trans proline' 0 C--N 1.359 1.079 0 C-N-CA 121.424 1.416 . . . . 0.0 111.737 178.396 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 99' ' ' LEU . . . . . . . . . . . . . 68.0 mt -79.72 -29.11 40.55 Favored 'General case' 0 C--N 1.327 -0.382 0 CA-C-N 115.742 -0.663 . . . . 0.0 110.679 -177.221 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 100' ' ' TYR . . . . . . . . . . . . . 46.9 t80 -52.79 -40.31 63.09 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 115.775 -0.648 . . . . 0.0 110.916 179.794 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 101' ' ' MET . . . . . . . . . . . . . 21.0 ptp -95.81 14.16 24.23 Favored 'General case' 0 C--N 1.323 -0.567 0 CA-C-N 115.931 -0.577 . . . . 0.0 111.423 -176.51 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 102' ' ' LYS . . . . . 0.501 ' HG3' ' O ' ' A' ' 98' ' ' PRO . 96.7 mttt -104.33 152.88 21.72 Favored 'General case' 0 C--N 1.324 -0.536 0 CA-C-O 121.054 0.454 . . . . 0.0 111.016 178.442 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 103' ' ' SER . . . . . 0.429 ' O ' HG13 ' A' ' 107' ' ' ILE . 37.9 t -70.74 146.37 49.88 Favored 'General case' 0 C--N 1.322 -0.615 0 CA-C-N 115.57 -0.741 . . . . 0.0 109.576 176.416 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 104' ' ' LEU . . . . . . . . . . . . . 30.6 tp -60.47 -31.87 70.87 Favored 'General case' 0 C--N 1.323 -0.574 0 CA-C-N 116.21 -0.45 . . . . 0.0 111.038 -176.56 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 105' ' ' SER . . . . . . . . . . . . . 56.3 p -87.89 -17.35 31.59 Favored 'General case' 0 C--N 1.329 -0.319 0 N-CA-C 112.29 0.478 . . . . 0.0 112.29 -176.019 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 106' ' ' GLU . . . . . 0.411 ' HG2' ' O ' ' A' ' 103' ' ' SER . 8.4 pt-20 -89.03 -18.53 27.14 Favored 'General case' 0 N--CA 1.464 0.234 0 C-N-CA 120.755 -0.378 . . . . 0.0 111.289 -174.263 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 107' ' ' ILE . . . . . 0.429 HG13 ' O ' ' A' ' 103' ' ' SER . 66.3 mt -73.0 111.08 6.87 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.467 0 CA-C-O 120.993 0.425 . . . . 0.0 110.961 -176.412 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 108' ' ' LEU . . . . . 0.407 ' HA ' ' HD3' ' A' ' 109' ' ' PRO . 1.7 pp -97.46 145.4 29.61 Favored Pre-proline 0 C--N 1.323 -0.58 0 CA-C-N 115.83 -0.623 . . . . 0.0 110.102 176.951 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 109' ' ' PRO . . . . . 0.453 ' HG3' ' HA ' ' A' ' 150' ' ' PRO . 52.4 Cg_exo -54.96 -33.19 81.83 Favored 'Trans proline' 0 C--N 1.343 0.283 0 C-N-CA 123.438 2.759 . . . . 0.0 113.74 -174.516 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 110' ' ' ALA . . . . . . . . . . . . . . . -59.62 -32.32 70.31 Favored 'General case' 0 C--N 1.331 -0.209 0 CA-C-O 120.697 0.284 . . . . 0.0 111.43 -178.98 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 111' ' ' ASP . . . . . . . . . . . . . 38.7 t70 -73.41 -46.82 46.47 Favored 'General case' 0 C--N 1.325 -0.473 0 CA-C-O 121.05 0.453 . . . . 0.0 110.374 -177.159 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 112' ' ' ILE . . . . . . . . . . . . . 27.9 mt -62.01 -39.93 85.49 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.399 0 CA-C-N 115.686 -0.688 . . . . 0.0 110.223 177.992 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 113' ' ' GLN . . . . . 0.415 ' O ' ' HB ' ' A' ' 116' ' ' ILE . 14.6 tm0? -65.54 -35.12 79.92 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 115.889 -0.596 . . . . 0.0 109.857 179.175 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 114' ' ' SER . . . . . 0.465 ' O ' ' HG2' ' A' ' 118' ' ' GLU . 57.5 m -64.74 -38.95 92.74 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.434 -0.348 . . . . 0.0 110.453 177.225 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 115' ' ' ILE . . . . . . . . . . . . . 67.7 mt -62.42 -36.55 75.38 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.337 0 CA-C-O 121.175 0.512 . . . . 0.0 109.951 176.235 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 116' ' ' ILE . . . . . 0.415 ' HB ' ' O ' ' A' ' 113' ' ' GLN . 42.1 mm -61.69 -42.09 92.96 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.338 0 CA-C-N 115.675 -0.693 . . . . 0.0 110.339 175.21 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 117' ' ' ASN . . . . . . . . . . . . . 83.9 m-20 -66.47 -32.02 73.13 Favored 'General case' 0 N--CA 1.466 0.368 0 CA-C-N 116.121 -0.491 . . . . 0.0 110.908 178.627 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 118' ' ' GLU . . . . . 0.465 ' HG2' ' O ' ' A' ' 114' ' ' SER . 65.9 mm-40 -80.63 -17.84 49.98 Favored 'General case' 0 C--N 1.327 -0.383 0 CA-C-N 116.146 -0.479 . . . . 0.0 111.011 -178.306 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 119' ' ' THR . . . . . . . . . . . . . 36.4 m -87.97 113.71 23.88 Favored 'General case' 0 C--N 1.321 -0.638 0 CA-C-N 116.13 -0.486 . . . . 0.0 109.871 178.69 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 120' ' ' LYS . . . . . . . . . . . . . 59.5 pttt -90.53 29.19 1.33 Allowed 'General case' 0 C--N 1.326 -0.424 0 CA-C-N 116.005 -0.543 . . . . 0.0 111.322 -175.294 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 121' ' ' LEU . . . . . 0.506 HD11 HG21 ' A' ' 125' ' ' THR . 95.9 mt -91.92 162.27 14.48 Favored 'General case' 0 C--N 1.32 -0.707 0 CA-C-N 116.167 -0.47 . . . . 0.0 109.999 179.348 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 122' ' ' ALA . . . . . . . . . . . . . . . -64.81 163.22 14.61 Favored 'General case' 0 C--N 1.326 -0.431 0 CA-C-O 120.979 0.419 . . . . 0.0 111.714 -176.967 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 123' ' ' LYS . . . . . 0.502 ' O ' ' HG3' ' A' ' 127' ' ' LYS . 19.7 pttp -55.05 -35.65 64.72 Favored 'General case' 0 C--N 1.331 -0.197 0 CA-C-N 115.624 -0.717 . . . . 0.0 111.897 -177.804 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 124' ' ' ASN . . . . . . . . . . . . . 48.5 t-20 -56.99 -52.14 66.46 Favored 'General case' 0 C--O 1.234 0.249 0 CA-C-O 121.156 0.503 . . . . 0.0 110.16 178.975 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 125' ' ' THR . . . . . 0.506 HG21 HD11 ' A' ' 121' ' ' LEU . 1.3 m -66.77 -37.2 84.12 Favored 'General case' 0 N--CA 1.449 -0.493 0 CA-C-N 115.801 -0.636 . . . . 0.0 110.809 -178.814 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 126' ' ' LEU . . . . . . . . . . . . . 90.9 mt -61.22 -43.52 98.75 Favored 'General case' 0 C--O 1.234 0.28 0 CA-C-N 116.274 -0.421 . . . . 0.0 110.873 178.52 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 127' ' ' LYS . . . . . 0.502 ' HG3' ' O ' ' A' ' 123' ' ' LYS . 47.6 mtpt -64.15 -41.53 97.14 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.307 -0.406 . . . . 0.0 110.455 178.21 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 128' ' ' ALA . . . . . . . . . . . . . . . -60.36 -44.09 95.9 Favored 'General case' 0 C--O 1.234 0.246 0 CA-C-N 116.168 -0.469 . . . . 0.0 111.173 179.855 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 129' ' ' ILE . . . . . 0.465 HG13 ' O ' ' A' ' 125' ' ' THR . 77.6 mt -62.54 -45.79 97.96 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.291 0 CA-C-N 116.249 -0.432 . . . . 0.0 110.27 177.728 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 130' ' ' ARG . . . . . 0.531 ' CZ ' ' HA ' ' A' ' 152' ' ' ASP . 0.3 OUTLIER -65.21 -40.59 94.35 Favored 'General case' 0 C--N 1.331 -0.206 0 CA-C-N 116.056 -0.52 . . . . 0.0 110.485 -179.139 . . . . . . . . 3 3 . 1 . 017 nuclear orig full ' A' A ' 131' ' ' ASN . . . . . 0.596 ' O ' ' HG2' ' A' ' 135' ' ' GLN . 9.2 m120 -59.67 -52.31 66.08 Favored 'General case' 0 CA--C 1.518 -0.26 0 CA-C-N 116.291 -0.413 . . . . 0.0 110.298 177.25 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 132' ' ' THR . . . . . 0.487 ' O ' HG13 ' A' ' 136' ' ' ILE . 55.1 m -51.7 -49.41 62.49 Favored 'General case' 0 C--N 1.329 -0.316 0 O-C-N 123.678 0.611 . . . . 0.0 110.785 178.74 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 133' ' ' ALA . . . . . . . . . . . . . . . -63.81 -44.15 94.12 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.19 -0.459 . . . . 0.0 111.508 -179.744 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 134' ' ' SER . . . . . . . . . . . . . 34.6 p -66.71 -29.51 69.52 Favored 'General case' 0 C--N 1.33 -0.254 0 C-N-CA 121.168 -0.213 . . . . 0.0 111.463 -177.141 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 135' ' ' GLN . . . . . 0.596 ' HG2' ' O ' ' A' ' 131' ' ' ASN . 11.1 mm100 -73.03 -32.68 65.25 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-O 120.784 0.326 . . . . 0.0 110.237 178.094 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 136' ' ' ILE . . . . . 0.487 HG13 ' O ' ' A' ' 132' ' ' THR . 75.2 mt -64.33 -48.06 86.97 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.21 0 CA-C-N 116.159 -0.473 . . . . 0.0 110.058 176.265 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 137' ' ' PHE . . . . . 0.509 ' O ' HG13 ' A' ' 141' ' ' ILE . 62.5 m-85 -62.38 -40.73 97.4 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.147 -0.479 . . . . 0.0 110.532 176.241 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 138' ' ' ARG . . . . . 0.405 HH11 ' HD2' ' A' ' 138' ' ' ARG . 9.7 mtp180 -57.02 -43.1 81.53 Favored 'General case' 0 CA--C 1.519 -0.247 0 CA-C-N 116.331 -0.395 . . . . 0.0 111.109 176.56 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 139' ' ' LEU . . . . . . . . . . . . . 41.2 tp -60.63 -35.76 76.97 Favored 'General case' 0 C--N 1.326 -0.451 0 CA-C-N 116.004 -0.544 . . . . 0.0 110.34 178.938 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 140' ' ' ALA . . . . . . . . . . . . . . . -72.74 -38.76 67.3 Favored 'General case' 0 C--N 1.324 -0.535 0 CA-C-N 116.12 -0.491 . . . . 0.0 110.652 176.555 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 141' ' ' ILE . . . . . 0.631 ' HA ' ' O ' ' A' ' 146' ' ' ILE . 76.1 mt -64.49 -47.37 89.55 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.272 0 CA-C-N 116.535 -0.302 . . . . 0.0 111.502 179.282 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 142' ' ' GLU . . . . . . . . . . . . . 13.0 pt-20 -67.15 -24.6 65.91 Favored 'General case' 0 C--N 1.33 -0.242 0 CA-C-O 120.787 0.327 . . . . 0.0 111.493 -176.796 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 143' ' ' ASN . . . . . . . . . . . . . 37.8 m-80 -99.11 9.45 43.47 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-O 120.823 0.344 . . . . 0.0 110.408 177.791 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 144' ' ' ARG . . . . . . . . . . . . . 25.9 mtm180 59.47 50.93 6.99 Favored 'General case' 0 N--CA 1.463 0.196 0 CA-C-N 115.53 -0.759 . . . . 0.0 112.707 174.827 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 145' ' ' ALA . . . . . . . . . . . . . . . -101.99 -35.36 8.99 Favored 'General case' 0 C--N 1.323 -0.549 0 CA-C-O 121.446 0.641 . . . . 0.0 109.624 170.384 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 146' ' ' ILE . . . . . 0.631 ' O ' ' HA ' ' A' ' 141' ' ' ILE . 13.5 tt -144.32 158.34 15.25 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.458 0 N-CA-C 108.663 -0.865 . . . . 0.0 108.663 176.322 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 147' ' ' ASP . . . . . . . . . . . . . 7.8 p-10 -121.57 16.72 11.22 Favored 'General case' 0 C--N 1.324 -0.536 0 CA-C-O 121.002 0.429 . . . . 0.0 110.766 -177.992 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 148' ' ' PHE . . . . . 0.4 ' H ' HG12 ' A' ' 146' ' ' ILE . 67.6 t80 -135.55 137.6 42.18 Favored 'General case' 0 C--N 1.324 -0.531 0 CA-C-N 116.012 -0.54 . . . . 0.0 109.757 -176.609 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 149' ' ' ASN . . . . . . . . . . . . . 43.0 t-20 -115.47 89.69 22.92 Favored Pre-proline 0 C--N 1.324 -0.538 0 CA-C-N 116.558 -0.292 . . . . 0.0 110.557 -179.311 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 150' ' ' PRO . . . . . 0.453 ' HA ' ' HG3' ' A' ' 109' ' ' PRO . 28.1 Cg_exo -61.71 -32.12 86.48 Favored 'Trans proline' 0 C--N 1.345 0.382 0 C-N-CA 122.78 2.32 . . . . 0.0 111.861 -179.208 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 151' ' ' ALA . . . . . . . . . . . . . . . -67.53 -30.57 70.27 Favored 'General case' 0 C--N 1.326 -0.445 0 CA-C-N 115.768 -0.651 . . . . 0.0 110.969 -177.932 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 152' ' ' ASP . . . . . 0.531 ' HA ' ' CZ ' ' A' ' 130' ' ' ARG . 33.6 t70 -77.03 -22.3 53.24 Favored 'General case' 0 C--N 1.326 -0.447 0 CA-C-O 121.419 0.628 . . . . 0.0 110.159 179.912 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 153' ' ' TYR . . . . . . . . . . . . . 29.6 t80 -85.14 -1.47 56.92 Favored 'General case' 0 C--N 1.324 -0.519 0 CA-C-N 115.562 -0.744 . . . . 0.0 109.786 178.997 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 154' ' ' VAL . . . . . . . . . . . . . 86.8 t -70.82 118.61 15.7 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.316 0 CA-C-N 115.959 -0.564 . . . . 0.0 109.499 173.412 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 155' ' ' ARG . . . . . . . . . . . . . 28.5 ttt85 -84.68 111.57 19.69 Favored 'General case' 0 C--N 1.319 -0.724 0 CA-C-N 116.115 -0.493 . . . . 0.0 110.355 -176.98 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 156' ' ' ILE . . . . . 0.495 HG21 ' HG2' ' A' ' 127' ' ' LYS . 47.6 mm -89.53 120.64 69.6 Favored Pre-proline 0 C--N 1.324 -0.505 0 CA-C-N 115.604 -0.726 . . . . 0.0 110.109 -178.727 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 157' ' ' PRO . . . . . 0.421 ' HD3' ' HA ' ' A' ' 156' ' ' ILE . 6.5 Cg_exo -73.39 130.49 15.13 Favored 'Trans proline' 0 N--CA 1.453 -0.861 0 C-N-CA 122.298 1.999 . . . . 0.0 111.123 177.376 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 158' ' ' LYS . . . . . . . . . . . . . 28.2 mtpp -94.63 1.51 55.58 Favored 'General case' 0 C--N 1.321 -0.661 0 CA-C-O 121.662 0.744 . . . . 0.0 109.386 177.64 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 159' ' ' ILE . . . . . . . . . . . . . 45.8 mt -81.71 87.14 1.73 Allowed 'Isoleucine or valine' 0 N--CA 1.45 -0.473 0 CA-C-N 114.995 -1.002 . . . . 0.0 110.128 179.766 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 160' ' ' ALA . . . . . . . . . . . . . . . -123.51 24.69 8.51 Favored 'General case' 0 C--N 1.321 -0.667 0 CA-C-N 115.694 -0.684 . . . . 0.0 109.312 177.121 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 161' ' ' LEU . . . . . . . . . . . . . 83.1 mt -54.73 117.47 3.41 Favored 'General case' 0 C--N 1.319 -0.757 0 CA-C-N 114.441 -1.254 . . . . 0.0 111.786 -176.072 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 162' ' ' GLU . . . . . . . . . . . . . 34.3 tt0 -69.82 -51.5 33.06 Favored 'General case' 0 C--N 1.327 -0.382 0 CA-C-N 115.953 -0.567 . . . . 0.0 109.857 175.09 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 163' ' ' HIS . . . . . . . . . . . . . 32.4 m80 -100.42 134.16 43.79 Favored 'General case' 0 C--N 1.324 -0.502 0 CA-C-N 115.594 -0.73 . . . . 0.0 110.073 178.608 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 164' ' ' HIS . . . . . . . . . . . . . 8.1 t60 -71.81 104.12 3.34 Favored 'General case' 0 C--N 1.322 -0.607 0 CA-C-N 116.04 -0.527 . . . . 0.0 109.887 178.206 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 165' ' ' HIS . . . . . 0.536 ' HD2' ' HA ' ' A' ' 168' ' ' HIS . 73.7 t60 -67.01 113.94 5.41 Favored 'General case' 0 C--N 1.323 -0.547 0 N-CA-C 109.111 -0.7 . . . . 0.0 109.111 176.251 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 166' ' ' HIS . . . . . . . . . . . . . 11.0 t60 -41.61 -66.06 0.38 Allowed 'General case' 0 N--CA 1.472 0.671 0 O-C-N 123.943 0.777 . . . . 0.0 111.995 -171.86 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 167' ' ' HIS . . . . . . . . . . . . . 11.0 t60 -115.95 103.81 10.97 Favored 'General case' 0 C--N 1.322 -0.592 0 N-CA-C 109.437 -0.579 . . . . 0.0 109.437 174.156 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 168' ' ' HIS . . . . . 0.536 ' HA ' ' HD2' ' A' ' 165' ' ' HIS . 18.5 p80 . . . . . 0 C--O 1.246 0.877 0 CA-C-O 118.367 -0.825 . . . . 0.0 110.176 179.541 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 61' ' ' ARG . . . . . . . . . . . . . 49.8 mtm180 . . . . . 0 N--CA 1.481 1.079 0 N-CA-C 110.278 -0.267 . . . . 0.0 110.278 . . . . . . . . . 0 0 . 1 . 018 nuclear orig full ' A' A ' 62' ' ' ASP . . . . . . . . . . . . . 15.8 m-20 50.31 76.88 0.13 Allowed 'General case' 0 N--CA 1.465 0.292 0 O-C-N 123.796 0.685 . . . . 0.0 111.666 179.295 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 63' ' ' SER . . . . . 0.537 ' HA ' ' HA ' ' A' ' 103' ' ' SER . 7.6 m -80.39 153.28 28.41 Favored 'General case' 0 C--N 1.323 -0.558 0 CA-C-N 116.062 -0.517 . . . . 0.0 109.844 178.628 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 64' ' ' PHE . . . . . 0.525 ' HB2' HD12 ' A' ' 107' ' ' ILE . 84.1 t80 -64.42 -42.52 95.99 Favored 'General case' 0 C--N 1.326 -0.455 0 N-CA-C 109.834 -0.432 . . . . 0.0 109.834 178.639 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 65' ' ' GLY . . . . . . . . . . . . . . . -62.8 -29.43 73.97 Favored Glycine 0 N--CA 1.45 -0.424 0 C-N-CA 120.784 -0.722 . . . . 0.0 112.083 176.137 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 66' ' ' ASP . . . . . . . . . . . . . 20.1 t70 -68.04 -48.13 66.5 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-O 120.837 0.351 . . . . 0.0 110.083 177.386 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 67' ' ' TRP . . . . . . . . . . . . . 52.8 m95 -70.99 -30.49 66.76 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 115.94 -0.573 . . . . 0.0 111.573 178.497 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 68' ' ' ALA . . . . . 0.496 ' O ' ' HG ' ' A' ' 72' ' ' LEU . . . -60.01 -49.34 78.04 Favored 'General case' 0 C--N 1.328 -0.359 0 N-CA-C 109.812 -0.44 . . . . 0.0 109.812 173.813 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 69' ' ' GLU . . . . . . . . . . . . . 5.6 mm-40 -58.19 -41.72 84.54 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 115.976 -0.556 . . . . 0.0 110.843 175.918 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 70' ' ' LYS . . . . . . . . . . . . . 61.6 tttm -62.45 -47.93 81.89 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.3 -0.409 . . . . 0.0 110.219 179.299 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 71' ' ' PHE . . . . . . . . . . . . . 33.7 t80 -59.56 -49.61 77.12 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 115.96 -0.564 . . . . 0.0 110.742 176.955 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 72' ' ' LEU . . . . . 0.496 ' HG ' ' O ' ' A' ' 68' ' ' ALA . 91.6 mt -61.01 -35.74 77.67 Favored 'General case' 0 C--N 1.327 -0.401 0 CA-C-N 116.281 -0.418 . . . . 0.0 111.154 -178.918 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 73' ' ' LYS . . . . . . . . . . . . . 61.8 mmtt -72.45 -41.64 65.89 Favored 'General case' 0 C--N 1.327 -0.376 0 C-N-CA 121.234 -0.186 . . . . 0.0 111.379 178.52 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 74' ' ' SER . . . . . . . . . . . . . 12.3 p -68.17 -29.43 68.31 Favored 'General case' 0 C--N 1.327 -0.396 0 CA-C-O 120.956 0.408 . . . . 0.0 110.399 177.139 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 75' ' ' LYS . . . . . . . . . . . . . 45.5 tptt -78.22 -31.43 49.36 Favored 'General case' 0 N--CA 1.446 -0.666 0 CA-C-O 121.085 0.469 . . . . 0.0 110.028 177.154 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 76' ' ' GLU . . . . . . . . . . . . . 37.1 tt0 -63.78 -40.34 96.44 Favored 'General case' 0 C--N 1.326 -0.431 0 CA-C-N 115.768 -0.651 . . . . 0.0 109.863 175.485 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 77' ' ' ALA . . . . . . . . . . . . . . . -80.02 -18.02 51.28 Favored 'General case' 0 C--N 1.327 -0.412 0 CA-C-N 115.891 -0.595 . . . . 0.0 111.123 176.318 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 78' ' ' ASP . . . . . . . . . . . . . 28.5 t70 -68.45 -21.41 64.65 Favored 'General case' 0 N--CA 1.465 0.3 0 CA-C-N 115.913 -0.585 . . . . 0.0 110.538 178.771 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 79' ' ' GLY . . . . . . . . . . . . . . . 102.51 71.26 0.89 Allowed Glycine 0 N--CA 1.447 -0.622 0 C-N-CA 120.734 -0.746 . . . . 0.0 112.276 177.387 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 80' ' ' VAL . . . . . . . . . . . . . 28.0 m -123.87 148.62 27.93 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.5 0 CA-C-O 121.083 0.468 . . . . 0.0 110.763 179.765 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 81' ' ' SER . . . . . . . . . . . . . 14.6 m -75.9 162.46 28.1 Favored 'General case' 0 C--N 1.322 -0.618 0 CA-C-N 115.649 -0.705 . . . . 0.0 109.941 177.093 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 82' ' ' VAL . . . . . . . . . . . . . 57.0 t -58.12 -45.23 88.58 Favored 'Isoleucine or valine' 0 C--O 1.222 -0.375 0 CA-C-N 116.414 -0.357 . . . . 0.0 111.195 -176.566 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 83' ' ' SER . . . . . . . . . . . . . 17.2 t -65.46 -32.65 74.37 Favored 'General case' 0 C--N 1.326 -0.419 0 CA-C-O 120.874 0.368 . . . . 0.0 111.272 -177.955 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 84' ' ' GLN . . . . . . . . . . . . . 8.7 tp-100 -69.85 -42.61 73.33 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-O 121.074 0.464 . . . . 0.0 110.314 179.258 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 85' ' ' LEU . . . . . . . . . . . . . 25.5 tp -75.07 -26.73 59.57 Favored 'General case' 0 C--N 1.321 -0.641 0 CA-C-O 121.282 0.563 . . . . 0.0 109.924 178.556 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 86' ' ' ASN . . . . . . . . . . . . . 26.5 t-20 -64.54 -47.7 77.81 Favored 'General case' 0 C--N 1.325 -0.464 0 CA-C-N 115.314 -0.857 . . . . 0.0 110.454 176.498 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 87' ' ' SER . . . . . . . . . . . . . 11.3 p -65.14 -35.89 82.55 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.295 -0.411 . . . . 0.0 110.623 179.75 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 88' ' ' TYR . . . . . . . . . . . . . 11.5 m-85 -57.99 -43.77 86.78 Favored 'General case' 0 C--O 1.234 0.28 0 CA-C-O 120.858 0.361 . . . . 0.0 110.393 174.265 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 89' ' ' LYS . . . . . . . . . . . . . 63.9 mttp -62.69 -38.57 90.92 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 116.044 -0.525 . . . . 0.0 110.605 176.617 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 90' ' ' ASN . . . . . . . . . . . . . 95.4 m-20 -62.64 -42.94 99.88 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.201 -0.454 . . . . 0.0 111.242 -178.9 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 91' ' ' TYR . . . . . . . . . . . . . 43.3 m-85 -59.25 -45.67 90.56 Favored 'General case' 0 C--O 1.235 0.334 0 CA-C-O 121.09 0.471 . . . . 0.0 110.14 177.217 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 92' ' ' CYS . . . . . 0.587 ' HA ' ' HB2' ' A' ' 96' ' ' LEU . 57.9 m -71.45 -43.52 66.53 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 115.626 -0.715 . . . . 0.0 112.014 -175.552 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 93' ' ' ARG . . . . . . . . . . . . . 18.8 mtp180 -84.58 -7.77 59.14 Favored 'General case' 0 C--N 1.325 -0.457 0 N-CA-C 112.454 0.538 . . . . 0.0 112.454 -173.576 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 94' ' ' ASN . . . . . . . . . . . . . 12.3 t-20 -111.1 -61.26 1.72 Allowed 'General case' 0 C--N 1.328 -0.355 0 CA-C-O 120.769 0.319 . . . . 0.0 111.859 179.006 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 95' ' ' HIS . . . . . . . . . . . . . 0.2 OUTLIER -87.67 -34.57 18.39 Favored 'General case' 0 C--N 1.324 -0.531 0 N-CA-C 112.363 0.505 . . . . 0.0 112.363 -175.473 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 96' ' ' LEU . . . . . 0.587 ' HB2' ' HA ' ' A' ' 92' ' ' CYS . 85.4 mt -91.65 12.45 21.05 Favored 'General case' 0 C--N 1.324 -0.507 0 C-N-CA 121.215 -0.194 . . . . 0.0 111.212 -176.809 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 97' ' ' SER . . . . . 0.509 ' N ' ' HD2' ' A' ' 98' ' ' PRO . 18.6 m -50.85 -50.2 75.46 Favored Pre-proline 0 CA--C 1.539 0.541 0 N-CA-C 112.284 0.476 . . . . 0.0 112.284 179.483 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 98' ' ' PRO . . . . . 0.509 ' HD2' ' N ' ' A' ' 97' ' ' SER . 13.8 Cg_endo -58.09 -41.33 68.85 Favored 'Trans proline' 0 C--N 1.358 1.034 0 C-N-CA 121.962 1.775 . . . . 0.0 112.585 177.622 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 99' ' ' LEU . . . . . . . . . . . . . 11.2 mp -79.8 -29.74 40.37 Favored 'General case' 0 C--N 1.326 -0.416 0 CA-C-N 116.459 -0.337 . . . . 0.0 111.801 -174.972 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 100' ' ' TYR . . . . . . . . . . . . . 46.3 t80 -52.74 -40.73 63.35 Favored 'General case' 0 C--N 1.328 -0.349 0 C-N-CA 122.795 0.438 . . . . 0.0 111.434 -176.738 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 101' ' ' MET . . . . . . . . . . . . . 64.5 mtt -89.94 -0.53 57.62 Favored 'General case' 0 C--N 1.325 -0.469 0 CA-C-N 116.258 -0.428 . . . . 0.0 111.69 -176.755 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 102' ' ' LYS . . . . . 0.453 ' HG3' ' O ' ' A' ' 98' ' ' PRO . 97.3 mttt -91.13 161.89 14.9 Favored 'General case' 0 C--N 1.326 -0.444 0 CA-C-O 121.047 0.451 . . . . 0.0 110.438 179.493 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 103' ' ' SER . . . . . 0.537 ' HA ' ' HA ' ' A' ' 63' ' ' SER . 29.0 t -82.12 154.87 25.33 Favored 'General case' 0 N--CA 1.447 -0.598 0 N-CA-C 108.881 -0.785 . . . . 0.0 108.881 172.423 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 104' ' ' LEU . . . . . . . . . . . . . 23.6 tp -61.62 -25.35 67.3 Favored 'General case' 0 C--N 1.321 -0.671 0 CA-C-O 121.092 0.473 . . . . 0.0 110.4 -179.041 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 105' ' ' SER . . . . . . . . . . . . . 35.5 t -86.27 -14.4 43.87 Favored 'General case' 0 C--N 1.327 -0.377 0 CA-C-N 116.003 -0.544 . . . . 0.0 111.375 178.855 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 106' ' ' GLU . . . . . 0.521 ' HG3' ' HB3' ' A' ' 103' ' ' SER . 49.4 mt-10 -93.03 4.72 53.52 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-O 120.861 0.362 . . . . 0.0 111.113 -177.258 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 107' ' ' ILE . . . . . 0.54 HG21 ' HZ ' ' A' ' 137' ' ' PHE . 74.7 mt -95.81 118.13 41.42 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.756 0 CA-C-O 121.23 0.538 . . . . 0.0 111.035 -177.456 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 108' ' ' LEU . . . . . . . . . . . . . 7.6 mp -97.05 138.88 21.27 Favored Pre-proline 0 C--N 1.323 -0.582 0 CA-C-N 115.364 -0.835 . . . . 0.0 110.038 -179.992 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 109' ' ' PRO . . . . . . . . . . . . . 11.2 Cg_endo -56.7 -35.74 97.82 Favored 'Trans proline' 0 C--O 1.234 0.322 0 C-N-CA 122.63 2.22 . . . . 0.0 112.268 177.404 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 110' ' ' ALA . . . . . . . . . . . . . . . -70.61 -29.67 66.13 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.236 -0.438 . . . . 0.0 111.232 179.788 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 111' ' ' ASP . . . . . . . . . . . . . 33.2 t70 -68.27 -41.52 80.92 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-O 121.073 0.463 . . . . 0.0 110.048 179.997 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 112' ' ' ILE . . . . . . . . . . . . . 18.7 mt -67.1 -43.04 88.99 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.355 0 CA-C-N 115.809 -0.632 . . . . 0.0 109.698 176.385 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 113' ' ' GLN . . . . . 0.574 ' HG2' ' HA ' ' A' ' 154' ' ' VAL . 0.0 OUTLIER -55.16 -41.62 72.1 Favored 'General case' 0 C--O 1.233 0.211 0 CA-C-N 115.627 -0.715 . . . . 0.0 111.023 176.568 . . . . . . . . 3 3 . 1 . 018 nuclear orig full ' A' A ' 114' ' ' SER . . . . . . . . . . . . . 14.3 t -59.75 -46.54 88.85 Favored 'General case' 0 N--CA 1.453 -0.319 0 CA-C-N 116.101 -0.5 . . . . 0.0 110.387 178.889 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 115' ' ' ILE . . . . . . . . . . . . . 69.3 mt -55.88 -51.93 54.91 Favored 'Isoleucine or valine' 0 C--O 1.233 0.225 0 CA-C-O 120.919 0.39 . . . . 0.0 110.918 -179.485 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 116' ' ' ILE . . . . . . . . . . . . . 49.8 mm -62.08 -39.38 83.6 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.322 0 CA-C-N 115.902 -0.59 . . . . 0.0 111.225 -178.421 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 117' ' ' ASN . . . . . 0.41 ' C ' HD21 ' A' ' 117' ' ' ASN . 0.2 OUTLIER -69.81 -39.27 76.62 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-O 120.929 0.395 . . . . 0.0 110.503 -178.873 . . . . . . . . 3 3 . 1 . 018 nuclear orig full ' A' A ' 118' ' ' GLU . . . . . . . . . . . . . 49.5 mt-10 -80.76 -8.7 59.75 Favored 'General case' 0 C--N 1.327 -0.374 0 CA-C-N 116.368 -0.378 . . . . 0.0 111.271 -177.192 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 119' ' ' THR . . . . . . . . . . . . . 89.5 m -89.88 123.47 33.85 Favored 'General case' 0 C--N 1.326 -0.438 0 CA-C-O 120.834 0.349 . . . . 0.0 110.912 176.17 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 120' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -98.9 80.52 2.51 Favored 'General case' 0 C--N 1.326 -0.443 0 CA-C-O 121.041 0.448 . . . . 0.0 110.692 178.358 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 121' ' ' LEU . . . . . . . . . . . . . 65.1 mt -132.54 -175.77 3.87 Favored 'General case' 0 C--N 1.324 -0.543 0 CA-C-N 115.713 -0.676 . . . . 0.0 109.747 178.463 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 122' ' ' ALA . . . . . . . . . . . . . . . -72.6 146.04 46.92 Favored 'General case' 0 C--N 1.325 -0.499 0 CA-C-N 116.434 -0.348 . . . . 0.0 110.33 177.722 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 123' ' ' LYS . . . . . 0.513 ' O ' ' HG3' ' A' ' 127' ' ' LYS . 59.6 pttt -58.54 -29.53 66.41 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-O 120.844 0.354 . . . . 0.0 110.915 -179.71 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 124' ' ' ASN . . . . . . . . . . . . . 14.4 m120 -68.34 -40.47 81.56 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.178 -0.465 . . . . 0.0 110.48 178.642 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 125' ' ' THR . . . . . . . . . . . . . 6.2 m -67.67 -35.76 79.46 Favored 'General case' 0 C--N 1.327 -0.378 0 CA-C-N 116.095 -0.502 . . . . 0.0 110.219 179.273 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 126' ' ' LEU . . . . . . . . . . . . . 90.7 mt -64.72 -37.17 86.7 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 115.885 -0.598 . . . . 0.0 110.493 178.068 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 127' ' ' LYS . . . . . 0.513 ' HG3' ' O ' ' A' ' 123' ' ' LYS . 97.7 mttt -68.58 -28.87 67.33 Favored 'General case' 0 C--N 1.332 -0.192 0 CA-C-N 116.092 -0.503 . . . . 0.0 110.835 178.032 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 128' ' ' ALA . . . . . . . . . . . . . . . -65.79 -43.86 87.45 Favored 'General case' 0 C--N 1.327 -0.378 0 CA-C-O 120.981 0.42 . . . . 0.0 110.492 176.606 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 129' ' ' ILE . . . . . . . . . . . . . 47.9 mt -64.71 -47.08 90.22 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.221 0 CA-C-N 115.909 -0.587 . . . . 0.0 109.773 176.166 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 130' ' ' ARG . . . . . . . . . . . . . 5.5 tpt180 -52.87 -45.05 67.28 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 115.587 -0.733 . . . . 0.0 110.882 174.768 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 131' ' ' ASN . . . . . . . . . . . . . 10.5 t30 -61.97 -55.95 24.15 Favored 'General case' 0 C--N 1.326 -0.445 0 CA-C-N 116.144 -0.48 . . . . 0.0 111.744 -176.872 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 132' ' ' THR . . . . . 0.411 ' O ' HG13 ' A' ' 136' ' ' ILE . 14.9 t -65.59 -33.03 74.96 Favored 'General case' 0 CA--C 1.531 0.222 0 C-N-CA 120.84 -0.344 . . . . 0.0 110.938 -175.371 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 133' ' ' ALA . . . . . . . . . . . . . . . -69.75 -46.39 65.97 Favored 'General case' 0 C--N 1.331 -0.205 0 CA-C-O 120.919 0.39 . . . . 0.0 110.515 178.358 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 134' ' ' SER . . . . . . . . . . . . . 22.9 t -61.0 -37.67 83.32 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 115.893 -0.594 . . . . 0.0 110.27 -179.977 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 135' ' ' GLN . . . . . . . . . . . . . 1.1 mp0 -59.08 -45.34 91.08 Favored 'General case' 0 C--N 1.331 -0.232 0 CA-C-N 116.401 -0.363 . . . . 0.0 111.042 176.489 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 136' ' ' ILE . . . . . 0.411 HG13 ' O ' ' A' ' 132' ' ' THR . 73.1 mt -65.03 -47.79 86.55 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.296 0 CA-C-O 120.904 0.383 . . . . 0.0 110.691 179.017 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 137' ' ' PHE . . . . . 0.54 ' HZ ' HG21 ' A' ' 107' ' ' ILE . 41.8 m-85 -62.28 -47.06 85.98 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 116.195 -0.457 . . . . 0.0 111.696 -179.645 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 138' ' ' ARG . . . . . 0.406 ' O ' ' HG2' ' A' ' 142' ' ' GLU . 11.3 ptm180 -74.05 -21.03 60.1 Favored 'General case' 0 C--N 1.327 -0.385 0 C-N-CA 120.538 -0.465 . . . . 0.0 110.853 -176.39 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 139' ' ' LEU . . . . . . . . . . . . . 62.6 tp -63.59 -41.8 98.32 Favored 'General case' 0 C--O 1.234 0.266 0 N-CA-C 109.232 -0.655 . . . . 0.0 109.232 173.256 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 140' ' ' ALA . . . . . 0.498 ' HB2' ' HB3' ' A' ' 145' ' ' ALA . . . -65.24 -32.57 74.31 Favored 'General case' 0 C--N 1.326 -0.429 0 CA-C-N 115.495 -0.775 . . . . 0.0 110.152 176.211 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 141' ' ' ILE . . . . . . . . . . . . . 60.4 mt -64.94 -44.16 96.15 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.29 0 CA-C-N 116.233 -0.44 . . . . 0.0 110.191 175.653 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 142' ' ' GLU . . . . . 0.406 ' HG2' ' O ' ' A' ' 138' ' ' ARG . 34.3 mm-40 -63.33 -29.31 70.64 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-O 121.088 0.471 . . . . 0.0 110.716 177.71 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 143' ' ' ASN . . . . . 0.465 HD21 ' N ' ' A' ' 143' ' ' ASN . 0.9 OUTLIER -93.23 0.85 57.2 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.064 -0.517 . . . . 0.0 111.003 -179.031 . . . . . . . . 3 3 . 1 . 018 nuclear orig full ' A' A ' 144' ' ' ARG . . . . . . . . . . . . . 35.1 mtp85 57.47 36.0 26.5 Favored 'General case' 0 N--CA 1.464 0.26 0 CA-C-N 115.752 -0.658 . . . . 0.0 112.272 -178.933 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 145' ' ' ALA . . . . . 0.498 ' HB3' ' HB2' ' A' ' 140' ' ' ALA . . . -82.29 -33.73 28.97 Favored 'General case' 0 C--N 1.325 -0.5 0 N-CA-C 109.268 -0.641 . . . . 0.0 109.268 173.357 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 146' ' ' ILE . . . . . . . . . . . . . 9.8 tt -159.22 125.63 0.54 Allowed 'Isoleucine or valine' 0 C--N 1.324 -0.526 0 CA-C-N 114.873 -1.058 . . . . 0.0 109.433 178.998 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 147' ' ' ASP . . . . . . . . . . . . . 20.9 t70 -99.1 68.46 1.68 Allowed 'General case' 0 C--N 1.319 -0.738 0 CA-C-O 121.662 0.744 . . . . 0.0 109.624 178.575 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 148' ' ' PHE . . . . . 0.465 ' O ' ' HD3' ' A' ' 150' ' ' PRO . 55.8 t80 -169.38 126.44 0.92 Allowed 'General case' 0 C--N 1.321 -0.667 0 CA-C-N 115.086 -0.961 . . . . 0.0 109.178 -179.158 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 149' ' ' ASN . . . . . . . . . . . . . 48.8 t-20 -108.52 95.96 17.85 Favored Pre-proline 0 C--N 1.323 -0.57 0 N-CA-C 110.076 -0.342 . . . . 0.0 110.076 179.272 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 150' ' ' PRO . . . . . 0.465 ' HD3' ' O ' ' A' ' 148' ' ' PHE . 21.6 Cg_exo -65.34 -26.37 56.04 Favored 'Trans proline' 0 C--N 1.342 0.229 0 C-N-CA 122.756 2.304 . . . . 0.0 112.03 -179.626 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 151' ' ' ALA . . . . . . . . . . . . . . . -72.6 -20.38 61.31 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 115.941 -0.572 . . . . 0.0 110.806 -178.032 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 152' ' ' ASP . . . . . . . . . . . . . 28.3 t70 -70.76 -24.91 62.69 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-O 121.089 0.471 . . . . 0.0 110.149 178.488 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 153' ' ' TYR . . . . . . . . . . . . . 58.8 m-85 -83.86 -1.47 54.5 Favored 'General case' 0 C--N 1.327 -0.374 0 CA-C-N 115.772 -0.649 . . . . 0.0 110.51 179.585 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 154' ' ' VAL . . . . . 0.574 ' HA ' ' HG2' ' A' ' 113' ' ' GLN . 55.9 t -88.74 111.52 22.72 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.504 0 CA-C-N 115.807 -0.633 . . . . 0.0 110.311 179.65 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 155' ' ' ARG . . . . . . . . . . . . . 83.9 mtm180 -83.99 141.24 31.35 Favored 'General case' 0 C--N 1.319 -0.742 0 CA-C-N 115.41 -0.814 . . . . 0.0 109.944 179.807 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 156' ' ' ILE . . . . . . . . . . . . . 50.7 mm -96.97 113.67 63.35 Favored Pre-proline 0 C--N 1.319 -0.741 0 N-CA-C 109.408 -0.59 . . . . 0.0 109.408 178.704 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 157' ' ' PRO . . . . . . . . . . . . . 28.4 Cg_exo -61.8 130.02 29.74 Favored 'Trans proline' 0 N--CA 1.46 -0.444 0 C-N-CA 122.53 2.153 . . . . 0.0 112.196 -177.754 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 158' ' ' LYS . . . . . . . . . . . . . 43.5 mtmt -109.35 41.48 1.64 Allowed 'General case' 0 C--N 1.319 -0.75 0 N-CA-C 109.184 -0.673 . . . . 0.0 109.184 178.809 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 159' ' ' ILE . . . . . . . . . . . . . 50.4 mt -78.34 75.46 0.66 Allowed 'Isoleucine or valine' 0 C--N 1.324 -0.532 0 CA-C-N 115.288 -0.869 . . . . 0.0 110.896 -175.841 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 160' ' ' ALA . . . . . . . . . . . . . . . -124.13 14.96 9.12 Favored 'General case' 0 C--N 1.322 -0.6 0 CA-C-O 122.277 1.037 . . . . 0.0 108.855 172.601 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 161' ' ' LEU . . . . . . . . . . . . . 0.9 OUTLIER -128.42 30.97 5.09 Favored 'General case' 0 C--N 1.315 -0.894 0 CA-C-N 113.813 -1.539 . . . . 0.0 109.748 -177.663 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 162' ' ' GLU . . . . . . . . . . . . . 8.2 tp10 79.48 151.44 0.11 Allowed 'General case' 0 C--O 1.233 0.226 0 CA-C-N 114.632 -1.167 . . . . 0.0 110.725 -175.458 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 163' ' ' HIS . . . . . . . . . . . . . 27.3 p-80 -99.7 136.88 38.97 Favored 'General case' 0 C--N 1.325 -0.466 0 CA-C-N 115.79 -0.641 . . . . 0.0 111.145 -173.708 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 164' ' ' HIS . . . . . . . . . . . . . 8.5 p80 -144.06 23.95 1.67 Allowed 'General case' 0 C--N 1.323 -0.568 0 CA-C-N 115.843 -0.617 . . . . 0.0 110.122 174.348 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 165' ' ' HIS . . . . . . . . . . . . . 72.7 t60 -75.93 88.65 2.92 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 115.489 -0.778 . . . . 0.0 109.351 172.292 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 166' ' ' HIS . . . . . . . . . . . . . 28.4 t-80 -117.61 121.4 40.81 Favored 'General case' 0 C--N 1.321 -0.65 0 CA-C-N 115.969 -0.559 . . . . 0.0 110.336 -179.647 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 167' ' ' HIS . . . . . . . . . . . . . 80.2 t60 -86.8 131.38 34.14 Favored 'General case' 0 C--N 1.32 -0.714 0 CA-C-N 115.703 -0.681 . . . . 0.0 110.031 -178.934 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 168' ' ' HIS . . . . . . . . . . . . . 47.3 t-80 . . . . . 0 C--O 1.247 0.968 0 CA-C-O 118.396 -0.812 . . . . 0.0 109.696 179.434 . . . . . . . . 0 0 . 1 . 019 nuclear orig full ' A' A ' 61' ' ' ARG . . . . . . . . . . . . . 13.7 ttt85 . . . . . 0 N--CA 1.476 0.87 0 N-CA-C 108.756 -0.831 . . . . 0.0 108.756 . . . . . . . . . 0 0 . 1 . 019 nuclear orig full ' A' A ' 62' ' ' ASP . . . . . 0.62 ' HB3' ' HB2' ' A' ' 66' ' ' ASP . 3.3 m-20 74.17 158.7 0.21 Allowed 'General case' 0 N--CA 1.467 0.378 0 CA-C-O 121.352 0.596 . . . . 0.0 111.47 174.947 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 63' ' ' SER . . . . . . . . . . . . . 78.6 p -100.42 179.86 4.32 Favored 'General case' 0 C--N 1.319 -0.72 0 N-CA-C 109.274 -0.639 . . . . 0.0 109.274 176.255 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 64' ' ' PHE . . . . . 0.468 ' HB3' ' O ' ' A' ' 99' ' ' LEU . 74.6 t80 -63.45 -35.93 82.05 Favored 'General case' 0 C--N 1.327 -0.378 0 C-N-CA 120.862 -0.335 . . . . 0.0 110.384 -177.409 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 65' ' ' GLY . . . . . . . . . . . . . . . -60.0 -38.33 94.05 Favored Glycine 0 N--CA 1.452 -0.249 0 C-N-CA 120.964 -0.636 . . . . 0.0 112.411 178.072 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 66' ' ' ASP . . . . . 0.62 ' HB2' ' HB3' ' A' ' 62' ' ' ASP . 16.4 m-20 -65.8 -43.57 88.33 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-O 120.917 0.389 . . . . 0.0 110.417 -179.921 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 67' ' ' TRP . . . . . . . . . . . . . 98.7 m95 -73.02 -34.21 66.21 Favored 'General case' 0 C--N 1.326 -0.43 0 CA-C-N 115.938 -0.573 . . . . 0.0 111.026 179.675 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 68' ' ' ALA . . . . . 0.537 ' O ' ' HG ' ' A' ' 72' ' ' LEU . . . -61.02 -44.22 97.73 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-O 120.903 0.382 . . . . 0.0 110.101 175.564 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 69' ' ' GLU . . . . . . . . . . . . . 31.2 tt0 -59.75 -45.98 90.57 Favored 'General case' 0 C--O 1.232 0.14 0 CA-C-N 115.806 -0.634 . . . . 0.0 110.22 175.127 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 70' ' ' LYS . . . . . . . . . . . . . 51.5 tttp -57.69 -42.95 84.69 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-N 115.541 -0.754 . . . . 0.0 110.442 179.326 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 71' ' ' PHE . . . . . . . . . . . . . 77.9 t80 -62.31 -49.99 73.44 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-N 115.77 -0.65 . . . . 0.0 110.627 176.525 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 72' ' ' LEU . . . . . 0.537 ' HG ' ' O ' ' A' ' 68' ' ' ALA . 93.4 mt -56.57 -41.54 77.08 Favored 'General case' 0 C--N 1.327 -0.379 0 CA-C-N 116.163 -0.472 . . . . 0.0 110.794 -179.915 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 73' ' ' LYS . . . . . 0.409 ' HA ' ' HB3' ' A' ' 76' ' ' GLU . 36.9 tttp -77.49 -28.45 52.21 Favored 'General case' 0 C--N 1.324 -0.514 0 CA-C-N 116.024 -0.535 . . . . 0.0 111.441 -175.963 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 74' ' ' SER . . . . . 0.41 ' O ' ' HB2' ' A' ' 78' ' ' ASP . 95.3 p -65.67 -31.43 72.44 Favored 'General case' 0 C--N 1.33 -0.262 0 C-N-CA 120.493 -0.483 . . . . 0.0 109.988 178.254 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 75' ' ' LYS . . . . . . . . . . . . . 0.8 OUTLIER -79.32 -42.0 26.7 Favored 'General case' 0 C--O 1.234 0.262 0 CA-C-N 116.444 -0.344 . . . . 0.0 110.509 173.606 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 76' ' ' GLU . . . . . 0.409 ' HB3' ' HA ' ' A' ' 73' ' ' LYS . 42.8 tt0 -52.43 -50.16 63.12 Favored 'General case' 0 CA--C 1.532 0.261 0 CA-C-N 116.137 -0.483 . . . . 0.0 110.776 175.307 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 77' ' ' ALA . . . . . . . . . . . . . . . -73.79 -30.13 62.57 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 115.958 -0.565 . . . . 0.0 111.726 -178.94 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 78' ' ' ASP . . . . . 0.41 ' HB2' ' O ' ' A' ' 74' ' ' SER . 16.1 t70 -62.03 -40.53 96.03 Favored 'General case' 0 N--CA 1.464 0.237 0 CA-C-O 120.985 0.421 . . . . 0.0 110.436 179.802 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 79' ' ' GLY . . . . . . . . . . . . . . . 121.01 33.26 0.99 Allowed Glycine 0 N--CA 1.447 -0.582 0 C-N-CA 120.702 -0.761 . . . . 0.0 113.269 176.291 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 80' ' ' VAL . . . . . . . . . . . . . 24.3 m -81.22 147.01 6.58 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.451 0 N-CA-C 109.894 -0.41 . . . . 0.0 109.894 176.471 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 81' ' ' SER . . . . . . . . . . . . . 23.2 t -68.14 155.58 39.31 Favored 'General case' 0 C--N 1.321 -0.649 0 CA-C-O 120.939 0.399 . . . . 0.0 110.952 -178.071 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 82' ' ' VAL . . . . . . . . . . . . . 7.5 p -56.8 -33.93 42.27 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.24 0 CA-C-N 115.769 -0.65 . . . . 0.0 111.457 -177.893 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 83' ' ' SER . . . . . . . . . . . . . 16.0 m -60.65 -39.62 89.0 Favored 'General case' 0 C--O 1.235 0.299 0 CA-C-O 121.061 0.458 . . . . 0.0 110.592 178.347 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 84' ' ' GLN . . . . . . . . . . . . . 5.8 tp-100 -76.01 -39.36 55.93 Favored 'General case' 0 C--N 1.327 -0.392 0 CA-C-N 116.175 -0.466 . . . . 0.0 109.912 -179.909 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 85' ' ' LEU . . . . . 0.427 HD23 ' HA ' ' A' ' 85' ' ' LEU . 0.3 OUTLIER -63.03 -40.23 97.12 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.06 -0.518 . . . . 0.0 109.932 178.548 . . . . . . . . 3 3 . 1 . 019 nuclear orig full ' A' A ' 86' ' ' ASN . . . . . 0.563 ' HA ' ' HD2' ' A' ' 89' ' ' LYS . 80.2 m-20 -62.58 -37.51 86.46 Favored 'General case' 0 CA--C 1.516 -0.338 0 CA-C-N 116.018 -0.537 . . . . 0.0 110.918 176.201 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 87' ' ' SER . . . . . . . . . . . . . 9.6 t -60.8 -41.82 96.39 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-O 120.888 0.375 . . . . 0.0 110.07 178.435 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 88' ' ' TYR . . . . . . . . . . . . . 34.0 m-85 -60.43 -34.43 73.96 Favored 'General case' 0 C--N 1.332 -0.171 0 CA-C-N 116.05 -0.523 . . . . 0.0 110.755 176.681 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 89' ' ' LYS . . . . . 0.563 ' HD2' ' HA ' ' A' ' 86' ' ' ASN . 56.3 mttm -63.88 -39.35 93.98 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.377 -0.374 . . . . 0.0 110.504 176.255 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 90' ' ' ASN . . . . . . . . . . . . . 23.9 m120 -60.0 -34.84 73.88 Favored 'General case' 0 C--O 1.233 0.228 0 CA-C-O 121.061 0.458 . . . . 0.0 110.495 177.164 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 91' ' ' TYR . . . . . . . . . . . . . 31.3 m-85 -80.75 -62.9 1.53 Allowed 'General case' 0 C--N 1.325 -0.467 0 CA-C-N 116.251 -0.431 . . . . 0.0 110.841 179.295 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 92' ' ' CYS . . . . . 0.417 ' HA ' ' HB2' ' A' ' 96' ' ' LEU . 70.2 m -68.54 -49.53 58.79 Favored 'General case' 0 C--N 1.324 -0.502 0 N-CA-C 112.595 0.591 . . . . 0.0 112.595 -171.4 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 93' ' ' ARG . . . . . 0.539 ' HD3' ' O ' ' A' ' 93' ' ' ARG . 0.7 OUTLIER -83.21 -38.41 22.3 Favored 'General case' 0 C--N 1.32 -0.708 0 C-N-CA 120.681 -0.408 . . . . 0.0 111.069 -171.639 . . . . . . . . 3 3 . 1 . 019 nuclear orig full ' A' A ' 94' ' ' ASN . . . . . . . . . . . . . 6.7 t30 -91.8 -41.49 10.63 Favored 'General case' 0 C--N 1.326 -0.431 0 N-CA-C 112.172 0.434 . . . . 0.0 112.172 -172.72 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 95' ' ' HIS . . . . . . . . . . . . . 45.6 m80 -88.7 -49.43 6.86 Favored 'General case' 0 C--N 1.328 -0.343 0 N-CA-C 112.069 0.396 . . . . 0.0 112.069 178.678 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 96' ' ' LEU . . . . . 0.536 ' HG ' HD12 ' A' ' 99' ' ' LEU . 9.9 mp -84.91 26.69 0.82 Allowed 'General case' 0 C--N 1.324 -0.507 0 CA-C-N 116.318 -0.401 . . . . 0.0 111.214 -175.743 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 97' ' ' SER . . . . . 0.496 ' N ' ' HD2' ' A' ' 98' ' ' PRO . 5.2 m -53.96 -52.05 71.58 Favored Pre-proline 0 CA--C 1.538 0.498 0 CA-C-N 116.174 -0.467 . . . . 0.0 112.167 -178.762 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 98' ' ' PRO . . . . . 0.496 ' HD2' ' N ' ' A' ' 97' ' ' SER . 18.8 Cg_endo -59.6 -38.27 83.15 Favored 'Trans proline' 0 C--N 1.355 0.92 0 C-N-CA 121.814 1.676 . . . . 0.0 112.142 178.162 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 99' ' ' LEU . . . . . 0.536 HD12 ' HG ' ' A' ' 96' ' ' LEU . 65.4 mt -69.26 -25.31 64.21 Favored 'General case' 0 C--N 1.327 -0.391 0 CA-C-N 116.103 -0.499 . . . . 0.0 111.157 -176.094 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 100' ' ' TYR . . . . . . . . . . . . . 0.2 OUTLIER -58.05 -34.13 69.76 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.361 -0.381 . . . . 0.0 111.449 179.784 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 101' ' ' MET . . . . . . . . . . . . . 23.8 ttt -98.08 2.99 49.28 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-O 121.499 0.666 . . . . 0.0 110.472 -178.773 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 102' ' ' LYS . . . . . 0.579 ' HB3' ' OE2' ' A' ' 106' ' ' GLU . 8.5 mtpm? -102.98 167.67 9.69 Favored 'General case' 0 C--N 1.322 -0.6 0 CA-C-N 115.872 -0.604 . . . . 0.0 110.277 -179.133 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 103' ' ' SER . . . . . 0.538 ' O ' HG13 ' A' ' 107' ' ' ILE . 44.3 m -110.14 136.03 50.0 Favored 'General case' 0 C--N 1.319 -0.723 0 N-CA-C 109.248 -0.649 . . . . 0.0 109.248 178.936 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 104' ' ' LEU . . . . . . . . . . . . . 1.6 pp -60.58 -13.43 14.18 Favored 'General case' 0 C--N 1.325 -0.487 0 N-CA-C 112.541 0.571 . . . . 0.0 112.541 -175.167 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 105' ' ' SER . . . . . . . . . . . . . 35.3 t -87.08 -14.61 40.92 Favored 'General case' 0 C--N 1.327 -0.404 0 CA-C-N 116.518 -0.31 . . . . 0.0 110.882 178.296 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 106' ' ' GLU . . . . . 0.579 ' OE2' ' HB3' ' A' ' 102' ' ' LYS . 0.8 OUTLIER -123.02 12.44 9.66 Favored 'General case' 0 CA--C 1.532 0.271 0 CA-C-O 121.162 0.506 . . . . 0.0 111.077 179.283 . . . . . . . . 3 3 . 1 . 019 nuclear orig full ' A' A ' 107' ' ' ILE . . . . . 0.538 HG13 ' O ' ' A' ' 103' ' ' SER . 77.4 mt -90.06 121.66 40.55 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.276 0 CA-C-N 116.018 -0.537 . . . . 0.0 109.884 173.607 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 108' ' ' LEU . . . . . . . . . . . . . 7.6 mp -85.48 147.52 47.02 Favored Pre-proline 0 C--N 1.323 -0.576 0 CA-C-N 116.105 -0.498 . . . . 0.0 110.723 -178.997 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 109' ' ' PRO . . . . . 0.411 ' HB3' ' HB2' ' A' ' 153' ' ' TYR . 35.2 Cg_exo -59.32 -31.61 95.33 Favored 'Trans proline' 0 N--CA 1.465 -0.191 0 C-N-CA 122.551 2.167 . . . . 0.0 111.249 174.136 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 110' ' ' ALA . . . . . . . . . . . . . . . -75.82 -20.91 57.81 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 115.742 -0.663 . . . . 0.0 111.108 179.129 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 111' ' ' ASP . . . . . . . . . . . . . 23.5 t0 -71.83 -48.49 45.8 Favored 'General case' 0 C--N 1.327 -0.413 0 N-CA-C 109.009 -0.737 . . . . 0.0 109.009 178.222 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 112' ' ' ILE . . . . . . . . . . . . . 46.4 mt -63.76 -38.49 82.44 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.284 0 CA-C-N 115.345 -0.843 . . . . 0.0 109.624 173.895 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 113' ' ' GLN . . . . . . . . . . . . . 27.2 tp60 -53.86 -44.49 70.4 Favored 'General case' 0 C--N 1.33 -0.241 0 CA-C-N 115.32 -0.855 . . . . 0.0 110.584 176.743 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 114' ' ' SER . . . . . . . . . . . . . 45.0 m -59.11 -46.61 87.86 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 115.821 -0.627 . . . . 0.0 110.509 178.898 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 115' ' ' ILE . . . . . . . . . . . . . 66.2 mt -56.86 -49.64 78.13 Favored 'Isoleucine or valine' 0 C--O 1.234 0.248 0 CA-C-O 120.967 0.413 . . . . 0.0 110.855 177.921 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 116' ' ' ILE . . . . . 0.42 HG13 HG13 ' A' ' 154' ' ' VAL . 47.6 mm -57.59 -42.44 81.27 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.262 0 CA-C-N 115.892 -0.594 . . . . 0.0 111.245 -179.886 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 117' ' ' ASN . . . . . . . . . . . . . 13.2 m120 -71.37 -30.93 66.74 Favored 'General case' 0 C--N 1.326 -0.451 0 CA-C-N 116.328 -0.396 . . . . 0.0 111.438 -176.991 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 118' ' ' GLU . . . . . . . . . . . . . 43.0 mt-10 -89.33 -5.26 57.67 Favored 'General case' 0 C--N 1.326 -0.428 0 CA-C-O 120.735 0.303 . . . . 0.0 111.279 -178.362 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 119' ' ' THR . . . . . . . . . . . . . 98.3 m -79.32 112.37 16.48 Favored 'General case' 0 C--N 1.323 -0.587 0 CA-C-O 121.078 0.466 . . . . 0.0 111.009 176.59 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 120' ' ' LYS . . . . . . . . . . . . . 69.6 mmtt -94.37 83.03 4.11 Favored 'General case' 0 C--N 1.325 -0.487 0 CA-C-N 116.31 -0.405 . . . . 0.0 110.121 176.289 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 121' ' ' LEU . . . . . 0.461 HD12 HG23 ' A' ' 125' ' ' THR . 77.8 mt -145.46 -175.35 4.68 Favored 'General case' 0 C--N 1.323 -0.564 0 CA-C-N 115.744 -0.662 . . . . 0.0 109.768 179.938 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 122' ' ' ALA . . . . . . . . . . . . . . . -62.66 149.49 43.43 Favored 'General case' 0 C--N 1.324 -0.525 0 CA-C-N 116.488 -0.324 . . . . 0.0 110.978 178.565 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 123' ' ' LYS . . . . . . . . . . . . . 17.8 ptpt -61.65 -30.96 71.06 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.132 -0.485 . . . . 0.0 111.475 -177.174 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 124' ' ' ASN . . . . . . . . . . . . . 9.6 t30 -66.29 -40.46 90.05 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-O 120.69 0.281 . . . . 0.0 110.436 176.15 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 125' ' ' THR . . . . . 0.583 ' O ' HG13 ' A' ' 129' ' ' ILE . 53.9 m -64.14 -39.13 93.37 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 116.197 -0.456 . . . . 0.0 110.678 179.151 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 126' ' ' LEU . . . . . . . . . . . . . 89.3 mt -56.58 -48.73 76.77 Favored 'General case' 0 C--O 1.234 0.25 0 CA-C-O 121.254 0.55 . . . . 0.0 110.24 177.253 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 127' ' ' LYS . . . . . . . . . . . . . 98.4 mttt -63.76 -40.03 95.72 Favored 'General case' 0 C--N 1.327 -0.37 0 CA-C-N 115.434 -0.803 . . . . 0.0 110.614 177.535 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 128' ' ' ALA . . . . . . . . . . . . . . . -64.65 -34.66 78.81 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.104 -0.498 . . . . 0.0 111.661 -178.872 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 129' ' ' ILE . . . . . 0.583 HG13 ' O ' ' A' ' 125' ' ' THR . 78.0 mt -62.47 -50.45 79.8 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.282 0 CA-C-O 121.052 0.453 . . . . 0.0 109.951 176.254 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 130' ' ' ARG . . . . . 0.501 ' HD2' ' HB ' ' A' ' 154' ' ' VAL . 47.8 ttt180 -60.72 -44.3 96.78 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 115.693 -0.685 . . . . 0.0 110.472 176.072 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 131' ' ' ASN . . . . . . . . . . . . . 2.8 t-20 -56.24 -48.45 76.5 Favored 'General case' 0 C--N 1.326 -0.413 0 CA-C-N 115.889 -0.596 . . . . 0.0 110.518 178.295 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 132' ' ' THR . . . . . . . . . . . . . 96.7 m -57.41 -51.4 69.55 Favored 'General case' 0 C--N 1.327 -0.404 0 CA-C-N 115.973 -0.558 . . . . 0.0 110.802 177.414 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 133' ' ' ALA . . . . . . . . . . . . . . . -61.1 -42.9 99.36 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 115.909 -0.587 . . . . 0.0 111.446 -178.634 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 134' ' ' SER . . . . . . . . . . . . . 51.1 p -64.18 -30.16 71.23 Favored 'General case' 0 C--N 1.33 -0.263 0 N-CA-C 111.755 0.28 . . . . 0.0 111.755 -176.73 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 135' ' ' GLN . . . . . . . . . . . . . 41.4 mt-30 -71.35 -38.37 71.63 Favored 'General case' 0 C--N 1.328 -0.329 0 C-N-CA 120.924 -0.31 . . . . 0.0 110.298 176.101 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 136' ' ' ILE . . . . . . . . . . . . . 65.7 mt -61.1 -46.11 97.28 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.251 0 CA-C-N 116.196 -0.456 . . . . 0.0 110.452 177.818 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 137' ' ' PHE . . . . . 0.48 ' O ' HG13 ' A' ' 141' ' ' ILE . 64.4 m-85 -66.03 -38.31 88.09 Favored 'General case' 0 C--N 1.33 -0.245 0 CA-C-N 116.355 -0.384 . . . . 0.0 110.827 177.745 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 138' ' ' ARG . . . . . 0.494 ' O ' ' HG3' ' A' ' 142' ' ' GLU . 19.9 mtp85 -59.19 -45.55 90.78 Favored 'General case' 0 CA--C 1.518 -0.279 0 CA-C-O 120.725 0.298 . . . . 0.0 110.739 175.952 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 139' ' ' LEU . . . . . . . . . . . . . 48.4 tp -55.81 -36.4 67.39 Favored 'General case' 0 C--N 1.327 -0.386 0 CA-C-N 115.753 -0.658 . . . . 0.0 110.42 178.697 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 140' ' ' ALA . . . . . 0.504 ' HB1' ' HB3' ' A' ' 145' ' ' ALA . . . -69.88 -45.14 68.33 Favored 'General case' 0 C--N 1.324 -0.518 0 CA-C-N 115.858 -0.61 . . . . 0.0 110.748 176.032 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 141' ' ' ILE . . . . . 0.568 ' HA ' ' O ' ' A' ' 146' ' ' ILE . 78.5 mt -55.86 -46.94 80.28 Favored 'Isoleucine or valine' 0 C--O 1.234 0.275 0 CA-C-O 120.997 0.427 . . . . 0.0 110.94 177.606 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 142' ' ' GLU . . . . . 0.494 ' HG3' ' O ' ' A' ' 138' ' ' ARG . 91.7 mt-10 -63.24 -27.55 69.43 Favored 'General case' 0 C--N 1.326 -0.416 0 CA-C-N 115.844 -0.616 . . . . 0.0 111.373 -177.564 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 143' ' ' ASN . . . . . . . . . . . . . 29.0 m-80 -99.49 14.64 29.14 Favored 'General case' 0 C--N 1.327 -0.402 0 CA-C-N 116.329 -0.396 . . . . 0.0 111.418 -178.704 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 144' ' ' ARG . . . . . . . . . . . . . 16.7 mmm180 65.68 27.94 11.23 Favored 'General case' 0 N--CA 1.468 0.462 0 N-CA-C 112.424 0.527 . . . . 0.0 112.424 176.409 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 145' ' ' ALA . . . . . 0.504 ' HB3' ' HB1' ' A' ' 140' ' ' ALA . . . -84.76 -39.66 18.17 Favored 'General case' 0 C--N 1.323 -0.568 0 CA-C-O 121.157 0.503 . . . . 0.0 110.51 177.918 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 146' ' ' ILE . . . . . 0.568 ' O ' ' HA ' ' A' ' 141' ' ' ILE . 15.5 tt -145.36 155.41 13.5 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.423 0 CA-C-N 115.688 -0.687 . . . . 0.0 109.217 -179.154 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 147' ' ' ASP . . . . . . . . . . . . . 3.8 m-20 -105.01 -1.56 25.58 Favored 'General case' 0 C--N 1.327 -0.401 0 N-CA-C 112.381 0.512 . . . . 0.0 112.381 -175.448 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 148' ' ' PHE . . . . . 0.41 ' H ' HG12 ' A' ' 146' ' ' ILE . 50.0 p90 -142.13 165.34 27.7 Favored 'General case' 0 C--N 1.322 -0.614 0 CA-C-O 120.76 0.314 . . . . 0.0 110.998 -176.569 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 149' ' ' ASN . . . . . . . . . . . . . 44.9 t-20 -119.11 101.8 49.44 Favored Pre-proline 0 C--N 1.322 -0.616 0 CA-C-N 116.021 -0.536 . . . . 0.0 110.549 -176.306 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 150' ' ' PRO . . . . . . . . . . . . . 35.2 Cg_exo -59.35 -32.69 97.1 Favored 'Trans proline' 0 C--N 1.342 0.197 0 C-N-CA 122.838 2.359 . . . . 0.0 112.724 178.915 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 151' ' ' ALA . . . . . 0.492 ' HA ' HG23 ' A' ' 154' ' ' VAL . . . -74.81 -19.47 60.18 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-O 121.047 0.451 . . . . 0.0 110.968 -178.466 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 152' ' ' ASP . . . . . . . . . . . . . 24.8 t70 -71.74 -19.81 61.98 Favored 'General case' 0 C--N 1.325 -0.46 0 CA-C-N 115.762 -0.653 . . . . 0.0 110.033 178.662 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 153' ' ' TYR . . . . . 0.411 ' HB2' ' HB3' ' A' ' 109' ' ' PRO . 68.6 m-85 -95.77 1.77 53.49 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 115.744 -0.662 . . . . 0.0 111.513 -178.238 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 154' ' ' VAL . . . . . 0.501 ' HB ' ' HD2' ' A' ' 130' ' ' ARG . 98.0 t -72.32 123.53 27.1 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.514 0 CA-C-O 121.043 0.449 . . . . 0.0 110.514 -178.954 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 155' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -86.12 101.58 13.11 Favored 'General case' 0 C--N 1.32 -0.711 0 N-CA-C 109.251 -0.648 . . . . 0.0 109.251 179.279 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 156' ' ' ILE . . . . . 0.413 HD12 ' HD3' ' A' ' 130' ' ' ARG . 0.9 OUTLIER -71.12 131.31 87.17 Favored Pre-proline 0 C--N 1.325 -0.469 0 N-CA-C 109.275 -0.639 . . . . 0.0 109.275 176.146 . . . . . . . . 3 3 . 1 . 019 nuclear orig full ' A' A ' 157' ' ' PRO . . . . . 0.404 ' HB2' HG13 ' A' ' 159' ' ' ILE . 92.4 Cg_endo -82.42 148.71 14.62 Favored 'Trans proline' 0 N--CA 1.456 -0.685 0 C-N-CA 122.522 2.148 . . . . 0.0 112.856 -176.088 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 158' ' ' LYS . . . . . . . . . . . . . 97.7 mttt -101.33 -38.77 7.91 Favored 'General case' 0 C--N 1.324 -0.54 0 N-CA-C 109.212 -0.662 . . . . 0.0 109.212 175.156 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 159' ' ' ILE . . . . . 0.404 HG13 ' HB2' ' A' ' 157' ' ' PRO . 59.1 mt 60.39 88.71 0.05 OUTLIER 'Isoleucine or valine' 0 C--O 1.233 0.194 0 CA-C-N 114.863 -1.062 . . . . 0.0 111.621 176.32 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 160' ' ' ALA . . . . . . . . . . . . . . . -87.72 110.55 20.53 Favored 'General case' 0 C--N 1.32 -0.68 0 CA-C-N 115.782 -0.645 . . . . 0.0 109.633 176.126 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 161' ' ' LEU . . . . . . . . . . . . . 80.6 mt -63.96 114.7 4.27 Favored 'General case' 0 C--N 1.323 -0.583 0 CA-C-N 115.84 -0.618 . . . . 0.0 110.6 -177.909 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 162' ' ' GLU . . . . . . . . . . . . . 5.4 tm-20 -157.63 -46.03 0.07 Allowed 'General case' 0 C--N 1.322 -0.617 0 CA-C-N 115.092 -0.958 . . . . 0.0 109.731 -172.733 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 163' ' ' HIS . . . . . . . . . . . . . 4.8 m-70 -49.17 109.43 0.26 Allowed 'General case' 0 N--CA 1.463 0.202 0 O-C-N 123.984 0.802 . . . . 0.0 111.172 -173.633 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 164' ' ' HIS . . . . . . . . . . . . . 98.5 m-70 -89.34 96.18 10.6 Favored 'General case' 0 C--N 1.324 -0.533 0 CA-C-N 115.612 -0.722 . . . . 0.0 111.179 -173.44 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 165' ' ' HIS . . . . . . . . . . . . . 12.1 t-80 61.12 29.39 18.84 Favored 'General case' 0 CA--C 1.532 0.262 0 CA-C-N 115.416 -0.811 . . . . 0.0 110.971 175.132 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 166' ' ' HIS . . . . . . . . . . . . . 14.6 t-80 -83.11 -1.59 53.23 Favored 'General case' 0 C--N 1.327 -0.37 0 C-N-CA 120.719 -0.393 . . . . 0.0 110.476 -179.894 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 167' ' ' HIS . . . . . . . . . . . . . 24.1 p80 -141.76 169.24 17.96 Favored 'General case' 0 C--N 1.324 -0.527 0 N-CA-C 109.685 -0.487 . . . . 0.0 109.685 175.606 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 168' ' ' HIS . . . . . . . . . . . . . 21.4 p80 . . . . . 0 C--O 1.247 0.929 0 N-CA-C 108.964 -0.754 . . . . 0.0 108.964 172.408 . . . . . . . . 0 0 . 1 . 020 nuclear orig full ' A' A ' 61' ' ' ARG . . . . . . . . . . . . . 45.7 mtm180 . . . . . 0 N--CA 1.477 0.913 0 CA-C-O 120.857 0.36 . . . . 0.0 110.127 . . . . . . . . . 0 0 . 1 . 020 nuclear orig full ' A' A ' 62' ' ' ASP . . . . . . . . . . . . . 6.6 m-20 -109.8 149.04 30.4 Favored 'General case' 0 C--N 1.322 -0.628 0 CA-C-N 116.266 -0.425 . . . . 0.0 110.544 -178.351 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 63' ' ' SER . . . . . 0.538 ' HA ' ' HA ' ' A' ' 103' ' ' SER . 39.5 t -90.94 146.73 23.64 Favored 'General case' 0 C--N 1.321 -0.657 0 CA-C-N 116.195 -0.457 . . . . 0.0 110.341 179.458 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 64' ' ' PHE . . . . . 0.477 ' HB2' HD11 ' A' ' 107' ' ' ILE . 78.9 t80 -59.85 -31.82 70.12 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 115.82 -0.627 . . . . 0.0 109.999 178.37 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 65' ' ' GLY . . . . . . . . . . . . . . . -59.24 -31.7 70.14 Favored Glycine 0 N--CA 1.447 -0.582 0 CA-C-N 115.685 -0.689 . . . . 0.0 112.571 178.894 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 66' ' ' ASP . . . . . . . . . . . . . 39.0 t70 -79.66 -48.38 13.81 Favored 'General case' 0 C--N 1.329 -0.308 0 C-N-CA 120.911 -0.316 . . . . 0.0 110.491 -179.959 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 67' ' ' TRP . . . . . . . . . . . . . 83.8 m95 -62.16 -36.59 82.31 Favored 'General case' 0 N--CA 1.465 0.282 0 CA-C-N 116.474 -0.33 . . . . 0.0 111.32 179.582 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 68' ' ' ALA . . . . . 0.583 ' O ' ' HG ' ' A' ' 72' ' ' LEU . . . -63.93 -50.92 66.77 Favored 'General case' 0 C--N 1.325 -0.495 0 CA-C-N 116.273 -0.421 . . . . 0.0 110.535 177.28 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 69' ' ' GLU . . . . . . . . . . . . . 14.9 tp10 -61.88 -35.18 77.58 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.083 -0.508 . . . . 0.0 110.07 178.055 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 70' ' ' LYS . . . . . . . . . . . . . 48.5 tttp -59.17 -44.97 92.16 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 115.932 -0.577 . . . . 0.0 110.325 177.145 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 71' ' ' PHE . . . . . . . . . . . . . 79.5 t80 -69.28 -41.22 77.14 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-O 120.98 0.419 . . . . 0.0 110.441 178.912 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 72' ' ' LEU . . . . . 0.583 ' HG ' ' O ' ' A' ' 68' ' ' ALA . 86.1 mt -63.9 -34.28 77.6 Favored 'General case' 0 C--N 1.325 -0.478 0 CA-C-N 116.14 -0.482 . . . . 0.0 110.526 179.647 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 73' ' ' LYS . . . . . 0.443 ' O ' ' HB3' ' A' ' 76' ' ' GLU . 14.0 ttmm -84.08 -33.33 24.43 Favored 'General case' 0 C--N 1.324 -0.543 0 CA-C-N 116.138 -0.483 . . . . 0.0 111.238 -176.505 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 74' ' ' SER . . . . . . . . . . . . . 15.4 p -71.47 -30.58 66.16 Favored 'General case' 0 C--N 1.324 -0.501 0 N-CA-C 110.051 -0.352 . . . . 0.0 110.051 175.982 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 75' ' ' LYS . . . . . 0.498 ' O ' ' HB3' ' A' ' 78' ' ' ASP . 22.0 tptp -76.62 -32.05 57.8 Favored 'General case' 0 N--CA 1.447 -0.612 0 CA-C-O 121.302 0.572 . . . . 0.0 109.475 174.589 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 76' ' ' GLU . . . . . 0.443 ' HB3' ' O ' ' A' ' 73' ' ' LYS . 30.3 tt0 -58.88 -47.87 83.43 Favored 'General case' 0 C--N 1.327 -0.407 0 CA-C-N 115.377 -0.829 . . . . 0.0 110.072 172.921 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 77' ' ' ALA . . . . . . . . . . . . . . . -76.08 -16.24 59.96 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 115.808 -0.633 . . . . 0.0 111.018 178.584 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 78' ' ' ASP . . . . . 0.498 ' HB3' ' O ' ' A' ' 75' ' ' LYS . 3.8 t70 -65.57 -53.78 37.09 Favored 'General case' 0 C--N 1.331 -0.218 0 CA-C-N 116.014 -0.539 . . . . 0.0 110.519 177.101 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 79' ' ' GLY . . . . . . . . . . . . . . . 142.34 63.97 0.03 OUTLIER Glycine 0 N--CA 1.446 -0.69 0 C-N-CA 120.506 -0.854 . . . . 0.0 112.26 178.495 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 80' ' ' VAL . . . . . . . . . . . . . 36.0 m -115.5 158.43 15.86 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.644 0 CA-C-O 120.759 0.314 . . . . 0.0 110.808 179.634 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 81' ' ' SER . . . . . . . . . . . . . 47.5 t -78.72 151.48 32.11 Favored 'General case' 0 C--N 1.321 -0.665 0 N-CA-C 109.487 -0.56 . . . . 0.0 109.487 174.777 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 82' ' ' VAL . . . . . . . . . . . . . 8.3 p -56.68 -34.4 42.57 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.329 0 CA-C-O 120.834 0.35 . . . . 0.0 110.667 177.631 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 83' ' ' SER . . . . . . . . . . . . . 3.4 m -62.98 -42.42 99.83 Favored 'General case' 0 C--O 1.235 0.291 0 CA-C-O 121.425 0.631 . . . . 0.0 110.181 178.199 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 84' ' ' GLN . . . . . 0.417 ' HG3' ' CE2' ' A' ' 88' ' ' TYR . 23.4 tp60 -74.78 -33.78 62.32 Favored 'General case' 0 C--N 1.325 -0.486 0 CA-C-N 115.497 -0.774 . . . . 0.0 110.389 -179.519 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 85' ' ' LEU . . . . . . . . . . . . . 36.7 tp -68.99 -42.97 75.79 Favored 'General case' 0 C--N 1.323 -0.562 0 CA-C-N 116.084 -0.507 . . . . 0.0 110.607 178.966 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 86' ' ' ASN . . . . . . . . . . . . . 86.3 m-20 -60.36 -44.83 95.21 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.32 -0.4 . . . . 0.0 111.075 178.78 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 87' ' ' SER . . . . . . . . . . . . . 2.0 p -63.58 -38.31 90.65 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 116.649 -0.25 . . . . 0.0 111.201 -179.489 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 88' ' ' TYR . . . . . 0.423 ' HB3' HD21 ' A' ' 72' ' ' LEU . 10.7 m-85 -60.48 -47.95 83.9 Favored 'General case' 0 N--CA 1.465 0.282 0 CA-C-O 121.037 0.446 . . . . 0.0 110.515 175.082 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 89' ' ' LYS . . . . . 0.493 ' HG2' HD13 ' A' ' 72' ' ' LEU . 68.4 mttm -63.38 -37.66 88.12 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 115.787 -0.642 . . . . 0.0 110.767 179.64 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 90' ' ' ASN . . . . . 0.5 ' O ' ' HB3' ' A' ' 94' ' ' ASN . 7.4 m-80 -62.48 -47.65 83.05 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.302 -0.408 . . . . 0.0 111.008 177.354 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 91' ' ' TYR . . . . . 0.775 ' HA ' ' HD2' ' A' ' 95' ' ' HIS . 14.0 m-85 -57.23 -45.36 83.95 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-O 120.991 0.424 . . . . 0.0 110.507 175.693 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 92' ' ' CYS . . . . . 0.542 ' SG ' ' HB1' ' A' ' 68' ' ' ALA . 47.8 t -66.54 -54.08 27.63 Favored 'General case' 0 C--N 1.321 -0.668 0 CA-C-N 115.507 -0.769 . . . . 0.0 112.407 -175.561 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 93' ' ' ARG . . . . . . . . . . . . . 31.7 ttm-85 -82.45 -35.02 27.91 Favored 'General case' 0 C--N 1.326 -0.451 0 N-CA-C 111.965 0.357 . . . . 0.0 111.965 -171.751 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 94' ' ' ASN . . . . . 0.5 ' HB3' ' O ' ' A' ' 90' ' ' ASN . 22.0 t-20 -83.97 -51.6 7.01 Favored 'General case' 0 C--N 1.326 -0.43 0 CA-C-O 120.651 0.262 . . . . 0.0 111.582 -176.583 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 95' ' ' HIS . . . . . 0.775 ' HD2' ' HA ' ' A' ' 91' ' ' TYR . 96.5 m-70 -85.49 -42.91 14.03 Favored 'General case' 0 C--N 1.327 -0.371 0 CA-C-O 120.701 0.286 . . . . 0.0 111.452 -174.207 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 96' ' ' LEU . . . . . 0.44 HD22 ' HB2' ' A' ' 133' ' ' ALA . 10.1 mp -91.56 26.73 2.21 Favored 'General case' 0 C--N 1.326 -0.435 0 CA-C-O 120.864 0.364 . . . . 0.0 110.464 -179.794 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 97' ' ' SER . . . . . 0.51 ' OG ' ' HD3' ' A' ' 98' ' ' PRO . 0.5 OUTLIER -55.44 -47.12 99.35 Favored Pre-proline 0 CA--C 1.539 0.526 0 N-CA-C 113.02 0.748 . . . . 0.0 113.02 -178.481 . . . . . . . . 3 3 . 1 . 020 nuclear orig full ' A' A ' 98' ' ' PRO . . . . . 0.51 ' HD3' ' OG ' ' A' ' 97' ' ' SER . 38.8 Cg_exo -58.08 -34.91 98.99 Favored 'Trans proline' 0 C--N 1.358 1.066 0 C-N-CA 121.663 1.575 . . . . 0.0 111.967 178.095 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 99' ' ' LEU . . . . . 0.443 HD22 HG22 ' A' ' 107' ' ' ILE . 33.2 mt -79.02 -36.82 40.5 Favored 'General case' 0 C--N 1.327 -0.391 0 CA-C-N 115.874 -0.603 . . . . 0.0 110.282 -177.275 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 100' ' ' TYR . . . . . . . . . . . . . 25.8 t80 -60.47 -24.82 65.56 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 115.509 -0.769 . . . . 0.0 111.072 -177.112 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 101' ' ' MET . . . . . . . . . . . . . 65.4 mtt -97.72 -2.58 40.94 Favored 'General case' 0 C--N 1.327 -0.375 0 CA-C-N 116.21 -0.45 . . . . 0.0 111.784 -177.153 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 102' ' ' LYS . . . . . . . . . . . . . 87.7 mttt -102.53 167.35 9.99 Favored 'General case' 0 C--O 1.237 0.402 0 CA-C-O 121.026 0.441 . . . . 0.0 111.012 -179.312 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 103' ' ' SER . . . . . 0.538 ' HA ' ' HA ' ' A' ' 63' ' ' SER . 5.2 m -83.13 156.77 23.1 Favored 'General case' 0 C--N 1.323 -0.569 0 CA-C-N 115.82 -0.627 . . . . 0.0 109.69 174.702 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 104' ' ' LEU . . . . . . . . . . . . . 52.1 tp -55.83 -45.11 78.44 Favored 'General case' 0 C--N 1.325 -0.457 0 CA-C-N 116.501 -0.318 . . . . 0.0 111.525 -176.828 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 105' ' ' SER . . . . . . . . . . . . . 14.8 m -87.12 0.38 55.36 Favored 'General case' 0 C--N 1.325 -0.493 0 CA-C-N 116.453 -0.34 . . . . 0.0 111.896 -174.572 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 106' ' ' GLU . . . . . . . . . . . . . 44.3 mt-10 -104.02 -2.46 25.98 Favored 'General case' 0 C--N 1.327 -0.377 0 O-C-N 122.247 -0.283 . . . . 0.0 111.624 -178.372 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 107' ' ' ILE . . . . . 0.477 HD11 ' HB2' ' A' ' 64' ' ' PHE . 66.9 mt -81.15 126.82 39.87 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.556 0 CA-C-O 121.133 0.492 . . . . 0.0 111.303 -178.116 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 108' ' ' LEU . . . . . . . . . . . . . 62.9 mt -97.61 147.28 32.78 Favored Pre-proline 0 C--N 1.323 -0.583 0 CA-C-N 115.724 -0.671 . . . . 0.0 110.444 -179.488 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 109' ' ' PRO . . . . . . . . . . . . . 19.1 Cg_endo -60.18 -30.33 91.06 Favored 'Trans proline' 0 N--CA 1.464 -0.241 0 C-N-CA 122.351 2.034 . . . . 0.0 111.352 174.977 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 110' ' ' ALA . . . . . . . . . . . . . . . -65.17 -29.85 70.71 Favored 'General case' 0 N--CA 1.454 -0.257 0 CA-C-N 115.868 -0.605 . . . . 0.0 111.043 178.662 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 111' ' ' ASP . . . . . 0.413 ' O ' HG13 ' A' ' 115' ' ' ILE . 79.2 m-20 -64.91 -51.26 62.85 Favored 'General case' 0 CA--C 1.519 -0.244 0 CA-C-O 121.141 0.496 . . . . 0.0 110.025 179.226 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 112' ' ' ILE . . . . . 0.47 ' O ' HG12 ' A' ' 116' ' ' ILE . 30.6 mt -65.16 -40.61 89.36 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.491 0 CA-C-N 115.67 -0.696 . . . . 0.0 110.15 179.741 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 113' ' ' GLN . . . . . . . . . . . . . 6.7 tp-100 -59.01 -42.54 90.35 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.018 -0.537 . . . . 0.0 110.514 175.663 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 114' ' ' SER . . . . . . . . . . . . . 7.4 t -60.25 -45.58 92.78 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-N 116.257 -0.429 . . . . 0.0 109.862 178.304 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 115' ' ' ILE . . . . . 0.413 HG13 ' O ' ' A' ' 111' ' ' ASP . 75.8 mt -56.69 -47.23 82.76 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.221 0 CA-C-N 116.434 -0.348 . . . . 0.0 110.822 178.401 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 116' ' ' ILE . . . . . 0.47 HG12 ' O ' ' A' ' 112' ' ' ILE . 50.3 mm -61.09 -40.99 87.61 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.36 0 CA-C-O 121.108 0.48 . . . . 0.0 110.876 179.165 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 117' ' ' ASN . . . . . . . . . . . . . 46.8 t-20 -71.6 -42.03 68.21 Favored 'General case' 0 C--N 1.324 -0.515 0 CA-C-N 115.797 -0.638 . . . . 0.0 111.067 -177.032 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 118' ' ' GLU . . . . . . . . . . . . . 46.9 mt-10 -80.65 -16.76 53.21 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.253 -0.43 . . . . 0.0 112.035 -174.467 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 119' ' ' THR . . . . . . . . . . . . . 94.8 m -82.0 112.86 19.46 Favored 'General case' 0 C--N 1.325 -0.481 0 CA-C-O 121.331 0.586 . . . . 0.0 110.96 179.985 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 120' ' ' LYS . . . . . . . . . . . . . 24.1 mtmt -93.47 63.24 3.47 Favored 'General case' 0 C--N 1.323 -0.548 0 CA-C-N 115.441 -0.799 . . . . 0.0 110.544 -177.959 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 121' ' ' LEU . . . . . . . . . . . . . 88.8 mt -126.92 -175.75 3.51 Favored 'General case' 0 C--N 1.322 -0.62 0 CA-C-N 115.16 -0.927 . . . . 0.0 109.939 178.305 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 122' ' ' ALA . . . . . . . . . . . . . . . -64.01 157.12 25.97 Favored 'General case' 0 C--N 1.327 -0.37 0 CA-C-O 120.964 0.411 . . . . 0.0 111.808 -176.729 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 123' ' ' LYS . . . . . . . . . . . . . 48.3 mmtm -62.01 -38.39 88.47 Favored 'General case' 0 C--N 1.331 -0.237 0 CA-C-N 115.979 -0.555 . . . . 0.0 111.12 -177.926 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 124' ' ' ASN . . . . . . . . . . . . . 28.9 p30 -65.45 -27.31 68.42 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.321 -0.399 . . . . 0.0 111.064 179.453 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 125' ' ' THR . . . . . 0.492 ' O ' HG13 ' A' ' 129' ' ' ILE . 10.2 m -76.18 -39.2 55.38 Favored 'General case' 0 C--N 1.325 -0.47 0 CA-C-N 116.257 -0.429 . . . . 0.0 110.061 179.125 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 126' ' ' LEU . . . . . 0.415 ' HB3' HG22 ' A' ' 116' ' ' ILE . 84.5 mt -62.42 -44.83 95.5 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.008 -0.542 . . . . 0.0 110.141 177.289 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 127' ' ' LYS . . . . . . . . . . . . . 98.6 mttt -59.7 -43.53 94.04 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 115.774 -0.648 . . . . 0.0 110.18 177.384 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 128' ' ' ALA . . . . . . . . . . . . . . . -60.71 -39.12 87.36 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 115.7 -0.682 . . . . 0.0 111.308 -178.861 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 129' ' ' ILE . . . . . 0.492 HG13 ' O ' ' A' ' 125' ' ' THR . 87.6 mt -58.36 -51.65 68.73 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.245 0 CA-C-N 116.462 -0.336 . . . . 0.0 110.654 178.394 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 130' ' ' ARG . . . . . 0.677 HH21 ' HA ' ' A' ' 152' ' ' ASP . 33.4 ttt-85 -65.15 -45.97 82.8 Favored 'General case' 0 C--N 1.331 -0.206 0 C-N-CA 120.885 -0.326 . . . . 0.0 110.92 179.079 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 131' ' ' ASN . . . . . . . . . . . . . 10.9 m120 -53.15 -53.06 56.06 Favored 'General case' 0 N--CA 1.466 0.343 0 O-C-N 123.184 0.302 . . . . 0.0 110.833 179.654 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 132' ' ' THR . . . . . 0.53 ' O ' HG12 ' A' ' 136' ' ' ILE . 29.7 m -55.7 -45.23 77.9 Favored 'General case' 0 C--N 1.327 -0.401 0 CA-C-N 116.303 -0.408 . . . . 0.0 110.824 -179.997 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 133' ' ' ALA . . . . . 0.44 ' HB2' HD22 ' A' ' 96' ' ' LEU . . . -64.3 -42.84 96.17 Favored 'General case' 0 C--N 1.331 -0.207 0 CA-C-N 116.21 -0.45 . . . . 0.0 111.388 -179.356 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 134' ' ' SER . . . . . 0.451 ' O ' ' HG3' ' A' ' 138' ' ' ARG . 70.5 p -64.4 -32.69 74.41 Favored 'General case' 0 C--N 1.33 -0.246 0 C-N-CA 121.033 -0.267 . . . . 0.0 110.959 -178.704 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 135' ' ' GLN . . . . . . . . . . . . . 1.2 mp0 -62.88 -41.18 99.3 Favored 'General case' 0 C--N 1.331 -0.206 0 CA-C-O 120.779 0.323 . . . . 0.0 110.245 175.169 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 136' ' ' ILE . . . . . 0.54 HD13 ' HA ' ' A' ' 68' ' ' ALA . 23.1 mm -61.63 -50.77 78.93 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.25 0 CA-C-N 116.014 -0.539 . . . . 0.0 110.402 178.737 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 137' ' ' PHE . . . . . 0.488 ' O ' HG13 ' A' ' 141' ' ' ILE . 62.2 m-85 -62.14 -38.15 87.88 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 115.843 -0.617 . . . . 0.0 111.405 -179.529 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 138' ' ' ARG . . . . . 0.578 ' O ' ' HG2' ' A' ' 142' ' ' GLU . 68.2 mtp180 -64.7 -37.54 87.94 Favored 'General case' 0 C--N 1.329 -0.314 0 C-N-CA 120.823 -0.351 . . . . 0.0 110.877 179.356 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 139' ' ' LEU . . . . . . . . . . . . . 63.4 tp -57.54 -41.77 81.59 Favored 'General case' 0 C--N 1.327 -0.387 0 CA-C-O 121.107 0.479 . . . . 0.0 109.975 176.301 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 140' ' ' ALA . . . . . . . . . . . . . . . -66.6 -38.74 87.63 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 115.716 -0.675 . . . . 0.0 110.711 177.355 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 141' ' ' ILE . . . . . 0.531 ' HA ' ' O ' ' A' ' 146' ' ' ILE . 75.7 mt -64.07 -43.74 97.58 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.268 0 CA-C-N 116.3 -0.409 . . . . 0.0 110.73 177.168 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 142' ' ' GLU . . . . . 0.578 ' HG2' ' O ' ' A' ' 138' ' ' ARG . 39.7 mm-40 -62.77 -30.43 71.44 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.274 -0.421 . . . . 0.0 110.955 179.434 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 143' ' ' ASN . . . . . . . . . . . . . 0.9 OUTLIER -91.23 1.9 56.76 Favored 'General case' 0 N--CA 1.464 0.229 0 CA-C-N 116.269 -0.423 . . . . 0.0 110.919 179.987 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 144' ' ' ARG . . . . . . . . . . . . . 24.5 mtp85 57.68 40.92 26.1 Favored 'General case' 0 C--O 1.233 0.233 0 CA-C-N 115.633 -0.712 . . . . 0.0 112.054 -177.892 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 145' ' ' ALA . . . . . . . . . . . . . . . -88.41 -28.78 20.7 Favored 'General case' 0 C--N 1.324 -0.508 0 N-CA-C 109.338 -0.616 . . . . 0.0 109.338 172.435 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 146' ' ' ILE . . . . . 0.531 ' O ' ' HA ' ' A' ' 141' ' ' ILE . 13.4 tt -155.07 146.49 13.18 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.479 0 CA-C-N 115.237 -0.892 . . . . 0.0 108.941 177.493 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 147' ' ' ASP . . . . . . . . . . . . . 7.6 m-20 -110.48 24.02 13.51 Favored 'General case' 0 C--N 1.323 -0.548 0 CA-C-O 121.283 0.563 . . . . 0.0 110.192 179.53 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 148' ' ' PHE . . . . . . . . . . . . . 1.2 m-85 -129.97 143.95 51.07 Favored 'General case' 0 C--N 1.323 -0.572 0 CA-C-N 115.631 -0.713 . . . . 0.0 110.336 -178.712 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 149' ' ' ASN . . . . . . . . . . . . . 48.0 t-20 -126.36 91.14 48.39 Favored Pre-proline 0 C--N 1.321 -0.664 0 CA-C-N 116.131 -0.486 . . . . 0.0 110.003 178.494 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 150' ' ' PRO . . . . . . . . . . . . . 35.8 Cg_exo -62.19 -26.52 77.78 Favored 'Trans proline' 0 C--N 1.343 0.258 0 C-N-CA 122.798 2.332 . . . . 0.0 112.082 -179.582 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 151' ' ' ALA . . . . . . . . . . . . . . . -70.21 -27.6 64.62 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 116.124 -0.489 . . . . 0.0 111.179 -177.635 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 152' ' ' ASP . . . . . 0.677 ' HA ' HH21 ' A' ' 130' ' ' ARG . 19.3 t70 -75.58 -17.65 59.98 Favored 'General case' 0 C--N 1.323 -0.552 0 CA-C-O 120.887 0.375 . . . . 0.0 110.514 -179.53 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 153' ' ' TYR . . . . . . . . . . . . . 43.7 m-85 -83.35 -10.84 58.23 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.243 -0.435 . . . . 0.0 110.653 178.819 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 154' ' ' VAL . . . . . . . . . . . . . 41.9 t -72.7 117.77 16.79 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.396 0 CA-C-N 116.101 -0.5 . . . . 0.0 110.945 -178.987 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 155' ' ' ARG . . . . . . . . . . . . . 3.8 mmp_? -89.91 131.68 35.7 Favored 'General case' 0 C--N 1.319 -0.719 0 CA-C-N 116.133 -0.485 . . . . 0.0 110.326 174.016 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 156' ' ' ILE . . . . . 0.425 ' HA ' ' HD2' ' A' ' 157' ' ' PRO . 1.9 mp -91.96 117.08 67.54 Favored Pre-proline 0 C--N 1.31 -1.109 0 N-CA-C 107.988 -1.116 . . . . 0.0 107.988 173.481 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 157' ' ' PRO . . . . . 0.425 ' HD2' ' HA ' ' A' ' 156' ' ' ILE . 5.7 Cg_endo -48.57 130.55 22.24 Favored 'Trans proline' 0 C--N 1.345 0.368 0 C-N-CA 123.22 2.613 . . . . 0.0 112.488 -173.657 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 158' ' ' LYS . . . . . . . . . . . . . 57.2 mtmt -89.33 40.31 0.98 Allowed 'General case' 0 C--N 1.324 -0.522 0 CA-C-N 115.601 -0.727 . . . . 0.0 110.33 -176.006 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 159' ' ' ILE . . . . . . . . . . . . . 22.4 mt -80.52 68.58 0.49 Allowed 'Isoleucine or valine' 0 C--N 1.326 -0.428 0 CA-C-N 115.75 -0.659 . . . . 0.0 109.553 178.43 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 160' ' ' ALA . . . . . . . . . . . . . . . -114.7 105.48 13.1 Favored 'General case' 0 C--N 1.321 -0.652 0 CA-C-N 115.573 -0.739 . . . . 0.0 109.855 178.734 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 161' ' ' LEU . . . . . . . . . . . . . 71.8 mt -95.13 3.99 54.14 Favored 'General case' 0 C--N 1.32 -0.694 0 CA-C-N 115.927 -0.579 . . . . 0.0 110.211 -178.156 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 162' ' ' GLU . . . . . . . . . . . . . 50.7 mt-10 -66.02 136.01 55.45 Favored 'General case' 0 C--N 1.325 -0.465 0 CA-C-N 115.391 -0.822 . . . . 0.0 110.529 178.161 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 163' ' ' HIS . . . . . . . . . . . . . 68.1 m80 -85.76 54.65 3.2 Favored 'General case' 0 C--N 1.323 -0.586 0 N-CA-C 109.519 -0.549 . . . . 0.0 109.519 179.659 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 164' ' ' HIS . . . . . . . . . . . . . 9.9 t-160 -103.31 11.2 37.02 Favored 'General case' 0 C--N 1.326 -0.431 0 CA-C-N 115.678 -0.692 . . . . 0.0 110.013 -175.822 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 165' ' ' HIS . . . . . . . . . . . . . 48.6 m-70 -119.15 149.91 40.93 Favored 'General case' 0 C--N 1.323 -0.558 0 CA-C-N 115.776 -0.647 . . . . 0.0 109.528 177.491 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 166' ' ' HIS . . . . . . . . . . . . . 21.9 p80 -123.35 89.51 3.11 Favored 'General case' 0 C--N 1.326 -0.43 0 CA-C-O 121.619 0.724 . . . . 0.0 111.137 176.726 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 167' ' ' HIS . . . . . . . . . . . . . 8.6 p80 -155.9 145.21 20.8 Favored 'General case' 0 C--N 1.323 -0.581 0 CA-C-N 115.773 -0.649 . . . . 0.0 109.803 176.311 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 168' ' ' HIS . . . . . . . . . . . . . 68.9 m-70 . . . . . 0 C--O 1.248 0.999 0 CA-C-O 118.677 -0.678 . . . . 0.0 109.576 179.962 . . . . . . . . 0 0 . 1 . 001 nuclear build core ' A' A ' 63' ' ' SER . . . . . 0.608 ' HA ' ' HA ' ' A' ' 103' ' ' SER . 29.4 p . . . . . 0 N--CA 1.449 -0.492 0 CA-C-O 120.908 0.385 . . . . 0.0 110.518 . . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 64' ' ' PHE . . . . . 0.504 ' HB2' HD11 ' A' ' 107' ' ' ILE . 83.2 t80 -62.32 -35.62 79.62 Favored 'General case' 0 C--N 1.327 -0.372 0 N-CA-C 109.852 -0.425 . . . . 0.0 109.852 179.174 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 65' ' ' GLY . . . . . . . . . . . . . . . -60.92 -37.57 94.0 Favored Glycine 0 N--CA 1.449 -0.483 0 CA-C-N 115.904 -0.589 . . . . 0.0 112.329 176.964 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 66' ' ' ASP . . . . . . . . . . . . . 9.4 t70 -59.84 -54.39 46.77 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-O 120.894 0.378 . . . . 0.0 110.603 178.063 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 67' ' ' TRP . . . . . . . . . . . . . 87.5 m95 -72.44 -31.38 65.42 Favored 'General case' 0 C--N 1.325 -0.464 0 CA-C-N 115.941 -0.572 . . . . 0.0 111.94 -176.953 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 68' ' ' ALA . . . . . 0.512 ' O ' HD13 ' A' ' 72' ' ' LEU . . . -64.03 -44.87 91.24 Favored 'General case' 0 C--N 1.327 -0.408 0 CA-C-O 120.872 0.368 . . . . 0.0 110.325 176.336 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 69' ' ' GLU . . . . . . . . . . . . . 15.7 tm-20 -62.47 -38.68 90.77 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 115.981 -0.554 . . . . 0.0 110.05 178.916 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 70' ' ' LYS . . . . . . . . . . . . . 90.0 mttt -68.07 -38.49 82.46 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.244 -0.434 . . . . 0.0 111.055 177.399 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 71' ' ' PHE . . . . . . . . . . . . . 87.8 t80 -64.04 -44.15 93.36 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-O 120.958 0.408 . . . . 0.0 110.355 176.786 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 72' ' ' LEU . . . . . 0.518 ' HG ' ' HG2' ' A' ' 89' ' ' LYS . 3.9 mp -56.6 -51.55 68.24 Favored 'General case' 0 C--N 1.327 -0.387 0 CA-C-N 115.735 -0.666 . . . . 0.0 110.421 175.866 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 73' ' ' LYS . . . . . . . . . . . . . 39.9 ttmt -63.01 -37.8 88.63 Favored 'General case' 0 C--N 1.326 -0.423 0 CA-C-N 115.968 -0.56 . . . . 0.0 110.635 179.229 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 74' ' ' SER . . . . . . . . . . . . . 31.4 t -57.68 -51.87 67.75 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.144 -0.48 . . . . 0.0 110.949 177.819 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 75' ' ' LYS . . . . . 0.547 ' HA ' ' HB2' ' A' ' 78' ' ' ASP . 25.9 mmtm -69.84 -30.21 67.65 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-O 120.862 0.363 . . . . 0.0 111.119 -178.044 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 76' ' ' GLU . . . . . . . . . . . . . 35.5 tt0 -64.68 -38.55 91.37 Favored 'General case' 0 C--N 1.323 -0.561 0 CA-C-N 116.105 -0.498 . . . . 0.0 110.195 175.332 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 77' ' ' ALA . . . . . . . . . . . . . . . -80.15 -23.72 40.91 Favored 'General case' 0 C--N 1.325 -0.461 0 CA-C-N 115.83 -0.623 . . . . 0.0 111.158 176.058 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 78' ' ' ASP . . . . . 0.547 ' HB2' ' HA ' ' A' ' 75' ' ' LYS . 11.2 m-20 -67.6 -33.38 74.87 Favored 'General case' 0 CA--C 1.517 -0.294 0 CA-C-N 116.443 -0.344 . . . . 0.0 110.795 177.43 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 79' ' ' GLY . . . . . . . . . . . . . . . 105.7 41.2 1.89 Allowed Glycine 0 N--CA 1.446 -0.669 0 C-N-CA 120.557 -0.83 . . . . 0.0 112.934 176.208 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 80' ' ' VAL . . . . . . . . . . . . . 30.0 m -87.26 158.25 3.15 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.567 0 N-CA-C 109.674 -0.491 . . . . 0.0 109.674 174.549 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 81' ' ' SER . . . . . . . . . . . . . 61.1 m -61.43 146.16 49.33 Favored 'General case' 0 C--N 1.323 -0.561 0 CA-C-N 116.581 -0.282 . . . . 0.0 110.546 177.636 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 82' ' ' VAL . . . . . . . . . . . . . 60.3 t -57.05 -43.17 80.7 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.378 0 CA-C-N 116.384 -0.371 . . . . 0.0 111.03 -178.345 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 83' ' ' SER . . . . . . . . . . . . . 27.9 m -59.65 -39.11 83.3 Favored 'General case' 0 C--N 1.326 -0.441 0 CA-C-N 116.374 -0.375 . . . . 0.0 110.545 176.889 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 84' ' ' GLN . . . . . . . . . . . . . 6.7 tp-100 -69.15 -44.24 72.69 Favored 'General case' 0 C--N 1.326 -0.423 0 CA-C-N 115.964 -0.562 . . . . 0.0 110.091 179.154 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 85' ' ' LEU . . . . . 0.527 ' O ' ' HG3' ' A' ' 89' ' ' LYS . 2.4 tm? -62.64 -43.76 97.98 Favored 'General case' 0 C--N 1.326 -0.438 0 CA-C-N 115.849 -0.614 . . . . 0.0 109.933 178.953 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 86' ' ' ASN . . . . . . . . . . . . . 77.4 m-20 -64.18 -26.94 68.74 Favored 'General case' 0 C--N 1.332 -0.182 0 CA-C-N 116.116 -0.493 . . . . 0.0 111.259 177.564 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 87' ' ' SER . . . . . . . . . . . . . 60.5 m -64.92 -47.27 78.3 Favored 'General case' 0 C--N 1.33 -0.263 0 N-CA-C 109.896 -0.409 . . . . 0.0 109.896 176.403 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 88' ' ' TYR . . . . . . . . . . . . . 44.2 m-85 -58.7 -45.92 88.46 Favored 'General case' 0 C--O 1.232 0.168 0 CA-C-N 116.252 -0.431 . . . . 0.0 110.215 177.298 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 89' ' ' LYS . . . . . 0.527 ' HG3' ' O ' ' A' ' 85' ' ' LEU . 46.5 mtpt -58.71 -44.05 90.27 Favored 'General case' 0 C--N 1.332 -0.19 0 CA-C-N 115.747 -0.661 . . . . 0.0 110.549 179.85 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 90' ' ' ASN . . . . . . . . . . . . . 8.8 t30 -63.66 -39.41 94.26 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 116.196 -0.456 . . . . 0.0 110.832 -179.532 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 91' ' ' TYR . . . . . . . . . . . . . 18.4 m-85 -60.59 -48.65 80.83 Favored 'General case' 0 C--N 1.331 -0.215 0 CA-C-N 116.615 -0.266 . . . . 0.0 111.054 179.895 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 92' ' ' CYS . . . . . 0.619 ' HA ' ' HB2' ' A' ' 96' ' ' LEU . 24.2 p -76.42 -27.47 56.28 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-O 120.711 0.291 . . . . 0.0 111.748 -176.465 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 93' ' ' ARG . . . . . . . . . . . . . 56.0 ttp180 -81.84 -42.9 18.98 Favored 'General case' 0 C--N 1.327 -0.406 0 CA-C-O 120.772 0.32 . . . . 0.0 111.833 -175.914 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 94' ' ' ASN . . . . . . . . . . . . . 13.5 m120 -95.46 -57.27 2.44 Favored 'General case' 0 C--N 1.325 -0.485 0 CA-C-N 116.305 -0.407 . . . . 0.0 111.909 -173.644 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 95' ' ' HIS . . . . . . . . . . . . . 36.6 m80 -78.59 -48.58 14.88 Favored 'General case' 0 C--N 1.327 -0.4 0 CA-C-O 120.849 0.357 . . . . 0.0 111.249 -174.355 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 96' ' ' LEU . . . . . 0.619 ' HB2' ' HA ' ' A' ' 92' ' ' CYS . 66.3 mt -88.82 21.98 2.85 Favored 'General case' 0 C--N 1.324 -0.536 0 CA-C-N 116.342 -0.39 . . . . 0.0 110.253 -179.504 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 97' ' ' SER . . . . . 0.546 ' N ' ' HD2' ' A' ' 98' ' ' PRO . 4.3 t -55.3 -48.26 96.64 Favored Pre-proline 0 CA--C 1.541 0.607 0 CA-C-N 115.881 -0.599 . . . . 0.0 111.477 -178.822 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 98' ' ' PRO . . . . . 0.546 ' HD2' ' N ' ' A' ' 97' ' ' SER . 17.3 Cg_endo -58.97 -33.0 98.57 Favored 'Trans proline' 0 C--N 1.358 1.054 0 C-N-CA 121.988 1.792 . . . . 0.0 112.264 176.314 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 99' ' ' LEU . . . . . 0.545 HD13 HD11 ' A' ' 115' ' ' ILE . 2.5 mp -78.51 -33.57 47.96 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 116.512 -0.313 . . . . 0.0 111.015 -179.129 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 100' ' ' TYR . . . . . . . . . . . . . 19.1 t80 -59.27 -28.07 66.4 Favored 'General case' 0 C--N 1.327 -0.374 0 CA-C-N 115.972 -0.558 . . . . 0.0 111.295 -176.325 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 101' ' ' MET . . . . . . . . . . . . . 27.0 ptt? -95.23 -0.68 52.82 Favored 'General case' 0 C--N 1.327 -0.374 0 CA-C-N 116.161 -0.472 . . . . 0.0 111.379 -179.329 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 102' ' ' LYS . . . . . 0.543 ' HG3' ' O ' ' A' ' 98' ' ' PRO . 91.5 mttt -101.69 162.6 12.78 Favored 'General case' 0 C--N 1.326 -0.45 0 CA-C-O 121.004 0.431 . . . . 0.0 110.562 -178.838 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 103' ' ' SER . . . . . 0.608 ' HA ' ' HA ' ' A' ' 63' ' ' SER . 39.4 t -91.27 158.72 16.41 Favored 'General case' 0 C--N 1.319 -0.722 0 N-CA-C 108.969 -0.752 . . . . 0.0 108.969 172.68 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 104' ' ' LEU . . . . . . . . . . . . . 93.5 mt -56.83 -35.26 68.6 Favored 'General case' 0 C--N 1.325 -0.465 0 CA-C-O 120.824 0.345 . . . . 0.0 111.269 -177.877 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 105' ' ' SER . . . . . . . . . . . . . 25.5 p -77.41 -16.58 58.76 Favored 'General case' 0 C--N 1.324 -0.513 0 CA-C-O 120.968 0.413 . . . . 0.0 111.144 -178.994 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 106' ' ' GLU . . . . . 0.552 ' OE1' ' HB3' ' A' ' 103' ' ' SER . 1.0 OUTLIER -97.08 2.73 51.64 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.119 -0.491 . . . . 0.0 110.875 -178.945 . . . . . . . . 3 3 . 1 . 001 nuclear build core ' A' A ' 107' ' ' ILE . . . . . 0.504 HD11 ' HB2' ' A' ' 64' ' ' PHE . 86.2 mt -96.28 128.92 47.05 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.538 0 CA-C-O 121.101 0.477 . . . . 0.0 110.658 179.749 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 108' ' ' LEU . . . . . 0.708 ' HB2' ' HB2' ' A' ' 111' ' ' ASP . 2.5 mm? -103.48 144.44 28.65 Favored Pre-proline 0 C--N 1.32 -0.682 0 CA-C-N 115.574 -0.739 . . . . 0.0 110.157 -177.937 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 109' ' ' PRO . . . . . . . . . . . . . 32.0 Cg_exo -59.35 -40.73 65.19 Favored 'Trans proline' 0 C--O 1.233 0.26 0 C-N-CA 122.429 2.086 . . . . 0.0 112.035 177.365 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 110' ' ' ALA . . . . . . . . . . . . . . . -75.92 -19.83 58.48 Favored 'General case' 0 C--N 1.332 -0.188 0 CA-C-N 116.295 -0.412 . . . . 0.0 110.794 179.247 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 111' ' ' ASP . . . . . 0.708 ' HB2' ' HB2' ' A' ' 108' ' ' LEU . 33.8 t70 -71.06 -40.83 71.42 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-O 121.299 0.571 . . . . 0.0 109.753 178.769 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 112' ' ' ILE . . . . . 0.52 HG12 HD21 ' A' ' 99' ' ' LEU . 47.9 mt -66.12 -39.34 84.14 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.41 0 CA-C-N 115.71 -0.677 . . . . 0.0 109.759 174.859 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 113' ' ' GLN . . . . . . . . . . . . . 29.6 tp60 -60.83 -31.11 70.54 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 115.388 -0.824 . . . . 0.0 110.095 176.611 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 114' ' ' SER . . . . . . . . . . . . . 22.9 t -67.82 -40.64 83.78 Favored 'General case' 0 C--N 1.33 -0.246 0 CA-C-N 115.866 -0.606 . . . . 0.0 110.29 178.35 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 115' ' ' ILE . . . . . 0.545 HD11 HD13 ' A' ' 99' ' ' LEU . 74.8 mt -59.5 -39.12 78.47 Favored 'Isoleucine or valine' 0 C--O 1.233 0.231 0 CA-C-O 121.012 0.434 . . . . 0.0 110.565 177.105 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 116' ' ' ILE . . . . . . . . . . . . . 47.6 mm -66.44 -31.81 55.24 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.455 0 CA-C-N 115.866 -0.606 . . . . 0.0 110.594 178.143 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 117' ' ' ASN . . . . . . . . . . . . . 8.2 t30 -70.09 -38.08 75.57 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-O 121.069 0.462 . . . . 0.0 110.7 178.269 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 118' ' ' GLU . . . . . . . . . . . . . 39.4 mm-40 -80.14 -30.27 38.97 Favored 'General case' 0 C--N 1.325 -0.494 0 CA-C-N 116.092 -0.503 . . . . 0.0 111.219 -177.677 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 119' ' ' THR . . . . . . . . . . . . . 51.4 m -79.67 110.87 15.42 Favored 'General case' 0 C--N 1.322 -0.591 0 CA-C-O 121.271 0.558 . . . . 0.0 109.851 176.117 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 120' ' ' LYS . . . . . . . . . . . . . 47.4 mttp -111.28 76.83 1.0 Allowed 'General case' 0 C--N 1.317 -0.806 0 CA-C-O 121.46 0.648 . . . . 0.0 110.268 -177.182 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 121' ' ' LEU . . . . . . . . . . . . . 97.9 mt -129.3 -174.88 3.4 Favored 'General case' 0 C--N 1.323 -0.576 0 CA-C-N 114.996 -1.002 . . . . 0.0 109.86 -178.666 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 122' ' ' ALA . . . . . . . . . . . . . . . -62.35 158.2 18.04 Favored 'General case' 0 C--N 1.327 -0.388 0 CA-C-O 120.997 0.427 . . . . 0.0 111.925 -179.001 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 123' ' ' LYS . . . . . . . . . . . . . 93.7 mttt -54.29 -49.6 69.27 Favored 'General case' 0 N--CA 1.464 0.252 0 CA-C-N 115.62 -0.718 . . . . 0.0 111.418 -177.823 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 124' ' ' ASN . . . . . . . . . . . . . 27.8 t-20 -55.13 -40.8 70.96 Favored 'General case' 0 C--N 1.331 -0.234 0 CA-C-N 115.607 -0.724 . . . . 0.0 111.265 -179.038 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 125' ' ' THR . . . . . 0.494 ' O ' HG13 ' A' ' 129' ' ' ILE . 6.5 m -69.13 -44.26 72.71 Favored 'General case' 0 C--N 1.327 -0.393 0 CA-C-N 116.075 -0.512 . . . . 0.0 110.717 -178.447 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 126' ' ' LEU . . . . . . . . . . . . . 87.2 mt -60.26 -45.42 93.36 Favored 'General case' 0 C--O 1.234 0.278 0 CA-C-N 116.26 -0.427 . . . . 0.0 110.907 -179.184 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 127' ' ' LYS . . . . . 0.785 ' HG2' HG13 ' A' ' 156' ' ' ILE . 96.5 mttt -68.28 -36.81 79.95 Favored 'General case' 0 C--N 1.326 -0.44 0 CA-C-N 116.062 -0.517 . . . . 0.0 110.707 179.725 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 128' ' ' ALA . . . . . . . . . . . . . . . -60.34 -41.32 93.35 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.419 -0.355 . . . . 0.0 110.912 179.196 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 129' ' ' ILE . . . . . 0.494 HG13 ' O ' ' A' ' 125' ' ' THR . 80.2 mt -59.87 -49.88 82.21 Favored 'Isoleucine or valine' 0 C--O 1.235 0.301 0 CA-C-N 116.15 -0.477 . . . . 0.0 110.239 177.485 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 130' ' ' ARG . . . . . 0.584 ' NH1' ' HA ' ' A' ' 152' ' ' ASP . 23.3 ttp85 -63.67 -46.11 87.06 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 115.845 -0.616 . . . . 0.0 110.606 -179.216 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 131' ' ' ASN . . . . . . . . . . . . . 92.5 m-20 -58.57 -40.17 82.35 Favored 'General case' 0 N--CA 1.464 0.242 0 CA-C-N 116.302 -0.408 . . . . 0.0 111.086 179.818 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 132' ' ' THR . . . . . 0.424 ' O ' HG13 ' A' ' 136' ' ' ILE . 53.8 m -61.8 -46.61 88.79 Favored 'General case' 0 C--N 1.33 -0.248 0 CA-C-O 120.813 0.34 . . . . 0.0 110.42 177.214 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 133' ' ' ALA . . . . . . . . . . . . . . . -61.15 -44.4 97.38 Favored 'General case' 0 C--N 1.331 -0.233 0 CA-C-N 116.012 -0.54 . . . . 0.0 110.64 178.938 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 134' ' ' SER . . . . . 0.473 ' O ' ' HG3' ' A' ' 138' ' ' ARG . 74.3 m -54.45 -45.9 73.2 Favored 'General case' 0 C--N 1.331 -0.227 0 CA-C-N 116.236 -0.438 . . . . 0.0 111.197 178.665 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 135' ' ' GLN . . . . . . . . . . . . . 75.2 mt-30 -64.9 -38.55 91.35 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-O 120.603 0.24 . . . . 0.0 110.969 -178.855 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 136' ' ' ILE . . . . . 0.424 HG13 ' O ' ' A' ' 132' ' ' THR . 72.4 mt -63.91 -47.01 92.51 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.269 0 CA-C-N 116.485 -0.325 . . . . 0.0 110.704 177.813 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 137' ' ' PHE . . . . . 0.541 ' O ' HG13 ' A' ' 141' ' ' ILE . 46.6 m-85 -63.03 -36.83 84.87 Favored 'General case' 0 C--N 1.331 -0.214 0 CA-C-N 116.303 -0.408 . . . . 0.0 111.004 178.2 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 138' ' ' ARG . . . . . 0.497 ' O ' ' HG3' ' A' ' 142' ' ' GLU . 91.4 mtt180 -61.5 -41.89 97.96 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.742 -0.208 . . . . 0.0 110.819 178.472 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 139' ' ' LEU . . . . . . . . . . . . . 58.2 tp -59.4 -43.02 93.03 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-O 121.147 0.498 . . . . 0.0 110.125 175.213 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 140' ' ' ALA . . . . . . . . . . . . . . . -62.22 -43.64 98.37 Favored 'General case' 0 C--N 1.324 -0.505 0 CA-C-N 115.885 -0.598 . . . . 0.0 110.527 177.201 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 141' ' ' ILE . . . . . 0.541 HG13 ' O ' ' A' ' 137' ' ' PHE . 75.0 mt -61.61 -34.0 59.88 Favored 'Isoleucine or valine' 0 CA--C 1.531 0.238 0 CA-C-N 116.466 -0.334 . . . . 0.0 111.26 176.225 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 142' ' ' GLU . . . . . 0.497 ' HG3' ' O ' ' A' ' 138' ' ' ARG . 43.6 mt-10 -60.37 -41.31 93.48 Favored 'General case' 0 C--N 1.332 -0.17 0 CA-C-O 120.874 0.369 . . . . 0.0 110.692 177.907 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 143' ' ' ASN . . . . . . . . . . . . . 3.1 m-20 -88.75 -1.58 58.15 Favored 'General case' 0 C--N 1.327 -0.403 0 CA-C-O 121.015 0.436 . . . . 0.0 110.189 176.754 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 144' ' ' ARG . . . . . . . . . . . . . 69.2 mtt180 65.02 27.78 12.54 Favored 'General case' 0 N--CA 1.462 0.155 0 CA-C-N 115.228 -0.897 . . . . 0.0 111.668 177.515 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 145' ' ' ALA . . . . . . . . . . . . . . . -66.62 -43.89 83.51 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 115.685 -0.689 . . . . 0.0 109.508 174.859 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 146' ' ' ILE . . . . . . . . . . . . . 20.5 tt -120.75 151.73 23.72 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.477 0 N-CA-C 108.586 -0.894 . . . . 0.0 108.586 172.632 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 147' ' ' ASP . . . . . . . . . . . . . 39.0 t70 -96.66 -5.86 37.92 Favored 'General case' 0 C--N 1.322 -0.617 0 N-CA-C 112.326 0.491 . . . . 0.0 112.326 -169.723 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 148' ' ' PHE . . . . . . . . . . . . . 47.6 p90 -154.63 171.19 19.89 Favored 'General case' 0 C--N 1.323 -0.558 0 O-C-N 122.18 -0.325 . . . . 0.0 110.783 -173.934 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 149' ' ' ASN . . . . . 0.415 ' HA ' ' HD2' ' A' ' 150' ' ' PRO . 42.9 t-20 -118.51 95.39 48.73 Favored Pre-proline 0 C--N 1.327 -0.393 0 CA-C-N 116.292 -0.413 . . . . 0.0 110.299 -179.011 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 150' ' ' PRO . . . . . 0.415 ' HD2' ' HA ' ' A' ' 149' ' ' ASN . 39.2 Cg_endo -66.61 -22.33 51.02 Favored 'Trans proline' 0 C--N 1.341 0.178 0 C-N-CA 122.817 2.345 . . . . 0.0 112.166 -178.433 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 151' ' ' ALA . . . . . . . . . . . . . . . -70.52 -28.91 65.31 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.227 -0.442 . . . . 0.0 110.564 -179.51 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 152' ' ' ASP . . . . . 0.584 ' HA ' ' NH1' ' A' ' 130' ' ' ARG . 85.6 m-20 -80.01 -10.84 59.8 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-O 121.2 0.524 . . . . 0.0 110.621 179.226 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 153' ' ' TYR . . . . . . . . . . . . . 60.3 t80 -88.9 -16.98 30.55 Favored 'General case' 0 C--N 1.321 -0.661 0 CA-C-N 115.572 -0.74 . . . . 0.0 109.216 174.566 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 154' ' ' VAL . . . . . . . . . . . . . 90.5 t -73.61 130.8 35.67 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.291 0 CA-C-N 115.656 -0.702 . . . . 0.0 109.997 177.535 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 155' ' ' ARG . . . . . . . . . . . . . 71.4 ttt180 -110.7 142.49 42.55 Favored 'General case' 0 C--N 1.318 -0.766 0 N-CA-C 109.523 -0.547 . . . . 0.0 109.523 178.81 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 156' ' ' ILE . . . . . 0.785 HG13 ' HG2' ' A' ' 127' ' ' LYS . 42.3 mm -87.86 116.0 64.81 Favored Pre-proline 0 C--N 1.32 -0.694 0 N-CA-C 109.476 -0.564 . . . . 0.0 109.476 -179.664 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 157' ' ' PRO . . . . . 0.435 ' HD3' ' HA ' ' A' ' 156' ' ' ILE . 24.0 Cg_exo . . . . . 0 N--CA 1.463 -0.269 0 C-N-CA 122.48 2.12 . . . . 0.0 112.144 -176.561 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 63' ' ' SER . . . . . . . . . . . . . 22.9 t . . . . . 0 N--CA 1.447 -0.609 0 N-CA-C 109.001 -0.741 . . . . 0.0 109.001 . . . . . . . . . 0 0 . 1 . 002 nuclear build core ' A' A ' 64' ' ' PHE . . . . . 0.433 ' HB2' HD11 ' A' ' 107' ' ' ILE . 73.8 t80 -66.18 -32.53 74.03 Favored 'General case' 0 C--N 1.328 -0.332 0 N-CA-C 109.149 -0.686 . . . . 0.0 109.149 177.386 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 65' ' ' GLY . . . . . . . . . . . . . . . -59.76 -40.21 96.32 Favored Glycine 0 N--CA 1.448 -0.508 0 CA-C-N 115.775 -0.648 . . . . 0.0 111.666 175.427 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 66' ' ' ASP . . . . . 0.424 ' O ' ' HB2' ' A' ' 70' ' ' LYS . 9.1 m-20 -61.96 -45.06 95.3 Favored 'General case' 0 CA--C 1.519 -0.239 0 CA-C-O 120.83 0.347 . . . . 0.0 110.628 178.682 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 67' ' ' TRP . . . . . 0.517 ' HA ' ' HB2' ' A' ' 70' ' ' LYS . 90.2 m95 -78.13 -31.92 50.14 Favored 'General case' 0 C--N 1.327 -0.383 0 CA-C-N 116.275 -0.42 . . . . 0.0 111.861 -176.856 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 68' ' ' ALA . . . . . 0.557 ' HB1' ' HB3' ' A' ' 92' ' ' CYS . . . -63.08 -44.2 96.42 Favored 'General case' 0 C--N 1.325 -0.474 0 N-CA-C 109.687 -0.486 . . . . 0.0 109.687 174.955 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 69' ' ' GLU . . . . . . . . . . . . . 3.7 tp10 -68.56 -38.12 80.49 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 115.639 -0.71 . . . . 0.0 109.885 174.9 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 70' ' ' LYS . . . . . 0.517 ' HB2' ' HA ' ' A' ' 67' ' ' TRP . 1.7 tppt? -57.51 -45.52 84.85 Favored 'General case' 0 C--N 1.331 -0.201 0 CA-C-N 115.86 -0.609 . . . . 0.0 110.343 179.303 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 71' ' ' PHE . . . . . . . . . . . . . 70.1 t80 -62.5 -44.45 96.34 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 115.834 -0.621 . . . . 0.0 110.593 179.651 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 72' ' ' LEU . . . . . 0.529 HD21 ' HA ' ' A' ' 89' ' ' LYS . 8.5 mp -60.33 -48.86 79.92 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.076 -0.511 . . . . 0.0 110.56 177.226 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 73' ' ' LYS . . . . . . . . . . . . . 59.1 mtpt -59.77 -38.52 82.05 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 116.284 -0.416 . . . . 0.0 110.943 178.335 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 74' ' ' SER . . . . . 0.428 ' O ' ' HB2' ' A' ' 78' ' ' ASP . 58.5 m -61.61 -45.03 95.83 Favored 'General case' 0 C--N 1.327 -0.371 0 CA-C-N 116.431 -0.349 . . . . 0.0 110.947 179.36 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 75' ' ' LYS . . . . . . . . . . . . . 72.3 mmtt -71.29 -42.93 68.09 Favored 'General case' 0 C--N 1.327 -0.377 0 CA-C-O 120.757 0.313 . . . . 0.0 111.071 178.774 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 76' ' ' GLU . . . . . . . . . . . . . 9.4 tp10 -57.48 -46.08 84.1 Favored 'General case' 0 C--N 1.327 -0.383 0 CA-C-N 115.825 -0.625 . . . . 0.0 110.513 179.205 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 77' ' ' ALA . . . . . . . . . . . . . . . -79.25 -21.97 45.4 Favored 'General case' 0 C--N 1.327 -0.405 0 CA-C-N 116.022 -0.535 . . . . 0.0 111.497 -178.582 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 78' ' ' ASP . . . . . 0.428 ' HB2' ' O ' ' A' ' 74' ' ' SER . 24.3 t70 -68.8 -54.5 15.49 Favored 'General case' 0 C--N 1.327 -0.378 0 CA-C-O 121.051 0.453 . . . . 0.0 110.28 179.907 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 79' ' ' GLY . . . . . . . . . . . . . . . 137.61 65.22 0.05 OUTLIER Glycine 0 N--CA 1.445 -0.76 0 CA-C-N 115.688 -0.687 . . . . 0.0 112.194 179.482 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 80' ' ' VAL . . . . . . . . . . . . . 35.0 m -119.0 160.01 19.17 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.523 0 N-CA-C 109.882 -0.414 . . . . 0.0 109.882 176.03 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 81' ' ' SER . . . . . . . . . . . . . 8.7 t -72.35 159.56 33.81 Favored 'General case' 0 C--N 1.322 -0.591 0 N-CA-C 110.08 -0.341 . . . . 0.0 110.08 179.693 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 82' ' ' VAL . . . . . . . . . . . . . 48.2 t -59.91 -46.07 94.37 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.322 0 CA-C-O 120.785 0.326 . . . . 0.0 110.699 -177.793 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 83' ' ' SER . . . . . . . . . . . . . 52.7 p -57.09 -40.83 77.72 Favored 'General case' 0 C--N 1.326 -0.414 0 CA-C-N 115.961 -0.563 . . . . 0.0 110.591 178.252 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 84' ' ' GLN . . . . . . . . . . . . . 6.6 tp-100 -65.5 -45.72 82.51 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 115.644 -0.707 . . . . 0.0 110.336 -179.382 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 85' ' ' LEU . . . . . 0.441 HD21 ' O ' ' A' ' 72' ' ' LEU . 1.3 tm? -64.28 -42.36 96.47 Favored 'General case' 0 C--N 1.325 -0.458 0 CA-C-N 116.059 -0.519 . . . . 0.0 109.618 178.767 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 86' ' ' ASN . . . . . . . . . . . . . 5.8 m-20 -66.82 -21.83 66.02 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.259 -0.428 . . . . 0.0 111.426 178.407 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 87' ' ' SER . . . . . . . . . . . . . 50.5 m -67.08 -48.54 67.91 Favored 'General case' 0 C--N 1.326 -0.445 0 N-CA-C 109.466 -0.568 . . . . 0.0 109.466 174.222 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 88' ' ' TYR . . . . . 0.418 ' HA ' ' CD2' ' A' ' 91' ' ' TYR . 47.8 m-85 -66.06 -35.78 81.46 Favored 'General case' 0 C--N 1.334 -0.107 0 CA-C-O 121.324 0.583 . . . . 0.0 109.832 176.689 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 89' ' ' LYS . . . . . 0.529 ' HA ' HD21 ' A' ' 72' ' ' LEU . 34.5 ttmt -60.14 -43.68 95.51 Favored 'General case' 0 C--N 1.325 -0.492 0 CA-C-N 115.208 -0.906 . . . . 0.0 110.389 177.862 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 90' ' ' ASN . . . . . 0.438 ' O ' ' HB2' ' A' ' 94' ' ' ASN . 36.1 t30 -63.46 -33.39 75.46 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 115.929 -0.578 . . . . 0.0 110.749 177.829 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 91' ' ' TYR . . . . . 0.418 ' CD2' ' HA ' ' A' ' 88' ' ' TYR . 23.2 m-85 -69.88 -59.76 2.72 Favored 'General case' 0 C--N 1.324 -0.52 0 CA-C-N 116.462 -0.335 . . . . 0.0 110.36 177.395 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 92' ' ' CYS . . . . . 0.557 ' HB3' ' HB1' ' A' ' 68' ' ' ALA . 82.0 m -66.53 -47.68 72.14 Favored 'General case' 0 C--N 1.326 -0.423 0 N-CA-C 112.778 0.658 . . . . 0.0 112.778 -173.086 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 93' ' ' ARG . . . . . 0.417 HH11 ' HD3' ' A' ' 93' ' ' ARG . 10.4 mmm180 -77.17 -49.12 15.89 Favored 'General case' 0 C--N 1.326 -0.449 0 N-CA-C 111.966 0.358 . . . . 0.0 111.966 -173.669 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 94' ' ' ASN . . . . . 0.438 ' HB2' ' O ' ' A' ' 90' ' ' ASN . 2.6 m-20 -84.8 -50.73 7.32 Favored 'General case' 0 C--N 1.325 -0.496 0 CA-C-N 116.167 -0.47 . . . . 0.0 111.819 -172.209 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 95' ' ' HIS . . . . . . . . . . . . . 78.5 m80 -86.24 -40.93 15.05 Favored 'General case' 0 C--N 1.325 -0.497 0 N-CA-C 112.017 0.377 . . . . 0.0 112.017 -172.391 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 96' ' ' LEU . . . . . 0.518 HD12 ' HA ' ' A' ' 92' ' ' CYS . 96.0 mt -89.17 22.26 2.89 Favored 'General case' 0 C--N 1.323 -0.586 0 CA-C-O 120.956 0.407 . . . . 0.0 110.699 -179.765 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 97' ' ' SER . . . . . 0.488 ' OG ' ' HD3' ' A' ' 98' ' ' PRO . 3.1 p -57.36 -41.49 91.11 Favored Pre-proline 0 CA--C 1.545 0.771 0 N-CA-C 113.188 0.81 . . . . 0.0 113.188 -179.183 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 98' ' ' PRO . . . . . 0.488 ' HD3' ' OG ' ' A' ' 97' ' ' SER . 31.5 Cg_exo -58.46 -35.74 98.32 Favored 'Trans proline' 0 C--N 1.363 1.33 0 C-N-CA 121.631 1.554 . . . . 0.0 112.109 176.965 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 99' ' ' LEU . . . . . . . . . . . . . 49.2 mt -84.63 -30.07 25.22 Favored 'General case' 0 C--N 1.326 -0.45 0 CA-C-N 116.263 -0.426 . . . . 0.0 110.657 -176.85 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 100' ' ' TYR . . . . . . . . . . . . . 17.4 t80 -57.82 -26.69 62.34 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 115.811 -0.631 . . . . 0.0 111.297 -176.495 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 101' ' ' MET . . . . . . . . . . . . . 26.8 ptt? -97.81 1.92 48.81 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.215 -0.448 . . . . 0.0 111.44 -178.115 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 102' ' ' LYS . . . . . . . . . . . . . 95.5 mttt -109.23 149.29 29.62 Favored 'General case' 0 C--N 1.326 -0.435 0 CA-C-O 120.732 0.301 . . . . 0.0 110.527 -178.285 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 103' ' ' SER . . . . . 0.422 ' O ' HG13 ' A' ' 107' ' ' ILE . 62.5 m -70.04 146.95 50.62 Favored 'General case' 0 C--N 1.323 -0.579 0 CA-C-N 116.226 -0.443 . . . . 0.0 110.238 178.867 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 104' ' ' LEU . . . . . . . . . . . . . 26.5 tp -55.28 -33.6 63.36 Favored 'General case' 0 C--N 1.326 -0.419 0 CA-C-N 115.816 -0.629 . . . . 0.0 111.861 -177.272 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 105' ' ' SER . . . . . . . . . . . . . 2.9 p -81.74 -16.59 50.63 Favored 'General case' 0 C--N 1.323 -0.571 0 N-CA-C 112.769 0.655 . . . . 0.0 112.769 -173.756 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 106' ' ' GLU . . . . . . . . . . . . . 20.3 pt-20 -108.21 9.32 28.11 Favored 'General case' 0 C--N 1.329 -0.325 0 C-N-CA 120.798 -0.361 . . . . 0.0 111.884 -172.388 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 107' ' ' ILE . . . . . 0.433 HD11 ' HB2' ' A' ' 64' ' ' PHE . 69.1 mt -88.03 102.68 12.86 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.5 0 CA-C-O 121.152 0.501 . . . . 0.0 110.707 -179.873 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 108' ' ' LEU . . . . . 0.626 ' H ' HD23 ' A' ' 108' ' ' LEU . 2.5 pt? -75.4 143.25 75.9 Favored Pre-proline 0 C--N 1.324 -0.519 0 CA-C-N 115.86 -0.609 . . . . 0.0 110.391 177.104 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 109' ' ' PRO . . . . . 0.456 ' HG3' ' HB3' ' A' ' 150' ' ' PRO . 32.5 Cg_exo -57.13 -31.41 90.33 Favored 'Trans proline' 0 C--N 1.347 0.479 0 C-N-CA 123.053 2.502 . . . . 0.0 112.347 -177.714 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 110' ' ' ALA . . . . . . . . . . . . . . . -61.55 -35.42 77.73 Favored 'General case' 0 C--N 1.327 -0.375 0 CA-C-N 115.677 -0.692 . . . . 0.0 111.375 -178.859 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 111' ' ' ASP . . . . . . . . . . . . . 26.0 t70 -72.06 -37.89 69.56 Favored 'General case' 0 C--O 1.234 0.289 0 CA-C-O 121.031 0.443 . . . . 0.0 110.338 -176.357 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 112' ' ' ILE . . . . . 0.442 ' HB ' HG21 ' A' ' 154' ' ' VAL . 34.9 mt -66.36 -38.39 81.71 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.363 0 CA-C-N 115.928 -0.578 . . . . 0.0 109.444 175.678 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 113' ' ' GLN . . . . . . . . . . . . . 27.3 tp60 -62.19 -37.46 85.36 Favored 'General case' 0 C--N 1.331 -0.216 0 CA-C-N 115.472 -0.786 . . . . 0.0 110.032 177.002 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 114' ' ' SER . . . . . . . . . . . . . 33.8 m -59.72 -40.67 88.8 Favored 'General case' 0 C--N 1.334 -0.09 0 CA-C-N 116.155 -0.475 . . . . 0.0 110.786 177.031 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 115' ' ' ILE . . . . . . . . . . . . . 69.4 mt -61.75 -47.89 91.19 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.303 0 CA-C-N 116.252 -0.431 . . . . 0.0 110.478 178.934 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 116' ' ' ILE . . . . . . . . . . . . . 38.9 mm -70.68 -18.18 20.89 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.31 0 CA-C-O 121.279 0.562 . . . . 0.0 110.653 -179.365 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 117' ' ' ASN . . . . . . . . . . . . . 1.9 m-20 -77.43 -51.29 11.03 Favored 'General case' 0 C--N 1.326 -0.421 0 CA-C-N 116.006 -0.543 . . . . 0.0 111.253 178.646 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 118' ' ' GLU . . . . . . . . . . . . . 25.3 mt-10 -82.93 -30.23 28.54 Favored 'General case' 0 C--O 1.236 0.346 0 N-CA-C 111.957 0.355 . . . . 0.0 111.957 -175.657 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 119' ' ' THR . . . . . . . . . . . . . 62.0 m -70.26 111.55 5.95 Favored 'General case' 0 C--N 1.325 -0.459 0 N-CA-C 109.474 -0.565 . . . . 0.0 109.474 177.031 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 120' ' ' LYS . . . . . . . . . . . . . 35.2 mtmm -111.91 78.29 1.11 Allowed 'General case' 0 C--N 1.323 -0.585 0 CA-C-O 121.658 0.742 . . . . 0.0 111.027 -176.68 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 121' ' ' LEU . . . . . 0.412 ' H ' HD21 ' A' ' 126' ' ' LEU . 4.6 mm? -108.79 -174.84 2.61 Favored 'General case' 0 C--N 1.318 -0.796 0 CA-C-N 114.357 -1.292 . . . . 0.0 108.402 172.949 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 122' ' ' ALA . . . . . . . . . . . . . . . -56.04 134.03 52.24 Favored 'General case' 0 C--N 1.324 -0.523 0 N-CA-C 109.643 -0.503 . . . . 0.0 109.643 172.164 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 123' ' ' LYS . . . . . 0.53 ' O ' ' HG3' ' A' ' 127' ' ' LYS . 35.1 mtmm -54.07 -35.53 62.16 Favored 'General case' 0 C--N 1.327 -0.403 0 CA-C-N 116.482 -0.326 . . . . 0.0 111.392 -178.644 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 124' ' ' ASN . . . . . . . . . . . . . 36.7 t30 -57.32 -43.39 83.27 Favored 'General case' 0 C--N 1.327 -0.407 0 CA-C-O 121.115 0.484 . . . . 0.0 110.455 175.961 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 125' ' ' THR . . . . . 0.47 ' O ' HG13 ' A' ' 129' ' ' ILE . 33.4 m -73.32 -34.75 65.85 Favored 'General case' 0 C--N 1.326 -0.432 0 CA-C-N 115.852 -0.613 . . . . 0.0 110.764 179.58 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 126' ' ' LEU . . . . . 0.412 HD21 ' H ' ' A' ' 121' ' ' LEU . 92.2 mt -60.96 -42.17 97.74 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-O 120.981 0.42 . . . . 0.0 110.348 177.061 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 127' ' ' LYS . . . . . 0.53 ' HG3' ' O ' ' A' ' 123' ' ' LYS . 44.7 mtpt -60.12 -45.9 91.45 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 115.703 -0.68 . . . . 0.0 109.996 175.16 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 128' ' ' ALA . . . . . . . . . . . . . . . -58.04 -45.86 86.27 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 115.719 -0.673 . . . . 0.0 111.355 -179.421 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 129' ' ' ILE . . . . . 0.47 HG13 ' O ' ' A' ' 125' ' ' THR . 71.9 mt -59.02 -48.32 87.05 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.228 0 CA-C-O 121.122 0.487 . . . . 0.0 110.439 178.155 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 130' ' ' ARG . . . . . 0.428 ' HD3' ' O ' ' A' ' 151' ' ' ALA . 1.5 tmm_? -62.81 -49.56 74.47 Favored 'General case' 0 C--N 1.326 -0.431 0 CA-C-N 115.672 -0.694 . . . . 0.0 110.333 -178.851 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 131' ' ' ASN . . . . . . . . . . . . . 95.9 m-20 -62.55 -39.25 93.03 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-N 116.165 -0.47 . . . . 0.0 111.195 -176.945 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 132' ' ' THR . . . . . 0.496 ' O ' HG13 ' A' ' 136' ' ' ILE . 56.5 m -59.5 -42.16 91.53 Favored 'General case' 0 C--N 1.327 -0.407 0 CA-C-O 120.796 0.331 . . . . 0.0 110.188 176.941 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 133' ' ' ALA . . . . . . . . . . . . . . . -65.37 -44.09 88.69 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 116.162 -0.472 . . . . 0.0 111.207 179.613 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 134' ' ' SER . . . . . 0.457 ' HA ' ' HB3' ' A' ' 151' ' ' ALA . 10.9 p -64.88 -30.31 71.3 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-O 120.651 0.262 . . . . 0.0 111.123 179.916 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 135' ' ' GLN . . . . . 0.541 ' HA ' ' HG2' ' A' ' 138' ' ' ARG . 2.1 mp0 -71.79 -34.96 69.84 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.423 -0.353 . . . . 0.0 110.515 175.813 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 136' ' ' ILE . . . . . 0.496 HG13 ' O ' ' A' ' 132' ' ' THR . 77.8 mt -63.11 -47.36 92.87 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.459 0 CA-C-N 116.128 -0.487 . . . . 0.0 110.492 175.737 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 137' ' ' PHE . . . . . 0.429 ' O ' HG13 ' A' ' 141' ' ' ILE . 48.7 m-85 -64.81 -38.36 90.72 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 116.18 -0.464 . . . . 0.0 111.712 -179.911 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 138' ' ' ARG . . . . . 0.541 ' HG2' ' HA ' ' A' ' 135' ' ' GLN . 9.4 ptm180 -73.73 -25.87 60.4 Favored 'General case' 0 C--N 1.329 -0.307 0 C-N-CA 120.622 -0.431 . . . . 0.0 110.377 -179.393 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 139' ' ' LEU . . . . . . . . . . . . . 55.9 tp -67.51 -32.56 73.45 Favored 'General case' 0 C--N 1.332 -0.153 0 CA-C-O 121.58 0.705 . . . . 0.0 109.391 173.712 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 140' ' ' ALA . . . . . 0.415 ' HB1' ' HB3' ' A' ' 145' ' ' ALA . . . -72.55 -38.33 68.01 Favored 'General case' 0 C--N 1.322 -0.61 0 CA-C-N 115.46 -0.791 . . . . 0.0 110.452 175.408 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 141' ' ' ILE . . . . . 0.429 HG13 ' O ' ' A' ' 137' ' ' PHE . 75.5 mt -56.93 -47.69 82.78 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.286 0 CA-C-N 116.118 -0.492 . . . . 0.0 111.455 177.335 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 142' ' ' GLU . . . . . . . . . . . . . 11.3 pt-20 -70.44 -6.71 37.79 Favored 'General case' 0 CA--C 1.533 0.302 0 CA-C-O 120.924 0.393 . . . . 0.0 111.671 -177.401 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 143' ' ' ASN . . . . . . . . . . . . . 45.4 m-80 -110.99 9.46 22.18 Favored 'General case' 0 C--N 1.326 -0.456 0 CA-C-O 120.857 0.36 . . . . 0.0 110.399 174.678 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 144' ' ' ARG . . . . . . . . . . . . . 41.1 mtm105 62.18 23.23 13.7 Favored 'General case' 0 N--CA 1.463 0.21 0 CA-C-N 115.346 -0.843 . . . . 0.0 111.427 177.429 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 145' ' ' ALA . . . . . 0.415 ' HB3' ' HB1' ' A' ' 140' ' ' ALA . . . -77.94 -35.48 50.35 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-O 120.981 0.419 . . . . 0.0 110.285 179.407 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 146' ' ' ILE . . . . . 0.449 HG12 ' H ' ' A' ' 148' ' ' PHE . 15.6 tt -144.0 152.0 16.08 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.509 0 CA-C-N 115.783 -0.644 . . . . 0.0 109.313 178.093 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 147' ' ' ASP . . . . . . . . . . . . . 33.4 t70 -113.03 14.93 19.71 Favored 'General case' 0 C--N 1.323 -0.573 0 CA-C-O 121.549 0.69 . . . . 0.0 110.495 -176.416 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 148' ' ' PHE . . . . . 0.449 ' H ' HG12 ' A' ' 146' ' ' ILE . 61.2 t80 -145.13 144.3 30.84 Favored 'General case' 0 C--N 1.321 -0.669 0 CA-C-N 115.643 -0.708 . . . . 0.0 109.576 -174.972 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 149' ' ' ASN . . . . . . . . . . . . . 48.0 t-20 -119.18 88.71 37.94 Favored Pre-proline 0 C--N 1.325 -0.467 0 CA-C-O 120.963 0.411 . . . . 0.0 110.413 179.14 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 150' ' ' PRO . . . . . 0.456 ' HB3' ' HG3' ' A' ' 109' ' ' PRO . 35.8 Cg_exo -59.95 -29.25 88.94 Favored 'Trans proline' 0 C--N 1.342 0.195 0 C-N-CA 122.612 2.208 . . . . 0.0 112.154 -178.549 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 151' ' ' ALA . . . . . 0.457 ' HB3' ' HA ' ' A' ' 134' ' ' SER . . . -70.33 -27.78 64.63 Favored 'General case' 0 N--CA 1.449 -0.483 0 CA-C-N 115.69 -0.687 . . . . 0.0 112.164 -173.218 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 152' ' ' ASP . . . . . . . . . . . . . 0.0 OUTLIER -79.03 -14.37 59.22 Favored 'General case' 0 C--N 1.331 -0.232 0 C-N-CA 119.531 -0.868 . . . . 0.0 109.889 -176.953 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 153' ' ' TYR . . . . . . . . . . . . . 86.3 m-85 -88.46 -1.0 57.81 Favored 'General case' 0 C--N 1.331 -0.227 0 CA-C-N 116.036 -0.529 . . . . 0.0 110.522 176.768 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 154' ' ' VAL . . . . . 0.442 HG21 ' HB ' ' A' ' 112' ' ' ILE . 73.5 t -85.87 126.36 40.56 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.436 0 CA-C-N 115.861 -0.608 . . . . 0.0 109.793 175.788 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 155' ' ' ARG . . . . . . . . . . . . . 38.7 ttt180 -103.63 140.59 37.36 Favored 'General case' 0 C--N 1.323 -0.585 0 CA-C-N 116.222 -0.445 . . . . 0.0 111.127 -173.421 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 156' ' ' ILE . . . . . 0.408 HG12 ' HG2' ' A' ' 127' ' ' LYS . 1.9 mp -88.32 140.7 30.4 Favored Pre-proline 0 C--N 1.328 -0.346 0 CA-C-N 115.656 -0.702 . . . . 0.0 110.135 177.904 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 157' ' ' PRO . . . . . . . . . . . . . 52.0 Cg_exo . . . . . 0 N--CA 1.459 -0.541 0 C-N-CA 122.083 1.855 . . . . 0.0 111.818 173.221 . . . . . . . . 0 0 . 1 . 003 nuclear build core ' A' A ' 63' ' ' SER . . . . . 0.437 ' HA ' ' HA ' ' A' ' 103' ' ' SER . 32.3 m . . . . . 0 N--CA 1.45 -0.43 0 N-CA-C 110.035 -0.357 . . . . 0.0 110.035 . . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 64' ' ' PHE . . . . . 0.411 ' HB3' ' O ' ' A' ' 99' ' ' LEU . 88.6 t80 -60.72 -44.71 96.29 Favored 'General case' 0 C--N 1.326 -0.438 0 CA-C-N 116.366 -0.379 . . . . 0.0 110.812 -177.888 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 65' ' ' GLY . . . . . . . . . . . . . . . -68.47 -23.83 75.15 Favored Glycine 0 N--CA 1.451 -0.365 0 C-N-CA 120.765 -0.731 . . . . 0.0 112.374 179.622 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 66' ' ' ASP . . . . . . . . . . . . . 29.9 t70 -74.64 -47.65 30.82 Favored 'General case' 0 C--N 1.322 -0.598 0 N-CA-C 109.512 -0.551 . . . . 0.0 109.512 177.221 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 67' ' ' TRP . . . . . 0.498 ' HA ' ' HG3' ' A' ' 70' ' ' LYS . 64.3 m95 -65.29 -31.37 72.47 Favored 'General case' 0 C--N 1.33 -0.243 0 CA-C-N 115.91 -0.586 . . . . 0.0 110.906 175.361 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 68' ' ' ALA . . . . . 0.552 ' O ' ' HG ' ' A' ' 72' ' ' LEU . . . -61.93 -41.69 98.25 Favored 'General case' 0 C--N 1.327 -0.403 0 CA-C-N 116.171 -0.468 . . . . 0.0 110.239 174.935 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 69' ' ' GLU . . . . . . . . . . . . . 76.8 tt0 -63.74 -41.44 98.03 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.106 -0.497 . . . . 0.0 109.884 177.2 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 70' ' ' LYS . . . . . 0.498 ' HG3' ' HA ' ' A' ' 67' ' ' TRP . 14.1 mmmt -55.72 -47.29 77.12 Favored 'General case' 0 C--N 1.333 -0.122 0 CA-C-N 115.696 -0.684 . . . . 0.0 109.695 174.919 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 71' ' ' PHE . . . . . . . . . . . . . 91.9 t80 -63.97 -44.54 92.44 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 115.378 -0.828 . . . . 0.0 111.219 179.421 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 72' ' ' LEU . . . . . 0.552 ' HG ' ' O ' ' A' ' 68' ' ' ALA . 96.4 mt -60.36 -49.11 78.88 Favored 'General case' 0 C--N 1.327 -0.405 0 CA-C-O 120.735 0.303 . . . . 0.0 111.05 -178.914 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 73' ' ' LYS . . . . . . . . . . . . . 55.7 tptt -65.26 -37.56 87.6 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-O 121.032 0.444 . . . . 0.0 110.331 179.607 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 74' ' ' SER . . . . . . . . . . . . . 27.3 t -66.11 -41.7 90.23 Favored 'General case' 0 C--N 1.326 -0.436 0 CA-C-N 116.07 -0.514 . . . . 0.0 110.277 177.994 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 75' ' ' LYS . . . . . 0.444 ' HA ' ' HD2' ' A' ' 75' ' ' LYS . 38.7 tptt -72.13 -30.8 65.41 Favored 'General case' 0 N--CA 1.447 -0.622 0 CA-C-O 121.011 0.434 . . . . 0.0 110.687 -177.927 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 76' ' ' GLU . . . . . . . . . . . . . 37.2 tt0 -58.82 -50.14 75.07 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.202 -0.454 . . . . 0.0 109.811 171.591 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 77' ' ' ALA . . . . . . . . . . . . . . . -69.3 -27.34 65.31 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 115.935 -0.575 . . . . 0.0 110.748 178.348 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 78' ' ' ASP . . . . . 0.407 ' HB3' ' O ' ' A' ' 75' ' ' LYS . 24.1 t70 -59.27 -31.15 68.84 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 115.752 -0.658 . . . . 0.0 110.009 175.823 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 79' ' ' GLY . . . . . . . . . . . . . . . 105.17 53.22 0.8 Allowed Glycine 0 N--CA 1.451 -0.319 0 C-N-CA 120.715 -0.755 . . . . 0.0 113.238 172.466 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 80' ' ' VAL . . . . . . . . . . . . . 30.2 m -99.73 161.38 3.26 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.519 0 CA-C-O 120.685 0.279 . . . . 0.0 111.001 178.644 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 81' ' ' SER . . . . . . . . . . . . . 5.5 m -66.09 154.61 39.13 Favored 'General case' 0 C--N 1.325 -0.496 0 CA-C-N 115.767 -0.651 . . . . 0.0 110.379 178.164 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 82' ' ' VAL . . . . . . . . . . . . . 8.7 p -59.78 -40.21 81.93 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.297 0 CA-C-O 120.542 0.21 . . . . 0.0 111.199 -178.433 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 83' ' ' SER . . . . . . . . . . . . . 69.2 m -74.09 -22.29 59.56 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-O 120.662 0.267 . . . . 0.0 110.725 178.59 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 84' ' ' GLN . . . . . . . . . . . . . 50.8 tt0 -71.96 -44.33 63.74 Favored 'General case' 0 N--CA 1.455 -0.189 0 N-CA-C 109.336 -0.616 . . . . 0.0 109.336 178.228 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 85' ' ' LEU . . . . . 0.447 ' HA ' HD22 ' A' ' 85' ' ' LEU . 0.3 OUTLIER -63.4 -36.14 82.75 Favored 'General case' 0 C--N 1.327 -0.409 0 N-CA-C 109.12 -0.696 . . . . 0.0 109.12 175.869 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' A' A ' 86' ' ' ASN . . . . . . . . . . . . . 8.1 m-80 -66.74 -37.52 84.82 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 115.612 -0.722 . . . . 0.0 111.707 178.392 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 87' ' ' SER . . . . . . . . . . . . . 66.6 p -67.1 -29.74 69.57 Favored 'General case' 0 C--N 1.332 -0.189 0 C-N-CA 120.667 -0.413 . . . . 0.0 110.694 178.846 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 88' ' ' TYR . . . . . . . . . . . . . 26.1 m-85 -66.68 -35.63 80.61 Favored 'General case' 0 N--CA 1.454 -0.227 0 N-CA-C 109.755 -0.461 . . . . 0.0 109.755 174.827 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 89' ' ' LYS . . . . . . . . . . . . . 62.9 mttm -63.89 -38.68 91.99 Favored 'General case' 0 CA--C 1.529 0.167 0 CA-C-N 116.063 -0.517 . . . . 0.0 110.113 173.873 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 90' ' ' ASN . . . . . 0.562 ' O ' ' HB3' ' A' ' 94' ' ' ASN . 6.8 m120 -57.88 -35.68 71.33 Favored 'General case' 0 N--CA 1.467 0.389 0 CA-C-N 116.055 -0.521 . . . . 0.0 111.012 177.441 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 91' ' ' TYR . . . . . 0.505 ' CD1' HG12 ' A' ' 129' ' ' ILE . 23.1 m-85 -84.54 -49.14 8.86 Favored 'General case' 0 C--N 1.318 -0.781 0 CA-C-N 116.325 -0.398 . . . . 0.0 111.121 -179.773 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 92' ' ' CYS . . . . . 0.53 ' HA ' ' HB2' ' A' ' 96' ' ' LEU . 50.3 t -70.22 -48.72 55.79 Favored 'General case' 0 C--N 1.323 -0.564 0 N-CA-C 112.236 0.458 . . . . 0.0 112.236 -174.524 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 93' ' ' ARG . . . . . 0.533 ' O ' ' HB3' ' A' ' 97' ' ' SER . 54.7 ttt180 -80.95 -25.13 37.62 Favored 'General case' 0 C--N 1.325 -0.464 0 CA-C-O 120.741 0.305 . . . . 0.0 111.63 -172.669 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 94' ' ' ASN . . . . . 0.562 ' HB3' ' O ' ' A' ' 90' ' ' ASN . 24.0 t-20 -100.18 -61.36 1.38 Allowed 'General case' 0 C--N 1.325 -0.467 0 C-N-CA 120.66 -0.416 . . . . 0.0 111.397 -178.514 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 95' ' ' HIS . . . . . . . . . . . . . 60.5 m80 -85.82 -14.46 45.0 Favored 'General case' 0 C--N 1.326 -0.453 0 N-CA-C 112.494 0.553 . . . . 0.0 112.494 -170.987 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 96' ' ' LEU . . . . . 0.53 ' HB2' ' HA ' ' A' ' 92' ' ' CYS . 93.5 mt -119.61 17.2 12.84 Favored 'General case' 0 C--N 1.321 -0.661 0 CA-C-O 120.796 0.332 . . . . 0.0 110.449 -179.606 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 97' ' ' SER . . . . . 0.536 ' N ' ' HD2' ' A' ' 98' ' ' PRO . 22.2 p -61.88 -42.19 81.13 Favored Pre-proline 0 CA--C 1.543 0.675 0 N-CA-C 113.073 0.768 . . . . 0.0 113.073 -176.251 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 98' ' ' PRO . . . . . 0.536 ' HD2' ' N ' ' A' ' 97' ' ' SER . 36.3 Cg_endo -65.42 -26.09 55.62 Favored 'Trans proline' 0 C--N 1.36 1.137 0 C-N-CA 121.431 1.421 . . . . 0.0 112.037 178.378 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 99' ' ' LEU . . . . . 0.414 HD22 HG23 ' A' ' 107' ' ' ILE . 80.9 mt -89.93 -21.67 22.36 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 115.978 -0.555 . . . . 0.0 110.673 -178.45 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 100' ' ' TYR . . . . . . . . . . . . . 28.1 t80 -55.06 -43.15 73.59 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 115.858 -0.61 . . . . 0.0 110.825 -179.07 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 101' ' ' MET . . . . . . . . . . . . . 23.1 ptt? -94.63 14.12 22.06 Favored 'General case' 0 C--N 1.319 -0.723 0 CA-C-N 115.807 -0.633 . . . . 0.0 111.52 -175.727 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 102' ' ' LYS . . . . . . . . . . . . . 64.6 mttm -108.77 165.99 11.14 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-O 120.962 0.41 . . . . 0.0 110.997 178.092 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 103' ' ' SER . . . . . 0.494 ' O ' ' HG2' ' A' ' 106' ' ' GLU . 3.1 m -79.91 143.06 34.58 Favored 'General case' 0 C--N 1.323 -0.559 0 N-CA-C 108.821 -0.807 . . . . 0.0 108.821 172.138 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 104' ' ' LEU . . . . . . . . . . . . . 1.9 pt? -68.14 -18.92 64.76 Favored 'General case' 0 C--N 1.322 -0.618 0 C-N-CA 120.898 -0.321 . . . . 0.0 111.748 -174.103 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 105' ' ' SER . . . . . . . . . . . . . 16.7 p -87.79 -22.17 24.67 Favored 'General case' 0 C--N 1.327 -0.411 0 N-CA-C 111.813 0.301 . . . . 0.0 111.813 -179.171 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 106' ' ' GLU . . . . . 0.494 ' HG2' ' O ' ' A' ' 103' ' ' SER . 11.5 pt-20 -89.66 -7.63 54.24 Favored 'General case' 0 C--N 1.331 -0.199 0 CA-C-O 120.963 0.411 . . . . 0.0 110.583 -177.633 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 107' ' ' ILE . . . . . 0.474 HG13 ' O ' ' A' ' 103' ' ' SER . 73.4 mt -70.41 135.16 28.73 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.48 0 CA-C-N 115.885 -0.598 . . . . 0.0 110.566 179.826 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 108' ' ' LEU . . . . . 0.451 ' HB2' ' HB2' ' A' ' 111' ' ' ASP . 54.3 mt -97.43 129.52 31.61 Favored Pre-proline 0 C--N 1.325 -0.49 0 CA-C-N 116.175 -0.466 . . . . 0.0 110.776 -176.434 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 109' ' ' PRO . . . . . . . . . . . . . 50.6 Cg_exo -56.95 -38.24 96.45 Favored 'Trans proline' 0 CA--C 1.529 0.274 0 C-N-CA 122.752 2.301 . . . . 0.0 112.032 177.213 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 110' ' ' ALA . . . . . . . . . . . . . . . -70.83 -32.37 69.4 Favored 'General case' 0 C--N 1.332 -0.192 0 CA-C-N 116.204 -0.453 . . . . 0.0 110.776 178.751 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 111' ' ' ASP . . . . . 0.451 ' HB2' ' HB2' ' A' ' 108' ' ' LEU . 36.6 t70 -64.93 -45.72 84.62 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.079 -0.51 . . . . 0.0 109.925 179.038 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 112' ' ' ILE . . . . . . . . . . . . . 36.4 mt -64.25 -39.37 85.29 Favored 'Isoleucine or valine' 0 C--O 1.234 0.277 0 CA-C-N 115.589 -0.732 . . . . 0.0 110.511 176.823 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 113' ' ' GLN . . . . . . . . . . . . . 6.5 tp-100 -58.3 -44.73 88.66 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 115.774 -0.648 . . . . 0.0 110.791 178.232 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 114' ' ' SER . . . . . . . . . . . . . 53.5 m -62.57 -36.0 81.29 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.667 -0.242 . . . . 0.0 110.911 178.097 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 115' ' ' ILE . . . . . 0.419 HG13 ' O ' ' A' ' 111' ' ' ASP . 72.4 mt -64.86 -48.63 83.53 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.193 0 CA-C-O 120.686 0.279 . . . . 0.0 110.384 177.707 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 116' ' ' ILE . . . . . . . . . . . . . 40.8 mm -61.45 -43.42 96.76 Favored 'Isoleucine or valine' 0 N--CA 1.463 0.209 0 CA-C-N 116.265 -0.425 . . . . 0.0 110.53 177.833 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 117' ' ' ASN . . . . . . . . . . . . . 40.3 t30 -60.17 -37.0 78.84 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 115.689 -0.687 . . . . 0.0 111.203 179.964 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 118' ' ' GLU . . . . . . . . . . . . . 48.4 mt-10 -93.8 0.76 56.44 Favored 'General case' 0 C--N 1.326 -0.417 0 CA-C-N 116.382 -0.372 . . . . 0.0 111.713 -178.513 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 119' ' ' THR . . . . . . . . . . . . . 94.2 m -88.04 110.02 20.29 Favored 'General case' 0 N--CA 1.447 -0.6 0 N-CA-C 108.067 -1.086 . . . . 0.0 108.067 168.876 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 120' ' ' LYS . . . . . . . . . . . . . 66.4 mttm -107.69 64.98 0.63 Allowed 'General case' 0 C--N 1.322 -0.601 0 CA-C-O 121.919 0.866 . . . . 0.0 110.471 -172.401 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 121' ' ' LEU . . . . . . . . . . . . . 87.5 mt -119.5 -174.19 2.68 Favored 'General case' 0 C--N 1.321 -0.634 0 CA-C-N 114.567 -1.197 . . . . 0.0 109.639 -179.526 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 122' ' ' ALA . . . . . . . . . . . . . . . -61.2 149.3 38.04 Favored 'General case' 0 C--N 1.325 -0.476 0 CA-C-N 116.337 -0.392 . . . . 0.0 111.364 -179.832 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 123' ' ' LYS . . . . . . . . . . . . . 55.5 pttt -56.14 -33.01 64.77 Favored 'General case' 0 C--N 1.327 -0.378 0 CA-C-N 115.802 -0.635 . . . . 0.0 111.217 178.473 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 124' ' ' ASN . . . . . . . . . . . . . 95.0 m-20 -62.18 -39.96 94.44 Favored 'General case' 0 C--N 1.331 -0.219 0 CA-C-N 116.069 -0.514 . . . . 0.0 110.472 177.944 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 125' ' ' THR . . . . . 0.555 ' O ' HG13 ' A' ' 129' ' ' ILE . 8.6 m -68.29 -41.41 81.01 Favored 'General case' 0 C--N 1.326 -0.424 0 CA-C-N 116.031 -0.532 . . . . 0.0 110.489 -179.895 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 126' ' ' LEU . . . . . . . . . . . . . 92.6 mt -59.99 -45.54 92.38 Favored 'General case' 0 C--O 1.235 0.324 0 CA-C-N 116.071 -0.513 . . . . 0.0 110.755 179.691 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 127' ' ' LYS . . . . . . . . . . . . . 98.8 mttt -67.29 -34.83 78.22 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.018 -0.537 . . . . 0.0 110.766 178.844 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 128' ' ' ALA . . . . . . . . . . . . . . . -65.82 -43.65 87.95 Favored 'General case' 0 C--N 1.327 -0.391 0 CA-C-N 116.162 -0.472 . . . . 0.0 111.059 -179.273 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 129' ' ' ILE . . . . . 0.555 HG13 ' O ' ' A' ' 125' ' ' THR . 59.1 mt -61.2 -41.82 90.98 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.185 0 CA-C-O 121.154 0.502 . . . . 0.0 109.795 176.998 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 130' ' ' ARG . . . . . 0.608 HH21 HG11 ' A' ' 154' ' ' VAL . 3.2 tpp180 -64.5 -48.1 76.45 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 115.843 -0.617 . . . . 0.0 110.723 179.032 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 131' ' ' ASN . . . . . . . . . . . . . 4.9 m-20 -57.83 -52.67 64.51 Favored 'General case' 0 C--N 1.328 -0.345 0 O-C-N 123.341 0.4 . . . . 0.0 110.899 -179.887 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 132' ' ' THR . . . . . 0.479 ' O ' HG13 ' A' ' 136' ' ' ILE . 33.3 m -54.55 -54.06 46.29 Favored 'General case' 0 C--N 1.327 -0.384 0 CA-C-N 116.098 -0.501 . . . . 0.0 110.94 -179.451 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 133' ' ' ALA . . . . . . . . . . . . . . . -62.9 -39.32 94.14 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 116.284 -0.416 . . . . 0.0 111.932 -176.929 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 134' ' ' SER . . . . . . . . . . . . . 79.4 p -65.46 -32.53 74.19 Favored 'General case' 0 C--O 1.233 0.188 0 CA-C-O 120.55 0.214 . . . . 0.0 111.259 -176.514 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 135' ' ' GLN . . . . . 0.484 ' O ' ' HG2' ' A' ' 138' ' ' ARG . 36.1 mt-30 -79.73 -26.11 40.9 Favored 'General case' 0 N--CA 1.453 -0.306 0 C-N-CA 120.946 -0.302 . . . . 0.0 110.808 -179.919 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 136' ' ' ILE . . . . . 0.479 HG13 ' O ' ' A' ' 132' ' ' THR . 73.5 mt -65.34 -46.59 89.94 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.323 0 N-CA-C 109.823 -0.436 . . . . 0.0 109.823 173.791 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 137' ' ' PHE . . . . . 0.424 ' O ' HG13 ' A' ' 141' ' ' ILE . 53.3 m-85 -64.87 -40.5 95.23 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 116.078 -0.51 . . . . 0.0 111.102 177.33 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 138' ' ' ARG . . . . . 0.484 ' HG2' ' O ' ' A' ' 135' ' ' GLN . 0.2 OUTLIER -67.5 -26.07 66.17 Favored 'General case' 0 CA--C 1.53 0.203 0 CA-C-O 120.805 0.336 . . . . 0.0 110.391 -177.751 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' A' A ' 139' ' ' LEU . . . . . 0.413 ' HA ' ' HG2' ' A' ' 142' ' ' GLU . 62.2 tp -67.65 -34.3 76.67 Favored 'General case' 0 C--N 1.332 -0.195 0 CA-C-O 121.28 0.562 . . . . 0.0 109.561 176.706 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 140' ' ' ALA . . . . . . . . . . . . . . . -74.61 -33.78 62.68 Favored 'General case' 0 C--N 1.325 -0.459 0 CA-C-N 115.907 -0.588 . . . . 0.0 110.081 175.697 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 141' ' ' ILE . . . . . 0.634 ' HA ' ' O ' ' A' ' 146' ' ' ILE . 75.9 mt -62.3 -47.94 90.73 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.28 0 CA-C-N 115.947 -0.569 . . . . 0.0 111.069 176.795 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 142' ' ' GLU . . . . . 0.413 ' HG2' ' HA ' ' A' ' 139' ' ' LEU . 5.3 pt-20 -69.56 -16.55 63.44 Favored 'General case' 0 C--N 1.331 -0.229 0 CA-C-O 120.917 0.389 . . . . 0.0 110.975 -179.52 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 143' ' ' ASN . . . . . . . . . . . . . 18.3 m-80 -98.41 2.9 48.31 Favored 'General case' 0 C--N 1.326 -0.435 0 CA-C-N 116.399 -0.364 . . . . 0.0 110.485 175.68 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 144' ' ' ARG . . . . . 0.434 HH11 ' HD2' ' A' ' 144' ' ' ARG . 25.6 mtm180 63.43 20.55 12.31 Favored 'General case' 0 N--CA 1.464 0.271 0 CA-C-N 115.649 -0.705 . . . . 0.0 112.146 175.663 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 145' ' ' ALA . . . . . . . . . . . . . . . -75.12 -37.58 61.38 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-O 121.367 0.604 . . . . 0.0 109.418 176.421 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 146' ' ' ILE . . . . . 0.634 ' O ' ' HA ' ' A' ' 141' ' ' ILE . 13.7 tt -146.85 137.9 18.17 Favored 'Isoleucine or valine' 0 N--CA 1.449 -0.513 0 CA-C-N 115.254 -0.885 . . . . 0.0 108.823 175.192 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 147' ' ' ASP . . . . . . . . . . . . . 7.9 p-10 -106.04 19.71 20.1 Favored 'General case' 0 C--N 1.321 -0.639 0 CA-C-O 121.19 0.519 . . . . 0.0 110.188 -178.947 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 148' ' ' PHE . . . . . 0.497 ' H ' HG12 ' A' ' 146' ' ' ILE . 70.6 t80 -132.12 123.35 26.96 Favored 'General case' 0 C--N 1.32 -0.689 0 CA-C-N 115.353 -0.84 . . . . 0.0 109.846 -175.058 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 149' ' ' ASN . . . . . 0.528 ' HB2' HD11 ' A' ' 141' ' ' ILE . 31.5 t-20 -107.58 98.12 22.79 Favored Pre-proline 0 C--N 1.325 -0.494 0 N-CA-C 110.058 -0.349 . . . . 0.0 110.058 -179.656 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 150' ' ' PRO . . . . . . . . . . . . . 55.2 Cg_endo -70.44 -13.89 33.41 Favored 'Trans proline' 0 C--N 1.344 0.338 0 C-N-CA 122.765 2.31 . . . . 0.0 112.661 -176.51 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 151' ' ' ALA . . . . . . . . . . . . . . . -71.24 -20.02 62.29 Favored 'General case' 0 C--N 1.326 -0.414 0 CA-C-N 116.206 -0.452 . . . . 0.0 110.987 -179.374 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 152' ' ' ASP . . . . . . . . . . . . . 31.0 t70 -71.99 -21.74 61.53 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-O 121.186 0.517 . . . . 0.0 110.902 -179.82 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 153' ' ' TYR . . . . . . . . . . . . . 99.2 m-85 -92.58 1.73 57.1 Favored 'General case' 0 C--N 1.324 -0.532 0 CA-C-N 115.893 -0.594 . . . . 0.0 110.81 -177.962 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 154' ' ' VAL . . . . . 0.608 HG11 HH21 ' A' ' 130' ' ' ARG . 60.6 t -88.11 106.52 16.56 Favored 'Isoleucine or valine' 0 N--CA 1.448 -0.529 0 N-CA-C 109.529 -0.545 . . . . 0.0 109.529 175.949 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 155' ' ' ARG . . . . . . . . . . . . . 12.0 tpp180 -77.01 121.6 23.75 Favored 'General case' 0 C--N 1.32 -0.675 0 CA-C-N 115.853 -0.612 . . . . 0.0 109.891 -178.982 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 156' ' ' ILE . . . . . . . . . . . . . 48.5 mm -90.0 120.2 69.31 Favored Pre-proline 0 C--N 1.325 -0.499 0 CA-C-N 116.272 -0.422 . . . . 0.0 110.213 179.932 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 157' ' ' PRO . . . . . . . . . . . . . 55.5 Cg_endo . . . . . 0 N--CA 1.461 -0.402 0 C-N-CA 122.349 2.033 . . . . 0.0 111.819 178.372 . . . . . . . . 0 0 . 1 . 004 nuclear build core ' A' A ' 63' ' ' SER . . . . . . . . . . . . . 36.5 t . . . . . 0 N--CA 1.45 -0.438 0 N-CA-C 109.744 -0.465 . . . . 0.0 109.744 . . . . . . . . . 0 0 . 1 . 004 nuclear build core ' A' A ' 64' ' ' PHE . . . . . 0.453 ' HB3' ' O ' ' A' ' 99' ' ' LEU . 87.4 t80 -59.07 -38.61 79.85 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-N 116.207 -0.451 . . . . 0.0 110.357 179.753 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 65' ' ' GLY . . . . . . . . . . . . . . . -65.38 -32.32 83.21 Favored Glycine 0 N--CA 1.45 -0.38 0 C-N-CA 120.91 -0.662 . . . . 0.0 112.745 179.99 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 66' ' ' ASP . . . . . . . . . . . . . 20.3 t70 -68.33 -41.45 80.78 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-O 121.043 0.449 . . . . 0.0 110.154 -179.645 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 67' ' ' TRP . . . . . . . . . . . . . 80.4 m95 -74.84 -31.56 61.69 Favored 'General case' 0 C--N 1.327 -0.399 0 CA-C-N 116.027 -0.533 . . . . 0.0 110.979 178.061 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 68' ' ' ALA . . . . . . . . . . . . . . . -62.07 -41.66 98.39 Favored 'General case' 0 C--N 1.33 -0.243 0 N-CA-C 109.874 -0.417 . . . . 0.0 109.874 174.342 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 69' ' ' GLU . . . . . . . . . . . . . 3.3 tm-20 -54.32 -51.09 65.79 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 115.607 -0.724 . . . . 0.0 110.246 175.034 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 70' ' ' LYS . . . . . . . . . . . . . 48.3 mttp -72.81 -25.44 61.14 Favored 'General case' 0 C--N 1.324 -0.531 0 CA-C-N 115.904 -0.589 . . . . 0.0 111.828 -176.688 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 71' ' ' PHE . . . . . . . . . . . . . 69.5 t80 -70.36 -49.38 49.78 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-O 120.876 0.37 . . . . 0.0 110.29 175.337 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 72' ' ' LEU . . . . . 0.442 HD13 ' HA ' ' A' ' 72' ' ' LEU . 4.0 mm? -65.42 -34.71 78.93 Favored 'General case' 0 C--N 1.326 -0.446 0 CA-C-O 120.882 0.373 . . . . 0.0 110.222 177.065 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 73' ' ' LYS . . . . . . . . . . . . . 3.9 tppp? -64.05 -45.9 86.77 Favored 'General case' 0 C--N 1.325 -0.469 0 CA-C-N 115.84 -0.618 . . . . 0.0 110.513 178.43 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 74' ' ' SER . . . . . 0.435 ' O ' ' HB2' ' A' ' 78' ' ' ASP . 13.1 p -70.33 -27.73 64.6 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 116.333 -0.394 . . . . 0.0 111.037 -179.023 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 75' ' ' LYS . . . . . 0.467 ' HA ' ' HD3' ' A' ' 75' ' ' LYS . 67.9 mmtt -74.83 -34.18 62.28 Favored 'General case' 0 C--O 1.236 0.346 0 CA-C-O 120.929 0.395 . . . . 0.0 110.842 174.462 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 76' ' ' GLU . . . . . . . . . . . . . 7.5 tp10 -63.06 -41.54 99.49 Favored 'General case' 0 C--N 1.324 -0.526 0 CA-C-O 121.369 0.604 . . . . 0.0 109.608 173.842 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 77' ' ' ALA . . . . . . . . . . . . . . . -81.18 -10.09 59.69 Favored 'General case' 0 C--N 1.327 -0.404 0 CA-C-N 115.755 -0.657 . . . . 0.0 110.92 177.033 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 78' ' ' ASP . . . . . 0.435 ' HB2' ' O ' ' A' ' 74' ' ' SER . 17.9 t70 -77.23 -49.48 15.0 Favored 'General case' 0 C--N 1.327 -0.4 0 CA-C-N 115.999 -0.546 . . . . 0.0 110.101 178.824 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 79' ' ' GLY . . . . . . . . . . . . . . . 121.43 25.54 2.17 Favored Glycine 0 N--CA 1.449 -0.489 0 C-N-CA 120.573 -0.822 . . . . 0.0 113.052 177.227 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 80' ' ' VAL . . . . . . . . . . . . . 15.9 m -67.67 157.39 6.24 Favored 'Isoleucine or valine' 0 C--O 1.234 0.262 0 CA-C-N 117.088 0.444 . . . . 0.0 110.559 176.734 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 81' ' ' SER . . . . . . . . . . . . . 28.7 t -58.67 138.39 57.02 Favored 'General case' 0 N--CA 1.451 -0.418 0 CA-C-N 115.985 -0.552 . . . . 0.0 109.755 174.812 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 82' ' ' VAL . . . . . . . . . . . . . 14.0 p -58.39 -34.07 49.49 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.583 0 CA-C-O 120.732 0.301 . . . . 0.0 110.786 -179.44 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 83' ' ' SER . . . . . . . . . . . . . 23.3 t -69.38 -43.16 74.09 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-O 121.17 0.509 . . . . 0.0 109.861 177.715 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 84' ' ' GLN . . . . . . . . . . . . . 24.6 tp60 -64.58 -37.62 88.17 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 115.757 -0.656 . . . . 0.0 110.085 178.008 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 85' ' ' LEU . . . . . . . . . . . . . 41.1 tp -66.02 -43.07 88.73 Favored 'General case' 0 C--N 1.327 -0.403 0 CA-C-N 115.646 -0.706 . . . . 0.0 110.564 177.781 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 86' ' ' ASN . . . . . . . . . . . . . 12.3 m-80 -59.6 -38.66 81.86 Favored 'General case' 0 N--CA 1.463 0.189 0 CA-C-N 116.452 -0.34 . . . . 0.0 110.405 176.469 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 87' ' ' SER . . . . . . . . . . . . . 33.1 t -60.62 -48.22 82.75 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 115.903 -0.589 . . . . 0.0 110.4 177.341 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 88' ' ' TYR . . . . . . . . . . . . . 21.8 m-85 -61.58 -45.16 95.32 Favored 'General case' 0 C--O 1.234 0.28 0 CA-C-O 120.786 0.327 . . . . 0.0 110.745 178.311 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 89' ' ' LYS . . . . . . . . . . . . . 97.4 mttt -61.27 -39.33 90.0 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 116.127 -0.488 . . . . 0.0 111.066 179.328 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 90' ' ' ASN . . . . . . . . . . . . . 8.7 t30 -65.26 -41.95 93.73 Favored 'General case' 0 C--N 1.327 -0.37 0 CA-C-O 120.762 0.315 . . . . 0.0 110.578 -179.399 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 91' ' ' TYR . . . . . . . . . . . . . 21.4 m-30 -64.63 -43.22 94.42 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.392 -0.367 . . . . 0.0 111.221 179.93 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 92' ' ' CYS . . . . . 0.527 ' HA ' HD12 ' A' ' 96' ' ' LEU . 58.4 m -76.37 -42.89 43.05 Favored 'General case' 0 C--N 1.323 -0.564 0 CA-C-N 116.5 -0.318 . . . . 0.0 111.844 -175.846 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 93' ' ' ARG . . . . . . . . . . . . . 63.8 ttt180 -79.25 -36.4 39.98 Favored 'General case' 0 C--N 1.326 -0.426 0 CA-C-O 120.669 0.271 . . . . 0.0 111.478 -174.46 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 94' ' ' ASN . . . . . . . . . . . . . 4.1 m-20 -101.03 -49.96 3.95 Favored 'General case' 0 C--N 1.328 -0.337 0 N-CA-C 111.997 0.369 . . . . 0.0 111.997 -174.509 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 95' ' ' HIS . . . . . . . . . . . . . 0.6 OUTLIER -82.25 -32.53 29.63 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-O 120.943 0.402 . . . . 0.0 111.248 -174.0 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 96' ' ' LEU . . . . . 0.554 HD21 ' NH2' ' A' ' 130' ' ' ARG . 93.3 mt -98.68 22.48 9.92 Favored 'General case' 0 C--N 1.324 -0.524 0 CA-C-N 116.115 -0.493 . . . . 0.0 110.741 179.746 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 97' ' ' SER . . . . . 0.551 ' OG ' ' HD3' ' A' ' 98' ' ' PRO . 2.5 p -53.86 -45.1 99.01 Favored Pre-proline 0 CA--C 1.544 0.742 0 N-CA-C 113.29 0.848 . . . . 0.0 113.29 -177.98 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 98' ' ' PRO . . . . . 0.551 ' HD3' ' OG ' ' A' ' 97' ' ' SER . 33.8 Cg_exo -60.3 -43.77 32.59 Favored 'Trans proline' 0 C--N 1.361 1.224 0 C-N-CA 121.593 1.528 . . . . 0.0 111.938 178.454 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 99' ' ' LEU . . . . . 0.453 ' O ' ' HB3' ' A' ' 64' ' ' PHE . 61.1 mt -76.29 -32.45 58.78 Favored 'General case' 0 C--N 1.326 -0.456 0 CA-C-N 115.818 -0.628 . . . . 0.0 110.592 -176.399 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 100' ' ' TYR . . . . . . . . . . . . . 42.8 t80 -57.84 -33.22 68.4 Favored 'General case' 0 C--N 1.326 -0.433 0 CA-C-N 115.73 -0.668 . . . . 0.0 110.801 -179.652 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 101' ' ' MET . . . . . . . . . . . . . 65.8 mtt -102.32 14.29 32.35 Favored 'General case' 0 C--N 1.324 -0.508 0 CA-C-N 116.206 -0.452 . . . . 0.0 110.889 -178.244 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 102' ' ' LYS . . . . . 0.437 ' HG3' ' O ' ' A' ' 98' ' ' PRO . 64.6 mttt -99.05 163.14 12.7 Favored 'General case' 0 C--N 1.326 -0.444 0 CA-C-O 121.24 0.543 . . . . 0.0 111.162 179.104 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 103' ' ' SER . . . . . . . . . . . . . 20.3 m -80.3 137.06 36.54 Favored 'General case' 0 N--CA 1.446 -0.662 0 CA-C-N 115.307 -0.86 . . . . 0.0 109.134 173.533 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 104' ' ' LEU . . . . . 0.563 ' HG ' HD12 ' A' ' 146' ' ' ILE . 50.3 tp -55.07 -43.82 74.25 Favored 'General case' 0 C--N 1.327 -0.409 0 N-CA-C 112.65 0.611 . . . . 0.0 112.65 -171.293 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 105' ' ' SER . . . . . . . . . . . . . 15.5 m -84.01 -9.72 58.44 Favored 'General case' 0 C--N 1.321 -0.665 0 N-CA-C 112.702 0.631 . . . . 0.0 112.702 -171.171 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 106' ' ' GLU . . . . . . . . . . . . . 0.2 OUTLIER -86.95 -22.12 25.8 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-O 120.871 0.367 . . . . 0.0 110.229 -177.082 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 107' ' ' ILE . . . . . . . . . . . . . 62.9 mt -60.66 126.25 18.2 Favored 'Isoleucine or valine' 0 C--O 1.236 0.35 0 CA-C-N 115.747 -0.66 . . . . 0.0 111.491 -174.939 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 108' ' ' LEU . . . . . 0.482 ' H ' HD23 ' A' ' 108' ' ' LEU . 1.4 pt? -112.25 149.32 40.81 Favored Pre-proline 0 C--N 1.325 -0.488 0 CA-C-N 115.432 -0.804 . . . . 0.0 110.31 -179.541 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 109' ' ' PRO . . . . . . . . . . . . . 50.9 Cg_exo -55.01 -39.77 89.25 Favored 'Trans proline' 0 C--N 1.344 0.324 0 C-N-CA 122.952 2.435 . . . . 0.0 112.906 179.674 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 110' ' ' ALA . . . . . 0.47 ' HB3' HD12 ' A' ' 108' ' ' LEU . . . -58.85 -38.67 79.28 Favored 'General case' 0 N--CA 1.464 0.243 0 N-CA-C 111.779 0.289 . . . . 0.0 111.779 -178.209 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 111' ' ' ASP . . . . . . . . . . . . . 28.2 t70 -66.49 -45.91 78.05 Favored 'General case' 0 C--N 1.327 -0.379 0 CA-C-O 121.246 0.546 . . . . 0.0 110.155 -178.172 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 112' ' ' ILE . . . . . 0.58 HD12 ' HB2' ' A' ' 150' ' ' PRO . 58.4 mt -65.74 -38.6 82.63 Favored 'Isoleucine or valine' 0 C--O 1.239 0.519 0 CA-C-N 115.564 -0.744 . . . . 0.0 110.581 177.486 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 113' ' ' GLN . . . . . . . . . . . . . 27.1 tp60 -61.91 -40.57 95.93 Favored 'General case' 0 C--N 1.327 -0.384 0 CA-C-N 115.266 -0.879 . . . . 0.0 110.348 179.597 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 114' ' ' SER . . . . . . . . . . . . . 19.0 t -60.18 -43.95 95.45 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 116.088 -0.506 . . . . 0.0 110.152 177.687 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 115' ' ' ILE . . . . . . . . . . . . . 69.0 mt -54.88 -39.52 48.93 Favored 'Isoleucine or valine' 0 CA--C 1.53 0.195 0 CA-C-O 120.8 0.333 . . . . 0.0 110.677 178.491 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 116' ' ' ILE . . . . . 0.503 HG12 HH11 ' A' ' 130' ' ' ARG . 23.3 mm -70.02 -40.0 77.99 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.238 0 CA-C-N 116.425 -0.352 . . . . 0.0 111.332 177.905 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 117' ' ' ASN . . . . . . . . . . . . . 6.4 t30 -67.39 -32.82 73.98 Favored 'General case' 0 C--N 1.324 -0.51 0 CA-C-O 120.948 0.404 . . . . 0.0 110.501 -178.772 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 118' ' ' GLU . . . . . . . . . . . . . 36.9 mt-10 -83.7 -30.61 26.63 Favored 'General case' 0 C--N 1.327 -0.391 0 CA-C-N 115.808 -0.633 . . . . 0.0 111.564 -178.848 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 119' ' ' THR . . . . . . . . . . . . . 97.9 m -83.77 121.06 26.79 Favored 'General case' 0 C--N 1.325 -0.467 0 CA-C-O 120.977 0.417 . . . . 0.0 111.399 -177.584 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 120' ' ' LYS . . . . . . . . . . . . . 74.6 mmtt -109.09 86.11 2.22 Favored 'General case' 0 C--N 1.321 -0.666 0 CA-C-O 121.293 0.568 . . . . 0.0 110.868 176.716 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 121' ' ' LEU . . . . . . . . . . . . . 85.8 mt -120.52 -175.2 2.97 Favored 'General case' 0 C--N 1.319 -0.755 0 CA-C-N 115.235 -0.893 . . . . 0.0 108.841 174.727 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 122' ' ' ALA . . . . . . . . . . . . . . . -58.5 139.42 55.69 Favored 'General case' 0 C--N 1.324 -0.529 0 N-CA-C 109.325 -0.62 . . . . 0.0 109.325 173.871 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 123' ' ' LYS . . . . . . . . . . . . . 91.6 mttt -62.33 -33.04 73.93 Favored 'General case' 0 C--N 1.322 -0.618 0 CA-C-O 121.141 0.495 . . . . 0.0 110.832 -174.432 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 124' ' ' ASN . . . . . . . . . . . . . 42.9 m-80 -65.56 -39.07 91.26 Favored 'General case' 0 C--N 1.325 -0.49 0 CA-C-N 115.666 -0.697 . . . . 0.0 110.312 175.09 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 125' ' ' THR . . . . . 0.475 ' O ' HG13 ' A' ' 129' ' ' ILE . 17.3 m -69.75 -37.39 76.42 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 116.001 -0.545 . . . . 0.0 110.691 179.48 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 126' ' ' LEU . . . . . . . . . . . . . 98.2 mt -56.8 -51.45 68.88 Favored 'General case' 0 C--O 1.237 0.442 0 CA-C-N 116.27 -0.423 . . . . 0.0 110.949 179.364 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 127' ' ' LYS . . . . . 0.56 ' HB3' HG21 ' A' ' 156' ' ' ILE . 12.7 ptmm? -71.29 -21.29 62.1 Favored 'General case' 0 C--N 1.327 -0.41 0 CA-C-N 116.269 -0.423 . . . . 0.0 111.254 179.593 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 128' ' ' ALA . . . . . . . . . . . . . . . -69.08 -43.02 75.4 Favored 'General case' 0 C--N 1.331 -0.222 0 CA-C-O 120.859 0.362 . . . . 0.0 110.654 175.353 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 129' ' ' ILE . . . . . 0.475 HG13 ' O ' ' A' ' 125' ' ' THR . 51.9 mt -66.07 -29.45 46.83 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.235 0 CA-C-O 121.177 0.513 . . . . 0.0 110.03 177.779 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 130' ' ' ARG . . . . . 0.866 ' HE ' ' HA ' ' A' ' 130' ' ' ARG . 0.4 OUTLIER -76.09 -43.31 44.06 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.397 -0.365 . . . . 0.0 110.932 175.69 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' A' A ' 131' ' ' ASN . . . . . 0.576 ' O ' ' HG2' ' A' ' 135' ' ' GLN . 27.2 t-20 -55.86 -51.51 67.29 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-O 120.889 0.376 . . . . 0.0 110.259 177.649 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 132' ' ' THR . . . . . . . . . . . . . 28.5 m -54.81 -48.57 72.61 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 115.569 -0.741 . . . . 0.0 110.966 178.454 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 133' ' ' ALA . . . . . . . . . . . . . . . -63.15 -39.27 94.18 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.122 -0.49 . . . . 0.0 111.04 179.654 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 134' ' ' SER . . . . . . . . . . . . . 11.1 t -63.98 -38.56 91.53 Favored 'General case' 0 C--N 1.327 -0.406 0 CA-C-N 116.372 -0.376 . . . . 0.0 110.429 -179.613 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 135' ' ' GLN . . . . . 0.576 ' HG2' ' O ' ' A' ' 131' ' ' ASN . 78.1 mm-40 -61.04 -37.81 83.92 Favored 'General case' 0 C--N 1.331 -0.229 0 CA-C-O 121.016 0.436 . . . . 0.0 110.198 177.474 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 136' ' ' ILE . . . . . . . . . . . . . 69.9 mt -64.57 -46.62 92.02 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.357 0 CA-C-N 115.71 -0.677 . . . . 0.0 110.683 177.998 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 137' ' ' PHE . . . . . 0.473 ' O ' HG13 ' A' ' 141' ' ' ILE . 53.4 m-85 -61.0 -42.27 98.11 Favored 'General case' 0 N--CA 1.462 0.14 0 CA-C-O 120.908 0.385 . . . . 0.0 110.548 176.192 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 138' ' ' ARG . . . . . 0.522 ' O ' ' HG3' ' A' ' 142' ' ' GLU . 25.9 mtp180 -57.88 -47.11 83.73 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 115.895 -0.593 . . . . 0.0 111.207 177.699 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 139' ' ' LEU . . . . . . . . . . . . . 61.7 tp -56.55 -37.34 70.38 Favored 'General case' 0 C--N 1.327 -0.392 0 CA-C-O 121.28 0.562 . . . . 0.0 110.637 178.67 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 140' ' ' ALA . . . . . 0.518 ' HB1' HD21 ' A' ' 104' ' ' LEU . . . -68.92 -43.09 75.85 Favored 'General case' 0 C--N 1.324 -0.511 0 CA-C-N 115.775 -0.648 . . . . 0.0 110.551 176.955 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 141' ' ' ILE . . . . . 0.473 HG13 ' O ' ' A' ' 137' ' ' PHE . 81.7 mt -60.3 -39.11 79.85 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.254 0 CA-C-N 116.109 -0.496 . . . . 0.0 110.911 177.094 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 142' ' ' GLU . . . . . 0.522 ' HG3' ' O ' ' A' ' 138' ' ' ARG . 42.5 mt-10 -61.5 -32.58 72.61 Favored 'General case' 0 C--N 1.33 -0.243 0 CA-C-N 116.419 -0.355 . . . . 0.0 111.16 179.624 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 143' ' ' ASN . . . . . . . . . . . . . 44.9 m-80 -95.34 6.58 48.63 Favored 'General case' 0 C--N 1.326 -0.42 0 CA-C-N 116.365 -0.38 . . . . 0.0 110.477 178.58 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 144' ' ' ARG . . . . . . . . . . . . . 47.7 mtp85 59.81 30.67 20.23 Favored 'General case' 0 N--CA 1.466 0.333 0 CA-C-N 115.525 -0.761 . . . . 0.0 111.426 179.309 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 145' ' ' ALA . . . . . . . . . . . . . . . -85.5 -9.43 57.43 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 115.897 -0.592 . . . . 0.0 110.237 177.703 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 146' ' ' ILE . . . . . 0.563 HD12 ' HG ' ' A' ' 104' ' ' LEU . 14.8 tt -160.08 150.4 6.0 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.454 0 CA-C-N 115.545 -0.752 . . . . 0.0 109.069 174.992 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 147' ' ' ASP . . . . . . . . . . . . . 21.2 t70 -116.76 19.83 14.28 Favored 'General case' 0 C--N 1.326 -0.447 0 CA-C-O 121.864 0.84 . . . . 0.0 109.469 -177.81 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 148' ' ' PHE . . . . . 0.46 ' H ' HG12 ' A' ' 146' ' ' ILE . 61.4 t80 -141.93 134.26 27.92 Favored 'General case' 0 C--N 1.321 -0.653 0 CA-C-N 115.321 -0.854 . . . . 0.0 109.985 -171.532 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 149' ' ' ASN . . . . . . . . . . . . . 54.7 t-20 -117.19 95.96 48.25 Favored Pre-proline 0 C--N 1.324 -0.539 0 N-CA-C 109.64 -0.504 . . . . 0.0 109.64 176.816 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 150' ' ' PRO . . . . . 0.58 ' HB2' HD12 ' A' ' 112' ' ' ILE . 23.3 Cg_exo -63.54 -32.26 70.26 Favored 'Trans proline' 0 CA--C 1.528 0.191 0 C-N-CA 122.604 2.202 . . . . 0.0 112.324 -177.692 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 151' ' ' ALA . . . . . . . . . . . . . . . -71.91 -20.09 61.83 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.114 -0.494 . . . . 0.0 111.163 -177.073 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 152' ' ' ASP . . . . . . . . . . . . . 31.9 t70 -68.85 -25.48 64.67 Favored 'General case' 0 C--N 1.326 -0.422 0 CA-C-N 116.196 -0.457 . . . . 0.0 110.854 -179.63 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 153' ' ' TYR . . . . . . . . . . . . . 78.8 m-85 -93.5 -7.29 44.74 Favored 'General case' 0 C--N 1.327 -0.373 0 CA-C-N 115.981 -0.554 . . . . 0.0 111.203 -176.857 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 154' ' ' VAL . . . . . . . . . . . . . 99.3 t -76.33 117.31 20.79 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.42 0 CA-C-O 121.033 0.444 . . . . 0.0 111.346 -175.284 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 155' ' ' ARG . . . . . . . . . . . . . 32.7 ptt85 -80.43 144.05 32.94 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 115.882 -0.599 . . . . 0.0 110.112 177.912 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 156' ' ' ILE . . . . . 0.624 HD11 ' HG3' ' A' ' 130' ' ' ARG . 24.3 mm -115.55 131.89 23.41 Favored Pre-proline 0 C--N 1.323 -0.546 0 CA-C-N 116.133 -0.485 . . . . 0.0 110.653 -179.024 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 157' ' ' PRO . . . . . . . . . . . . . 55.7 Cg_endo . . . . . 0 N--CA 1.459 -0.5 0 C-N-CA 122.186 1.924 . . . . 0.0 111.278 174.068 . . . . . . . . 0 0 . 1 . 005 nuclear build core ' A' A ' 63' ' ' SER . . . . . . . . . . . . . 93.9 p . . . . . 0 C--O 1.234 0.283 0 CA-C-O 120.733 0.301 . . . . 0.0 110.258 . . . . . . . . . 0 0 . 1 . 005 nuclear build core ' A' A ' 64' ' ' PHE . . . . . 0.474 ' HB2' HD11 ' A' ' 107' ' ' ILE . 64.0 t80 -64.78 -29.91 70.9 Favored 'General case' 0 C--N 1.327 -0.382 0 N-CA-C 109.634 -0.506 . . . . 0.0 109.634 178.587 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 65' ' ' GLY . . . . . . . . . . . . . . . -61.4 -39.37 97.18 Favored Glycine 0 C--N 1.332 0.342 0 CA-C-N 115.885 -0.598 . . . . 0.0 112.133 176.664 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 66' ' ' ASP . . . . . . . . . . . . . 20.5 m-20 -62.57 -51.68 66.39 Favored 'General case' 0 N--CA 1.463 0.187 0 CA-C-O 121.106 0.479 . . . . 0.0 110.162 178.263 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 67' ' ' TRP . . . . . . . . . . . . . 95.7 m95 -68.78 -29.32 67.66 Favored 'General case' 0 C--N 1.326 -0.451 0 CA-C-N 115.577 -0.738 . . . . 0.0 111.937 -177.777 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 68' ' ' ALA . . . . . 0.629 ' HB1' ' SG ' ' A' ' 92' ' ' CYS . . . -61.23 -48.78 79.9 Favored 'General case' 0 C--N 1.324 -0.517 0 CA-C-O 121.086 0.469 . . . . 0.0 110.282 175.725 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 69' ' ' GLU . . . . . . . . . . . . . 5.1 mm-40 -59.71 -44.14 93.82 Favored 'General case' 0 C--N 1.326 -0.416 0 CA-C-N 115.525 -0.761 . . . . 0.0 111.055 176.218 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 70' ' ' LYS . . . . . . . . . . . . . 57.0 mtpt -66.28 -33.97 76.95 Favored 'General case' 0 C--N 1.327 -0.388 0 CA-C-N 115.936 -0.575 . . . . 0.0 110.825 -179.872 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 71' ' ' PHE . . . . . 0.552 ' CE1' ' HB3' ' A' ' 135' ' ' GLN . 65.9 t80 -66.91 -49.35 65.84 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-O 120.843 0.354 . . . . 0.0 110.657 176.683 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 72' ' ' LEU . . . . . 0.456 ' HG ' ' O ' ' A' ' 68' ' ' ALA . 89.9 mt -59.89 -40.58 89.22 Favored 'General case' 0 C--N 1.324 -0.526 0 CA-C-N 116.238 -0.437 . . . . 0.0 110.681 -179.047 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 73' ' ' LYS . . . . . 0.729 ' HA ' ' HG2' ' A' ' 76' ' ' GLU . 28.1 tttp -78.34 -27.0 46.97 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.412 -0.358 . . . . 0.0 111.549 -175.989 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 74' ' ' SER . . . . . . . . . . . . . 22.1 p -75.89 -26.08 56.67 Favored 'General case' 0 C--N 1.321 -0.64 0 C-N-CA 120.197 -0.601 . . . . 0.0 110.226 176.355 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 75' ' ' LYS . . . . . 0.438 ' HG2' ' O ' ' A' ' 71' ' ' PHE . 28.8 mmmt -77.52 -43.25 32.69 Favored 'General case' 0 C--O 1.234 0.251 0 CA-C-N 116.554 -0.293 . . . . 0.0 110.835 177.368 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 76' ' ' GLU . . . . . 0.729 ' HG2' ' HA ' ' A' ' 73' ' ' LYS . 12.2 pt-20 -62.05 -35.39 78.48 Favored 'General case' 0 N--CA 1.462 0.167 0 CA-C-O 120.84 0.353 . . . . 0.0 110.223 176.709 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 77' ' ' ALA . . . . . . . . . . . . . . . -73.8 -32.7 63.88 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.21 -0.45 . . . . 0.0 110.85 176.987 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 78' ' ' ASP . . . . . . . . . . . . . 19.3 t70 -61.68 -54.77 38.26 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.099 -0.5 . . . . 0.0 110.787 178.47 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 79' ' ' GLY . . . . . . . . . . . . . . . 145.89 50.43 0.03 OUTLIER Glycine 0 N--CA 1.45 -0.427 0 C-N-CA 120.275 -0.964 . . . . 0.0 113.068 177.076 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 80' ' ' VAL . . . . . 0.452 HG21 HD23 ' A' ' 85' ' ' LEU . 31.0 m -106.56 155.48 7.34 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.514 0 O-C-N 122.652 -0.322 . . . . 0.0 110.334 177.055 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 81' ' ' SER . . . . . . . . . . . . . 13.0 m -70.73 150.55 45.8 Favored 'General case' 0 C--N 1.32 -0.682 0 CA-C-N 116.137 -0.483 . . . . 0.0 109.789 175.162 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 82' ' ' VAL . . . . . . . . . . . . . 14.1 p -60.75 -35.61 65.37 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.402 0 CA-C-O 120.597 0.237 . . . . 0.0 110.556 179.274 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 83' ' ' SER . . . . . . . . . . . . . 8.5 m -65.29 -37.49 87.31 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-O 121.081 0.467 . . . . 0.0 110.57 177.419 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 84' ' ' GLN . . . . . . . . . . . . . 6.1 tp-100 -68.42 -40.08 81.35 Favored 'General case' 0 C--N 1.332 -0.179 0 CA-C-N 115.971 -0.559 . . . . 0.0 109.609 177.031 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 85' ' ' LEU . . . . . 0.46 ' HA ' HD22 ' A' ' 85' ' ' LEU . 0.7 OUTLIER -65.12 -36.73 85.2 Favored 'General case' 0 C--N 1.327 -0.385 0 CA-C-N 115.59 -0.732 . . . . 0.0 109.486 177.35 . . . . . . . . 3 3 . 1 . 005 nuclear build core ' A' A ' 86' ' ' ASN . . . . . . . . . . . . . 11.6 m120 -57.64 -39.47 77.06 Favored 'General case' 0 CA--C 1.519 -0.221 0 CA-C-N 116.046 -0.524 . . . . 0.0 110.622 175.261 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 87' ' ' SER . . . . . . . . . . . . . 49.0 m -65.23 -46.3 81.17 Favored 'General case' 0 C--N 1.326 -0.42 0 CA-C-N 116.407 -0.36 . . . . 0.0 110.547 178.588 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 88' ' ' TYR . . . . . . . . . . . . . 49.2 m-85 -57.5 -46.45 83.75 Favored 'General case' 0 N--CA 1.463 0.198 0 CA-C-O 121.01 0.433 . . . . 0.0 110.404 175.495 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 89' ' ' LYS . . . . . . . . . . . . . 38.4 ttmt -66.44 -35.6 80.69 Favored 'General case' 0 C--N 1.324 -0.528 0 CA-C-N 115.652 -0.704 . . . . 0.0 110.734 -178.951 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 90' ' ' ASN . . . . . . . . . . . . . 25.9 t-20 -62.29 -47.86 82.46 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-O 120.943 0.401 . . . . 0.0 110.207 178.553 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 91' ' ' TYR . . . . . . . . . . . . . 31.0 m-85 -62.3 -50.94 69.65 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.085 -0.507 . . . . 0.0 110.185 177.361 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 92' ' ' CYS . . . . . 0.629 ' SG ' ' HB1' ' A' ' 68' ' ' ALA . 42.0 t -63.96 -48.56 76.0 Favored 'General case' 0 C--N 1.323 -0.579 0 N-CA-C 112.368 0.507 . . . . 0.0 112.368 -175.262 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 93' ' ' ARG . . . . . . . . . . . . . 72.5 ttt180 -70.93 -38.5 72.91 Favored 'General case' 0 C--N 1.324 -0.504 0 N-CA-C 111.914 0.338 . . . . 0.0 111.914 -173.293 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 94' ' ' ASN . . . . . . . . . . . . . 73.1 m-20 -102.96 -58.12 1.93 Allowed 'General case' 0 C--N 1.324 -0.527 0 C-N-CA 120.912 -0.315 . . . . 0.0 111.718 -172.437 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 95' ' ' HIS . . . . . . . . . . . . . 78.0 m-70 -74.05 -42.7 59.84 Favored 'General case' 0 C--N 1.326 -0.425 0 CA-C-O 120.73 0.3 . . . . 0.0 111.086 -174.572 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 96' ' ' LEU . . . . . 0.568 ' HB2' ' HA ' ' A' ' 92' ' ' CYS . 96.0 mt -93.16 16.88 11.98 Favored 'General case' 0 C--N 1.325 -0.471 0 CA-C-N 116.475 -0.329 . . . . 0.0 110.63 179.414 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 97' ' ' SER . . . . . 0.575 ' N ' ' HD2' ' A' ' 98' ' ' PRO . 18.6 t -54.37 -47.55 97.28 Favored Pre-proline 0 CA--C 1.537 0.476 0 CA-C-N 115.811 -0.632 . . . . 0.0 111.427 178.665 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 98' ' ' PRO . . . . . 0.586 ' O ' ' HG3' ' A' ' 102' ' ' LYS . 10.3 Cg_endo -53.56 -32.38 63.6 Favored 'Trans proline' 0 C--N 1.36 1.143 0 C-N-CA 122.329 2.019 . . . . 0.0 112.758 175.554 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 99' ' ' LEU . . . . . 0.583 HD21 HG12 ' A' ' 112' ' ' ILE . 10.7 mp -81.22 -39.76 24.87 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-O 120.766 0.317 . . . . 0.0 110.865 178.243 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 100' ' ' TYR . . . . . . . . . . . . . 33.4 t80 -54.03 -33.69 57.98 Favored 'General case' 0 C--N 1.331 -0.225 0 CA-C-N 115.642 -0.708 . . . . 0.0 110.531 179.062 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 101' ' ' MET . . . . . . . . . . . . . 65.0 mtt -91.15 6.41 45.16 Favored 'General case' 0 C--N 1.327 -0.401 0 CA-C-N 115.539 -0.755 . . . . 0.0 111.652 -177.586 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 102' ' ' LYS . . . . . 0.586 ' HG3' ' O ' ' A' ' 98' ' ' PRO . 59.3 mttp -108.92 166.52 10.76 Favored 'General case' 0 C--N 1.326 -0.456 0 CA-C-O 121.555 0.693 . . . . 0.0 111.148 178.942 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 103' ' ' SER . . . . . 0.492 ' O ' HG13 ' A' ' 107' ' ' ILE . 28.6 t -96.93 160.38 14.38 Favored 'General case' 0 C--N 1.32 -0.703 0 CA-C-N 115.199 -0.909 . . . . 0.0 109.312 174.218 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 104' ' ' LEU . . . . . 0.513 ' HB3' HD12 ' A' ' 146' ' ' ILE . 84.9 mt -50.21 -59.57 3.81 Favored 'General case' 0 N--CA 1.468 0.469 0 N-CA-C 113.407 0.891 . . . . 0.0 113.407 -171.087 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 105' ' ' SER . . . . . . . . . . . . . 29.4 t -81.02 -0.47 39.85 Favored 'General case' 0 C--N 1.325 -0.483 0 CA-C-O 121.061 0.457 . . . . 0.0 111.046 -174.115 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 106' ' ' GLU . . . . . . . . . . . . . 3.4 mp0 -99.46 -1.8 37.62 Favored 'General case' 0 C--N 1.325 -0.481 0 CA-C-N 116.131 -0.486 . . . . 0.0 110.702 -175.962 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 107' ' ' ILE . . . . . 0.492 HG13 ' O ' ' A' ' 103' ' ' SER . 76.0 mt -87.13 129.0 39.31 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.455 0 CA-C-N 115.889 -0.596 . . . . 0.0 110.596 179.83 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 108' ' ' LEU . . . . . . . . . . . . . 91.9 mt -97.44 136.63 21.25 Favored Pre-proline 0 C--N 1.321 -0.636 0 CA-C-N 116.093 -0.503 . . . . 0.0 110.206 178.311 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 109' ' ' PRO . . . . . . . . . . . . . 32.5 Cg_exo -59.03 -32.94 98.42 Favored 'Trans proline' 0 CA--C 1.528 0.215 0 C-N-CA 122.738 2.292 . . . . 0.0 111.892 177.06 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 110' ' ' ALA . . . . . . . . . . . . . . . -67.04 -30.72 70.87 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 115.77 -0.65 . . . . 0.0 110.988 178.651 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 111' ' ' ASP . . . . . 0.431 ' O ' HG13 ' A' ' 115' ' ' ILE . 32.5 t70 -65.92 -39.61 90.7 Favored 'General case' 0 C--N 1.331 -0.218 0 N-CA-C 109.448 -0.575 . . . . 0.0 109.448 179.975 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 112' ' ' ILE . . . . . 0.583 HG12 HD21 ' A' ' 99' ' ' LEU . 15.6 mt -68.39 -40.95 83.09 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.308 0 CA-C-N 115.358 -0.837 . . . . 0.0 110.238 177.474 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 113' ' ' GLN . . . . . 0.517 ' HA ' HG23 ' A' ' 154' ' ' VAL . 0.0 OUTLIER -63.14 -40.63 98.13 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 115.911 -0.586 . . . . 0.0 109.988 -179.514 . . . . . . . . 3 3 . 1 . 005 nuclear build core ' A' A ' 114' ' ' SER . . . . . . . . . . . . . 58.2 m -59.59 -41.47 90.36 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 116.358 -0.383 . . . . 0.0 110.862 176.921 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 115' ' ' ILE . . . . . 0.504 HD11 ' HG2' ' A' ' 98' ' ' PRO . 78.1 mt -57.65 -50.38 77.56 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.211 0 CA-C-O 120.81 0.338 . . . . 0.0 110.52 176.547 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 116' ' ' ILE . . . . . 0.404 HG23 ' HB3' ' A' ' 126' ' ' LEU . 49.5 mm -60.56 -43.2 94.0 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.343 0 CA-C-N 115.897 -0.592 . . . . 0.0 111.017 179.784 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 117' ' ' ASN . . . . . . . . . . . . . 55.1 t30 -67.18 -36.55 82.02 Favored 'General case' 0 C--N 1.324 -0.503 0 CA-C-N 115.925 -0.579 . . . . 0.0 111.492 -177.492 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 118' ' ' GLU . . . . . . . . . . . . . 43.2 mt-10 -84.19 -19.89 33.27 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 116.496 -0.32 . . . . 0.0 111.813 -177.43 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 119' ' ' THR . . . . . 0.412 HG23 HD23 ' A' ' 121' ' ' LEU . 96.1 m -70.82 126.29 29.18 Favored 'General case' 0 C--N 1.323 -0.563 0 N-CA-C 109.817 -0.438 . . . . 0.0 109.817 176.202 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 120' ' ' LYS . . . . . . . . . . . . . 21.8 mtpp -102.44 35.75 2.35 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-O 120.862 0.363 . . . . 0.0 111.591 -174.659 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 121' ' ' LEU . . . . . 0.412 HD23 HG23 ' A' ' 119' ' ' THR . 3.9 mm? -100.92 -175.92 3.02 Favored 'General case' 0 C--N 1.323 -0.574 0 CA-C-N 116.215 -0.448 . . . . 0.0 109.919 177.105 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 122' ' ' ALA . . . . . 0.422 ' O ' ' HG ' ' A' ' 126' ' ' LEU . . . -69.65 162.68 27.2 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-O 121.072 0.463 . . . . 0.0 111.67 -177.228 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 123' ' ' LYS . . . . . . . . . . . . . 53.2 mtmt -62.84 -34.2 76.82 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 115.764 -0.653 . . . . 0.0 111.073 -179.043 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 124' ' ' ASN . . . . . 0.743 ' HA ' ' HE3' ' A' ' 127' ' ' LYS . 65.2 t30 -64.4 -39.45 93.88 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-O 121.06 0.457 . . . . 0.0 109.911 176.937 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 125' ' ' THR . . . . . 0.44 ' O ' HG13 ' A' ' 129' ' ' ILE . 3.5 m -65.98 -39.0 89.97 Favored 'General case' 0 C--N 1.327 -0.399 0 CA-C-N 115.665 -0.698 . . . . 0.0 110.29 178.6 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 126' ' ' LEU . . . . . 0.422 ' HG ' ' O ' ' A' ' 122' ' ' ALA . 85.0 mt -62.33 -43.16 99.47 Favored 'General case' 0 C--O 1.234 0.26 0 CA-C-N 115.862 -0.608 . . . . 0.0 110.563 177.151 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 127' ' ' LYS . . . . . 0.743 ' HE3' ' HA ' ' A' ' 124' ' ' ASN . 27.0 mtmt -59.92 -41.35 91.54 Favored 'General case' 0 C--N 1.331 -0.237 0 CA-C-N 116.132 -0.486 . . . . 0.0 110.766 177.328 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 128' ' ' ALA . . . . . . . . . . . . . . . -60.99 -34.78 75.32 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.148 -0.478 . . . . 0.0 111.327 -179.308 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 129' ' ' ILE . . . . . 0.44 HG13 ' O ' ' A' ' 125' ' ' THR . 64.6 mt -65.69 -50.55 70.51 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.304 0 CA-C-N 116.519 -0.31 . . . . 0.0 110.397 178.424 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 130' ' ' ARG . . . . . . . . . . . . . 24.5 ttt180 -60.68 -42.85 97.93 Favored 'General case' 0 N--CA 1.462 0.14 0 CA-C-N 116.455 -0.339 . . . . 0.0 110.336 176.23 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 131' ' ' ASN . . . . . . . . . . . . . 7.7 t30 -55.91 -52.31 64.56 Favored 'General case' 0 C--N 1.327 -0.384 0 CA-C-N 115.816 -0.629 . . . . 0.0 110.519 -179.768 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 132' ' ' THR . . . . . 0.571 ' O ' HG13 ' A' ' 136' ' ' ILE . 37.7 m -57.43 -48.88 77.95 Favored 'General case' 0 C--N 1.326 -0.442 0 CA-C-N 115.714 -0.675 . . . . 0.0 110.814 178.898 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 133' ' ' ALA . . . . . . . . . . . . . . . -63.3 -46.99 84.14 Favored 'General case' 0 C--N 1.331 -0.213 0 CA-C-N 116.109 -0.496 . . . . 0.0 111.601 -177.859 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 134' ' ' SER . . . . . . . . . . . . . 9.5 t -62.98 -38.78 92.53 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-O 120.73 0.3 . . . . 0.0 110.519 -177.596 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 135' ' ' GLN . . . . . 0.552 ' HB3' ' CE1' ' A' ' 71' ' ' PHE . 0.8 OUTLIER -61.73 -39.97 93.44 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.255 -0.43 . . . . 0.0 110.967 176.67 . . . . . . . . 3 3 . 1 . 005 nuclear build core ' A' A ' 136' ' ' ILE . . . . . 0.571 HG13 ' O ' ' A' ' 132' ' ' THR . 66.3 mt -65.7 -48.52 82.11 Favored 'Isoleucine or valine' 0 C--O 1.233 0.213 0 CA-C-N 116.344 -0.389 . . . . 0.0 110.635 178.336 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 137' ' ' PHE . . . . . 0.457 ' O ' HG13 ' A' ' 141' ' ' ILE . 40.6 m-85 -58.19 -43.92 87.81 Favored 'General case' 0 CA--C 1.521 -0.143 0 CA-C-N 116.179 -0.464 . . . . 0.0 110.748 178.321 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 138' ' ' ARG . . . . . 0.595 ' O ' ' HG3' ' A' ' 142' ' ' GLU . 62.3 mtt85 -59.51 -42.3 91.88 Favored 'General case' 0 C--O 1.222 -0.354 0 CA-C-N 116.278 -0.419 . . . . 0.0 111.163 178.673 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 139' ' ' LEU . . . . . . . . . . . . . 57.4 tp -56.95 -41.89 79.1 Favored 'General case' 0 C--N 1.326 -0.456 0 CA-C-O 120.942 0.401 . . . . 0.0 110.398 178.301 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 140' ' ' ALA . . . . . . . . . . . . . . . -66.84 -40.46 87.96 Favored 'General case' 0 C--N 1.327 -0.389 0 CA-C-N 116.144 -0.48 . . . . 0.0 110.475 176.693 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 141' ' ' ILE . . . . . 0.457 HG13 ' O ' ' A' ' 137' ' ' PHE . 80.1 mt -63.3 -40.5 89.28 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.301 0 CA-C-N 116.207 -0.451 . . . . 0.0 110.831 178.428 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 142' ' ' GLU . . . . . 0.595 ' HG3' ' O ' ' A' ' 138' ' ' ARG . 50.2 mt-10 -63.47 -29.99 71.19 Favored 'General case' 0 C--N 1.331 -0.228 0 CA-C-O 120.812 0.339 . . . . 0.0 111.049 179.971 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 143' ' ' ASN . . . . . . . . . . . . . 3.4 m-20 -92.98 6.18 48.82 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-O 120.95 0.405 . . . . 0.0 110.32 176.927 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 144' ' ' ARG . . . . . 0.409 ' HD3' ' HA ' ' A' ' 144' ' ' ARG . 3.8 mmt180 59.52 28.33 17.7 Favored 'General case' 0 N--CA 1.464 0.26 0 CA-C-N 115.545 -0.752 . . . . 0.0 112.096 179.087 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 145' ' ' ALA . . . . . . . . . . . . . . . -78.51 -31.25 47.56 Favored 'General case' 0 C--N 1.327 -0.395 0 CA-C-O 121.074 0.464 . . . . 0.0 109.965 176.874 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 146' ' ' ILE . . . . . 0.513 HD12 ' HB3' ' A' ' 104' ' ' LEU . 14.8 tt -141.75 142.48 28.37 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.464 0 CA-C-N 115.641 -0.708 . . . . 0.0 109.165 175.503 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 147' ' ' ASP . . . . . . . . . . . . . 33.1 t70 -108.28 25.66 11.37 Favored 'General case' 0 C--N 1.322 -0.626 0 CA-C-O 121.681 0.753 . . . . 0.0 110.394 -175.999 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 148' ' ' PHE . . . . . 0.445 ' H ' HG12 ' A' ' 146' ' ' ILE . 80.7 t80 -148.81 141.96 24.98 Favored 'General case' 0 C--N 1.325 -0.498 0 CA-C-N 115.909 -0.587 . . . . 0.0 110.498 -177.393 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 149' ' ' ASN . . . . . . . . . . . . . 47.3 t-20 -116.73 99.61 52.95 Favored Pre-proline 0 C--N 1.326 -0.427 0 N-CA-C 110.111 -0.329 . . . . 0.0 110.111 177.83 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 150' ' ' PRO . . . . . . . . . . . . . 24.1 Cg_exo -64.54 -21.69 65.68 Favored 'Trans proline' 0 C--N 1.342 0.229 0 C-N-CA 122.892 2.395 . . . . 0.0 112.757 -178.593 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 151' ' ' ALA . . . . . 0.466 ' O ' HG12 ' A' ' 154' ' ' VAL . . . -73.62 -14.35 61.16 Favored 'General case' 0 C--N 1.327 -0.39 0 CA-C-O 120.875 0.369 . . . . 0.0 111.322 -176.719 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 152' ' ' ASP . . . . . . . . . . . . . 24.1 t70 -64.87 -27.89 69.17 Favored 'General case' 0 C--N 1.324 -0.54 0 CA-C-O 121.044 0.45 . . . . 0.0 110.395 178.201 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 153' ' ' TYR . . . . . . . . . . . . . 63.2 m-85 -97.26 0.81 48.78 Favored 'General case' 0 C--N 1.328 -0.343 0 N-CA-C 112.787 0.662 . . . . 0.0 112.787 -175.275 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 154' ' ' VAL . . . . . 0.517 HG23 ' HA ' ' A' ' 113' ' ' GLN . 6.3 p -94.21 106.7 18.39 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.384 0 C-N-CA 119.667 -0.813 . . . . 0.0 110.224 177.146 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 155' ' ' ARG . . . . . . . . . . . . . 18.2 ptt180 -93.04 144.55 25.15 Favored 'General case' 0 C--N 1.322 -0.622 0 CA-C-N 115.666 -0.697 . . . . 0.0 111.015 -177.249 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 156' ' ' ILE . . . . . . . . . . . . . 44.4 mm -89.25 116.82 67.34 Favored Pre-proline 0 C--N 1.323 -0.555 0 CA-C-N 115.655 -0.702 . . . . 0.0 109.803 179.616 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 157' ' ' PRO . . . . . . . . . . . . . 13.0 Cg_exo . . . . . 0 N--CA 1.464 -0.264 0 C-N-CA 122.613 2.209 . . . . 0.0 111.867 -179.613 . . . . . . . . 0 0 . 1 . 006 nuclear build core ' A' A ' 63' ' ' SER . . . . . 0.513 ' HA ' ' HA ' ' A' ' 103' ' ' SER . 10.7 p . . . . . 0 N--CA 1.452 -0.352 0 N-CA-C 110.259 -0.274 . . . . 0.0 110.259 . . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 64' ' ' PHE . . . . . 0.54 ' HB2' HD11 ' A' ' 107' ' ' ILE . 86.6 t80 -60.99 -34.55 74.96 Favored 'General case' 0 C--N 1.33 -0.249 0 N-CA-C 109.933 -0.395 . . . . 0.0 109.933 179.693 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 65' ' ' GLY . . . . . . . . . . . . . . . -58.5 -44.82 95.19 Favored Glycine 0 N--CA 1.447 -0.6 0 CA-C-N 115.901 -0.59 . . . . 0.0 112.256 176.326 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 66' ' ' ASP . . . . . . . . . . . . . 36.9 t70 -65.08 -40.98 95.42 Favored 'General case' 0 C--N 1.327 -0.393 0 CA-C-O 120.819 0.342 . . . . 0.0 110.324 178.273 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 67' ' ' TRP . . . . . 0.418 ' CH2' ' HA ' ' A' ' 140' ' ' ALA . 87.0 m95 -62.36 -42.02 99.07 Favored 'General case' 0 C--N 1.332 -0.18 0 CA-C-N 116.278 -0.419 . . . . 0.0 110.967 177.011 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 68' ' ' ALA . . . . . 0.519 ' O ' ' HG ' ' A' ' 72' ' ' LEU . . . -59.73 -44.69 93.65 Favored 'General case' 0 C--N 1.327 -0.373 0 CA-C-N 116.287 -0.415 . . . . 0.0 110.669 177.8 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 69' ' ' GLU . . . . . . . . . . . . . 80.6 mt-10 -61.57 -42.85 99.44 Favored 'General case' 0 C--N 1.325 -0.461 0 CA-C-N 116.242 -0.436 . . . . 0.0 111.177 178.51 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 70' ' ' LYS . . . . . . . . . . . . . 43.2 mtmt -69.63 -28.64 66.09 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.272 -0.422 . . . . 0.0 110.731 179.639 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 71' ' ' PHE . . . . . . . . . . . . . 87.8 t80 -74.53 -40.12 61.94 Favored 'General case' 0 C--N 1.325 -0.488 0 CA-C-N 116.07 -0.514 . . . . 0.0 110.216 176.371 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 72' ' ' LEU . . . . . 0.519 ' HG ' ' O ' ' A' ' 68' ' ' ALA . 91.1 mt -65.93 -36.48 83.48 Favored 'General case' 0 C--N 1.327 -0.37 0 CA-C-O 120.883 0.373 . . . . 0.0 110.307 176.773 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 73' ' ' LYS . . . . . . . . . . . . . 39.4 ttmt -63.11 -45.8 90.31 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 115.943 -0.571 . . . . 0.0 110.642 178.472 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 74' ' ' SER . . . . . . . . . . . . . 6.4 p -73.75 -39.8 63.97 Favored 'General case' 0 C--N 1.326 -0.456 0 CA-C-N 115.847 -0.615 . . . . 0.0 111.323 -178.023 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 75' ' ' LYS . . . . . 0.492 ' O ' ' HB3' ' A' ' 78' ' ' ASP . 10.8 tptp -69.61 -21.93 63.54 Favored 'General case' 0 N--CA 1.454 -0.268 0 CA-C-O 120.811 0.338 . . . . 0.0 111.074 179.29 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 76' ' ' GLU . . . . . . . . . . . . . 31.1 tt0 -73.15 -43.5 61.44 Favored 'General case' 0 C--N 1.324 -0.532 0 N-CA-C 109.304 -0.628 . . . . 0.0 109.304 174.183 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 77' ' ' ALA . . . . . . . . . . . . . . . -65.65 -27.18 68.19 Favored 'General case' 0 C--N 1.331 -0.213 0 CA-C-N 115.668 -0.696 . . . . 0.0 110.672 175.714 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 78' ' ' ASP . . . . . 0.492 ' HB3' ' O ' ' A' ' 75' ' ' LYS . 18.5 t0 -51.98 -44.1 63.87 Favored 'General case' 0 C--O 1.235 0.295 0 CA-C-N 115.555 -0.748 . . . . 0.0 109.605 173.712 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 79' ' ' GLY . . . . . . . . . . . . . . . 107.31 29.06 4.65 Favored Glycine 0 N--CA 1.448 -0.521 0 CA-C-N 115.44 -0.8 . . . . 0.0 112.141 -179.315 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 80' ' ' VAL . . . . . . . . . . . . . 33.1 m -69.63 150.35 10.34 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.347 0 CA-C-O 120.956 0.407 . . . . 0.0 110.675 179.758 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 81' ' ' SER . . . . . . . . . . . . . 14.0 m -72.92 168.34 19.16 Favored 'General case' 0 C--N 1.324 -0.518 0 CA-C-N 115.849 -0.614 . . . . 0.0 111.016 -179.383 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 82' ' ' VAL . . . . . . . . . . . . . 48.9 t -57.44 -52.37 57.88 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.187 0 CA-C-N 116.259 -0.428 . . . . 0.0 111.425 -176.523 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 83' ' ' SER . . . . . . . . . . . . . 59.8 m -62.42 -27.6 69.21 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-O 120.891 0.377 . . . . 0.0 111.113 -179.095 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 84' ' ' GLN . . . . . . . . . . . . . 51.5 tp60 -69.18 -54.55 14.25 Favored 'General case' 0 C--N 1.327 -0.396 0 CA-C-N 116.152 -0.476 . . . . 0.0 109.812 -179.74 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 85' ' ' LEU . . . . . . . . . . . . . 31.7 tp -69.17 -30.33 68.53 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.22 -0.446 . . . . 0.0 110.216 179.835 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 86' ' ' ASN . . . . . . . . . . . . . 27.2 t-20 -58.03 -44.65 87.45 Favored 'General case' 0 C--O 1.235 0.3 0 CA-C-N 116.094 -0.503 . . . . 0.0 110.195 176.018 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 87' ' ' SER . . . . . . . . . . . . . 8.7 t -66.83 -39.24 87.58 Favored 'General case' 0 N--CA 1.452 -0.327 0 CA-C-N 115.66 -0.7 . . . . 0.0 110.1 178.821 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 88' ' ' TYR . . . . . . . . . . . . . 30.9 m-85 -59.17 -46.32 88.71 Favored 'General case' 0 C--O 1.231 0.101 0 CA-C-N 116.321 -0.399 . . . . 0.0 111.106 177.053 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 89' ' ' LYS . . . . . . . . . . . . . 88.3 mttt -62.82 -44.38 96.3 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.5 -0.318 . . . . 0.0 110.45 179.09 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 90' ' ' ASN . . . . . . . . . . . . . 27.1 t-20 -57.98 -50.35 73.71 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.095 -0.502 . . . . 0.0 110.913 -179.5 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 91' ' ' TYR . . . . . . . . . . . . . 22.3 m-30 -58.68 -52.1 67.11 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.321 -0.4 . . . . 0.0 110.909 -179.492 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 92' ' ' CYS . . . . . 0.478 ' HA ' ' HB2' ' A' ' 96' ' ' LEU . 61.5 m -67.52 -44.9 77.26 Favored 'General case' 0 C--N 1.325 -0.461 0 CA-C-N 116.173 -0.467 . . . . 0.0 112.117 -173.771 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 93' ' ' ARG . . . . . . . . . . . . . 23.9 mmm-85 -81.08 -28.97 35.07 Favored 'General case' 0 C--N 1.329 -0.318 0 N-CA-C 112.194 0.442 . . . . 0.0 112.194 -173.123 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 94' ' ' ASN . . . . . . . . . . . . . 4.4 m-20 -105.54 -61.95 1.42 Allowed 'General case' 0 C--N 1.328 -0.366 0 C-N-CA 120.407 -0.517 . . . . 0.0 112.115 -176.409 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 95' ' ' HIS . . . . . . . . . . . . . 38.9 t-80 -75.84 -26.21 56.95 Favored 'General case' 0 C--N 1.326 -0.416 0 CA-C-O 120.826 0.346 . . . . 0.0 111.148 -172.37 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 96' ' ' LEU . . . . . 0.478 ' HB2' ' HA ' ' A' ' 92' ' ' CYS . 86.7 mt -108.37 14.95 24.4 Favored 'General case' 0 C--N 1.324 -0.504 0 CA-C-N 116.334 -0.394 . . . . 0.0 110.69 -179.793 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 97' ' ' SER . . . . . 0.585 ' N ' ' HD2' ' A' ' 98' ' ' PRO . 8.1 t -57.76 -46.03 99.77 Favored Pre-proline 0 CA--C 1.541 0.632 0 CA-C-N 116.342 -0.39 . . . . 0.0 111.897 -179.249 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 98' ' ' PRO . . . . . 0.585 ' HD2' ' N ' ' A' ' 97' ' ' SER . 10.2 Cg_endo -55.13 -28.19 59.65 Favored 'Trans proline' 0 C--N 1.357 0.992 0 C-N-CA 122.306 2.004 . . . . 0.0 112.591 175.604 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 99' ' ' LEU . . . . . 0.503 HD11 HG12 ' A' ' 112' ' ' ILE . 72.8 mt -89.29 -30.48 18.44 Favored 'General case' 0 C--N 1.326 -0.413 0 CA-C-N 116.251 -0.431 . . . . 0.0 110.219 -179.895 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 100' ' ' TYR . . . . . . . . . . . . . 16.4 t80 -57.11 -39.84 75.88 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 115.473 -0.785 . . . . 0.0 110.577 -179.519 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 101' ' ' MET . . . . . . . . . . . . . 24.7 ttt -76.47 -23.23 53.83 Favored 'General case' 0 C--O 1.233 0.222 0 CA-C-N 115.764 -0.653 . . . . 0.0 110.751 179.706 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 102' ' ' LYS . . . . . . . . . . . . . 50.0 mttm -75.72 146.46 40.1 Favored 'General case' 0 C--N 1.323 -0.573 0 CA-C-O 121.298 0.57 . . . . 0.0 111.63 -177.945 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 103' ' ' SER . . . . . 0.513 ' HA ' ' HA ' ' A' ' 63' ' ' SER . 7.4 m -76.4 160.73 29.29 Favored 'General case' 0 N--CA 1.445 -0.698 0 N-CA-C 108.109 -1.071 . . . . 0.0 108.109 169.788 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 104' ' ' LEU . . . . . 0.556 ' HG ' HD12 ' A' ' 146' ' ' ILE . 18.0 tp -56.5 -33.48 66.03 Favored 'General case' 0 C--N 1.323 -0.568 0 N-CA-C 111.914 0.339 . . . . 0.0 111.914 -174.007 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 105' ' ' SER . . . . . . . . . . . . . 12.1 p -87.77 -2.11 58.4 Favored 'General case' 0 CA--C 1.536 0.437 0 N-CA-C 112.416 0.524 . . . . 0.0 112.416 -177.698 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 106' ' ' GLU . . . . . 0.404 ' HG3' ' HB2' ' A' ' 103' ' ' SER . 43.3 mt-10 -94.41 -6.11 44.82 Favored 'General case' 0 C--O 1.234 0.268 0 CA-C-O 120.93 0.395 . . . . 0.0 111.17 -178.519 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 107' ' ' ILE . . . . . 0.54 HD11 ' HB2' ' A' ' 64' ' ' PHE . 74.8 mt -95.19 120.13 44.19 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.685 0 CA-C-N 116.147 -0.479 . . . . 0.0 111.456 -173.341 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 108' ' ' LEU . . . . . . . . . . . . . 85.7 mt -101.47 152.47 38.02 Favored Pre-proline 0 C--N 1.323 -0.549 0 CA-C-N 115.726 -0.67 . . . . 0.0 109.618 176.744 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 109' ' ' PRO . . . . . . . . . . . . . 18.4 Cg_endo -61.77 -24.39 77.38 Favored 'Trans proline' 0 C--O 1.233 0.235 0 C-N-CA 122.235 1.957 . . . . 0.0 111.516 176.446 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 110' ' ' ALA . . . . . . . . . . . . . . . -69.42 -38.44 77.9 Favored 'General case' 0 N--CA 1.452 -0.354 0 CA-C-N 115.612 -0.722 . . . . 0.0 111.011 179.761 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 111' ' ' ASP . . . . . 0.42 ' O ' HG13 ' A' ' 115' ' ' ILE . 54.6 m-20 -57.7 -52.94 63.37 Favored 'General case' 0 N--CA 1.464 0.228 0 CA-C-O 121.129 0.49 . . . . 0.0 110.437 -179.508 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 112' ' ' ILE . . . . . 0.503 HG12 HD11 ' A' ' 99' ' ' LEU . 28.4 mt -62.58 -47.39 93.16 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.51 0 CA-C-N 115.388 -0.824 . . . . 0.0 111.015 -177.745 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 113' ' ' GLN . . . . . . . . . . . . . 12.2 tm0? -64.97 -40.11 94.5 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.166 -0.47 . . . . 0.0 110.653 -176.2 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 114' ' ' SER . . . . . . . . . . . . . 27.9 t -57.11 -49.47 75.8 Favored 'General case' 0 C--O 1.237 0.438 0 CA-C-O 120.842 0.354 . . . . 0.0 110.477 179.034 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 115' ' ' ILE . . . . . 0.42 HG13 ' O ' ' A' ' 111' ' ' ASP . 60.9 mt -59.4 -49.34 83.89 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.179 0 CA-C-N 115.943 -0.571 . . . . 0.0 109.969 179.015 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 116' ' ' ILE . . . . . 0.47 HG21 HD12 ' A' ' 156' ' ' ILE . 33.4 mm -56.16 -44.29 78.59 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.227 0 CA-C-N 116.033 -0.531 . . . . 0.0 111.024 178.462 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 117' ' ' ASN . . . . . . . . . . . . . 10.1 t30 -55.62 -40.73 72.51 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 115.826 -0.624 . . . . 0.0 112.207 -177.494 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 118' ' ' GLU . . . . . . . . . . . . . 10.9 pt-20 -92.29 -9.22 42.79 Favored 'General case' 0 C--N 1.325 -0.462 0 N-CA-C 112.308 0.484 . . . . 0.0 112.308 -178.572 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 119' ' ' THR . . . . . . . . . . . . . 84.4 m -76.25 132.73 40.04 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-O 120.731 0.301 . . . . 0.0 110.844 178.91 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 120' ' ' LYS . . . . . 0.452 ' HE3' ' HB2' ' A' ' 120' ' ' LYS . 39.3 mtmt -106.91 89.55 3.04 Favored 'General case' 0 C--N 1.328 -0.364 0 N-CA-C 110.247 -0.279 . . . . 0.0 110.247 179.619 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 121' ' ' LEU . . . . . . . . . . . . . 86.8 mt -135.44 173.23 11.95 Favored 'General case' 0 C--N 1.322 -0.598 0 CA-C-N 116.565 -0.289 . . . . 0.0 110.265 178.27 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 122' ' ' ALA . . . . . . . . . . . . . . . -68.4 157.19 36.3 Favored 'General case' 0 C--N 1.327 -0.384 0 CA-C-N 116.359 -0.382 . . . . 0.0 110.543 178.906 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 123' ' ' LYS . . . . . . . . . . . . . 59.2 pttt -57.56 -36.41 71.63 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.2 -0.454 . . . . 0.0 110.83 -179.556 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 124' ' ' ASN . . . . . . . . . . . . . 52.9 t30 -64.82 -46.25 82.76 Favored 'General case' 0 C--N 1.332 -0.161 0 CA-C-N 116.235 -0.439 . . . . 0.0 110.405 177.591 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 125' ' ' THR . . . . . 0.476 ' O ' HG13 ' A' ' 129' ' ' ILE . 2.3 m -66.39 -45.31 80.46 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 115.573 -0.739 . . . . 0.0 111.187 -176.246 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 126' ' ' LEU . . . . . 0.638 ' HB3' HD11 ' A' ' 156' ' ' ILE . 83.8 mt -61.84 -48.01 82.48 Favored 'General case' 0 C--O 1.234 0.246 0 CA-C-N 116.286 -0.415 . . . . 0.0 111.248 -179.144 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 127' ' ' LYS . . . . . . . . . . . . . 98.1 mttt -63.56 -35.11 79.4 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.378 -0.374 . . . . 0.0 110.782 177.81 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 128' ' ' ALA . . . . . . . . . . . . . . . -62.18 -43.28 99.18 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-N 116.57 -0.286 . . . . 0.0 110.969 179.517 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 129' ' ' ILE . . . . . 0.476 HG13 ' O ' ' A' ' 125' ' ' THR . 68.4 mt -61.28 -47.52 93.13 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.33 0 CA-C-O 120.878 0.37 . . . . 0.0 110.499 178.491 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 130' ' ' ARG . . . . . 0.451 ' HD2' ' HB ' ' A' ' 154' ' ' VAL . 9.7 ttt180 -65.31 -45.89 82.52 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.258 -0.428 . . . . 0.0 111.213 -179.666 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 131' ' ' ASN . . . . . . . . . . . . . 92.9 m-20 -63.94 -33.39 75.61 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-O 120.65 0.262 . . . . 0.0 111.094 -179.755 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 132' ' ' THR . . . . . . . . . . . . . 98.0 m -65.53 -45.35 83.81 Favored 'General case' 0 C--N 1.325 -0.493 0 CA-C-O 120.887 0.375 . . . . 0.0 110.331 174.823 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 133' ' ' ALA . . . . . . . . . . . . . . . -64.4 -43.88 93.04 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 115.923 -0.58 . . . . 0.0 111.111 -179.386 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 134' ' ' SER . . . . . 0.534 ' O ' ' HG3' ' A' ' 138' ' ' ARG . 23.6 p -64.3 -35.51 81.1 Favored 'General case' 0 C--N 1.331 -0.196 0 CA-C-N 116.667 -0.242 . . . . 0.0 110.797 -179.373 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 135' ' ' GLN . . . . . . . . . . . . . 13.1 mm100 -59.63 -42.06 91.88 Favored 'General case' 0 C--N 1.331 -0.236 0 CA-C-O 120.803 0.335 . . . . 0.0 110.794 175.034 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 136' ' ' ILE . . . . . . . . . . . . . 69.3 mt -65.07 -42.98 95.89 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.365 0 CA-C-N 115.938 -0.573 . . . . 0.0 110.508 178.045 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 137' ' ' PHE . . . . . 0.437 ' O ' HG13 ' A' ' 141' ' ' ILE . 35.3 m-85 -66.92 -37.83 85.06 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.213 -0.449 . . . . 0.0 110.927 178.207 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 138' ' ' ARG . . . . . 0.534 ' HG3' ' O ' ' A' ' 134' ' ' SER . 54.1 mtp180 -59.32 -43.33 92.69 Favored 'General case' 0 CA--C 1.517 -0.324 0 N-CA-C 110.022 -0.362 . . . . 0.0 110.022 174.92 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 139' ' ' LEU . . . . . . . . . . . . . 49.9 tp -58.87 -41.18 86.47 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 115.75 -0.659 . . . . 0.0 110.075 178.205 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 140' ' ' ALA . . . . . 0.466 ' HB1' HD21 ' A' ' 104' ' ' LEU . . . -64.99 -41.63 95.23 Favored 'General case' 0 C--N 1.327 -0.391 0 CA-C-N 116.086 -0.506 . . . . 0.0 110.62 177.16 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 141' ' ' ILE . . . . . 0.437 HG13 ' O ' ' A' ' 137' ' ' PHE . 74.7 mt -61.81 -46.11 97.23 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.374 0 CA-C-N 116.14 -0.482 . . . . 0.0 110.902 176.299 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 142' ' ' GLU . . . . . . . . . . . . . 44.5 mt-10 -60.61 -36.77 79.41 Favored 'General case' 0 N--CA 1.465 0.282 0 CA-C-O 120.79 0.329 . . . . 0.0 111.012 178.548 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 143' ' ' ASN . . . . . . . . . . . . . 40.4 m-80 -88.23 10.44 19.56 Favored 'General case' 0 C--N 1.331 -0.225 0 CA-C-N 116.154 -0.475 . . . . 0.0 110.719 178.934 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 144' ' ' ARG . . . . . . . . . . . . . 61.6 mtt-85 64.23 21.71 12.61 Favored 'General case' 0 N--CA 1.466 0.334 0 CA-C-N 115.621 -0.718 . . . . 0.0 112.389 171.246 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 145' ' ' ALA . . . . . . . . . . . . . . . -85.26 -27.6 25.91 Favored 'General case' 0 C--N 1.323 -0.552 0 CA-C-O 120.806 0.336 . . . . 0.0 111.595 -176.678 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 146' ' ' ILE . . . . . 0.556 HD12 ' HG ' ' A' ' 104' ' ' LEU . 13.8 tt -143.88 149.58 17.72 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.536 0 CA-C-O 120.906 0.384 . . . . 0.0 110.452 -179.79 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 147' ' ' ASP . . . . . . . . . . . . . 0.9 OUTLIER -114.92 25.03 11.24 Favored 'General case' 0 C--N 1.325 -0.46 0 CA-C-O 121.254 0.549 . . . . 0.0 110.249 179.524 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 148' ' ' PHE . . . . . 0.441 ' H ' HG12 ' A' ' 146' ' ' ILE . 60.1 t80 -144.29 134.01 23.67 Favored 'General case' 0 C--N 1.323 -0.582 0 CA-C-N 115.581 -0.736 . . . . 0.0 109.589 -174.434 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 149' ' ' ASN . . . . . . . . . . . . . 53.6 t-20 -115.19 95.66 43.05 Favored Pre-proline 0 C--N 1.324 -0.525 0 N-CA-C 109.987 -0.375 . . . . 0.0 109.987 178.5 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 150' ' ' PRO . . . . . . . . . . . . . 32.9 Cg_exo -58.62 -33.18 98.01 Favored 'Trans proline' 0 C--N 1.342 0.225 0 C-N-CA 122.937 2.425 . . . . 0.0 112.769 -178.575 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 151' ' ' ALA . . . . . 0.507 ' HA ' HG23 ' A' ' 154' ' ' VAL . . . -73.38 -20.73 60.69 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 116.442 -0.345 . . . . 0.0 111.502 -176.327 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 152' ' ' ASP . . . . . . . . . . . . . 29.9 t70 -70.15 -23.72 63.05 Favored 'General case' 0 C--N 1.325 -0.5 0 CA-C-O 121.123 0.487 . . . . 0.0 110.62 178.942 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 153' ' ' TYR . . . . . . . . . . . . . 77.0 m-85 -96.59 -2.88 43.97 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.114 -0.493 . . . . 0.0 110.763 -178.571 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 154' ' ' VAL . . . . . 0.507 HG23 ' HA ' ' A' ' 151' ' ' ALA . 61.0 t -77.64 117.66 23.15 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.391 0 CA-C-N 116.384 -0.371 . . . . 0.0 110.374 179.19 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 155' ' ' ARG . . . . . . . . . . . . . 51.1 mtp85 -92.12 141.9 28.09 Favored 'General case' 0 C--N 1.318 -0.802 0 CA-C-O 120.972 0.415 . . . . 0.0 110.514 176.32 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 156' ' ' ILE . . . . . 0.638 HD11 ' HB3' ' A' ' 126' ' ' LEU . 2.9 tp -106.97 129.31 24.55 Favored Pre-proline 0 C--N 1.318 -0.789 0 CA-C-N 115.456 -0.793 . . . . 0.0 109.609 -176.889 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 157' ' ' PRO . . . . . . . . . . . . . 86.1 Cg_endo . . . . . 0 N--CA 1.454 -0.8 0 C-N-CA 122.631 2.221 . . . . 0.0 113.08 -179.426 . . . . . . . . 0 0 . 1 . 007 nuclear build core ' A' A ' 63' ' ' SER . . . . . 0.6 ' HA ' ' HA ' ' A' ' 103' ' ' SER . 47.0 m . . . . . 0 N--CA 1.444 -0.77 0 CA-C-O 120.753 0.311 . . . . 0.0 110.54 . . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 64' ' ' PHE . . . . . 0.517 ' HB2' HD11 ' A' ' 107' ' ' ILE . 80.6 t80 -58.47 -34.4 70.84 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 115.865 -0.607 . . . . 0.0 111.145 -176.171 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 65' ' ' GLY . . . . . . . . . . . . . . . -61.68 -40.78 99.23 Favored Glycine 0 N--CA 1.453 -0.224 0 C-N-CA 120.898 -0.668 . . . . 0.0 112.636 179.901 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 66' ' ' ASP . . . . . . . . . . . . . 24.7 t70 -61.11 -52.16 66.08 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-O 120.936 0.398 . . . . 0.0 110.163 177.635 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 67' ' ' TRP . . . . . 0.413 ' NE1' HD11 ' A' ' 104' ' ' LEU . 98.7 m95 -65.51 -34.47 78.33 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-N 115.58 -0.737 . . . . 0.0 111.403 -179.204 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 68' ' ' ALA . . . . . 0.592 ' O ' ' HG ' ' A' ' 72' ' ' LEU . . . -61.96 -50.85 70.46 Favored 'General case' 0 C--N 1.327 -0.377 0 CA-C-O 120.665 0.269 . . . . 0.0 110.827 178.598 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 69' ' ' GLU . . . . . . . . . . . . . 33.3 tt0 -69.87 -34.37 73.48 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-O 120.769 0.319 . . . . 0.0 110.213 -179.791 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 70' ' ' LYS . . . . . . . . . . . . . 48.9 tttm -61.72 -42.93 99.6 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-O 121.298 0.57 . . . . 0.0 109.556 176.264 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 71' ' ' PHE . . . . . . . . . . . . . 71.4 t80 -64.31 -45.15 89.17 Favored 'General case' 0 C--N 1.326 -0.423 0 CA-C-N 115.244 -0.889 . . . . 0.0 111.056 176.82 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 72' ' ' LEU . . . . . 0.592 ' HG ' ' O ' ' A' ' 68' ' ' ALA . 89.2 mt -61.44 -42.41 98.72 Favored 'General case' 0 C--N 1.327 -0.396 0 CA-C-O 121.017 0.436 . . . . 0.0 110.38 178.706 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 73' ' ' LYS . . . . . 0.511 ' HD2' ' HA ' ' A' ' 73' ' ' LYS . 18.2 tptt -70.0 -38.22 75.91 Favored 'General case' 0 C--N 1.326 -0.434 0 CA-C-N 115.842 -0.617 . . . . 0.0 111.15 -176.023 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 74' ' ' SER . . . . . . . . . . . . . 8.1 p -70.06 -32.4 70.48 Favored 'General case' 0 C--N 1.327 -0.376 0 C-N-CA 121.077 -0.249 . . . . 0.0 110.877 179.987 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 75' ' ' LYS . . . . . . . . . . . . . 30.8 mmtp -73.09 -37.28 66.81 Favored 'General case' 0 C--O 1.234 0.273 0 CA-C-O 120.775 0.322 . . . . 0.0 110.478 174.634 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 76' ' ' GLU . . . . . . . . . . . . . 42.0 tt0 -61.84 -46.12 90.83 Favored 'General case' 0 C--N 1.327 -0.379 0 CA-C-N 116.053 -0.521 . . . . 0.0 110.251 177.474 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 77' ' ' ALA . . . . . . . . . . . . . . . -70.54 -33.41 71.12 Favored 'General case' 0 C--N 1.325 -0.466 0 CA-C-N 115.816 -0.629 . . . . 0.0 111.072 177.644 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 78' ' ' ASP . . . . . . . . . . . . . 20.1 t70 -57.9 -47.05 83.95 Favored 'General case' 0 CA--C 1.518 -0.286 0 CA-C-N 116.142 -0.481 . . . . 0.0 110.431 177.449 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 79' ' ' GLY . . . . . . . . . . . . . . . 114.98 41.17 0.85 Allowed Glycine 0 N--CA 1.443 -0.835 0 C-N-CA 120.436 -0.887 . . . . 0.0 112.966 176.288 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 80' ' ' VAL . . . . . . . . . . . . . 29.0 m -77.33 157.53 5.29 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.442 0 N-CA-C 110.137 -0.319 . . . . 0.0 110.137 174.649 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 81' ' ' SER . . . . . . . . . . . . . 18.4 m -62.07 150.3 38.7 Favored 'General case' 0 C--N 1.324 -0.534 0 N-CA-C 110.239 -0.282 . . . . 0.0 110.239 177.925 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 82' ' ' VAL . . . . . . . . . . . . . 55.4 t -58.97 -42.82 87.24 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.495 0 CA-C-N 116.356 -0.384 . . . . 0.0 110.453 -177.348 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 83' ' ' SER . . . . . . . . . . . . . 13.4 m -59.44 -39.19 82.76 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 116.311 -0.404 . . . . 0.0 111.131 179.054 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 84' ' ' GLN . . . . . . . . . . . . . 59.2 tp60 -63.32 -45.03 93.2 Favored 'General case' 0 C--O 1.234 0.274 0 CA-C-O 121.107 0.48 . . . . 0.0 110.298 177.407 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 85' ' ' LEU . . . . . . . . . . . . . 46.8 tp -67.88 -36.18 79.79 Favored 'General case' 0 C--N 1.327 -0.408 0 CA-C-N 115.936 -0.575 . . . . 0.0 110.428 179.455 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 86' ' ' ASN . . . . . . . . . . . . . 11.8 m120 -60.83 -47.2 87.45 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.233 -0.44 . . . . 0.0 110.563 178.215 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 87' ' ' SER . . . . . . . . . . . . . 3.5 p -63.36 -36.32 83.3 Favored 'General case' 0 CA--C 1.531 0.243 0 C-N-CA 121.038 -0.265 . . . . 0.0 111.319 179.396 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 88' ' ' TYR . . . . . . . . . . . . . 6.6 m-85 -59.62 -54.49 45.86 Favored 'General case' 0 C--O 1.233 0.232 0 CA-C-O 121.707 0.765 . . . . 0.0 110.167 174.236 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 89' ' ' LYS . . . . . 0.403 ' HE3' ' HB2' ' A' ' 89' ' ' LYS . 34.6 ttmt -65.59 -32.97 74.84 Favored 'General case' 0 C--N 1.325 -0.467 0 CA-C-N 114.597 -1.183 . . . . 0.0 110.88 -175.741 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 90' ' ' ASN . . . . . . . . . . . . . 27.6 t-20 -64.43 -52.18 59.41 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 116.02 -0.536 . . . . 0.0 111.324 179.708 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 91' ' ' TYR . . . . . . . . . . . . . 22.3 m-85 -61.06 -39.72 90.91 Favored 'General case' 0 C--O 1.234 0.259 0 CA-C-O 121.033 0.444 . . . . 0.0 110.233 179.756 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 92' ' ' CYS . . . . . 0.614 ' HA ' ' HB2' ' A' ' 96' ' ' LEU . 42.7 t -64.63 -49.57 70.56 Favored 'General case' 0 C--N 1.325 -0.474 0 CA-C-N 115.31 -0.859 . . . . 0.0 111.094 -178.09 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 93' ' ' ARG . . . . . . . . . . . . . 28.9 mmt180 -73.09 -6.56 46.47 Favored 'General case' 0 C--N 1.328 -0.35 0 N-CA-C 112.94 0.718 . . . . 0.0 112.94 -175.099 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 94' ' ' ASN . . . . . . . . . . . . . 52.7 m-80 -118.9 -64.66 1.25 Allowed 'General case' 0 C--N 1.327 -0.403 0 C-N-CA 119.537 -0.865 . . . . 0.0 112.721 -179.402 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 95' ' ' HIS . . . . . . . . . . . . . 82.7 m-70 -88.98 -20.49 24.39 Favored 'General case' 0 C--N 1.325 -0.469 0 N-CA-C 112.617 0.599 . . . . 0.0 112.617 -173.838 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 96' ' ' LEU . . . . . 0.614 ' HB2' ' HA ' ' A' ' 92' ' ' CYS . 83.4 mt -99.05 7.14 46.22 Favored 'General case' 0 C--N 1.325 -0.463 0 C-N-CA 120.946 -0.302 . . . . 0.0 111.065 -178.751 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 97' ' ' SER . . . . . 0.545 ' N ' ' HD2' ' A' ' 98' ' ' PRO . 50.2 m -57.63 -49.26 94.78 Favored Pre-proline 0 CA--C 1.537 0.453 0 CA-C-N 116.383 -0.371 . . . . 0.0 111.896 178.907 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 98' ' ' PRO . . . . . 0.545 ' HD2' ' N ' ' A' ' 97' ' ' SER . 9.5 Cg_endo -53.9 -40.07 82.13 Favored 'Trans proline' 0 C--N 1.358 1.037 0 C-N-CA 122.047 1.831 . . . . 0.0 112.458 176.727 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 99' ' ' LEU . . . . . 0.558 HD23 ' HD2' ' A' ' 102' ' ' LYS . 90.6 mt -75.28 -29.53 60.16 Favored 'General case' 0 C--N 1.332 -0.188 0 CA-C-N 116.255 -0.43 . . . . 0.0 111.107 -178.736 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 100' ' ' TYR . . . . . . . . . . . . . 23.4 t80 -55.74 -29.82 60.19 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 115.759 -0.655 . . . . 0.0 111.701 -174.318 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 101' ' ' MET . . . . . . . . . . . . . 65.2 mtt -106.77 10.75 30.72 Favored 'General case' 0 C--N 1.326 -0.44 0 CA-C-O 120.663 0.268 . . . . 0.0 111.571 -178.16 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 102' ' ' LYS . . . . . 0.558 ' HD2' HD23 ' A' ' 99' ' ' LEU . 68.3 mttm -97.03 134.41 40.42 Favored 'General case' 0 C--N 1.326 -0.424 0 N-CA-C 110.217 -0.29 . . . . 0.0 110.217 177.628 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 103' ' ' SER . . . . . 0.6 ' HA ' ' HA ' ' A' ' 63' ' ' SER . 68.0 m -73.52 152.28 40.72 Favored 'General case' 0 C--N 1.323 -0.568 0 N-CA-C 109.298 -0.631 . . . . 0.0 109.298 172.823 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 104' ' ' LEU . . . . . 0.442 ' HA ' HD12 ' A' ' 107' ' ' ILE . 82.2 mt -53.51 -35.9 61.16 Favored 'General case' 0 C--N 1.33 -0.276 0 N-CA-C 112.265 0.469 . . . . 0.0 112.265 -174.64 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 105' ' ' SER . . . . . . . . . . . . . 2.7 p -79.55 -6.81 57.79 Favored 'General case' 0 C--N 1.325 -0.474 0 N-CA-C 111.95 0.352 . . . . 0.0 111.95 -177.748 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 106' ' ' GLU . . . . . 0.532 ' OE1' ' HB2' ' A' ' 103' ' ' SER . 1.9 mp0 -112.21 7.21 19.4 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-O 120.746 0.308 . . . . 0.0 110.974 178.704 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 107' ' ' ILE . . . . . 0.517 HD11 ' HB2' ' A' ' 64' ' ' PHE . 81.8 mt -88.99 117.02 31.54 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.46 0 CA-C-O 121.106 0.479 . . . . 0.0 110.464 179.553 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 108' ' ' LEU . . . . . . . . . . . . . 85.6 mt -95.25 134.34 24.69 Favored Pre-proline 0 C--N 1.322 -0.609 0 CA-C-N 115.877 -0.601 . . . . 0.0 110.273 -179.868 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 109' ' ' PRO . . . . . . . . . . . . . 40.1 Cg_exo -58.79 -34.4 98.98 Favored 'Trans proline' 0 C--N 1.343 0.264 0 C-N-CA 122.643 2.229 . . . . 0.0 111.735 176.771 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 110' ' ' ALA . . . . . . . . . . . . . . . -70.64 -23.4 62.53 Favored 'General case' 0 C--N 1.33 -0.243 0 CA-C-N 115.624 -0.716 . . . . 0.0 111.106 178.702 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 111' ' ' ASP . . . . . 0.537 ' OD2' ' HE3' ' A' ' 102' ' ' LYS . 31.1 t70 -71.86 -42.97 66.25 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-O 121.181 0.515 . . . . 0.0 109.631 -179.932 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 112' ' ' ILE . . . . . 0.471 HD12 ' HB2' ' A' ' 150' ' ' PRO . 37.4 mt -67.89 -39.7 82.21 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.437 0 CA-C-N 115.69 -0.686 . . . . 0.0 110.186 176.689 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 113' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -59.86 -47.19 86.76 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 115.607 -0.724 . . . . 0.0 110.055 179.081 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 114' ' ' SER . . . . . . . . . . . . . 13.1 p -65.91 -27.56 68.28 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 116.261 -0.427 . . . . 0.0 111.148 -179.261 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 115' ' ' ILE . . . . . 0.519 HG13 ' O ' ' A' ' 111' ' ' ASP . 76.7 mt -61.19 -43.33 96.19 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.231 0 CA-C-O 121.198 0.523 . . . . 0.0 110.399 173.515 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 116' ' ' ILE . . . . . . . . . . . . . 50.7 mm -63.18 -33.35 60.42 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.599 0 CA-C-O 121.22 0.534 . . . . 0.0 110.17 177.228 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 117' ' ' ASN . . . . . . . . . . . . . 0.2 OUTLIER -75.56 -29.18 59.27 Favored 'General case' 0 C--N 1.326 -0.429 0 CA-C-N 115.799 -0.637 . . . . 0.0 110.77 -179.151 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 118' ' ' GLU . . . . . 0.488 ' HG3' ' HA ' ' A' ' 115' ' ' ILE . 3.1 pp20? -87.81 -8.99 55.19 Favored 'General case' 0 C--N 1.33 -0.245 0 C-N-CA 120.599 -0.441 . . . . 0.0 110.887 179.587 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 119' ' ' THR . . . . . . . . . . . . . 34.6 m -80.83 117.77 21.77 Favored 'General case' 0 N--CA 1.449 -0.5 0 N-CA-C 109.472 -0.566 . . . . 0.0 109.472 174.307 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 120' ' ' LYS . . . . . . . . . . . . . 67.3 mttm -98.29 32.14 2.57 Favored 'General case' 0 C--N 1.324 -0.534 0 CA-C-O 121.37 0.605 . . . . 0.0 110.77 -175.734 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 121' ' ' LEU . . . . . 0.414 HD23 HG21 ' A' ' 125' ' ' THR . 10.8 mp -100.86 -175.57 2.92 Favored 'General case' 0 C--N 1.322 -0.619 0 CA-C-N 115.642 -0.708 . . . . 0.0 110.266 178.998 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 122' ' ' ALA . . . . . 0.533 ' O ' ' HG ' ' A' ' 126' ' ' LEU . . . -75.03 164.56 26.41 Favored 'General case' 0 C--N 1.325 -0.495 0 CA-C-O 121.142 0.496 . . . . 0.0 111.888 -175.462 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 123' ' ' LYS . . . . . . . . . . . . . 64.6 tttp -59.86 -42.16 93.06 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 115.28 -0.873 . . . . 0.0 111.879 -175.784 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 124' ' ' ASN . . . . . . . . . . . . . 26.8 p-10 -63.29 -34.3 77.39 Favored 'General case' 0 C--N 1.326 -0.436 0 CA-C-O 120.822 0.344 . . . . 0.0 110.988 179.947 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 125' ' ' THR . . . . . 0.414 HG21 HD23 ' A' ' 121' ' ' LEU . 17.2 m -73.1 -38.02 66.51 Favored 'General case' 0 C--N 1.326 -0.428 0 CA-C-O 120.794 0.33 . . . . 0.0 110.358 177.989 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 126' ' ' LEU . . . . . 0.533 ' HG ' ' O ' ' A' ' 122' ' ' ALA . 89.5 mt -58.96 -49.01 79.49 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-O 121.146 0.498 . . . . 0.0 110.686 178.556 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 127' ' ' LYS . . . . . 0.534 ' HA ' ' HB3' ' A' ' 130' ' ' ARG . 16.4 ptmt -74.91 -20.25 59.79 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-N 116.072 -0.513 . . . . 0.0 110.93 -177.089 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 128' ' ' ALA . . . . . . . . . . . . . . . -66.57 -41.76 88.08 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-O 120.757 0.313 . . . . 0.0 110.62 174.822 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 129' ' ' ILE . . . . . . . . . . . . . 46.9 mt -64.86 -40.28 88.53 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.24 0 N-CA-C 109.192 -0.67 . . . . 0.0 109.192 175.057 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 130' ' ' ARG . . . . . 0.534 ' HB3' ' HA ' ' A' ' 127' ' ' LYS . 13.5 tpt85 -55.02 -45.41 75.16 Favored 'General case' 0 CA--C 1.533 0.314 0 CA-C-N 115.13 -0.941 . . . . 0.0 111.092 173.427 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 131' ' ' ASN . . . . . . . . . . . . . 12.9 m-80 -66.84 -47.04 73.2 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.366 -0.379 . . . . 0.0 111.251 178.637 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 132' ' ' THR . . . . . . . . . . . . . 40.3 m -57.9 -53.18 61.1 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.28 -0.418 . . . . 0.0 111.201 -178.786 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 133' ' ' ALA . . . . . . . . . . . . . . . -60.67 -36.25 78.27 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.234 -0.439 . . . . 0.0 111.034 -178.82 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 134' ' ' SER . . . . . 0.519 ' O ' ' HG3' ' A' ' 138' ' ' ARG . 39.0 t -60.31 -50.0 75.38 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.252 -0.431 . . . . 0.0 110.798 179.925 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 135' ' ' GLN . . . . . . . . . . . . . 75.4 mt-30 -59.47 -37.28 77.78 Favored 'General case' 0 C--N 1.331 -0.216 0 CA-C-N 116.384 -0.371 . . . . 0.0 110.832 -177.993 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 136' ' ' ILE . . . . . . . . . . . . . 71.0 mt -64.55 -47.35 89.49 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.386 0 CA-C-N 116.034 -0.53 . . . . 0.0 110.769 178.879 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 137' ' ' PHE . . . . . 0.459 ' O ' HG13 ' A' ' 141' ' ' ILE . 41.7 m-85 -65.98 -35.08 79.6 Favored 'General case' 0 C--N 1.331 -0.224 0 CA-C-N 116.544 -0.298 . . . . 0.0 111.41 179.543 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 138' ' ' ARG . . . . . 0.519 ' HG3' ' O ' ' A' ' 134' ' ' SER . 45.0 mtp-105 -61.9 -38.84 89.87 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-O 120.888 0.375 . . . . 0.0 110.492 178.157 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 139' ' ' LEU . . . . . . . . . . . . . 50.2 tp -60.55 -36.88 79.54 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-N 115.878 -0.601 . . . . 0.0 110.355 178.072 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 140' ' ' ALA . . . . . . . . . . . . . . . -69.6 -37.75 77.03 Favored 'General case' 0 C--N 1.327 -0.37 0 CA-C-N 115.961 -0.563 . . . . 0.0 110.365 177.353 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 141' ' ' ILE . . . . . 0.459 HG13 ' O ' ' A' ' 137' ' ' PHE . 70.2 mt -63.26 -44.46 99.21 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.277 0 CA-C-N 116.061 -0.518 . . . . 0.0 110.403 175.955 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 142' ' ' GLU . . . . . . . . . . . . . 51.8 mt-10 -62.14 -27.99 69.33 Favored 'General case' 0 C--N 1.331 -0.224 0 CA-C-N 116.129 -0.487 . . . . 0.0 111.59 178.632 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 143' ' ' ASN . . . . . 0.514 ' C ' ' HD2' ' A' ' 144' ' ' ARG . 34.9 m-80 -97.26 21.18 10.33 Favored 'General case' 0 C--N 1.324 -0.511 0 CA-C-N 116.143 -0.481 . . . . 0.0 110.783 178.439 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 144' ' ' ARG . . . . . 0.514 ' HD2' ' C ' ' A' ' 143' ' ' ASN . 0.0 OUTLIER 38.48 39.18 0.29 Allowed 'General case' 0 N--CA 1.472 0.648 0 C-N-CA 124.347 1.059 . . . . 0.0 112.496 -177.497 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' A' A ' 145' ' ' ALA . . . . . . . . . . . . . . . -88.33 -32.88 18.2 Favored 'General case' 0 C--N 1.325 -0.466 0 CA-C-N 115.808 -0.633 . . . . 0.0 109.613 176.983 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 146' ' ' ILE . . . . . 0.511 HG12 ' H ' ' A' ' 148' ' ' PHE . 16.6 tt -149.47 133.56 8.69 Favored 'Isoleucine or valine' 0 N--CA 1.449 -0.514 0 CA-C-N 115.283 -0.871 . . . . 0.0 109.439 177.506 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 147' ' ' ASP . . . . . . . . . . . . . 35.2 t70 -102.56 24.18 10.83 Favored 'General case' 0 C--N 1.325 -0.496 0 CA-C-O 122.09 0.948 . . . . 0.0 109.484 179.636 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 148' ' ' PHE . . . . . 0.511 ' H ' HG12 ' A' ' 146' ' ' ILE . 68.7 t80 -132.7 133.26 43.31 Favored 'General case' 0 C--N 1.319 -0.718 0 CA-C-N 114.927 -1.033 . . . . 0.0 109.64 -174.312 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 149' ' ' ASN . . . . . . . . . . . . . 18.5 t-20 -116.16 99.57 52.78 Favored Pre-proline 0 C--N 1.323 -0.571 0 N-CA-C 110.283 -0.266 . . . . 0.0 110.283 -179.84 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 150' ' ' PRO . . . . . 0.471 ' HB2' HD12 ' A' ' 112' ' ' ILE . 22.0 Cg_exo -65.67 -26.08 53.75 Favored 'Trans proline' 0 C--O 1.23 0.124 0 C-N-CA 122.68 2.253 . . . . 0.0 112.283 -178.818 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 151' ' ' ALA . . . . . . . . . . . . . . . -69.92 -20.89 63.33 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 115.995 -0.548 . . . . 0.0 111.333 -177.469 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 152' ' ' ASP . . . . . . . . . . . . . 25.2 t70 -64.15 -29.79 70.89 Favored 'General case' 0 C--O 1.234 0.253 0 CA-C-N 116.122 -0.49 . . . . 0.0 110.863 179.807 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 153' ' ' TYR . . . . . . . . . . . . . 78.7 m-85 -87.73 -5.19 58.78 Favored 'General case' 0 C--N 1.327 -0.383 0 CA-C-N 115.709 -0.678 . . . . 0.0 111.17 -176.175 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 154' ' ' VAL . . . . . . . . . . . . . 66.0 t -79.5 107.42 11.91 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.445 0 CA-C-O 120.929 0.395 . . . . 0.0 110.214 -179.399 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 155' ' ' ARG . . . . . . . . . . . . . 89.4 mtt180 -91.09 133.75 35.08 Favored 'General case' 0 C--N 1.323 -0.585 0 CA-C-N 116.104 -0.498 . . . . 0.0 110.54 -178.432 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 156' ' ' ILE . . . . . . . . . . . . . 50.6 mm -91.94 116.49 66.56 Favored Pre-proline 0 C--N 1.325 -0.495 0 CA-C-N 116.114 -0.494 . . . . 0.0 110.491 -176.951 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 157' ' ' PRO . . . . . . . . . . . . . 31.9 Cg_endo . . . . . 0 C--O 1.235 0.355 0 C-N-CA 122.97 2.447 . . . . 0.0 113.219 -175.86 . . . . . . . . 0 0 . 1 . 008 nuclear build core ' A' A ' 63' ' ' SER . . . . . . . . . . . . . 72.4 p . . . . . 0 N--CA 1.448 -0.545 0 N-CA-C 109.565 -0.531 . . . . 0.0 109.565 . . . . . . . . . 0 0 . 1 . 008 nuclear build core ' A' A ' 64' ' ' PHE . . . . . 0.491 ' HB2' HD11 ' A' ' 107' ' ' ILE . 87.1 t80 -60.25 -35.71 76.12 Favored 'General case' 0 C--N 1.329 -0.299 0 N-CA-C 109.896 -0.409 . . . . 0.0 109.896 176.642 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 65' ' ' GLY . . . . . . . . . . . . . . . -62.01 -39.32 97.42 Favored Glycine 0 N--CA 1.452 -0.267 0 C-N-CA 121.13 -0.557 . . . . 0.0 112.106 176.964 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 66' ' ' ASP . . . . . 0.401 ' O ' ' HG3' ' A' ' 70' ' ' LYS . 8.6 m-20 -63.39 -52.08 63.14 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-O 120.908 0.385 . . . . 0.0 110.445 177.958 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 67' ' ' TRP . . . . . . . . . . . . . 95.9 m95 -67.19 -35.3 79.33 Favored 'General case' 0 C--N 1.326 -0.433 0 CA-C-N 115.921 -0.582 . . . . 0.0 111.37 -178.011 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 68' ' ' ALA . . . . . 0.671 ' O ' ' HG ' ' A' ' 72' ' ' LEU . . . -61.07 -51.09 70.62 Favored 'General case' 0 C--N 1.326 -0.449 0 N-CA-C 110.065 -0.346 . . . . 0.0 110.065 175.806 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 69' ' ' GLU . . . . . . . . . . . . . 11.9 tp10 -61.29 -37.86 84.72 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.099 -0.5 . . . . 0.0 110.665 -179.379 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 70' ' ' LYS . . . . . 0.401 ' HG3' ' O ' ' A' ' 66' ' ' ASP . 57.2 mtpt -66.57 -45.8 78.11 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.465 -0.334 . . . . 0.0 110.79 176.956 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 71' ' ' PHE . . . . . . . . . . . . . 89.9 t80 -61.77 -42.29 98.79 Favored 'General case' 0 C--N 1.327 -0.381 0 CA-C-N 116.241 -0.436 . . . . 0.0 110.384 179.215 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 72' ' ' LEU . . . . . 0.671 ' HG ' ' O ' ' A' ' 68' ' ' ALA . 91.7 mt -62.82 -44.23 96.7 Favored 'General case' 0 C--N 1.326 -0.439 0 CA-C-N 115.978 -0.555 . . . . 0.0 110.751 178.335 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 73' ' ' LYS . . . . . . . . . . . . . 22.7 tptp -65.67 -37.16 85.72 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-O 121.137 0.494 . . . . 0.0 110.057 179.794 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 74' ' ' SER . . . . . . . . . . . . . 9.8 t -65.44 -44.57 86.88 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 115.688 -0.687 . . . . 0.0 110.183 177.766 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 75' ' ' LYS . . . . . . . . . . . . . 20.6 mmtt -68.17 -31.55 71.18 Favored 'General case' 0 C--N 1.331 -0.204 0 CA-C-N 116.371 -0.377 . . . . 0.0 110.983 178.796 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 76' ' ' GLU . . . . . . . . . . . . . 38.9 tt0 -57.64 -49.13 77.47 Favored 'General case' 0 C--N 1.324 -0.51 0 CA-C-N 115.92 -0.582 . . . . 0.0 110.097 174.947 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 77' ' ' ALA . . . . . . . . . . . . . . . -74.69 -29.13 61.11 Favored 'General case' 0 C--N 1.327 -0.382 0 CA-C-N 115.705 -0.68 . . . . 0.0 111.34 178.824 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 78' ' ' ASP . . . . . . . . . . . . . 19.8 t70 -55.34 -45.45 76.42 Favored 'General case' 0 N--CA 1.465 0.32 0 CA-C-N 116.098 -0.501 . . . . 0.0 110.564 177.058 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 79' ' ' GLY . . . . . . . . . . . . . . . 128.41 62.46 0.12 Allowed Glycine 0 N--CA 1.446 -0.697 0 C-N-CA 120.679 -0.772 . . . . 0.0 112.308 176.906 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 80' ' ' VAL . . . . . . . . . . . . . 34.4 m -115.66 155.17 17.02 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.589 0 CA-C-O 120.677 0.275 . . . . 0.0 110.562 177.403 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 81' ' ' SER . . . . . . . . . . . . . 31.0 t -65.06 153.75 39.82 Favored 'General case' 0 C--N 1.324 -0.532 0 CA-C-N 115.817 -0.629 . . . . 0.0 110.261 175.818 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 82' ' ' VAL . . . . . . . . . . . . . 10.2 p -60.03 -36.83 69.79 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.318 0 CA-C-O 120.818 0.342 . . . . 0.0 110.325 177.453 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 83' ' ' SER . . . . . . . . . . . . . 34.2 t -69.43 -34.48 74.51 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-O 121.185 0.517 . . . . 0.0 109.973 178.254 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 84' ' ' GLN . . . . . . . . . . . . . 55.5 tp60 -65.97 -40.63 91.41 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 115.825 -0.625 . . . . 0.0 109.852 178.23 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 85' ' ' LEU . . . . . 0.42 HD11 ' HB3' ' A' ' 72' ' ' LEU . 54.4 tp -70.41 -43.65 69.53 Favored 'General case' 0 C--N 1.326 -0.42 0 CA-C-N 115.987 -0.551 . . . . 0.0 110.831 178.229 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 86' ' ' ASN . . . . . . . . . . . . . 97.3 m-20 -60.45 -44.34 95.96 Favored 'General case' 0 C--N 1.332 -0.16 0 CA-C-N 116.437 -0.347 . . . . 0.0 110.922 179.498 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 87' ' ' SER . . . . . . . . . . . . . 8.4 p -61.58 -38.2 86.66 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.669 -0.241 . . . . 0.0 110.798 -179.735 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 88' ' ' TYR . . . . . 0.408 ' HA ' ' CD2' ' A' ' 91' ' ' TYR . 18.0 m-30 -57.89 -46.05 85.5 Favored 'General case' 0 C--O 1.231 0.1 0 CA-C-O 120.983 0.421 . . . . 0.0 110.32 173.81 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 89' ' ' LYS . . . . . 0.593 ' HA ' ' SG ' ' A' ' 92' ' ' CYS . 60.0 mttm -63.24 -38.1 89.85 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 115.681 -0.69 . . . . 0.0 110.872 179.264 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 90' ' ' ASN . . . . . . . . . . . . . 28.6 m-80 -60.02 -32.49 70.94 Favored 'General case' 0 C--N 1.327 -0.401 0 CA-C-O 120.753 0.311 . . . . 0.0 111.085 177.408 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 91' ' ' TYR . . . . . 0.408 ' CD2' ' HA ' ' A' ' 88' ' ' TYR . 21.1 m-85 -70.38 -52.6 21.27 Favored 'General case' 0 C--O 1.235 0.327 0 CA-C-O 120.735 0.302 . . . . 0.0 110.619 178.17 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 92' ' ' CYS . . . . . 0.704 ' HA ' ' HB2' ' A' ' 96' ' ' LEU . 21.2 p -75.79 -39.18 57.4 Favored 'General case' 0 C--N 1.33 -0.253 0 N-CA-C 112.256 0.465 . . . . 0.0 112.256 -172.903 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 93' ' ' ARG . . . . . . . . . . . . . 43.8 ttt-85 -69.87 -47.92 60.72 Favored 'General case' 0 C--N 1.324 -0.51 0 CA-C-O 120.866 0.365 . . . . 0.0 111.502 -176.902 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 94' ' ' ASN . . . . . . . . . . . . . 17.7 m120 -87.54 -57.63 2.88 Favored 'General case' 0 C--N 1.325 -0.469 0 N-CA-C 112.205 0.446 . . . . 0.0 112.205 -173.282 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 95' ' ' HIS . . . . . . . . . . . . . 8.5 m80 -86.46 -40.57 15.19 Favored 'General case' 0 C--N 1.327 -0.389 0 N-CA-C 113.263 0.838 . . . . 0.0 113.263 -173.292 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 96' ' ' LEU . . . . . 0.704 ' HB2' ' HA ' ' A' ' 92' ' ' CYS . 76.6 mt -87.0 21.45 2.3 Favored 'General case' 0 C--N 1.325 -0.459 0 C-N-CA 120.704 -0.398 . . . . 0.0 110.69 -179.276 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 97' ' ' SER . . . . . 0.565 ' OG ' ' HD3' ' A' ' 98' ' ' PRO . 1.8 p -55.65 -45.29 99.9 Favored Pre-proline 0 CA--C 1.54 0.56 0 N-CA-C 113.003 0.742 . . . . 0.0 113.003 -179.006 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 98' ' ' PRO . . . . . 0.565 ' HD3' ' OG ' ' A' ' 97' ' ' SER . 32.2 Cg_exo -58.28 -38.23 91.75 Favored 'Trans proline' 0 C--N 1.36 1.18 0 C-N-CA 121.581 1.521 . . . . 0.0 111.688 177.488 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 99' ' ' LEU . . . . . 0.576 HD22 HG23 ' A' ' 107' ' ' ILE . 34.9 mt -77.44 -34.34 54.57 Favored 'General case' 0 C--N 1.325 -0.459 0 CA-C-N 115.809 -0.632 . . . . 0.0 110.34 -178.055 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 100' ' ' TYR . . . . . . . . . . . . . 5.7 t80 -55.5 -30.55 60.86 Favored 'General case' 0 C--N 1.326 -0.436 0 CA-C-N 115.279 -0.873 . . . . 0.0 111.226 -175.922 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 101' ' ' MET . . . . . . . . . . . . . 21.6 mmt -100.69 4.2 42.99 Favored 'General case' 0 C--N 1.326 -0.438 0 CA-C-N 116.346 -0.388 . . . . 0.0 111.403 -177.044 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 102' ' ' LYS . . . . . 0.487 ' HG3' ' O ' ' A' ' 98' ' ' PRO . 99.0 mttt -107.39 160.88 15.3 Favored 'General case' 0 C--N 1.325 -0.49 0 CA-C-O 121.055 0.455 . . . . 0.0 111.193 -178.309 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 103' ' ' SER . . . . . 0.408 ' O ' HG13 ' A' ' 107' ' ' ILE . 27.9 t -88.55 162.51 16.35 Favored 'General case' 0 C--N 1.325 -0.48 0 CA-C-N 115.862 -0.608 . . . . 0.0 109.998 176.531 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 104' ' ' LEU . . . . . 0.412 ' HB3' HD12 ' A' ' 146' ' ' ILE . 67.0 mt -61.61 -29.72 70.23 Favored 'General case' 0 C--N 1.326 -0.421 0 CA-C-N 116.039 -0.528 . . . . 0.0 111.81 -174.646 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 105' ' ' SER . . . . . . . . . . . . . 19.9 p -84.84 -15.86 43.31 Favored 'General case' 0 C--N 1.325 -0.462 0 CA-C-N 116.38 -0.373 . . . . 0.0 111.332 -178.318 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 106' ' ' GLU . . . . . . . . . . . . . 47.5 mt-10 -94.97 -24.23 17.04 Favored 'General case' 0 C--N 1.327 -0.393 0 CA-C-O 121.09 0.471 . . . . 0.0 110.719 -176.319 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 107' ' ' ILE . . . . . 0.576 HG23 HD22 ' A' ' 99' ' ' LEU . 82.4 mt -71.2 113.97 8.55 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.58 0 CA-C-N 115.624 -0.716 . . . . 0.0 110.695 -179.917 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 108' ' ' LEU . . . . . . . . . . . . . 88.5 mt -96.49 147.74 33.41 Favored Pre-proline 0 C--N 1.321 -0.646 0 CA-C-N 115.573 -0.739 . . . . 0.0 110.434 -179.985 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 109' ' ' PRO . . . . . 0.745 ' HB3' ' HB3' ' A' ' 153' ' ' TYR . 15.8 Cg_endo -58.55 -35.73 98.28 Favored 'Trans proline' 0 C--N 1.343 0.24 0 C-N-CA 122.653 2.236 . . . . 0.0 112.068 178.514 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 110' ' ' ALA . . . . . . . . . . . . . . . -68.51 -31.45 70.71 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 116.041 -0.527 . . . . 0.0 110.892 179.829 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 111' ' ' ASP . . . . . . . . . . . . . 24.6 t70 -68.9 -46.98 66.96 Favored 'General case' 0 C--N 1.327 -0.396 0 CA-C-O 121.22 0.533 . . . . 0.0 109.631 179.534 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 112' ' ' ILE . . . . . . . . . . . . . 30.7 mt -62.34 -41.17 90.6 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.291 0 CA-C-N 115.633 -0.712 . . . . 0.0 109.926 175.505 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 113' ' ' GLN . . . . . . . . . . . . . 24.3 tp60 -57.09 -42.8 81.42 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-N 115.524 -0.762 . . . . 0.0 110.207 178.002 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 114' ' ' SER . . . . . . . . . . . . . 36.5 m -59.19 -38.79 80.71 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 115.971 -0.559 . . . . 0.0 110.778 179.342 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 115' ' ' ILE . . . . . . . . . . . . . 73.3 mt -64.08 -47.99 87.83 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.358 0 CA-C-N 116.238 -0.437 . . . . 0.0 110.759 176.938 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 116' ' ' ILE . . . . . . . . . . . . . 48.1 mm -59.99 -41.72 87.13 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.442 0 CA-C-O 121.001 0.429 . . . . 0.0 110.79 179.78 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 117' ' ' ASN . . . . . . . . . . . . . 9.2 m-20 -65.82 -38.96 90.32 Favored 'General case' 0 C--N 1.327 -0.408 0 CA-C-N 115.707 -0.679 . . . . 0.0 112.111 -177.321 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 118' ' ' GLU . . . . . . . . . . . . . 10.8 pt-20 -80.74 -22.09 40.55 Favored 'General case' 0 C--O 1.234 0.285 0 C-N-CA 120.973 -0.291 . . . . 0.0 111.649 -176.454 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 119' ' ' THR . . . . . 0.469 HG22 ' H ' ' A' ' 121' ' ' LEU . 86.9 m -68.0 112.76 5.18 Favored 'General case' 0 C--N 1.325 -0.459 0 CA-C-O 121.137 0.494 . . . . 0.0 110.788 -177.95 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 120' ' ' LYS . . . . . . . . . . . . . 21.5 ptmt -91.08 26.46 2.14 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 115.896 -0.593 . . . . 0.0 111.263 -177.236 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 121' ' ' LEU . . . . . 0.469 ' H ' HG22 ' A' ' 119' ' ' THR . 85.7 mt -90.28 173.4 8.16 Favored 'General case' 0 C--N 1.32 -0.712 0 N-CA-C 109.571 -0.529 . . . . 0.0 109.571 179.307 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 122' ' ' ALA . . . . . . . . . . . . . . . -61.29 151.25 32.44 Favored 'General case' 0 C--N 1.326 -0.439 0 CA-C-O 120.78 0.324 . . . . 0.0 111.125 -178.015 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 123' ' ' LYS . . . . . . . . . . . . . 85.9 tttt -57.26 -36.5 71.07 Favored 'General case' 0 C--N 1.327 -0.41 0 CA-C-N 115.999 -0.546 . . . . 0.0 111.215 -178.932 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 124' ' ' ASN . . . . . . . . . . . . . 31.3 p30 -64.87 -25.21 67.8 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-O 121.084 0.468 . . . . 0.0 111.092 177.38 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 125' ' ' THR . . . . . 0.453 ' O ' HG13 ' A' ' 129' ' ' ILE . 16.6 m -81.92 -36.99 27.48 Favored 'General case' 0 N--CA 1.45 -0.464 0 CA-C-N 116.061 -0.518 . . . . 0.0 109.814 178.681 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 126' ' ' LEU . . . . . . . . . . . . . 94.2 mt -58.79 -45.89 88.82 Favored 'General case' 0 C--N 1.33 -0.246 0 CA-C-N 116.002 -0.545 . . . . 0.0 109.622 174.083 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 127' ' ' LYS . . . . . . . . . . . . . 50.1 mttm -62.16 -35.08 77.72 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-N 115.382 -0.827 . . . . 0.0 111.219 176.785 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 128' ' ' ALA . . . . . . . . . . . . . . . -65.72 -47.8 74.11 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.367 -0.379 . . . . 0.0 110.806 178.554 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 129' ' ' ILE . . . . . 0.453 HG13 ' O ' ' A' ' 125' ' ' THR . 58.3 mt -62.02 -45.68 98.17 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.226 0 CA-C-N 116.289 -0.414 . . . . 0.0 109.92 178.032 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 130' ' ' ARG . . . . . . . . . . . . . 8.9 tpt85 -55.95 -54.27 46.74 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-N 115.512 -0.767 . . . . 0.0 111.19 177.057 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 131' ' ' ASN . . . . . . . . . . . . . 8.8 t30 -57.71 -47.41 82.47 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 116.478 -0.328 . . . . 0.0 111.289 -177.312 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 132' ' ' THR . . . . . 0.478 ' O ' HG13 ' A' ' 136' ' ' ILE . 30.8 m -57.77 -51.79 68.12 Favored 'General case' 0 C--N 1.324 -0.517 0 CA-C-N 115.971 -0.559 . . . . 0.0 110.855 -178.993 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 133' ' ' ALA . . . . . . . . . . . . . . . -61.96 -41.07 97.59 Favored 'General case' 0 C--N 1.331 -0.206 0 CA-C-N 116.183 -0.462 . . . . 0.0 111.103 -179.96 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 134' ' ' SER . . . . . 0.621 ' O ' ' HG3' ' A' ' 138' ' ' ARG . 50.0 m -58.24 -49.59 76.55 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.022 -0.536 . . . . 0.0 111.284 -178.327 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 135' ' ' GLN . . . . . . . . . . . . . 22.0 mt-30 -66.62 -32.25 73.46 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.517 -0.31 . . . . 0.0 111.205 -177.162 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 136' ' ' ILE . . . . . 0.478 HG13 ' O ' ' A' ' 132' ' ' THR . 82.9 mt -61.57 -47.11 94.89 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.231 0 CA-C-O 120.799 0.333 . . . . 0.0 110.518 177.155 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 137' ' ' PHE . . . . . 0.436 ' HZ ' HG21 ' A' ' 107' ' ' ILE . 54.3 m-85 -64.99 -39.74 93.93 Favored 'General case' 0 C--N 1.327 -0.401 0 CA-C-N 116.325 -0.398 . . . . 0.0 111.432 178.53 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 138' ' ' ARG . . . . . 0.621 ' HG3' ' O ' ' A' ' 134' ' ' SER . 41.0 mtp180 -67.67 -31.25 71.09 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-O 120.779 0.323 . . . . 0.0 110.409 -179.761 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 139' ' ' LEU . . . . . . . . . . . . . 60.8 tp -62.8 -40.73 98.27 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-O 121.245 0.545 . . . . 0.0 109.852 174.994 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 140' ' ' ALA . . . . . . . . . . . . . . . -64.34 -35.28 80.36 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-N 115.652 -0.704 . . . . 0.0 110.682 177.637 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 141' ' ' ILE . . . . . 0.544 ' HA ' ' O ' ' A' ' 146' ' ' ILE . 70.4 mt -63.3 -44.04 98.92 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.224 0 CA-C-O 120.858 0.361 . . . . 0.0 110.462 175.126 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 142' ' ' GLU . . . . . . . . . . . . . 19.1 mm-40 -67.57 -25.47 65.8 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.148 -0.478 . . . . 0.0 111.538 179.796 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 143' ' ' ASN . . . . . . . . . . . . . 4.6 m-20 -94.12 5.04 52.99 Favored 'General case' 0 C--N 1.323 -0.58 0 CA-C-N 116.278 -0.419 . . . . 0.0 110.446 176.423 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 144' ' ' ARG . . . . . . . . . . . . . 57.5 mtp85 64.62 25.22 13.1 Favored 'General case' 0 N--CA 1.465 0.313 0 CA-C-N 115.517 -0.765 . . . . 0.0 112.787 174.001 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 145' ' ' ALA . . . . . . . . . . . . . . . -83.43 -27.52 29.48 Favored 'General case' 0 C--N 1.325 -0.46 0 CA-C-O 121.294 0.569 . . . . 0.0 109.993 176.384 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 146' ' ' ILE . . . . . 0.544 ' O ' ' HA ' ' A' ' 141' ' ' ILE . 18.1 tt -145.91 154.56 13.05 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.461 0 CA-C-N 115.653 -0.703 . . . . 0.0 109.185 178.728 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 147' ' ' ASP . . . . . . . . . . . . . 4.9 p-10 -103.44 -5.2 23.11 Favored 'General case' 0 N--CA 1.467 0.393 0 N-CA-C 111.963 0.357 . . . . 0.0 111.963 -174.455 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 148' ' ' PHE . . . . . 0.423 ' H ' HG12 ' A' ' 146' ' ' ILE . 76.2 t80 -155.66 145.23 21.11 Favored 'General case' 0 C--N 1.324 -0.513 0 N-CA-C 110.166 -0.309 . . . . 0.0 110.166 -176.7 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 149' ' ' ASN . . . . . 0.415 ' HA ' ' HD2' ' A' ' 150' ' ' PRO . 20.0 p-10 -107.28 112.27 62.87 Favored Pre-proline 0 C--N 1.323 -0.563 0 CA-C-O 121.053 0.454 . . . . 0.0 110.943 178.99 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 150' ' ' PRO . . . . . 0.415 ' HD2' ' HA ' ' A' ' 149' ' ' ASN . 35.6 Cg_endo -65.34 -11.0 28.17 Favored 'Trans proline' 0 N--CA 1.473 0.323 0 C-N-CA 122.969 2.446 . . . . 0.0 112.291 179.31 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 151' ' ' ALA . . . . . . . . . . . . . . . -67.5 -31.85 72.26 Favored 'General case' 0 C--N 1.327 -0.387 0 CA-C-N 115.968 -0.56 . . . . 0.0 110.775 178.088 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 152' ' ' ASP . . . . . . . . . . . . . 25.9 t70 -72.91 -15.77 61.57 Favored 'General case' 0 N--CA 1.464 0.262 0 CA-C-O 121.589 0.709 . . . . 0.0 110.04 179.594 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 153' ' ' TYR . . . . . 0.745 ' HB3' ' HB3' ' A' ' 109' ' ' PRO . 3.1 t80 -84.26 -20.82 31.56 Favored 'General case' 0 C--N 1.325 -0.48 0 CA-C-N 115.234 -0.894 . . . . 0.0 109.458 179.444 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 154' ' ' VAL . . . . . . . . . . . . . 59.1 t -72.85 129.54 35.92 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.423 0 CA-C-N 115.726 -0.67 . . . . 0.0 110.812 -178.768 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 155' ' ' ARG . . . . . 0.406 ' HE ' ' HB2' ' A' ' 155' ' ' ARG . 59.2 mtm180 -86.6 146.99 26.12 Favored 'General case' 0 C--N 1.324 -0.538 0 CA-C-N 116.218 -0.446 . . . . 0.0 110.675 -178.3 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 156' ' ' ILE . . . . . . . . . . . . . 37.8 mm -108.36 113.49 60.27 Favored Pre-proline 0 C--N 1.317 -0.823 0 CA-C-N 115.669 -0.696 . . . . 0.0 109.517 172.754 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 157' ' ' PRO . . . . . . . . . . . . . 51.1 Cg_exo . . . . . 0 C--N 1.344 0.325 0 C-N-CA 122.542 2.162 . . . . 0.0 111.62 -179.982 . . . . . . . . 0 0 . 1 . 009 nuclear build core ' A' A ' 63' ' ' SER . . . . . 0.55 ' HA ' ' HA ' ' A' ' 103' ' ' SER . 1.3 m . . . . . 0 N--CA 1.451 -0.414 0 N-CA-C 109.366 -0.605 . . . . 0.0 109.366 . . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 64' ' ' PHE . . . . . 0.583 ' HB2' HD11 ' A' ' 107' ' ' ILE . 56.0 t80 -63.44 -44.58 94.15 Favored 'General case' 0 C--N 1.324 -0.504 0 C-N-CA 120.959 -0.297 . . . . 0.0 110.434 -179.319 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 65' ' ' GLY . . . . . . . . . . . . . . . -65.35 -29.76 76.02 Favored Glycine 0 C--N 1.331 0.289 0 C-N-CA 120.845 -0.693 . . . . 0.0 112.062 177.654 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 66' ' ' ASP . . . . . . . . . . . . . 12.2 t0 -65.89 -54.16 30.21 Favored 'General case' 0 C--O 1.24 0.579 0 CA-C-O 121.475 0.655 . . . . 0.0 110.209 177.91 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 67' ' ' TRP . . . . . . . . . . . . . 96.3 m95 -70.62 -23.78 62.61 Favored 'General case' 0 C--N 1.325 -0.463 0 CA-C-N 115.802 -0.635 . . . . 0.0 110.91 178.162 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 68' ' ' ALA . . . . . . . . . . . . . . . -62.61 -48.81 77.77 Favored 'General case' 0 C--O 1.225 -0.208 0 CA-C-N 116.406 -0.361 . . . . 0.0 110.671 176.419 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 69' ' ' GLU . . . . . . . . . . . . . 43.6 tt0 -59.05 -44.57 91.82 Favored 'General case' 0 C--O 1.234 0.281 0 C-N-CA 120.856 -0.338 . . . . 0.0 110.114 177.382 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 70' ' ' LYS . . . . . . . . . . . . . 24.5 ttmm -58.91 -43.02 91.0 Favored 'General case' 0 CA--C 1.535 0.399 0 CA-C-N 116.105 -0.498 . . . . 0.0 110.955 179.151 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 71' ' ' PHE . . . . . . . . . . . . . 82.3 t80 -72.11 -44.56 62.99 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-O 120.88 0.371 . . . . 0.0 111.332 -179.626 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 72' ' ' LEU . . . . . 0.505 HD23 ' HG2' ' A' ' 89' ' ' LYS . 7.3 mp -61.38 -39.44 90.67 Favored 'General case' 0 C--N 1.325 -0.472 0 CA-C-N 116.332 -0.395 . . . . 0.0 111.32 -178.297 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 73' ' ' LYS . . . . . 0.486 ' O ' ' HB3' ' A' ' 76' ' ' GLU . 57.3 tttp -77.21 -33.32 56.27 Favored 'General case' 0 C--N 1.326 -0.429 0 C-N-CA 120.644 -0.422 . . . . 0.0 111.416 -178.403 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 74' ' ' SER . . . . . . . . . . . . . 12.3 p -68.76 -29.34 67.71 Favored 'General case' 0 C--N 1.324 -0.513 0 C-N-CA 120.268 -0.573 . . . . 0.0 109.847 176.679 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 75' ' ' LYS . . . . . 0.517 ' O ' HG22 ' A' ' 80' ' ' VAL . 43.3 mmtt -77.39 -34.73 54.84 Favored 'General case' 0 C--N 1.331 -0.217 0 CA-C-N 116.267 -0.424 . . . . 0.0 110.529 173.14 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 76' ' ' GLU . . . . . 0.486 ' HB3' ' O ' ' A' ' 73' ' ' LYS . 34.6 tt0 -51.75 -47.61 64.03 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 116.018 -0.537 . . . . 0.0 110.057 172.444 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 77' ' ' ALA . . . . . . . . . . . . . . . -84.56 -12.65 53.71 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 115.677 -0.692 . . . . 0.0 111.751 178.847 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 78' ' ' ASP . . . . . . . . . . . . . 29.5 t70 -65.99 -35.85 81.7 Favored 'General case' 0 N--CA 1.467 0.386 0 CA-C-O 120.876 0.369 . . . . 0.0 110.473 178.773 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 79' ' ' GLY . . . . . . . . . . . . . . . 133.76 2.07 3.61 Favored Glycine 0 N--CA 1.447 -0.567 0 C-N-CA 120.073 -1.06 . . . . 0.0 113.447 176.047 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 80' ' ' VAL . . . . . 0.517 HG22 ' O ' ' A' ' 75' ' ' LYS . 28.4 m -70.15 136.96 25.0 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.339 0 CA-C-N 117.324 0.562 . . . . 0.0 110.377 179.499 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 81' ' ' SER . . . . . . . . . . . . . 23.3 t -72.62 164.7 26.07 Favored 'General case' 0 C--N 1.322 -0.607 0 CA-C-O 121.147 0.498 . . . . 0.0 110.224 179.947 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 82' ' ' VAL . . . . . . . . . . . . . 28.8 m -57.08 -29.69 32.35 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.609 0 CA-C-N 115.305 -0.861 . . . . 0.0 111.7 -177.177 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 83' ' ' SER . . . . . . . . . . . . . 5.9 p -62.71 -48.01 81.13 Favored 'General case' 0 C--N 1.326 -0.432 0 CA-C-O 121.173 0.511 . . . . 0.0 110.701 177.337 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 84' ' ' GLN . . . . . . . . . . . . . 6.8 tp-100 -73.83 -37.13 64.94 Favored 'General case' 0 C--N 1.325 -0.484 0 CA-C-N 115.793 -0.64 . . . . 0.0 110.074 -179.954 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 85' ' ' LEU . . . . . . . . . . . . . 43.5 tp -62.49 -44.79 95.54 Favored 'General case' 0 C--N 1.326 -0.442 0 CA-C-N 115.836 -0.62 . . . . 0.0 110.655 178.734 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 86' ' ' ASN . . . . . . . . . . . . . 83.5 m-20 -61.52 -37.02 82.18 Favored 'General case' 0 CA--C 1.519 -0.214 0 CA-C-N 116.487 -0.324 . . . . 0.0 110.377 176.265 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 87' ' ' SER . . . . . . . . . . . . . 27.2 t -56.1 -49.34 74.14 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 116.176 -0.466 . . . . 0.0 110.284 178.753 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 88' ' ' TYR . . . . . . . . . . . . . 32.3 m-85 -58.47 -41.28 84.85 Favored 'General case' 0 C--O 1.233 0.188 0 CA-C-O 120.87 0.366 . . . . 0.0 110.895 178.908 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 89' ' ' LYS . . . . . 0.566 ' HA ' ' SG ' ' A' ' 92' ' ' CYS . 85.1 mttt -70.76 -31.65 68.53 Favored 'General case' 0 C--N 1.327 -0.386 0 CA-C-N 116.197 -0.456 . . . . 0.0 111.294 -177.675 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 90' ' ' ASN . . . . . . . . . . . . . 27.6 m-80 -64.55 -36.17 83.36 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-O 120.97 0.414 . . . . 0.0 110.384 175.61 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 91' ' ' TYR . . . . . . . . . . . . . 42.4 m-85 -67.01 -48.9 66.97 Favored 'General case' 0 C--N 1.326 -0.415 0 CA-C-N 116.279 -0.419 . . . . 0.0 111.306 179.43 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 92' ' ' CYS . . . . . 0.611 ' HA ' ' HB2' ' A' ' 96' ' ' LEU . 26.1 p -72.56 -32.99 66.49 Favored 'General case' 0 C--N 1.331 -0.238 0 N-CA-C 111.849 0.315 . . . . 0.0 111.849 -175.63 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 93' ' ' ARG . . . . . . . . . . . . . 99.7 mtt180 -78.53 -38.99 39.23 Favored 'General case' 0 C--N 1.328 -0.365 0 N-CA-C 112.022 0.378 . . . . 0.0 112.022 -178.358 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 94' ' ' ASN . . . . . . . . . . . . . 17.4 m120 -99.62 -60.4 1.54 Allowed 'General case' 0 C--N 1.327 -0.384 0 N-CA-C 112.539 0.57 . . . . 0.0 112.539 -175.19 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 95' ' ' HIS . . . . . . . . . . . . . 6.1 m80 -78.79 -47.73 16.17 Favored 'General case' 0 C--N 1.325 -0.463 0 N-CA-C 112.502 0.556 . . . . 0.0 112.502 -172.4 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 96' ' ' LEU . . . . . 0.611 ' HB2' ' HA ' ' A' ' 92' ' ' CYS . 86.6 mt -91.59 21.53 4.6 Favored 'General case' 0 C--N 1.32 -0.698 0 CA-C-N 116.718 -0.219 . . . . 0.0 111.188 -175.386 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 97' ' ' SER . . . . . 0.525 ' N ' ' HD2' ' A' ' 98' ' ' PRO . 3.1 p -59.94 -43.22 94.06 Favored Pre-proline 0 CA--C 1.544 0.739 0 N-CA-C 112.667 0.617 . . . . 0.0 112.667 -179.719 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 98' ' ' PRO . . . . . 0.525 ' HD2' ' N ' ' A' ' 97' ' ' SER . 22.9 Cg_endo -63.41 -32.03 71.97 Favored 'Trans proline' 0 C--N 1.362 1.241 0 C-N-CA 121.59 1.527 . . . . 0.0 112.195 175.951 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 99' ' ' LEU . . . . . 0.65 ' HA ' ' HD2' ' A' ' 102' ' ' LYS . 10.8 mp -80.1 -31.45 39.2 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.407 -0.36 . . . . 0.0 110.51 179.682 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 100' ' ' TYR . . . . . . . . . . . . . 36.1 t80 -54.39 -34.63 61.66 Favored 'General case' 0 C--N 1.327 -0.374 0 CA-C-N 115.673 -0.694 . . . . 0.0 111.193 -178.258 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 101' ' ' MET . . . . . . . . . . . . . 22.5 mmt -91.83 -4.29 55.04 Favored 'General case' 0 C--N 1.331 -0.228 0 CA-C-N 115.791 -0.64 . . . . 0.0 111.06 -176.661 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 102' ' ' LYS . . . . . 0.65 ' HD2' ' HA ' ' A' ' 99' ' ' LEU . 51.8 mttm -87.93 150.01 23.73 Favored 'General case' 0 C--N 1.323 -0.566 0 CA-C-N 116.132 -0.485 . . . . 0.0 110.71 179.662 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 103' ' ' SER . . . . . 0.55 ' HA ' ' HA ' ' A' ' 63' ' ' SER . 8.7 m -82.52 162.98 21.83 Favored 'General case' 0 C--N 1.322 -0.597 0 N-CA-C 107.972 -1.121 . . . . 0.0 107.972 167.622 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 104' ' ' LEU . . . . . . . . . . . . . 95.2 mt -52.54 -39.31 61.28 Favored 'General case' 0 C--N 1.324 -0.535 0 N-CA-C 111.983 0.364 . . . . 0.0 111.983 -177.53 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 105' ' ' SER . . . . . . . . . . . . . 9.0 m -83.65 0.24 47.76 Favored 'General case' 0 C--N 1.326 -0.446 0 N-CA-C 111.933 0.345 . . . . 0.0 111.933 -177.641 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 106' ' ' GLU . . . . . . . . . . . . . 44.9 mt-10 -102.92 -3.24 26.44 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-O 121.026 0.441 . . . . 0.0 110.253 178.4 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 107' ' ' ILE . . . . . 0.606 HG21 ' HZ ' ' A' ' 137' ' ' PHE . 62.0 mt -94.13 112.57 27.15 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.645 0 CA-C-N 115.998 -0.547 . . . . 0.0 110.5 -177.741 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 108' ' ' LEU . . . . . . . . . . . . . 64.5 mt -96.09 146.15 30.81 Favored Pre-proline 0 C--N 1.318 -0.769 0 CA-C-N 115.887 -0.597 . . . . 0.0 110.004 179.856 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 109' ' ' PRO . . . . . . . . . . . . . 42.0 Cg_exo -57.91 -28.39 82.56 Favored 'Trans proline' 0 N--CA 1.464 -0.245 0 C-N-CA 122.317 2.011 . . . . 0.0 111.33 175.437 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 110' ' ' ALA . . . . . . . . . . . . . . . -65.6 -34.73 78.92 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-N 115.724 -0.671 . . . . 0.0 110.983 177.083 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 111' ' ' ASP . . . . . 0.455 ' O ' HG13 ' A' ' 115' ' ' ILE . 70.6 m-20 -61.6 -46.24 90.68 Favored 'General case' 0 CA--C 1.516 -0.354 0 CA-C-O 121.027 0.441 . . . . 0.0 109.814 178.864 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 112' ' ' ILE . . . . . 0.542 ' O ' HG12 ' A' ' 116' ' ' ILE . 46.0 mt -69.73 -45.16 78.3 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.585 0 CA-C-N 115.892 -0.595 . . . . 0.0 110.293 179.67 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 113' ' ' GLN . . . . . . . . . . . . . 54.9 tp60 -57.81 -43.45 85.71 Favored 'General case' 0 C--N 1.332 -0.18 0 CA-C-N 116.374 -0.376 . . . . 0.0 111.143 179.721 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 114' ' ' SER . . . . . 0.504 ' O ' ' HG2' ' A' ' 118' ' ' GLU . 13.5 p -66.33 -37.56 85.64 Favored 'General case' 0 C--N 1.327 -0.399 0 C-N-CA 120.903 -0.319 . . . . 0.0 110.814 -179.906 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 115' ' ' ILE . . . . . 0.455 HG13 ' O ' ' A' ' 111' ' ' ASP . 69.0 mt -63.47 -41.92 94.39 Favored 'Isoleucine or valine' 0 N--CA 1.465 0.288 0 CA-C-O 120.731 0.301 . . . . 0.0 110.548 176.184 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 116' ' ' ILE . . . . . 0.542 HG12 ' O ' ' A' ' 112' ' ' ILE . 50.0 mm -65.01 -26.33 39.76 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.323 0 CA-C-O 121.307 0.575 . . . . 0.0 110.439 178.005 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 117' ' ' ASN . . . . . . . . . . . . . 8.8 t30 -86.63 -37.17 18.31 Favored 'General case' 0 C--N 1.325 -0.499 0 CA-C-N 115.759 -0.655 . . . . 0.0 111.435 -179.916 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 118' ' ' GLU . . . . . 0.504 ' HG2' ' O ' ' A' ' 114' ' ' SER . 33.9 mm-40 -79.78 -29.21 40.31 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-N 116.514 -0.312 . . . . 0.0 111.388 -176.212 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 119' ' ' THR . . . . . 0.492 ' HB ' HD21 ' A' ' 126' ' ' LEU . 62.0 m -76.03 111.31 11.3 Favored 'General case' 0 C--N 1.323 -0.573 0 CA-C-O 121.415 0.626 . . . . 0.0 109.752 176.83 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 120' ' ' LYS . . . . . . . . . . . . . 45.4 mtmt -96.11 31.59 2.13 Favored 'General case' 0 C--N 1.322 -0.599 0 CA-C-N 115.499 -0.773 . . . . 0.0 110.766 -174.157 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 121' ' ' LEU . . . . . 0.428 HD13 HG23 ' A' ' 119' ' ' THR . 11.2 mp -90.09 -174.93 4.39 Favored 'General case' 0 C--N 1.321 -0.641 0 CA-C-N 115.296 -0.865 . . . . 0.0 110.235 178.11 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 122' ' ' ALA . . . . . . . . . . . . . . . -62.33 152.62 33.31 Favored 'General case' 0 C--N 1.326 -0.439 0 CA-C-N 115.955 -0.566 . . . . 0.0 111.581 -177.301 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 123' ' ' LYS . . . . . 0.78 ' HE3' ' HA ' ' A' ' 123' ' ' LYS . 1.0 OUTLIER -56.88 -39.65 74.75 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 115.508 -0.769 . . . . 0.0 110.791 -177.784 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' A' A ' 124' ' ' ASN . . . . . . . . . . . . . 17.7 m120 -55.85 -47.33 77.47 Favored 'General case' 0 C--N 1.331 -0.217 0 CA-C-N 116.056 -0.52 . . . . 0.0 111.156 179.594 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 125' ' ' THR . . . . . 0.56 ' O ' HG13 ' A' ' 129' ' ' ILE . 19.0 m -59.41 -44.94 92.75 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.054 -0.521 . . . . 0.0 110.715 -178.955 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 126' ' ' LEU . . . . . 0.492 HD21 ' HB ' ' A' ' 119' ' ' THR . 97.5 mt -61.53 -41.68 97.7 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 115.932 -0.576 . . . . 0.0 111.033 179.553 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 127' ' ' LYS . . . . . 0.458 ' HG3' ' O ' ' A' ' 123' ' ' LYS . 51.5 mtpt -66.35 -37.53 85.53 Favored 'General case' 0 C--N 1.326 -0.437 0 CA-C-N 115.872 -0.604 . . . . 0.0 110.359 179.626 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 128' ' ' ALA . . . . . . . . . . . . . . . -67.3 -36.14 80.91 Favored 'General case' 0 C--N 1.326 -0.428 0 CA-C-N 116.055 -0.52 . . . . 0.0 111.149 179.442 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 129' ' ' ILE . . . . . 0.56 HG13 ' O ' ' A' ' 125' ' ' THR . 80.2 mt -58.86 -51.96 66.04 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.277 0 CA-C-O 120.851 0.358 . . . . 0.0 110.432 177.355 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 130' ' ' ARG . . . . . 0.408 HH11 ' HD3' ' A' ' 130' ' ' ARG . 39.8 ttt-85 -62.94 -44.07 97.07 Favored 'General case' 0 C--N 1.331 -0.203 0 CA-C-N 116.045 -0.525 . . . . 0.0 110.602 178.606 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 131' ' ' ASN . . . . . . . . . . . . . 47.5 t30 -57.5 -47.0 83.1 Favored 'General case' 0 N--CA 1.465 0.278 0 CA-C-N 116.111 -0.495 . . . . 0.0 111.277 -179.297 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 132' ' ' THR . . . . . . . . . . . . . 34.6 m -61.31 -49.17 78.11 Favored 'General case' 0 C--N 1.326 -0.413 0 CA-C-N 116.34 -0.391 . . . . 0.0 110.816 -179.748 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 133' ' ' ALA . . . . . . . . . . . . . . . -62.75 -41.72 99.34 Favored 'General case' 0 C--N 1.331 -0.211 0 CA-C-N 116.274 -0.421 . . . . 0.0 111.126 -179.173 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 134' ' ' SER . . . . . . . . . . . . . 32.7 t -60.04 -42.41 94.39 Favored 'General case' 0 C--N 1.327 -0.402 0 CA-C-N 116.182 -0.463 . . . . 0.0 110.993 -178.189 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 135' ' ' GLN . . . . . . . . . . . . . 49.8 mt-30 -65.13 -35.68 81.89 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-N 116.382 -0.372 . . . . 0.0 110.709 179.953 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 136' ' ' ILE . . . . . . . . . . . . . 74.4 mt -65.32 -44.37 94.8 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.272 0 CA-C-N 116.338 -0.392 . . . . 0.0 110.44 177.143 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 137' ' ' PHE . . . . . 0.606 ' HZ ' HG21 ' A' ' 107' ' ' ILE . 50.1 m-85 -62.02 -39.47 92.38 Favored 'General case' 0 N--CA 1.461 0.119 0 CA-C-N 116.3 -0.409 . . . . 0.0 110.675 177.243 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 138' ' ' ARG . . . . . 0.599 ' O ' ' HG2' ' A' ' 142' ' ' GLU . 73.9 mtp180 -58.64 -44.8 90.16 Favored 'General case' 0 C--N 1.33 -0.242 0 CA-C-N 116.395 -0.366 . . . . 0.0 110.768 177.645 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 139' ' ' LEU . . . . . . . . . . . . . 53.9 tp -59.13 -36.93 76.05 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-O 121.061 0.457 . . . . 0.0 110.686 179.232 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 140' ' ' ALA . . . . . . . . . . . . . . . -67.97 -41.0 83.06 Favored 'General case' 0 C--N 1.326 -0.417 0 CA-C-N 116.096 -0.502 . . . . 0.0 110.515 176.792 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 141' ' ' ILE . . . . . 0.57 ' HA ' ' O ' ' A' ' 146' ' ' ILE . 72.2 mt -61.12 -44.33 98.09 Favored 'Isoleucine or valine' 0 C--O 1.234 0.239 0 CA-C-N 116.254 -0.43 . . . . 0.0 110.482 176.482 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 142' ' ' GLU . . . . . 0.599 ' HG2' ' O ' ' A' ' 138' ' ' ARG . 24.8 mm-40 -54.57 -43.99 72.54 Favored 'General case' 0 C--N 1.33 -0.241 0 CA-C-N 115.993 -0.549 . . . . 0.0 110.862 178.458 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 143' ' ' ASN . . . . . . . . . . . . . 42.5 m-80 -90.0 14.05 13.22 Favored 'General case' 0 C--N 1.325 -0.496 0 CA-C-N 115.695 -0.684 . . . . 0.0 111.558 -176.718 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 144' ' ' ARG . . . . . . . . . . . . . 92.6 mtt180 61.98 32.14 17.82 Favored 'General case' 0 N--CA 1.467 0.419 0 N-CA-C 112.144 0.424 . . . . 0.0 112.144 174.367 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 145' ' ' ALA . . . . . . . . . . . . . . . -89.8 -29.95 18.3 Favored 'General case' 0 C--N 1.324 -0.513 0 CA-C-O 121.219 0.533 . . . . 0.0 110.416 177.047 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 146' ' ' ILE . . . . . 0.57 ' O ' ' HA ' ' A' ' 141' ' ' ILE . 16.4 tt -147.32 155.94 10.58 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.69 0 N-CA-C 108.457 -0.942 . . . . 0.0 108.457 177.941 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 147' ' ' ASP . . . . . . . . . . . . . 16.9 t70 -122.34 18.72 10.61 Favored 'General case' 0 C--N 1.323 -0.57 0 CA-C-O 121.122 0.486 . . . . 0.0 111.569 -176.446 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 148' ' ' PHE . . . . . 0.428 ' H ' HG12 ' A' ' 146' ' ' ILE . 49.7 p90 -149.29 154.77 39.51 Favored 'General case' 0 C--N 1.321 -0.635 0 N-CA-C 110.147 -0.316 . . . . 0.0 110.147 176.797 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 149' ' ' ASN . . . . . . . . . . . . . 57.3 t-20 -118.72 96.84 50.42 Favored Pre-proline 0 C--N 1.324 -0.51 0 CA-C-N 116.271 -0.422 . . . . 0.0 110.427 -176.696 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 150' ' ' PRO . . . . . . . . . . . . . 31.9 Cg_exo -59.33 -33.63 97.72 Favored 'Trans proline' 0 C--N 1.342 0.188 0 C-N-CA 122.897 2.398 . . . . 0.0 111.939 179.312 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 151' ' ' ALA . . . . . 0.402 ' HA ' HG23 ' A' ' 154' ' ' VAL . . . -69.37 -32.06 70.86 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.12 -0.491 . . . . 0.0 110.68 -179.555 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 152' ' ' ASP . . . . . . . . . . . . . 30.6 t70 -70.84 -22.72 62.28 Favored 'General case' 0 C--N 1.326 -0.421 0 CA-C-O 121.226 0.536 . . . . 0.0 109.91 178.624 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 153' ' ' TYR . . . . . . . . . . . . . 75.5 t80 -82.85 -16.08 49.05 Favored 'General case' 0 C--N 1.324 -0.512 0 CA-C-N 115.518 -0.765 . . . . 0.0 110.213 -179.04 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 154' ' ' VAL . . . . . 0.402 HG23 ' HA ' ' A' ' 151' ' ' ALA . 24.2 t -68.98 132.44 33.04 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.304 0 CA-C-N 116.25 -0.432 . . . . 0.0 110.298 176.145 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 155' ' ' ARG . . . . . . . . . . . . . 17.3 tpp180 -109.41 119.49 39.62 Favored 'General case' 0 C--N 1.318 -0.79 0 N-CA-C 109.816 -0.438 . . . . 0.0 109.816 173.897 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 156' ' ' ILE . . . . . . . . . . . . . 33.1 mm -66.02 124.48 87.87 Favored Pre-proline 0 C--N 1.327 -0.396 0 CA-C-N 115.658 -0.701 . . . . 0.0 109.731 174.121 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 157' ' ' PRO . . . . . . . . . . . . . 14.7 Cg_exo . . . . . 0 N--CA 1.455 -0.748 0 C-N-CA 121.92 1.747 . . . . 0.0 110.91 173.41 . . . . . . . . 0 0 . 1 . 010 nuclear build core ' A' A ' 63' ' ' SER . . . . . . . . . . . . . 29.1 t . . . . . 0 N--CA 1.452 -0.358 0 N-CA-C 109.703 -0.48 . . . . 0.0 109.703 . . . . . . . . . 0 0 . 1 . 010 nuclear build core ' A' A ' 64' ' ' PHE . . . . . 0.533 ' HB2' HD11 ' A' ' 107' ' ' ILE . 73.4 t80 -60.11 -30.04 69.0 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-O 120.76 0.314 . . . . 0.0 110.427 179.194 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 65' ' ' GLY . . . . . 0.461 ' HA2' ' CD1' ' A' ' 100' ' ' TYR . . . -61.11 -41.04 99.34 Favored Glycine 0 N--CA 1.449 -0.472 0 C-N-CA 121.08 -0.581 . . . . 0.0 112.217 176.675 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 66' ' ' ASP . . . . . 0.509 ' O ' ' HG2' ' A' ' 70' ' ' LYS . 33.9 t70 -66.69 -42.58 86.23 Favored 'General case' 0 C--N 1.325 -0.463 0 N-CA-C 109.767 -0.457 . . . . 0.0 109.767 178.185 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 67' ' ' TRP . . . . . . . . . . . . . 93.8 m95 -67.72 -27.82 67.13 Favored 'General case' 0 C--N 1.331 -0.23 0 CA-C-N 115.827 -0.624 . . . . 0.0 111.54 -179.961 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 68' ' ' ALA . . . . . 0.49 ' O ' ' HG ' ' A' ' 72' ' ' LEU . . . -62.22 -49.55 75.3 Favored 'General case' 0 C--N 1.328 -0.355 0 N-CA-C 109.779 -0.452 . . . . 0.0 109.779 174.291 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 69' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER -61.83 -37.64 85.19 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.087 -0.506 . . . . 0.0 110.65 175.262 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 70' ' ' LYS . . . . . 0.509 ' HG2' ' O ' ' A' ' 66' ' ' ASP . 27.0 mmmt -57.58 -52.09 66.83 Favored 'General case' 0 N--CA 1.464 0.254 0 CA-C-N 116.356 -0.384 . . . . 0.0 110.47 176.364 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 71' ' ' PHE . . . . . . . . . . . . . 92.0 t80 -62.12 -40.3 95.44 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 115.998 -0.546 . . . . 0.0 110.829 -179.669 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 72' ' ' LEU . . . . . 0.49 ' HG ' ' O ' ' A' ' 68' ' ' ALA . 79.5 mt -61.74 -51.65 67.48 Favored 'General case' 0 C--N 1.326 -0.456 0 CA-C-N 116.223 -0.444 . . . . 0.0 111.097 179.496 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 73' ' ' LYS . . . . . 0.454 ' HA ' ' HB3' ' A' ' 76' ' ' GLU . 55.0 tttp -71.44 -24.06 61.95 Favored 'General case' 0 C--N 1.326 -0.441 0 C-N-CA 120.216 -0.594 . . . . 0.0 110.59 -179.165 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 74' ' ' SER . . . . . . . . . . . . . 33.5 t -60.26 -45.47 93.19 Favored 'General case' 0 C--N 1.328 -0.358 0 N-CA-C 109.795 -0.446 . . . . 0.0 109.795 173.745 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 75' ' ' LYS . . . . . . . . . . . . . 27.5 mmtm -76.11 -30.35 58.2 Favored 'General case' 0 C--N 1.327 -0.399 0 CA-C-N 116.384 -0.371 . . . . 0.0 110.855 177.605 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 76' ' ' GLU . . . . . 0.454 ' HB3' ' HA ' ' A' ' 73' ' ' LYS . 2.7 tm-20 -58.08 -53.43 58.38 Favored 'General case' 0 C--N 1.327 -0.379 0 CA-C-N 116.092 -0.504 . . . . 0.0 109.722 173.969 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 77' ' ' ALA . . . . . . . . . . . . . . . -71.33 -27.04 63.09 Favored 'General case' 0 C--N 1.325 -0.473 0 CA-C-N 115.721 -0.672 . . . . 0.0 111.229 179.322 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 78' ' ' ASP . . . . . . . . . . . . . 17.4 t70 -64.08 -49.09 73.62 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.114 -0.494 . . . . 0.0 110.528 178.117 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 79' ' ' GLY . . . . . . . . . . . . . . . 131.32 55.15 0.09 OUTLIER Glycine 0 N--CA 1.448 -0.555 0 C-N-CA 120.633 -0.794 . . . . 0.0 112.975 177.084 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 80' ' ' VAL . . . . . 0.631 HG23 ' HG ' ' A' ' 85' ' ' LEU . 22.8 m -112.16 168.91 4.69 Favored 'Isoleucine or valine' 0 C--O 1.237 0.431 0 O-C-N 122.462 -0.434 . . . . 0.0 110.732 175.328 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 81' ' ' SER . . . . . . . . . . . . . 74.9 p -83.08 169.31 16.03 Favored 'General case' 0 C--N 1.322 -0.612 0 CA-C-N 115.929 -0.578 . . . . 0.0 110.944 -178.721 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 82' ' ' VAL . . . . . . . . . . . . . 94.3 t -64.33 -37.83 80.98 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.431 0 N-CA-C 109.379 -0.601 . . . . 0.0 109.379 173.817 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 83' ' ' SER . . . . . . . . . . . . . 13.6 t -60.38 -47.65 85.13 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 115.758 -0.655 . . . . 0.0 110.536 178.657 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 84' ' ' GLN . . . . . 0.412 ' HG3' ' CE2' ' A' ' 88' ' ' TYR . 6.7 tp-100 -63.71 -45.1 91.51 Favored 'General case' 0 C--N 1.332 -0.157 0 CA-C-N 116.369 -0.378 . . . . 0.0 110.396 179.704 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 85' ' ' LEU . . . . . 0.631 ' HG ' HG23 ' A' ' 80' ' ' VAL . 19.1 mt -62.46 -36.07 81.28 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.225 -0.443 . . . . 0.0 111.266 177.418 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 86' ' ' ASN . . . . . . . . . . . . . 53.7 t30 -72.77 -29.95 63.72 Favored 'General case' 0 C--N 1.322 -0.621 0 CA-C-N 115.837 -0.62 . . . . 0.0 109.856 -177.9 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 87' ' ' SER . . . . . 0.413 ' O ' ' HD1' ' A' ' 91' ' ' TYR . 42.4 t -64.27 -49.94 69.87 Favored 'General case' 0 N--CA 1.452 -0.363 0 CA-C-N 115.655 -0.702 . . . . 0.0 109.682 172.877 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 88' ' ' TYR . . . . . 0.412 ' CE2' ' HG3' ' A' ' 84' ' ' GLN . 25.7 m-85 -59.86 -38.72 82.95 Favored 'General case' 0 C--N 1.331 -0.234 0 CA-C-N 116.208 -0.451 . . . . 0.0 111.265 179.733 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 89' ' ' LYS . . . . . 0.467 ' HG3' ' O ' ' A' ' 85' ' ' LEU . 64.6 mttp -57.92 -44.58 86.94 Favored 'General case' 0 C--N 1.333 -0.115 0 CA-C-O 120.801 0.334 . . . . 0.0 110.89 177.625 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 90' ' ' ASN . . . . . . . . . . . . . 20.7 t-20 -64.49 -42.9 95.57 Favored 'General case' 0 C--N 1.325 -0.487 0 CA-C-N 116.038 -0.528 . . . . 0.0 111.048 -177.295 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 91' ' ' TYR . . . . . 0.413 ' HD1' ' O ' ' A' ' 87' ' ' SER . 11.8 m-85 -66.54 -46.65 75.41 Favored 'General case' 0 C--N 1.324 -0.524 0 N-CA-C 111.719 0.266 . . . . 0.0 111.719 -177.926 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 92' ' ' CYS . . . . . 0.499 ' HA ' HD12 ' A' ' 96' ' ' LEU . 24.5 p -75.98 -25.68 56.04 Favored 'General case' 0 C--N 1.327 -0.391 0 N-CA-C 111.883 0.327 . . . . 0.0 111.883 -175.122 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 93' ' ' ARG . . . . . 0.409 ' HB2' ' O ' ' A' ' 89' ' ' LYS . 51.3 mtt85 -98.12 -31.87 11.89 Favored 'General case' 0 C--N 1.325 -0.494 0 N-CA-C 112.912 0.708 . . . . 0.0 112.912 -176.116 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 94' ' ' ASN . . . . . . . . . . . . . 16.7 m120 -95.31 -45.26 7.22 Favored 'General case' 0 C--N 1.325 -0.469 0 C-N-CA 120.581 -0.448 . . . . 0.0 111.608 -179.285 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 95' ' ' HIS . . . . . . . . . . . . . 80.3 m80 -84.96 -44.46 13.09 Favored 'General case' 0 C--N 1.327 -0.39 0 CA-C-O 120.881 0.372 . . . . 0.0 110.501 -177.611 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 96' ' ' LEU . . . . . 0.499 HD12 ' HA ' ' A' ' 92' ' ' CYS . 79.8 mt -91.72 26.8 2.24 Favored 'General case' 0 C--N 1.324 -0.534 0 CA-C-N 116.107 -0.497 . . . . 0.0 110.061 179.854 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 97' ' ' SER . . . . . 0.585 ' OG ' ' HD3' ' A' ' 98' ' ' PRO . 1.4 p -54.43 -48.04 95.97 Favored Pre-proline 0 CA--C 1.542 0.657 0 N-CA-C 113.276 0.843 . . . . 0.0 113.276 -176.841 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 98' ' ' PRO . . . . . 0.585 ' HD3' ' OG ' ' A' ' 97' ' ' SER . 13.1 Cg_exo -69.18 -13.96 37.07 Favored 'Trans proline' 0 C--N 1.356 0.934 0 C-N-CA 121.873 1.715 . . . . 0.0 112.233 -178.837 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 99' ' ' LEU . . . . . 0.482 HD12 HD22 ' A' ' 96' ' ' LEU . 61.2 mt -95.02 -30.84 13.89 Favored 'General case' 0 C--N 1.324 -0.516 0 CA-C-N 116.353 -0.385 . . . . 0.0 110.418 -178.519 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 100' ' ' TYR . . . . . 0.461 ' CD1' ' HA2' ' A' ' 65' ' ' GLY . 84.4 t80 -56.5 -32.77 65.35 Favored 'General case' 0 C--N 1.331 -0.203 0 CA-C-N 115.855 -0.612 . . . . 0.0 111.716 -176.458 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 101' ' ' MET . . . . . . . . . . . . . 25.6 ttt -98.92 1.19 45.41 Favored 'General case' 0 C--N 1.323 -0.575 0 CA-C-O 120.871 0.367 . . . . 0.0 111.406 -176.051 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 102' ' ' LYS . . . . . 0.477 ' HG3' ' O ' ' A' ' 98' ' ' PRO . 77.8 mttt -90.42 145.65 24.76 Favored 'General case' 0 C--N 1.322 -0.595 0 CA-C-O 121.482 0.658 . . . . 0.0 111.813 -178.561 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 103' ' ' SER . . . . . 0.426 ' O ' HG13 ' A' ' 107' ' ' ILE . 44.8 t -66.88 145.02 55.91 Favored 'General case' 0 C--N 1.323 -0.576 0 CA-C-N 115.236 -0.893 . . . . 0.0 109.183 173.0 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 104' ' ' LEU . . . . . . . . . . . . . 41.9 tp -56.85 -51.19 69.98 Favored 'General case' 0 C--N 1.328 -0.353 0 N-CA-C 112.536 0.569 . . . . 0.0 112.536 -170.043 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 105' ' ' SER . . . . . . . . . . . . . 4.8 m -74.29 -11.35 60.24 Favored 'General case' 0 C--N 1.327 -0.382 0 CA-C-O 121.001 0.429 . . . . 0.0 111.388 -175.966 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 106' ' ' GLU . . . . . . . . . . . . . 2.1 mp0 -96.84 5.64 50.17 Favored 'General case' 0 C--N 1.326 -0.416 0 CA-C-N 116.071 -0.513 . . . . 0.0 111.434 -174.688 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 107' ' ' ILE . . . . . 0.533 HD11 ' HB2' ' A' ' 64' ' ' PHE . 70.2 mt -89.57 137.6 21.02 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.455 0 CA-C-O 120.992 0.425 . . . . 0.0 111.0 -179.695 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 108' ' ' LEU . . . . . 0.44 ' N ' HD22 ' A' ' 108' ' ' LEU . 2.1 mm? -108.66 148.32 37.51 Favored Pre-proline 0 C--N 1.325 -0.482 0 CA-C-N 115.777 -0.647 . . . . 0.0 110.294 -179.863 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 109' ' ' PRO . . . . . . . . . . . . . 27.5 Cg_endo -63.59 -22.52 70.44 Favored 'Trans proline' 0 C--N 1.343 0.239 0 C-N-CA 122.182 1.921 . . . . 0.0 111.031 174.296 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 110' ' ' ALA . . . . . . . . . . . . . . . -63.76 -41.81 97.92 Favored 'General case' 0 N--CA 1.454 -0.255 0 CA-C-N 115.464 -0.789 . . . . 0.0 111.16 -179.641 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 111' ' ' ASP . . . . . 0.483 ' O ' HG13 ' A' ' 115' ' ' ILE . 20.2 m-20 -58.33 -44.43 88.68 Favored 'General case' 0 N--CA 1.465 0.288 0 CA-C-O 121.189 0.519 . . . . 0.0 110.897 178.837 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 112' ' ' ILE . . . . . 0.581 HG21 HH22 ' A' ' 130' ' ' ARG . 12.7 mt -72.09 -33.89 48.49 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.59 0 CA-C-N 115.863 -0.608 . . . . 0.0 110.652 -176.373 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 113' ' ' GLN . . . . . . . . . . . . . 25.1 tp60 -64.92 -40.55 95.23 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 115.996 -0.547 . . . . 0.0 110.626 -179.619 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 114' ' ' SER . . . . . . . . . . . . . 6.8 p -72.52 -36.13 68.26 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 116.46 -0.336 . . . . 0.0 110.935 179.616 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 115' ' ' ILE . . . . . 0.483 HG13 ' O ' ' A' ' 111' ' ' ASP . 77.5 mt -56.4 -46.78 82.1 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.158 0 CA-C-O 120.896 0.379 . . . . 0.0 110.292 175.729 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 116' ' ' ILE . . . . . . . . . . . . . 49.1 mm -67.22 -35.59 74.47 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.316 0 CA-C-N 116.094 -0.503 . . . . 0.0 110.686 178.661 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 117' ' ' ASN . . . . . . . . . . . . . 50.8 t30 -66.05 -40.93 91.34 Favored 'General case' 0 C--N 1.327 -0.398 0 CA-C-N 116.158 -0.473 . . . . 0.0 111.171 -179.735 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 118' ' ' GLU . . . . . . . . . . . . . 43.0 mt-10 -84.91 -19.3 32.47 Favored 'General case' 0 C--N 1.326 -0.444 0 CA-C-N 116.169 -0.468 . . . . 0.0 111.787 -176.605 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 119' ' ' THR . . . . . . . . . . . . . 69.6 m -84.04 112.94 20.65 Favored 'General case' 0 C--N 1.326 -0.444 0 CA-C-O 121.209 0.528 . . . . 0.0 109.763 175.042 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 120' ' ' LYS . . . . . 0.405 ' HB3' ' HE2' ' A' ' 120' ' ' LYS . 11.4 ptpt -110.34 86.29 2.28 Favored 'General case' 0 C--N 1.32 -0.696 0 CA-C-O 121.817 0.818 . . . . 0.0 110.887 -177.614 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 121' ' ' LEU . . . . . . . . . . . . . 96.0 mt -133.16 -175.04 3.66 Favored 'General case' 0 C--N 1.322 -0.622 0 CA-C-N 114.65 -1.159 . . . . 0.0 109.122 179.29 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 122' ' ' ALA . . . . . . . . . . . . . . . -58.52 145.58 38.55 Favored 'General case' 0 C--N 1.326 -0.419 0 O-C-N 123.123 0.264 . . . . 0.0 110.644 178.009 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 123' ' ' LYS . . . . . . . . . . . . . 21.4 ptmt -60.75 -33.93 73.67 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.662 -0.244 . . . . 0.0 111.537 -175.563 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 124' ' ' ASN . . . . . . . . . . . . . 1.9 p-10 -68.66 -27.15 65.74 Favored 'General case' 0 N--CA 1.463 0.208 0 CA-C-O 121.127 0.489 . . . . 0.0 110.036 178.925 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 125' ' ' THR . . . . . 0.402 ' O ' HG13 ' A' ' 129' ' ' ILE . 20.7 m -78.22 -34.63 49.19 Favored 'General case' 0 N--CA 1.452 -0.356 0 CA-C-N 115.932 -0.576 . . . . 0.0 109.828 178.877 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 126' ' ' LEU . . . . . . . . . . . . . 91.8 mt -67.42 -38.14 84.15 Favored 'General case' 0 C--N 1.327 -0.407 0 CA-C-N 115.809 -0.632 . . . . 0.0 109.879 175.723 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 127' ' ' LYS . . . . . 0.572 ' HG2' HG21 ' A' ' 156' ' ' ILE . 50.2 mtpt -70.4 -26.61 63.77 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.009 -0.541 . . . . 0.0 110.706 176.184 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 128' ' ' ALA . . . . . . . . . . . . . . . -67.09 -41.19 86.73 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-O 120.845 0.355 . . . . 0.0 110.132 174.97 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 129' ' ' ILE . . . . . 0.402 HG13 ' O ' ' A' ' 125' ' ' THR . 62.6 mt -65.29 -43.33 95.15 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.289 0 CA-C-N 116.017 -0.538 . . . . 0.0 109.791 175.628 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 130' ' ' ARG . . . . . 0.672 ' HA ' ' CZ ' ' A' ' 130' ' ' ARG . 0.5 OUTLIER -58.39 -49.92 75.53 Favored 'General case' 0 C--N 1.331 -0.229 0 CA-C-N 115.562 -0.745 . . . . 0.0 110.435 176.721 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' A' A ' 131' ' ' ASN . . . . . . . . . . . . . 5.4 t30 -55.96 -55.86 27.6 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 115.677 -0.692 . . . . 0.0 111.233 178.041 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 132' ' ' THR . . . . . 0.498 ' O ' HG13 ' A' ' 136' ' ' ILE . 37.3 m -56.12 -53.56 55.62 Favored 'General case' 0 C--N 1.327 -0.373 0 CA-C-N 116.055 -0.52 . . . . 0.0 111.488 -175.16 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 133' ' ' ALA . . . . . . . . . . . . . . . -63.2 -37.57 87.74 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.52 -0.309 . . . . 0.0 111.133 -177.858 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 134' ' ' SER . . . . . 0.469 ' O ' ' HG3' ' A' ' 138' ' ' ARG . 8.3 t -66.26 -44.3 84.02 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.433 -0.349 . . . . 0.0 110.512 -177.486 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 135' ' ' GLN . . . . . . . . . . . . . 44.5 mt-30 -62.93 -33.53 75.53 Favored 'General case' 0 C--O 1.233 0.199 0 CA-C-O 120.669 0.271 . . . . 0.0 110.914 -179.078 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 136' ' ' ILE . . . . . 0.498 HG13 ' O ' ' A' ' 132' ' ' THR . 66.3 mt -63.61 -48.44 86.75 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.218 0 CA-C-N 116.347 -0.388 . . . . 0.0 110.696 176.95 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 137' ' ' PHE . . . . . 0.419 ' O ' HG13 ' A' ' 141' ' ' ILE . 56.4 m-85 -66.25 -37.53 85.71 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-N 116.635 -0.257 . . . . 0.0 110.879 178.579 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 138' ' ' ARG . . . . . 0.469 ' HG3' ' O ' ' A' ' 134' ' ' SER . 41.4 mtp-105 -60.03 -40.3 88.85 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-N 116.449 -0.342 . . . . 0.0 110.454 176.871 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 139' ' ' LEU . . . . . . . . . . . . . 62.1 tp -62.73 -38.56 90.97 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 115.947 -0.569 . . . . 0.0 110.225 177.35 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 140' ' ' ALA . . . . . . . . . . . . . . . -63.94 -41.55 97.58 Favored 'General case' 0 C--N 1.326 -0.427 0 CA-C-N 115.942 -0.572 . . . . 0.0 110.522 176.408 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 141' ' ' ILE . . . . . 0.419 HG13 ' O ' ' A' ' 137' ' ' PHE . 58.9 mt -63.62 -39.04 83.88 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.267 0 CA-C-N 116.565 -0.289 . . . . 0.0 111.021 174.76 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 142' ' ' GLU . . . . . 0.449 ' HG3' ' O ' ' A' ' 138' ' ' ARG . 48.8 mt-10 -60.87 -39.29 88.65 Favored 'General case' 0 N--CA 1.462 0.157 0 CA-C-O 120.858 0.361 . . . . 0.0 110.626 177.169 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 143' ' ' ASN . . . . . . . . . . . . . 4.3 m-20 -84.87 0.94 49.25 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.204 -0.453 . . . . 0.0 110.189 177.074 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 144' ' ' ARG . . . . . . . . . . . . . 99.5 mtt180 55.15 44.7 27.41 Favored 'General case' 0 C--O 1.232 0.139 0 CA-C-N 115.341 -0.845 . . . . 0.0 111.713 179.222 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 145' ' ' ALA . . . . . . . . . . . . . . . -88.21 -55.59 3.68 Favored 'General case' 0 C--N 1.327 -0.4 0 CA-C-N 115.44 -0.8 . . . . 0.0 109.632 173.897 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 146' ' ' ILE . . . . . 0.446 HG12 ' H ' ' A' ' 148' ' ' PHE . 18.3 tt -104.85 147.49 10.68 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.44 0 N-CA-C 109.359 -0.608 . . . . 0.0 109.359 175.966 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 147' ' ' ASP . . . . . . . . . . . . . 27.2 t70 -87.7 -6.3 58.28 Favored 'General case' 0 C--N 1.324 -0.52 0 CA-C-N 116.4 -0.364 . . . . 0.0 111.891 -172.593 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 148' ' ' PHE . . . . . 0.446 ' H ' HG12 ' A' ' 146' ' ' ILE . 33.0 p90 -155.33 168.7 26.23 Favored 'General case' 0 C--N 1.325 -0.458 0 CA-C-O 120.885 0.374 . . . . 0.0 111.023 -174.003 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 149' ' ' ASN . . . . . . . . . . . . . 29.6 t30 -115.15 102.16 54.63 Favored Pre-proline 0 C--N 1.324 -0.527 0 CA-C-N 115.857 -0.611 . . . . 0.0 110.163 178.303 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 150' ' ' PRO . . . . . . . . . . . . . 40.7 Cg_endo -68.04 -17.96 46.0 Favored 'Trans proline' 0 C--N 1.343 0.254 0 C-N-CA 122.787 2.324 . . . . 0.0 112.48 -178.367 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 151' ' ' ALA . . . . . 0.462 ' HB1' HH21 ' A' ' 130' ' ' ARG . . . -71.54 -20.35 62.04 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 116.269 -0.423 . . . . 0.0 110.942 -179.453 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 152' ' ' ASP . . . . . . . . . . . . . 36.7 t70 -72.92 -15.39 61.58 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 115.821 -0.627 . . . . 0.0 110.822 -178.301 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 153' ' ' TYR . . . . . . . . . . . . . 88.4 m-85 -92.21 2.51 56.56 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.061 -0.518 . . . . 0.0 111.255 -177.922 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 154' ' ' VAL . . . . . . . . . . . . . 81.1 t -90.99 121.86 41.8 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.449 0 CA-C-O 120.752 0.31 . . . . 0.0 111.107 -177.505 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 155' ' ' ARG . . . . . . . . . . . . . 12.4 ttm180 -80.97 134.12 35.64 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 116.155 -0.475 . . . . 0.0 110.03 177.865 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 156' ' ' ILE . . . . . 0.572 HG21 ' HG2' ' A' ' 127' ' ' LYS . 46.1 mm -105.95 130.26 23.28 Favored Pre-proline 0 C--N 1.325 -0.484 0 CA-C-N 116.174 -0.466 . . . . 0.0 109.765 176.613 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 157' ' ' PRO . . . . . . . . . . . . . 18.4 Cg_endo . . . . . 0 C--N 1.344 0.335 0 C-N-CA 122.343 2.029 . . . . 0.0 111.912 179.323 . . . . . . . . 0 0 . 1 . 011 nuclear build core ' A' A ' 63' ' ' SER . . . . . 0.511 ' HA ' ' HA ' ' A' ' 103' ' ' SER . 97.7 p . . . . . 0 N--CA 1.452 -0.333 0 N-CA-C 109.556 -0.535 . . . . 0.0 109.556 . . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 64' ' ' PHE . . . . . . . . . . . . . 82.4 t80 -62.02 -28.74 69.79 Favored 'General case' 0 C--N 1.324 -0.542 0 CA-C-O 120.994 0.426 . . . . 0.0 109.987 178.021 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 65' ' ' GLY . . . . . . . . . . . . . . . -63.8 -37.57 94.87 Favored Glycine 0 N--CA 1.449 -0.497 0 CA-C-N 115.941 -0.572 . . . . 0.0 112.144 176.711 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 66' ' ' ASP . . . . . . . . . . . . . 56.1 m-20 -65.31 -43.77 90.02 Favored 'General case' 0 C--O 1.234 0.243 0 CA-C-O 120.958 0.408 . . . . 0.0 109.957 178.308 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 67' ' ' TRP . . . . . . . . . . . . . 99.4 m95 -69.6 -36.74 76.5 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 115.787 -0.642 . . . . 0.0 111.059 178.371 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 68' ' ' ALA . . . . . 0.469 ' O ' ' HG ' ' A' ' 72' ' ' LEU . . . -59.13 -43.4 92.0 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-O 120.868 0.366 . . . . 0.0 110.544 176.998 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 69' ' ' GLU . . . . . 0.466 ' O ' ' HG2' ' A' ' 73' ' ' LYS . 36.6 tt0 -62.4 -44.77 95.66 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.229 -0.442 . . . . 0.0 110.166 175.506 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 70' ' ' LYS . . . . . 0.455 ' HG2' HD21 ' A' ' 139' ' ' LEU . 64.2 tttp -59.42 -39.99 85.27 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 115.886 -0.597 . . . . 0.0 110.66 -179.963 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 71' ' ' PHE . . . . . . . . . . . . . 68.7 t80 -63.62 -44.42 93.98 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.207 -0.451 . . . . 0.0 110.142 176.619 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 72' ' ' LEU . . . . . 0.469 ' HG ' ' O ' ' A' ' 68' ' ' ALA . 82.8 mt -64.62 -36.65 84.92 Favored 'General case' 0 C--N 1.325 -0.486 0 CA-C-N 116.177 -0.465 . . . . 0.0 110.982 -179.913 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 73' ' ' LYS . . . . . 0.466 ' HG2' ' O ' ' A' ' 69' ' ' GLU . 33.3 mmtp -70.6 -40.84 72.97 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-O 120.681 0.277 . . . . 0.0 111.268 -179.912 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 74' ' ' SER . . . . . . . . . . . . . 8.1 p -71.97 -34.56 69.05 Favored 'General case' 0 C--N 1.324 -0.535 0 CA-C-O 120.829 0.347 . . . . 0.0 110.513 179.169 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 75' ' ' LYS . . . . . 0.52 ' HE3' HG11 ' A' ' 80' ' ' VAL . 46.1 tptt -74.02 -30.24 62.34 Favored 'General case' 0 N--CA 1.444 -0.752 0 CA-C-O 120.928 0.394 . . . . 0.0 110.065 177.087 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 76' ' ' GLU . . . . . . . . . . . . . 33.9 tt0 -59.48 -50.24 74.69 Favored 'General case' 0 C--N 1.327 -0.403 0 CA-C-O 121.183 0.516 . . . . 0.0 109.628 171.291 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 77' ' ' ALA . . . . . . . . . . . . . . . -72.69 -10.96 60.41 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-N 115.332 -0.849 . . . . 0.0 111.06 179.131 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 78' ' ' ASP . . . . . 0.504 ' HB3' ' O ' ' A' ' 75' ' ' LYS . 27.9 t70 -73.54 -15.83 61.29 Favored 'General case' 0 C--N 1.326 -0.439 0 CA-C-N 115.844 -0.616 . . . . 0.0 109.983 175.649 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 79' ' ' GLY . . . . . . . . . . . . . . . 91.87 60.42 1.27 Allowed Glycine 0 N--CA 1.446 -0.655 0 CA-C-N 115.762 -0.654 . . . . 0.0 112.06 177.354 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 80' ' ' VAL . . . . . 0.52 HG11 ' HE3' ' A' ' 75' ' ' LYS . 34.9 m -115.79 152.42 17.47 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.433 0 CA-C-O 120.87 0.367 . . . . 0.0 110.74 178.76 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 81' ' ' SER . . . . . . . . . . . . . 31.2 t -64.45 153.01 40.09 Favored 'General case' 0 C--N 1.322 -0.627 0 CA-C-N 115.732 -0.667 . . . . 0.0 109.829 175.668 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 82' ' ' VAL . . . . . . . . . . . . . 59.2 t -62.56 -43.53 98.51 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.336 0 CA-C-O 120.874 0.369 . . . . 0.0 110.575 -179.203 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 83' ' ' SER . . . . . . . . . . . . . 18.0 t -64.48 -30.71 71.74 Favored 'General case' 0 C--N 1.326 -0.428 0 CA-C-N 116.135 -0.484 . . . . 0.0 110.421 177.509 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 84' ' ' GLN . . . . . . . . . . . . . 47.9 tp60 -71.86 -38.79 70.01 Favored 'General case' 0 C--N 1.332 -0.187 0 CA-C-N 116.076 -0.511 . . . . 0.0 109.738 176.961 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 85' ' ' LEU . . . . . 0.405 ' HA ' ' HD2' ' A' ' 88' ' ' TYR . 40.1 tp -66.56 -38.76 87.77 Favored 'General case' 0 C--N 1.327 -0.389 0 CA-C-N 115.878 -0.601 . . . . 0.0 110.217 176.226 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 86' ' ' ASN . . . . . . . . . . . . . 86.0 m-20 -64.47 -26.87 68.63 Favored 'General case' 0 C--O 1.233 0.201 0 CA-C-N 116.129 -0.487 . . . . 0.0 110.716 176.382 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 87' ' ' SER . . . . . . . . . . . . . 13.0 t -65.71 -48.54 71.65 Favored 'General case' 0 C--N 1.324 -0.501 0 N-CA-C 109.711 -0.477 . . . . 0.0 109.711 175.771 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 88' ' ' TYR . . . . . 0.405 ' HD2' ' HA ' ' A' ' 85' ' ' LEU . 77.7 m-85 -62.45 -35.5 79.49 Favored 'General case' 0 N--CA 1.464 0.25 0 CA-C-O 121.084 0.468 . . . . 0.0 110.38 175.638 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 89' ' ' LYS . . . . . . . . . . . . . 39.1 ttmt -61.2 -37.17 82.01 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-N 115.709 -0.678 . . . . 0.0 110.154 178.809 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 90' ' ' ASN . . . . . 0.484 ' O ' ' HB3' ' A' ' 94' ' ' ASN . 26.6 t-20 -65.49 -39.2 91.63 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 115.79 -0.641 . . . . 0.0 110.414 177.66 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 91' ' ' TYR . . . . . . . . . . . . . 56.5 m-85 -63.91 -59.75 4.13 Favored 'General case' 0 C--N 1.327 -0.409 0 CA-C-N 116.363 -0.38 . . . . 0.0 110.879 176.96 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 92' ' ' CYS . . . . . 0.508 ' HA ' HD12 ' A' ' 96' ' ' LEU . 58.3 m -63.55 -46.71 84.71 Favored 'General case' 0 C--N 1.326 -0.456 0 N-CA-C 112.594 0.59 . . . . 0.0 112.594 -173.485 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 93' ' ' ARG . . . . . . . . . . . . . 40.8 ttm180 -86.13 -39.98 16.15 Favored 'General case' 0 C--N 1.327 -0.405 0 N-CA-C 112.355 0.502 . . . . 0.0 112.355 -172.71 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 94' ' ' ASN . . . . . 0.484 ' HB3' ' O ' ' A' ' 90' ' ' ASN . 49.8 t30 -92.78 -52.81 4.44 Favored 'General case' 0 C--N 1.328 -0.368 0 C-N-CA 120.726 -0.39 . . . . 0.0 111.842 -173.876 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 95' ' ' HIS . . . . . . . . . . . . . 8.8 m80 -77.71 -36.17 51.27 Favored 'General case' 0 C--N 1.326 -0.427 0 C-N-CA 120.789 -0.364 . . . . 0.0 111.57 -176.204 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 96' ' ' LEU . . . . . 0.508 HD12 ' HA ' ' A' ' 92' ' ' CYS . 84.3 mt -98.16 27.05 4.83 Favored 'General case' 0 C--N 1.321 -0.65 0 CA-C-N 116.441 -0.345 . . . . 0.0 110.37 178.678 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 97' ' ' SER . . . . . 0.512 ' N ' ' HD2' ' A' ' 98' ' ' PRO . 1.8 p -53.01 -46.72 97.47 Favored Pre-proline 0 CA--C 1.543 0.686 0 N-CA-C 113.444 0.905 . . . . 0.0 113.444 -175.884 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 98' ' ' PRO . . . . . 0.512 ' HD2' ' N ' ' A' ' 97' ' ' SER . 18.3 Cg_endo -60.43 -34.24 93.32 Favored 'Trans proline' 0 C--N 1.359 1.091 0 C-N-CA 121.771 1.647 . . . . 0.0 112.106 178.301 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 99' ' ' LEU . . . . . 0.539 HD22 HG23 ' A' ' 107' ' ' ILE . 41.1 mt -83.81 -28.78 27.85 Favored 'General case' 0 C--N 1.325 -0.475 0 CA-C-O 121.071 0.462 . . . . 0.0 110.366 -177.668 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 100' ' ' TYR . . . . . . . . . . . . . 44.1 t80 -59.38 -25.79 64.55 Favored 'General case' 0 C--N 1.325 -0.497 0 CA-C-N 115.218 -0.901 . . . . 0.0 111.603 -176.802 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 101' ' ' MET . . . . . . . . . . . . . 22.5 ptp -104.17 5.18 34.76 Favored 'General case' 0 C--N 1.327 -0.385 0 CA-C-N 116.347 -0.388 . . . . 0.0 111.24 -178.867 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 102' ' ' LYS . . . . . 0.539 ' HB3' ' HB3' ' A' ' 106' ' ' GLU . 64.0 mttm -105.43 166.96 10.06 Favored 'General case' 0 C--N 1.324 -0.501 0 CA-C-N 116.55 -0.295 . . . . 0.0 110.521 -179.561 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 103' ' ' SER . . . . . 0.511 ' HA ' ' HA ' ' A' ' 63' ' ' SER . 50.9 p -94.97 170.8 9.17 Favored 'General case' 0 C--N 1.32 -0.688 0 N-CA-C 109.613 -0.514 . . . . 0.0 109.613 173.806 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 104' ' ' LEU . . . . . . . . . . . . . 96.5 mt -58.69 -31.04 67.86 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-O 120.747 0.308 . . . . 0.0 111.028 179.222 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 105' ' ' SER . . . . . . . . . . . . . 14.0 m -86.91 -20.99 26.57 Favored 'General case' 0 C--N 1.327 -0.391 0 CA-C-N 116.344 -0.389 . . . . 0.0 111.112 -179.109 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 106' ' ' GLU . . . . . 0.539 ' HB3' ' HB3' ' A' ' 102' ' ' LYS . 0.6 OUTLIER -83.04 -25.23 32.31 Favored 'General case' 0 C--N 1.326 -0.433 0 CA-C-O 121.219 0.533 . . . . 0.0 110.443 -176.901 . . . . . . . . 3 3 . 1 . 011 nuclear build core ' A' A ' 107' ' ' ILE . . . . . 0.539 HG23 HD22 ' A' ' 99' ' ' LEU . 78.9 mt -70.84 127.11 32.36 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.571 0 CA-C-N 115.929 -0.578 . . . . 0.0 111.329 -179.004 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 108' ' ' LEU . . . . . 0.422 ' HA ' ' HD3' ' A' ' 109' ' ' PRO . 93.5 mt -100.44 137.89 20.05 Favored Pre-proline 0 C--N 1.326 -0.452 0 CA-C-N 115.691 -0.686 . . . . 0.0 110.457 176.669 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 109' ' ' PRO . . . . . 0.422 ' HD3' ' HA ' ' A' ' 108' ' ' LEU . 44.2 Cg_exo -56.62 -44.04 49.32 Favored 'Trans proline' 0 CA--C 1.53 0.315 0 C-N-CA 122.709 2.273 . . . . 0.0 112.528 178.97 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 110' ' ' ALA . . . . . . . . . . . . . . . -65.78 -27.99 68.69 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-O 120.818 0.342 . . . . 0.0 111.469 -178.502 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 111' ' ' ASP . . . . . 0.539 ' O ' HG13 ' A' ' 115' ' ' ILE . 10.3 t70 -68.68 -39.82 80.37 Favored 'General case' 0 C--N 1.325 -0.486 0 CA-C-O 121.383 0.611 . . . . 0.0 109.703 179.996 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 112' ' ' ILE . . . . . 0.521 ' HB ' HG21 ' A' ' 154' ' ' VAL . 40.5 mt -67.62 -38.25 80.14 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.39 0 CA-C-N 115.583 -0.735 . . . . 0.0 109.829 175.178 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 113' ' ' GLN . . . . . 0.434 ' HA ' HG13 ' A' ' 154' ' ' VAL . 25.2 tp60 -62.88 -41.23 99.33 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-N 115.466 -0.788 . . . . 0.0 110.794 -179.012 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 114' ' ' SER . . . . . 0.415 ' HA ' ' HB3' ' A' ' 117' ' ' ASN . 41.3 p -70.1 -30.66 67.93 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.761 -0.2 . . . . 0.0 111.024 -179.516 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 115' ' ' ILE . . . . . 0.539 HG13 ' O ' ' A' ' 111' ' ' ASP . 83.6 mt -56.55 -55.32 20.03 Favored 'Isoleucine or valine' 0 N--CA 1.463 0.193 0 CA-C-O 120.951 0.405 . . . . 0.0 110.045 174.442 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 116' ' ' ILE . . . . . 0.422 HG23 ' HB3' ' A' ' 126' ' ' LEU . 45.2 mm -64.71 -30.04 49.12 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.378 0 CA-C-N 115.815 -0.63 . . . . 0.0 110.432 179.569 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 117' ' ' ASN . . . . . 0.415 ' HB3' ' HA ' ' A' ' 114' ' ' SER . 8.1 t30 -66.37 -43.25 86.49 Favored 'General case' 0 C--N 1.324 -0.505 0 CA-C-N 115.564 -0.744 . . . . 0.0 111.524 -178.587 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 118' ' ' GLU . . . . . . . . . . . . . 39.3 mt-10 -91.61 -30.46 16.35 Favored 'General case' 0 C--N 1.327 -0.39 0 N-CA-C 112.41 0.522 . . . . 0.0 112.41 -175.897 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 119' ' ' THR . . . . . . . . . . . . . 63.4 m -64.99 111.9 3.07 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-O 120.96 0.409 . . . . 0.0 110.356 -178.68 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 120' ' ' LYS . . . . . . . . . . . . . 91.2 mttt -92.93 79.58 4.63 Favored 'General case' 0 C--N 1.326 -0.42 0 CA-C-O 121.309 0.576 . . . . 0.0 110.734 -176.896 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 121' ' ' LEU . . . . . . . . . . . . . 76.5 mt -126.97 -175.66 3.48 Favored 'General case' 0 C--N 1.321 -0.658 0 CA-C-N 115.5 -0.773 . . . . 0.0 109.612 177.559 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 122' ' ' ALA . . . . . . . . . . . . . . . -65.53 152.28 44.42 Favored 'General case' 0 C--N 1.325 -0.495 0 CA-C-N 116.497 -0.319 . . . . 0.0 110.328 178.812 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 123' ' ' LYS . . . . . . . . . . . . . 0.4 OUTLIER -63.56 -35.66 81.22 Favored 'General case' 0 C--N 1.325 -0.491 0 CA-C-N 116.273 -0.421 . . . . 0.0 110.238 -176.043 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 124' ' ' ASN . . . . . 0.783 ' HA ' ' HE3' ' A' ' 127' ' ' LYS . 11.6 t30 -69.61 -35.69 75.5 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 116.176 -0.465 . . . . 0.0 110.246 177.979 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 125' ' ' THR . . . . . 0.545 ' O ' HG13 ' A' ' 129' ' ' ILE . 8.6 m -65.43 -44.25 87.92 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.226 -0.443 . . . . 0.0 110.274 177.015 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 126' ' ' LEU . . . . . 0.422 ' HB3' HG23 ' A' ' 116' ' ' ILE . 98.6 mt -61.55 -43.27 99.16 Favored 'General case' 0 C--N 1.33 -0.246 0 CA-C-N 115.911 -0.586 . . . . 0.0 110.57 178.665 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 127' ' ' LYS . . . . . 0.783 ' HE3' ' HA ' ' A' ' 124' ' ' ASN . 44.9 mtmt -60.87 -40.06 91.53 Favored 'General case' 0 C--N 1.331 -0.219 0 CA-C-N 116.118 -0.492 . . . . 0.0 110.519 175.824 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 128' ' ' ALA . . . . . . . . . . . . . . . -64.47 -34.38 78.06 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 116.086 -0.506 . . . . 0.0 110.995 179.48 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 129' ' ' ILE . . . . . 0.545 HG13 ' O ' ' A' ' 125' ' ' THR . 71.3 mt -63.26 -53.42 46.04 Favored 'Isoleucine or valine' 0 C--O 1.234 0.244 0 CA-C-N 116.565 -0.289 . . . . 0.0 110.347 177.196 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 130' ' ' ARG . . . . . . . . . . . . . 40.4 ttp180 -62.85 -40.69 98.23 Favored 'General case' 0 CA--C 1.521 -0.154 0 CA-C-O 120.793 0.33 . . . . 0.0 110.126 178.455 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 131' ' ' ASN . . . . . 0.632 ' O ' ' HG2' ' A' ' 135' ' ' GLN . 7.5 t30 -54.98 -55.91 25.55 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-N 115.777 -0.647 . . . . 0.0 110.832 178.538 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 132' ' ' THR . . . . . 0.465 ' O ' HG13 ' A' ' 136' ' ' ILE . 32.0 m -57.04 -45.6 83.04 Favored 'General case' 0 C--N 1.326 -0.433 0 CA-C-N 116.295 -0.412 . . . . 0.0 110.79 -178.705 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 133' ' ' ALA . . . . . . . . . . . . . . . -63.34 -48.67 77.03 Favored 'General case' 0 C--N 1.332 -0.193 0 CA-C-N 116.325 -0.398 . . . . 0.0 111.56 179.796 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 134' ' ' SER . . . . . 0.585 ' O ' ' HG3' ' A' ' 138' ' ' ARG . 26.9 p -66.53 -32.0 73.08 Favored 'General case' 0 C--N 1.327 -0.39 0 CA-C-N 116.633 -0.258 . . . . 0.0 111.27 -177.108 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 135' ' ' GLN . . . . . 0.632 ' HG2' ' O ' ' A' ' 131' ' ' ASN . 11.0 mm100 -65.53 -38.24 89.08 Favored 'General case' 0 C--N 1.331 -0.205 0 C-N-CA 120.967 -0.293 . . . . 0.0 110.36 176.777 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 136' ' ' ILE . . . . . 0.465 HG13 ' O ' ' A' ' 132' ' ' THR . 76.3 mt -64.0 -39.9 87.11 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.262 0 CA-C-N 116.285 -0.416 . . . . 0.0 109.986 176.699 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 137' ' ' PHE . . . . . 0.523 ' O ' HG13 ' A' ' 141' ' ' ILE . 44.2 m-85 -62.86 -42.89 99.92 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.183 -0.462 . . . . 0.0 110.638 175.435 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 138' ' ' ARG . . . . . 0.585 ' HG3' ' O ' ' A' ' 134' ' ' SER . 42.4 mtt180 -60.84 -38.56 85.91 Favored 'General case' 0 N--CA 1.465 0.283 0 CA-C-O 120.804 0.335 . . . . 0.0 110.537 178.559 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 139' ' ' LEU . . . . . 0.455 HD21 ' HG2' ' A' ' 70' ' ' LYS . 65.5 tp -56.45 -38.65 71.92 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 115.821 -0.627 . . . . 0.0 110.519 177.071 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 140' ' ' ALA . . . . . . . . . . . . . . . -74.87 -33.27 62.07 Favored 'General case' 0 C--N 1.325 -0.47 0 CA-C-N 115.872 -0.604 . . . . 0.0 110.706 177.43 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 141' ' ' ILE . . . . . 0.65 ' HA ' ' O ' ' A' ' 146' ' ' ILE . 73.6 mt -64.35 -43.59 97.12 Favored 'Isoleucine or valine' 0 C--O 1.233 0.228 0 CA-C-N 116.08 -0.509 . . . . 0.0 111.01 177.983 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 142' ' ' GLU . . . . . 0.48 ' HG3' ' O ' ' A' ' 138' ' ' ARG . 48.4 mt-10 -60.69 -39.33 88.08 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.113 -0.494 . . . . 0.0 110.657 178.976 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 143' ' ' ASN . . . . . . . . . . . . . 43.7 m-80 -83.97 3.09 35.77 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 115.782 -0.645 . . . . 0.0 110.622 179.555 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 144' ' ' ARG . . . . . . . . . . . . . 99.5 mtt180 60.87 28.66 18.42 Favored 'General case' 0 C--O 1.234 0.267 0 CA-C-N 115.423 -0.808 . . . . 0.0 111.762 174.014 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 145' ' ' ALA . . . . . . . . . . . . . . . -78.25 -37.77 44.43 Favored 'General case' 0 C--N 1.326 -0.428 0 CA-C-N 115.672 -0.694 . . . . 0.0 109.224 174.276 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 146' ' ' ILE . . . . . 0.65 ' O ' ' HA ' ' A' ' 141' ' ' ILE . 13.8 tt -144.73 140.26 23.47 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.626 0 CA-C-N 115.011 -0.995 . . . . 0.0 108.847 175.961 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 147' ' ' ASP . . . . . . . . . . . . . 31.6 t70 -117.1 46.12 1.74 Allowed 'General case' 0 C--N 1.318 -0.791 0 N-CA-C 108.75 -0.833 . . . . 0.0 108.75 178.53 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 148' ' ' PHE . . . . . . . . . . . . . 70.5 t80 -151.42 123.9 8.39 Favored 'General case' 0 C--N 1.322 -0.603 0 CA-C-N 114.851 -1.068 . . . . 0.0 109.321 -177.105 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 149' ' ' ASN . . . . . . . . . . . . . 49.0 t-20 -110.74 98.12 36.26 Favored Pre-proline 0 C--N 1.321 -0.634 0 N-CA-C 110.119 -0.326 . . . . 0.0 110.119 -179.354 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 150' ' ' PRO . . . . . . . . . . . . . 26.6 Cg_exo -62.37 -33.2 80.64 Favored 'Trans proline' 0 C--O 1.232 0.181 0 C-N-CA 122.689 2.259 . . . . 0.0 111.98 -179.335 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 151' ' ' ALA . . . . . . . . . . . . . . . -73.46 -18.11 61.16 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 115.988 -0.551 . . . . 0.0 111.386 -176.51 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 152' ' ' ASP . . . . . . . . . . . . . 34.6 t70 -72.49 -24.3 61.15 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-O 121.288 0.566 . . . . 0.0 110.234 179.216 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 153' ' ' TYR . . . . . . . . . . . . . 62.5 m-85 -89.91 -4.41 57.54 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-N 115.954 -0.567 . . . . 0.0 110.138 179.916 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 154' ' ' VAL . . . . . 0.521 HG21 ' HB ' ' A' ' 112' ' ' ILE . 60.3 t -89.67 139.11 18.01 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.544 0 CA-C-N 115.531 -0.759 . . . . 0.0 109.495 176.437 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 155' ' ' ARG . . . . . . . . . . . . . 15.9 ptt180 -124.58 155.55 38.9 Favored 'General case' 0 C--N 1.321 -0.648 0 C-N-CA 120.554 -0.458 . . . . 0.0 110.963 179.855 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 156' ' ' ILE . . . . . 0.424 ' HA ' ' HD3' ' A' ' 157' ' ' PRO . 2.4 mp -96.43 116.29 66.07 Favored Pre-proline 0 C--N 1.324 -0.51 0 CA-C-N 115.843 -0.617 . . . . 0.0 109.986 179.734 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 157' ' ' PRO . . . . . 0.424 ' HD3' ' HA ' ' A' ' 156' ' ' ILE . 14.2 Cg_exo . . . . . 0 N--CA 1.456 -0.685 0 C-N-CA 122.591 2.194 . . . . 0.0 111.181 177.191 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 63' ' ' SER . . . . . 0.596 ' HB2' ' HB2' ' A' ' 66' ' ' ASP . 5.5 m . . . . . 0 N--CA 1.454 -0.24 0 N-CA-C 109.784 -0.451 . . . . 0.0 109.784 . . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 64' ' ' PHE . . . . . 0.491 ' HB2' HD11 ' A' ' 107' ' ' ILE . 80.0 t80 -64.23 -50.37 68.28 Favored 'General case' 0 C--N 1.328 -0.365 0 N-CA-C 109.989 -0.374 . . . . 0.0 109.989 178.588 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 65' ' ' GLY . . . . . . . . . . . . . . . -62.87 -27.67 70.58 Favored Glycine 0 C--N 1.33 0.247 0 C-N-CA 120.816 -0.707 . . . . 0.0 112.193 177.378 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 66' ' ' ASP . . . . . 0.596 ' HB2' ' HB2' ' A' ' 63' ' ' SER . 8.1 t70 -62.68 -53.28 56.88 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-O 121.107 0.479 . . . . 0.0 110.34 177.692 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 67' ' ' TRP . . . . . . . . . . . . . 90.8 m95 -75.22 -27.26 59.47 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 115.788 -0.642 . . . . 0.0 111.256 -179.922 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 68' ' ' ALA . . . . . 0.557 ' O ' ' HG ' ' A' ' 72' ' ' LEU . . . -60.34 -48.54 81.33 Favored 'General case' 0 C--N 1.326 -0.419 0 N-CA-C 110.025 -0.361 . . . . 0.0 110.025 174.995 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 69' ' ' GLU . . . . . . . . . . . . . 17.8 tp10 -56.68 -44.06 81.07 Favored 'General case' 0 C--O 1.233 0.236 0 CA-C-N 115.885 -0.598 . . . . 0.0 110.527 175.358 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 70' ' ' LYS . . . . . . . . . . . . . 59.2 mttp -61.27 -45.1 95.91 Favored 'General case' 0 C--N 1.326 -0.416 0 CA-C-N 116.07 -0.514 . . . . 0.0 110.832 177.597 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 71' ' ' PHE . . . . . . . . . . . . . 69.8 t80 -66.04 -42.79 89.12 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.352 -0.385 . . . . 0.0 111.058 -178.974 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 72' ' ' LEU . . . . . 0.557 ' HG ' ' O ' ' A' ' 68' ' ' ALA . 88.6 mt -63.74 -49.94 71.05 Favored 'General case' 0 C--N 1.326 -0.417 0 CA-C-O 120.857 0.361 . . . . 0.0 110.667 179.805 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 73' ' ' LYS . . . . . . . . . . . . . 5.7 ttpm? -69.32 -32.32 71.36 Favored 'General case' 0 C--N 1.323 -0.548 0 CA-C-N 116.173 -0.467 . . . . 0.0 111.406 -175.653 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 74' ' ' SER . . . . . . . . . . . . . 37.9 p -71.04 -32.25 68.94 Favored 'General case' 0 C--N 1.328 -0.327 0 C-N-CA 120.628 -0.429 . . . . 0.0 110.216 175.955 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 75' ' ' LYS . . . . . 0.402 ' O ' HG22 ' A' ' 80' ' ' VAL . 39.5 mmtt -70.59 -35.92 73.27 Favored 'General case' 0 C--O 1.233 0.203 0 CA-C-O 120.801 0.334 . . . . 0.0 110.687 174.082 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 76' ' ' GLU . . . . . . . . . . . . . 33.9 tt0 -56.22 -44.8 79.9 Favored 'General case' 0 C--N 1.327 -0.403 0 CA-C-N 116.011 -0.54 . . . . 0.0 110.175 176.083 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 77' ' ' ALA . . . . . . . . . . . . . . . -80.96 -24.1 38.32 Favored 'General case' 0 C--N 1.326 -0.423 0 CA-C-N 115.818 -0.628 . . . . 0.0 111.276 177.417 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 78' ' ' ASP . . . . . . . . . . . . . 15.6 t70 -57.35 -54.6 45.03 Favored 'General case' 0 N--CA 1.466 0.343 0 CA-C-N 116.108 -0.496 . . . . 0.0 110.735 179.192 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 79' ' ' GLY . . . . . . . . . . . . . . . 146.52 56.37 0.02 OUTLIER Glycine 0 N--CA 1.443 -0.884 0 C-N-CA 120.335 -0.936 . . . . 0.0 112.656 178.2 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 80' ' ' VAL . . . . . 0.619 ' HB ' ' HB2' ' A' ' 84' ' ' GLN . 32.9 m -121.2 148.88 24.27 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.642 0 CA-C-O 120.763 0.316 . . . . 0.0 110.223 176.67 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 81' ' ' SER . . . . . . . . . . . . . 13.1 p -81.94 172.78 12.88 Favored 'General case' 0 C--N 1.319 -0.733 0 CA-C-N 116.146 -0.479 . . . . 0.0 110.076 176.789 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 82' ' ' VAL . . . . . . . . . . . . . 7.9 p -58.7 -40.08 78.38 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.47 0 CA-C-N 116.49 -0.323 . . . . 0.0 111.463 -176.178 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 83' ' ' SER . . . . . . . . . . . . . 13.7 t -62.86 -33.43 75.25 Favored 'General case' 0 C--N 1.331 -0.206 0 CA-C-O 120.623 0.249 . . . . 0.0 110.734 -178.631 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 84' ' ' GLN . . . . . 0.619 ' HB2' ' HB ' ' A' ' 80' ' ' VAL . 87.1 mm-40 -68.35 -57.49 5.83 Favored 'General case' 0 C--N 1.332 -0.191 0 N-CA-C 109.896 -0.409 . . . . 0.0 109.896 177.464 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 85' ' ' LEU . . . . . 0.49 HD21 ' O ' ' A' ' 72' ' ' LEU . 0.2 OUTLIER -58.93 -39.87 82.86 Favored 'General case' 0 C--N 1.325 -0.462 0 CA-C-N 116.051 -0.522 . . . . 0.0 110.507 -176.618 . . . . . . . . 3 3 . 1 . 012 nuclear build core ' A' A ' 86' ' ' ASN . . . . . . . . . . . . . 62.7 t30 -63.83 -35.67 81.38 Favored 'General case' 0 C--N 1.326 -0.453 0 CA-C-N 115.865 -0.607 . . . . 0.0 110.832 -179.486 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 87' ' ' SER . . . . . . . . . . . . . 75.9 p -78.55 -36.85 44.08 Favored 'General case' 0 CA--C 1.531 0.239 0 C-N-CA 121.033 -0.267 . . . . 0.0 111.143 178.448 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 88' ' ' TYR . . . . . . . . . . . . . 29.8 m-85 -56.6 -47.69 79.05 Favored 'General case' 0 N--CA 1.463 0.182 0 CA-C-O 121.381 0.61 . . . . 0.0 109.728 173.791 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 89' ' ' LYS . . . . . 0.434 ' HB2' ' HE2' ' A' ' 89' ' ' LYS . 21.9 ttmm -64.64 -41.81 95.9 Favored 'General case' 0 C--N 1.327 -0.392 0 CA-C-N 115.173 -0.921 . . . . 0.0 110.554 178.859 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 90' ' ' ASN . . . . . . . . . . . . . 20.3 t30 -53.41 -50.02 66.04 Favored 'General case' 0 C--O 1.237 0.427 0 CA-C-O 120.945 0.402 . . . . 0.0 111.094 177.831 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 91' ' ' TYR . . . . . 0.423 ' O ' ' HB2' ' A' ' 95' ' ' HIS . 34.0 m-85 -60.39 -48.97 79.46 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.335 -0.393 . . . . 0.0 111.112 179.599 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 92' ' ' CYS . . . . . 0.554 ' HA ' ' HB2' ' A' ' 96' ' ' LEU . 51.2 t -71.14 -24.99 62.37 Favored 'General case' 0 C--N 1.324 -0.532 0 CA-C-O 120.878 0.37 . . . . 0.0 111.609 -176.299 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 93' ' ' ARG . . . . . 0.413 ' O ' ' HB3' ' A' ' 97' ' ' SER . 37.5 ttt180 -77.31 -52.24 9.52 Favored 'General case' 0 C--N 1.324 -0.512 0 CA-C-N 116.371 -0.377 . . . . 0.0 111.844 -174.951 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 94' ' ' ASN . . . . . . . . . . . . . 52.9 t30 -103.65 -36.45 7.9 Favored 'General case' 0 C--N 1.33 -0.269 0 C-N-CA 120.937 -0.305 . . . . 0.0 111.812 -175.211 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 95' ' ' HIS . . . . . 0.423 ' HB2' ' O ' ' A' ' 91' ' ' TYR . 42.6 m80 -85.71 -21.14 28.44 Favored 'General case' 0 C--N 1.322 -0.605 0 C-N-CA 120.688 -0.405 . . . . 0.0 111.344 -175.544 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 96' ' ' LEU . . . . . 0.554 ' HB2' ' HA ' ' A' ' 92' ' ' CYS . 89.7 mt -117.66 24.52 11.02 Favored 'General case' 0 C--N 1.324 -0.511 0 CA-C-O 121.124 0.487 . . . . 0.0 110.173 177.123 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 97' ' ' SER . . . . . 0.587 ' OG ' ' HD3' ' A' ' 98' ' ' PRO . 8.1 p -61.16 -43.12 89.37 Favored Pre-proline 0 CA--C 1.541 0.63 0 N-CA-C 113.272 0.841 . . . . 0.0 113.272 -177.548 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 98' ' ' PRO . . . . . 0.587 ' HD3' ' OG ' ' A' ' 97' ' ' SER . 17.5 Cg_exo -66.9 -15.06 46.02 Favored 'Trans proline' 0 C--N 1.361 1.208 0 C-N-CA 121.711 1.607 . . . . 0.0 112.028 -179.924 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 99' ' ' LEU . . . . . 0.405 HD12 HD22 ' A' ' 96' ' ' LEU . 49.9 mt -98.33 -33.69 10.97 Favored 'General case' 0 C--N 1.324 -0.501 0 CA-C-N 115.942 -0.572 . . . . 0.0 110.575 -178.835 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 100' ' ' TYR . . . . . . . . . . . . . 45.0 t80 -53.94 -43.44 69.81 Favored 'General case' 0 N--CA 1.465 0.279 0 CA-C-N 115.931 -0.577 . . . . 0.0 111.956 -175.434 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 101' ' ' MET . . . . . . . . . . . . . 0.7 OUTLIER -80.18 -16.13 55.51 Favored 'General case' 0 C--N 1.328 -0.335 0 N-CA-C 112.175 0.435 . . . . 0.0 112.175 -176.601 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 102' ' ' LYS . . . . . . . . . . . . . 95.4 mttt -88.95 153.64 20.87 Favored 'General case' 0 C--N 1.325 -0.5 0 CA-C-O 121.204 0.526 . . . . 0.0 110.975 -176.731 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 103' ' ' SER . . . . . 0.603 ' HB2' ' CG ' ' A' ' 106' ' ' GLU . 3.1 m -69.69 148.09 49.71 Favored 'General case' 0 C--N 1.324 -0.521 0 CA-C-N 115.651 -0.704 . . . . 0.0 109.174 175.003 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 104' ' ' LEU . . . . . . . . . . . . . 25.1 tp -59.87 -55.37 34.99 Favored 'General case' 0 C--N 1.323 -0.548 0 CA-C-O 120.803 0.335 . . . . 0.0 111.582 -171.466 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 105' ' ' SER . . . . . . . . . . . . . 34.4 t -73.09 -11.87 60.7 Favored 'General case' 0 C--N 1.325 -0.465 0 CA-C-N 116.212 -0.449 . . . . 0.0 111.45 -176.741 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 106' ' ' GLU . . . . . 0.603 ' CG ' ' HB2' ' A' ' 103' ' ' SER . 6.6 mm-40 -88.29 -15.55 35.48 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-O 120.686 0.279 . . . . 0.0 110.657 -178.465 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 107' ' ' ILE . . . . . 0.531 HG13 ' O ' ' A' ' 103' ' ' SER . 81.5 mt -69.78 129.27 34.05 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.376 0 CA-C-N 116.246 -0.433 . . . . 0.0 110.691 -179.49 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 108' ' ' LEU . . . . . . . . . . . . . 65.6 mt -88.3 146.01 37.04 Favored Pre-proline 0 C--N 1.322 -0.618 0 CA-C-N 115.916 -0.583 . . . . 0.0 109.871 178.267 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 109' ' ' PRO . . . . . . . . . . . . . 52.6 Cg_exo -55.38 -31.05 75.79 Favored 'Trans proline' 0 N--CA 1.463 -0.318 0 C-N-CA 122.184 1.923 . . . . 0.0 111.123 173.387 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 110' ' ' ALA . . . . . . . . . . . . . . . -60.98 -37.93 84.21 Favored 'General case' 0 N--CA 1.453 -0.287 0 CA-C-N 115.342 -0.844 . . . . 0.0 111.434 178.319 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 111' ' ' ASP . . . . . 0.432 ' O ' HG13 ' A' ' 115' ' ' ILE . 5.9 m-20 -58.46 -56.58 20.24 Favored 'General case' 0 N--CA 1.466 0.329 0 CA-C-O 120.9 0.381 . . . . 0.0 110.999 -179.247 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 112' ' ' ILE . . . . . . . . . . . . . 18.6 mt -65.43 -43.35 94.66 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.514 0 CA-C-N 115.578 -0.737 . . . . 0.0 110.684 -176.332 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 113' ' ' GLN . . . . . 0.473 ' HA ' HG13 ' A' ' 154' ' ' VAL . 24.7 tp60 -61.96 -40.95 97.32 Favored 'General case' 0 C--N 1.332 -0.195 0 CA-C-N 116.227 -0.442 . . . . 0.0 110.524 -179.927 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 114' ' ' SER . . . . . 0.429 ' O ' ' HG2' ' A' ' 118' ' ' GLU . 48.3 t -59.42 -46.22 89.33 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.088 -0.505 . . . . 0.0 110.492 178.194 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 115' ' ' ILE . . . . . 0.432 HG13 ' O ' ' A' ' 111' ' ' ASP . 79.2 mt -58.87 -57.63 10.37 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.224 0 CA-C-N 116.162 -0.472 . . . . 0.0 110.683 179.812 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 116' ' ' ILE . . . . . . . . . . . . . 47.3 mm -57.86 -38.48 66.22 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.371 0 CA-C-N 116.196 -0.456 . . . . 0.0 111.55 -177.51 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 117' ' ' ASN . . . . . . . . . . . . . 7.8 t30 -65.93 -38.32 88.35 Favored 'General case' 0 C--N 1.327 -0.384 0 CA-C-N 116.457 -0.338 . . . . 0.0 111.707 -175.452 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 118' ' ' GLU . . . . . 0.429 ' HG2' ' O ' ' A' ' 114' ' ' SER . 11.0 pt-20 -96.43 -12.41 24.28 Favored 'General case' 0 C--N 1.33 -0.279 0 N-CA-C 112.239 0.459 . . . . 0.0 112.239 -176.255 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 119' ' ' THR . . . . . . . . . . . . . 90.3 m -68.95 113.7 6.59 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-O 121.259 0.552 . . . . 0.0 110.103 177.98 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 120' ' ' LYS . . . . . . . . . . . . . 47.9 mttp -93.8 81.28 4.22 Favored 'General case' 0 C--N 1.322 -0.618 0 CA-C-N 115.726 -0.67 . . . . 0.0 110.429 -174.924 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 121' ' ' LEU . . . . . . . . . . . . . 85.2 mt -133.86 -175.48 3.85 Favored 'General case' 0 C--N 1.325 -0.499 0 CA-C-N 115.308 -0.86 . . . . 0.0 109.695 179.825 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 122' ' ' ALA . . . . . . . . . . . . . . . -71.78 158.3 36.36 Favored 'General case' 0 C--N 1.325 -0.489 0 CA-C-O 120.83 0.348 . . . . 0.0 111.097 -179.045 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 123' ' ' LYS . . . . . . . . . . . . . 54.9 mtpt -60.04 -40.2 88.54 Favored 'General case' 0 C--N 1.33 -0.244 0 CA-C-N 115.858 -0.61 . . . . 0.0 111.3 -176.08 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 124' ' ' ASN . . . . . . . . . . . . . 20.4 p-10 -73.36 -30.52 63.36 Favored 'General case' 0 C--N 1.326 -0.442 0 CA-C-N 116.077 -0.51 . . . . 0.0 110.726 -179.76 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 125' ' ' THR . . . . . 0.403 ' O ' HG13 ' A' ' 129' ' ' ILE . 8.0 m -70.5 -41.17 73.02 Favored 'General case' 0 C--N 1.323 -0.578 0 CA-C-N 116.326 -0.397 . . . . 0.0 110.623 178.982 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 126' ' ' LEU . . . . . . . . . . . . . 91.1 mt -61.74 -44.02 97.71 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 116.105 -0.498 . . . . 0.0 110.675 178.348 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 127' ' ' LYS . . . . . 0.629 ' HG2' HG13 ' A' ' 156' ' ' ILE . 87.8 mttt -64.45 -39.0 92.99 Favored 'General case' 0 C--N 1.331 -0.213 0 CA-C-N 116.126 -0.488 . . . . 0.0 111.005 178.985 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 128' ' ' ALA . . . . . . . . . . . . . . . -58.32 -44.41 88.62 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.276 -0.42 . . . . 0.0 110.895 -179.874 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 129' ' ' ILE . . . . . 0.403 HG13 ' O ' ' A' ' 125' ' ' THR . 65.2 mt -61.97 -47.81 91.45 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.37 0 CA-C-N 115.86 -0.609 . . . . 0.0 110.446 179.024 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 130' ' ' ARG . . . . . 0.415 HH11 ' HD2' ' A' ' 130' ' ' ARG . 10.4 ttp180 -64.95 -43.82 91.46 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 115.864 -0.607 . . . . 0.0 110.952 -178.188 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 131' ' ' ASN . . . . . . . . . . . . . 9.9 t30 -62.12 -44.56 96.38 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.421 -0.354 . . . . 0.0 111.084 -179.317 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 132' ' ' THR . . . . . 0.485 ' O ' HG13 ' A' ' 136' ' ' ILE . 35.8 m -58.17 -48.22 80.98 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.268 -0.424 . . . . 0.0 110.292 178.844 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 133' ' ' ALA . . . . . . . . . . . . . . . -65.1 -38.83 91.98 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.131 -0.486 . . . . 0.0 110.991 178.905 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 134' ' ' SER . . . . . 0.443 ' HA ' ' HB3' ' A' ' 151' ' ' ALA . 18.5 t -61.76 -41.92 98.31 Favored 'General case' 0 C--N 1.327 -0.393 0 CA-C-N 116.048 -0.524 . . . . 0.0 110.622 -179.199 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 135' ' ' GLN . . . . . . . . . . . . . 49.7 mt-30 -66.8 -31.0 71.35 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 116.544 -0.298 . . . . 0.0 111.322 178.101 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 136' ' ' ILE . . . . . 0.485 HG13 ' O ' ' A' ' 132' ' ' THR . 76.1 mt -65.95 -50.93 66.44 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.225 0 CA-C-O 120.807 0.337 . . . . 0.0 110.202 176.761 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 137' ' ' PHE . . . . . 0.491 ' O ' HG13 ' A' ' 141' ' ' ILE . 66.0 m-85 -62.7 -37.46 86.57 Favored 'General case' 0 C--N 1.331 -0.213 0 CA-C-N 116.279 -0.418 . . . . 0.0 110.539 176.431 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 138' ' ' ARG . . . . . . . . . . . . . 26.5 ttp85 -60.1 -44.28 94.94 Favored 'General case' 0 N--CA 1.45 -0.469 0 CA-C-N 116.11 -0.496 . . . . 0.0 110.549 178.88 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 139' ' ' LEU . . . . . . . . . . . . . 65.9 tp -60.29 -34.92 74.44 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 115.678 -0.692 . . . . 0.0 110.562 177.87 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 140' ' ' ALA . . . . . 0.481 ' HB1' ' HB3' ' A' ' 145' ' ' ALA . . . -72.62 -34.65 67.48 Favored 'General case' 0 C--N 1.323 -0.579 0 CA-C-N 115.975 -0.557 . . . . 0.0 110.868 178.512 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 141' ' ' ILE . . . . . 0.562 ' HA ' ' O ' ' A' ' 146' ' ' ILE . 81.7 mt -60.31 -49.96 82.18 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.235 0 CA-C-N 116.708 -0.224 . . . . 0.0 111.281 176.982 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 142' ' ' GLU . . . . . . . . . . . . . 14.9 pt-20 -70.08 -18.78 63.28 Favored 'General case' 0 N--CA 1.464 0.252 0 CA-C-O 120.943 0.402 . . . . 0.0 111.298 -179.216 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 143' ' ' ASN . . . . . . . . . . . . . 20.8 m-80 -97.74 6.22 48.18 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.37 -0.377 . . . . 0.0 110.515 175.32 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 144' ' ' ARG . . . . . . . . . . . . . 44.7 mtt180 60.1 32.45 20.97 Favored 'General case' 0 N--CA 1.464 0.26 0 CA-C-N 115.65 -0.705 . . . . 0.0 112.037 173.966 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 145' ' ' ALA . . . . . 0.481 ' HB3' ' HB1' ' A' ' 140' ' ' ALA . . . -88.4 -32.09 18.51 Favored 'General case' 0 C--N 1.324 -0.524 0 CA-C-O 121.073 0.463 . . . . 0.0 109.754 175.009 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 146' ' ' ILE . . . . . 0.562 ' O ' ' HA ' ' A' ' 141' ' ' ILE . 16.5 tt -143.11 144.5 23.81 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.444 0 CA-C-N 115.32 -0.854 . . . . 0.0 108.882 176.293 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 147' ' ' ASP . . . . . . . . . . . . . 34.6 t70 -96.89 -0.45 47.67 Favored 'General case' 0 C--N 1.323 -0.551 0 CA-C-O 120.953 0.406 . . . . 0.0 111.887 -172.823 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 148' ' ' PHE . . . . . 0.453 ' H ' HG12 ' A' ' 146' ' ' ILE . 46.7 p90 -144.43 163.28 34.27 Favored 'General case' 0 C--N 1.324 -0.52 0 O-C-N 122.026 -0.421 . . . . 0.0 111.07 -175.949 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 149' ' ' ASN . . . . . 0.505 ' HB2' HD11 ' A' ' 141' ' ' ILE . 47.1 t-20 -120.67 89.84 45.36 Favored Pre-proline 0 C--N 1.328 -0.365 0 CA-C-N 116.24 -0.436 . . . . 0.0 110.394 -177.492 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 150' ' ' PRO . . . . . . . . . . . . . 35.9 Cg_endo -66.15 -22.08 54.69 Favored 'Trans proline' 0 C--N 1.343 0.246 0 C-N-CA 122.59 2.193 . . . . 0.0 112.173 -178.223 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 151' ' ' ALA . . . . . 0.443 ' HB3' ' HA ' ' A' ' 134' ' ' SER . . . -70.75 -30.66 67.22 Favored 'General case' 0 C--N 1.327 -0.399 0 CA-C-N 116.269 -0.423 . . . . 0.0 110.553 179.694 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 152' ' ' ASP . . . . . . . . . . . . . 9.3 t70 -77.81 -15.29 59.19 Favored 'General case' 0 C--N 1.329 -0.306 0 N-CA-C 109.195 -0.669 . . . . 0.0 109.195 178.561 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 153' ' ' TYR . . . . . . . . . . . . . 73.3 t80 -83.18 -16.44 46.58 Favored 'General case' 0 C--N 1.327 -0.411 0 CA-C-N 115.656 -0.702 . . . . 0.0 109.453 177.396 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 154' ' ' VAL . . . . . 0.473 HG13 ' HA ' ' A' ' 113' ' ' GLN . 63.2 t -71.83 136.26 26.13 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.422 0 CA-C-N 115.724 -0.671 . . . . 0.0 110.006 177.474 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 155' ' ' ARG . . . . . 0.424 HH11 ' HD2' ' A' ' 155' ' ' ARG . 40.4 mtt180 -98.43 141.43 31.31 Favored 'General case' 0 C--N 1.322 -0.627 0 CA-C-N 115.838 -0.619 . . . . 0.0 111.167 -177.535 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 156' ' ' ILE . . . . . 0.629 HG13 ' HG2' ' A' ' 127' ' ' LYS . 46.8 mm -98.22 107.27 40.51 Favored Pre-proline 0 C--N 1.321 -0.672 0 N-CA-C 108.593 -0.891 . . . . 0.0 108.593 170.922 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 157' ' ' PRO . . . . . . . . . . . . . 58.8 Cg_endo . . . . . 0 N--CA 1.451 -0.976 0 C-N-CA 121.281 1.321 . . . . 0.0 113.288 -173.754 . . . . . . . . 0 0 . 1 . 013 nuclear build core ' A' A ' 63' ' ' SER . . . . . 0.599 ' HA ' ' HA ' ' A' ' 103' ' ' SER . 18.7 m . . . . . 0 C--O 1.242 0.693 0 CA-C-O 121.408 0.623 . . . . 0.0 111.177 . . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 64' ' ' PHE . . . . . 0.433 ' HB2' HD11 ' A' ' 107' ' ' ILE . 79.5 t80 -60.01 -37.18 78.97 Favored 'General case' 0 C--N 1.325 -0.484 0 CA-C-N 115.206 -0.906 . . . . 0.0 110.32 179.479 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 65' ' ' GLY . . . . . . . . . . . . . . . -58.19 -40.83 94.33 Favored Glycine 0 N--CA 1.451 -0.305 0 C-N-CA 121.145 -0.55 . . . . 0.0 112.692 177.606 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 66' ' ' ASP . . . . . . . . . . . . . 7.3 m-20 -59.9 -53.2 60.62 Favored 'General case' 0 C--O 1.236 0.357 0 CA-C-O 121.375 0.607 . . . . 0.0 110.756 179.04 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 67' ' ' TRP . . . . . 0.424 ' CE3' ' HD3' ' A' ' 70' ' ' LYS . 87.4 m95 -76.91 -23.25 52.52 Favored 'General case' 0 C--N 1.325 -0.494 0 CA-C-N 115.614 -0.721 . . . . 0.0 111.955 -175.804 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 68' ' ' ALA . . . . . 0.597 ' O ' ' HG ' ' A' ' 72' ' ' LEU . . . -63.51 -48.59 76.95 Favored 'General case' 0 C--N 1.325 -0.473 0 CA-C-O 120.837 0.351 . . . . 0.0 110.573 175.969 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 69' ' ' GLU . . . . . 0.515 ' HA ' HD12 ' A' ' 72' ' ' LEU . 26.4 mt-10 -74.2 -22.12 59.52 Favored 'General case' 0 C--N 1.327 -0.375 0 CA-C-N 116.469 -0.332 . . . . 0.0 110.939 -179.965 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 70' ' ' LYS . . . . . 0.424 ' HD3' ' CE3' ' A' ' 67' ' ' TRP . 60.9 tttp -68.19 -41.81 80.87 Favored 'General case' 0 C--N 1.326 -0.43 0 N-CA-C 109.568 -0.53 . . . . 0.0 109.568 172.637 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 71' ' ' PHE . . . . . . . . . . . . . 61.9 t80 -61.61 -44.09 97.65 Favored 'General case' 0 N--CA 1.454 -0.251 0 CA-C-N 116.038 -0.528 . . . . 0.0 109.935 174.2 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 72' ' ' LEU . . . . . 0.597 ' HG ' ' O ' ' A' ' 68' ' ' ALA . 87.3 mt -56.87 -43.96 81.74 Favored 'General case' 0 C--N 1.327 -0.38 0 CA-C-N 116.162 -0.472 . . . . 0.0 110.361 176.802 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 73' ' ' LYS . . . . . . . . . . . . . 24.8 ttmm -64.49 -37.08 86.29 Favored 'General case' 0 C--N 1.326 -0.422 0 CA-C-N 115.763 -0.653 . . . . 0.0 111.207 -179.358 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 74' ' ' SER . . . . . . . . . . . . . 96.8 p -68.89 -34.13 74.92 Favored 'General case' 0 C--O 1.226 -0.181 0 C-N-CA 120.588 -0.445 . . . . 0.0 110.458 179.288 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 75' ' ' LYS . . . . . 0.659 ' HE2' ' HA ' ' A' ' 75' ' ' LYS . 11.3 mmpt? -70.04 -39.47 75.72 Favored 'General case' 0 C--O 1.233 0.189 0 CA-C-O 121.117 0.484 . . . . 0.0 109.989 175.589 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 76' ' ' GLU . . . . . . . . . . . . . 33.2 tt0 -57.17 -46.05 83.13 Favored 'General case' 0 C--N 1.324 -0.517 0 CA-C-N 115.222 -0.899 . . . . 0.0 110.867 177.394 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 77' ' ' ALA . . . . . . . . . . . . . . . -80.31 -20.07 45.15 Favored 'General case' 0 C--N 1.323 -0.567 0 CA-C-N 115.762 -0.654 . . . . 0.0 111.518 179.638 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 78' ' ' ASP . . . . . . . . . . . . . 20.6 t70 -68.22 -53.22 26.3 Favored 'General case' 0 C--N 1.327 -0.384 0 CA-C-O 121.003 0.43 . . . . 0.0 110.604 -179.894 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 79' ' ' GLY . . . . . . . . . . . . . . . 137.51 65.77 0.05 OUTLIER Glycine 0 N--CA 1.447 -0.595 0 C-N-CA 120.518 -0.848 . . . . 0.0 112.42 179.539 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 80' ' ' VAL . . . . . . . . . . . . . 35.0 m -121.69 150.19 24.94 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.558 0 CA-C-O 120.737 0.303 . . . . 0.0 110.407 177.253 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 81' ' ' SER . . . . . . . . . . . . . 45.9 t -76.09 168.57 19.8 Favored 'General case' 0 C--N 1.324 -0.501 0 CA-C-N 116.398 -0.365 . . . . 0.0 110.252 179.02 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 82' ' ' VAL . . . . . . . . . . . . . 67.4 t -56.87 -51.07 72.54 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.215 0 CA-C-N 116.381 -0.372 . . . . 0.0 110.782 -178.657 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 83' ' ' SER . . . . . . . . . . . . . 14.9 m -59.73 -28.07 67.03 Favored 'General case' 0 C--N 1.327 -0.381 0 CA-C-N 116.361 -0.381 . . . . 0.0 111.358 -178.912 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 84' ' ' GLN . . . . . . . . . . . . . 6.5 tp-100 -80.48 -48.18 13.19 Favored 'General case' 0 C--N 1.327 -0.38 0 CA-C-O 120.824 0.345 . . . . 0.0 110.458 -179.328 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 85' ' ' LEU . . . . . . . . . . . . . 51.2 tp -64.55 -42.36 95.75 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-O 121.105 0.479 . . . . 0.0 110.229 178.738 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 86' ' ' ASN . . . . . . . . . . . . . 50.2 t30 -63.42 -33.9 76.56 Favored 'General case' 0 C--N 1.325 -0.457 0 CA-C-N 115.626 -0.715 . . . . 0.0 110.062 177.627 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 87' ' ' SER . . . . . . . . . . . . . 9.1 t -63.31 -45.19 92.46 Favored 'General case' 0 C--N 1.329 -0.283 0 N-CA-C 109.634 -0.506 . . . . 0.0 109.634 175.7 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 88' ' ' TYR . . . . . . . . . . . . . 18.5 m-85 -58.88 -43.61 90.96 Favored 'General case' 0 C--O 1.234 0.289 0 CA-C-N 116.465 -0.334 . . . . 0.0 110.531 176.708 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 89' ' ' LYS . . . . . 0.591 ' HG2' HD13 ' A' ' 72' ' ' LEU . 67.5 mttm -60.59 -42.35 96.57 Favored 'General case' 0 C--N 1.332 -0.163 0 CA-C-N 116.138 -0.483 . . . . 0.0 110.398 176.983 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 90' ' ' ASN . . . . . . . . . . . . . 26.3 t30 -56.95 -44.84 82.98 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.002 -0.545 . . . . 0.0 111.17 178.144 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 91' ' ' TYR . . . . . . . . . . . . . 63.3 m-85 -63.52 -49.2 74.47 Favored 'General case' 0 C--N 1.325 -0.458 0 C-N-CA 120.891 -0.323 . . . . 0.0 111.094 179.384 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 92' ' ' CYS . . . . . 0.471 ' HA ' HD12 ' A' ' 96' ' ' LEU . 58.6 m -65.88 -42.54 90.21 Favored 'General case' 0 C--N 1.326 -0.443 0 CA-C-O 121.064 0.459 . . . . 0.0 111.574 -177.308 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 93' ' ' ARG . . . . . . . . . . . . . 10.0 ttt180 -82.35 -51.06 8.24 Favored 'General case' 0 C--N 1.323 -0.553 0 N-CA-C 112.434 0.531 . . . . 0.0 112.434 -174.353 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 94' ' ' ASN . . . . . . . . . . . . . 31.9 t30 -89.53 -40.5 12.6 Favored 'General case' 0 C--N 1.325 -0.475 0 N-CA-C 112.121 0.415 . . . . 0.0 112.121 -172.04 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 95' ' ' HIS . . . . . . . . . . . . . 82.4 m-70 -85.46 -34.38 21.66 Favored 'General case' 0 C--N 1.322 -0.629 0 O-C-N 122.056 -0.402 . . . . 0.0 111.435 -176.755 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 96' ' ' LEU . . . . . 0.472 HD22 HD22 ' A' ' 99' ' ' LEU . 86.9 mt -106.46 27.07 9.13 Favored 'General case' 0 C--N 1.323 -0.574 0 CA-C-N 116.374 -0.376 . . . . 0.0 111.164 -176.647 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 97' ' ' SER . . . . . 0.444 ' N ' ' HD2' ' A' ' 98' ' ' PRO . 15.3 m -46.92 -53.05 29.04 Favored Pre-proline 0 CA--C 1.541 0.608 0 N-CA-C 112.715 0.635 . . . . 0.0 112.715 -178.985 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 98' ' ' PRO . . . . . 0.444 ' HD2' ' N ' ' A' ' 97' ' ' SER . 38.0 Cg_endo -66.44 -20.82 54.24 Favored 'Trans proline' 0 C--N 1.356 0.954 0 C-N-CA 121.936 1.757 . . . . 0.0 113.285 -178.185 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 99' ' ' LEU . . . . . 0.571 HD21 HG12 ' A' ' 112' ' ' ILE . 11.2 mp -88.89 -27.79 20.76 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-O 120.903 0.383 . . . . 0.0 110.476 -179.559 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 100' ' ' TYR . . . . . . . . . . . . . 5.9 t80 -57.76 -31.75 66.8 Favored 'General case' 0 C--N 1.325 -0.472 0 CA-C-N 115.541 -0.754 . . . . 0.0 111.394 -174.962 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 101' ' ' MET . . . . . . . . . . . . . 66.3 mtt -102.17 14.05 33.01 Favored 'General case' 0 C--N 1.327 -0.394 0 CA-C-N 116.217 -0.447 . . . . 0.0 111.334 -178.447 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 102' ' ' LYS . . . . . . . . . . . . . 96.5 mttt -103.26 151.11 23.05 Favored 'General case' 0 C--N 1.326 -0.422 0 N-CA-C 110.136 -0.32 . . . . 0.0 110.136 176.825 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 103' ' ' SER . . . . . 0.599 ' HA ' ' HA ' ' A' ' 63' ' ' SER . 46.6 t -75.85 161.41 29.02 Favored 'General case' 0 C--N 1.322 -0.588 0 N-CA-C 109.084 -0.71 . . . . 0.0 109.084 171.296 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 104' ' ' LEU . . . . . 0.42 ' HB3' HD12 ' A' ' 146' ' ' ILE . 90.3 mt -58.91 -28.93 66.66 Favored 'General case' 0 C--N 1.323 -0.56 0 CA-C-O 121.041 0.448 . . . . 0.0 110.613 179.208 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 105' ' ' SER . . . . . . . . . . . . . 26.4 t -87.97 -7.57 56.91 Favored 'General case' 0 CA--C 1.534 0.357 0 CA-C-N 115.98 -0.555 . . . . 0.0 111.472 -179.269 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 106' ' ' GLU . . . . . 0.528 ' HG3' ' HB3' ' A' ' 103' ' ' SER . 45.2 mt-10 -96.67 -6.38 36.68 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-O 120.792 0.33 . . . . 0.0 111.049 -177.553 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 107' ' ' ILE . . . . . 0.433 HD11 ' HB2' ' A' ' 64' ' ' PHE . 72.4 mt -93.89 122.23 45.2 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.594 0 CA-C-O 120.972 0.415 . . . . 0.0 110.778 -176.963 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 108' ' ' LEU . . . . . 0.428 ' HB2' ' HB2' ' A' ' 111' ' ' ASP . 86.4 mt -96.72 143.79 26.72 Favored Pre-proline 0 C--N 1.326 -0.445 0 CA-C-N 115.944 -0.571 . . . . 0.0 110.641 -178.88 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 109' ' ' PRO . . . . . 0.603 ' HB3' ' HB2' ' A' ' 153' ' ' TYR . 50.2 Cg_exo -55.31 -45.33 40.95 Favored 'Trans proline' 0 CA--C 1.531 0.374 0 C-N-CA 122.81 2.34 . . . . 0.0 112.378 176.823 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 110' ' ' ALA . . . . . . . . . . . . . . . -69.34 -25.11 64.04 Favored 'General case' 0 C--N 1.332 -0.186 0 CA-C-N 116.497 -0.32 . . . . 0.0 111.134 -179.46 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 111' ' ' ASP . . . . . 0.428 ' HB2' ' HB2' ' A' ' 108' ' ' LEU . 38.2 t70 -65.99 -45.14 82.7 Favored 'General case' 0 C--N 1.326 -0.437 0 CA-C-O 121.131 0.491 . . . . 0.0 109.785 179.309 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 112' ' ' ILE . . . . . 0.571 HG12 HD21 ' A' ' 99' ' ' LEU . 19.2 mt -69.14 -39.95 79.98 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.295 0 CA-C-N 115.752 -0.658 . . . . 0.0 110.071 176.557 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 113' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -58.18 -43.22 87.4 Favored 'General case' 0 C--N 1.331 -0.215 0 CA-C-N 115.892 -0.595 . . . . 0.0 109.89 178.877 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 114' ' ' SER . . . . . . . . . . . . . 40.8 t -56.12 -50.25 71.63 Favored 'General case' 0 C--N 1.331 -0.231 0 CA-C-N 116.039 -0.528 . . . . 0.0 110.226 177.052 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 115' ' ' ILE . . . . . . . . . . . . . 67.1 mt -58.15 -44.44 87.59 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.193 0 CA-C-N 116.372 -0.376 . . . . 0.0 111.002 179.309 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 116' ' ' ILE . . . . . 0.411 HG12 ' O ' ' A' ' 112' ' ' ILE . 47.3 mm -62.81 -41.35 92.17 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.326 0 CA-C-O 120.821 0.343 . . . . 0.0 111.1 -179.93 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 117' ' ' ASN . . . . . . . . . . . . . 8.4 t30 -69.98 -33.67 72.37 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-N 116.391 -0.368 . . . . 0.0 111.165 -179.251 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 118' ' ' GLU . . . . . . . . . . . . . 28.3 mm-40 -80.1 -21.94 42.74 Favored 'General case' 0 C--N 1.327 -0.396 0 CA-C-N 116.251 -0.431 . . . . 0.0 110.846 179.48 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 119' ' ' THR . . . . . . . . . . . . . 61.7 m -78.38 111.04 13.98 Favored 'General case' 0 N--CA 1.448 -0.526 0 N-CA-C 108.937 -0.764 . . . . 0.0 108.937 173.897 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 120' ' ' LYS . . . . . 0.456 ' C ' HD12 ' A' ' 121' ' ' LEU . 96.2 mttt -111.61 78.22 1.1 Allowed 'General case' 0 C--N 1.32 -0.693 0 CA-C-O 121.992 0.901 . . . . 0.0 110.993 -173.001 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 121' ' ' LEU . . . . . 0.458 HD22 HG21 ' A' ' 125' ' ' THR . 8.0 mp -131.61 -174.44 3.41 Favored 'General case' 0 C--N 1.326 -0.426 0 CA-C-N 114.093 -1.412 . . . . 0.0 108.825 178.462 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 122' ' ' ALA . . . . . . . . . . . . . . . -59.88 148.54 34.49 Favored 'General case' 0 C--N 1.326 -0.431 0 CA-C-O 120.611 0.243 . . . . 0.0 110.568 177.296 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 123' ' ' LYS . . . . . . . . . . . . . 56.0 mtmt -60.79 -29.46 69.46 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-N 116.332 -0.395 . . . . 0.0 111.241 -176.719 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 124' ' ' ASN . . . . . . . . . . . . . 0.2 OUTLIER -59.93 -37.97 81.02 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.193 -0.458 . . . . 0.0 109.882 176.959 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 125' ' ' THR . . . . . 0.458 HG21 HD22 ' A' ' 121' ' ' LEU . 17.7 m -71.82 -39.63 69.67 Favored 'General case' 0 C--N 1.327 -0.394 0 CA-C-N 115.921 -0.582 . . . . 0.0 110.361 179.512 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 126' ' ' LEU . . . . . . . . . . . . . 93.3 mt -61.72 -40.91 96.73 Favored 'General case' 0 C--N 1.327 -0.383 0 CA-C-N 116.051 -0.522 . . . . 0.0 110.345 177.802 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 127' ' ' LYS . . . . . . . . . . . . . 90.6 mttt -66.18 -31.83 72.9 Favored 'General case' 0 C--N 1.327 -0.377 0 CA-C-N 116.025 -0.534 . . . . 0.0 111.399 177.961 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 128' ' ' ALA . . . . . . . . . . . . . . . -62.25 -43.96 97.64 Favored 'General case' 0 C--N 1.325 -0.457 0 CA-C-O 120.766 0.317 . . . . 0.0 110.602 178.923 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 129' ' ' ILE . . . . . . . . . . . . . 35.4 mt -67.16 -43.67 88.37 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.313 0 CA-C-N 116.145 -0.479 . . . . 0.0 109.736 177.264 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 130' ' ' ARG . . . . . 0.588 ' HB2' HD11 ' A' ' 156' ' ' ILE . 16.4 tpt85 -55.8 -51.74 66.39 Favored 'General case' 0 C--N 1.331 -0.219 0 CA-C-N 115.35 -0.841 . . . . 0.0 111.005 178.159 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 131' ' ' ASN . . . . . . . . . . . . . 14.4 m-80 -58.59 -54.41 47.42 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.202 -0.454 . . . . 0.0 111.109 179.986 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 132' ' ' THR . . . . . 0.419 ' O ' HG13 ' A' ' 136' ' ' ILE . 33.6 m -52.9 -50.7 63.38 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-N 116.136 -0.483 . . . . 0.0 111.255 -178.519 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 133' ' ' ALA . . . . . . . . . . . . . . . -61.45 -48.46 81.06 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.301 -0.409 . . . . 0.0 111.39 -178.266 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 134' ' ' SER . . . . . 0.498 ' O ' ' HG2' ' A' ' 138' ' ' ARG . 52.9 p -62.44 -36.35 82.15 Favored 'General case' 0 C--N 1.331 -0.214 0 CA-C-N 116.569 -0.287 . . . . 0.0 111.157 -177.918 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 135' ' ' GLN . . . . . 0.436 ' HA ' ' HG2' ' A' ' 138' ' ' ARG . 85.2 mm-40 -66.37 -36.26 82.43 Favored 'General case' 0 C--N 1.333 -0.138 0 CA-C-N 116.576 -0.284 . . . . 0.0 111.266 -178.723 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 136' ' ' ILE . . . . . 0.419 HG13 ' O ' ' A' ' 132' ' ' THR . 79.5 mt -66.75 -45.68 87.42 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.505 0 CA-C-O 120.786 0.327 . . . . 0.0 110.73 179.624 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 137' ' ' PHE . . . . . 0.477 ' O ' HG13 ' A' ' 141' ' ' ILE . 58.5 m-85 -67.47 -45.21 76.6 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.373 -0.376 . . . . 0.0 111.566 -178.962 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 138' ' ' ARG . . . . . 0.498 ' HG2' ' O ' ' A' ' 134' ' ' SER . 13.3 ptm180 -65.17 -33.02 75.02 Favored 'General case' 0 N--CA 1.463 0.19 0 C-N-CA 120.796 -0.362 . . . . 0.0 110.77 -179.327 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 139' ' ' LEU . . . . . . . . . . . . . 54.6 tp -63.93 -41.19 97.71 Favored 'General case' 0 C--N 1.33 -0.239 0 CA-C-O 121.014 0.435 . . . . 0.0 109.901 176.608 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 140' ' ' ALA . . . . . . . . . . . . . . . -64.62 -37.67 88.37 Favored 'General case' 0 C--N 1.326 -0.42 0 CA-C-N 116.033 -0.531 . . . . 0.0 110.499 176.629 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 141' ' ' ILE . . . . . 0.477 HG13 ' O ' ' A' ' 137' ' ' PHE . 78.4 mt -63.7 -42.86 97.43 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.299 0 CA-C-N 116.22 -0.445 . . . . 0.0 110.469 177.138 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 142' ' ' GLU . . . . . 0.459 ' HG3' ' O ' ' A' ' 138' ' ' ARG . 43.5 mt-10 -69.07 -8.9 49.44 Favored 'General case' 0 N--CA 1.463 0.219 0 CA-C-N 116.248 -0.433 . . . . 0.0 111.558 179.758 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 143' ' ' ASN . . . . . . . . . . . . . 43.2 m-80 -114.38 14.52 17.95 Favored 'General case' 0 C--N 1.327 -0.378 0 CA-C-N 116.656 -0.247 . . . . 0.0 111.425 177.617 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 144' ' ' ARG . . . . . . . . . . . . . 99.4 mtt180 62.12 26.24 15.76 Favored 'General case' 0 N--CA 1.471 0.59 0 O-C-N 123.434 0.459 . . . . 0.0 112.063 176.738 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 145' ' ' ALA . . . . . . . . . . . . . . . -90.48 -23.52 20.94 Favored 'General case' 0 C--N 1.324 -0.537 0 CA-C-O 120.823 0.344 . . . . 0.0 110.924 -179.35 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 146' ' ' ILE . . . . . 0.466 ' O ' ' HA ' ' A' ' 141' ' ' ILE . 13.3 tt -159.95 157.62 2.83 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.596 0 N-CA-C 109.231 -0.655 . . . . 0.0 109.231 178.131 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 147' ' ' ASP . . . . . . . . . . . . . 31.2 t70 -126.62 27.54 6.08 Favored 'General case' 0 C--N 1.322 -0.598 0 CA-C-O 121.849 0.833 . . . . 0.0 110.188 -179.436 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 148' ' ' PHE . . . . . 0.437 ' H ' HG12 ' A' ' 146' ' ' ILE . 78.2 t80 -141.26 132.73 26.85 Favored 'General case' 0 C--N 1.319 -0.732 0 CA-C-N 115.579 -0.737 . . . . 0.0 109.589 -179.906 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 149' ' ' ASN . . . . . . . . . . . . . 48.6 t-20 -114.93 92.6 31.14 Favored Pre-proline 0 C--N 1.322 -0.607 0 CA-C-N 116.488 -0.324 . . . . 0.0 110.322 -179.657 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 150' ' ' PRO . . . . . . . . . . . . . 23.7 Cg_exo -64.71 -27.9 60.21 Favored 'Trans proline' 0 C--N 1.344 0.297 0 C-N-CA 122.803 2.335 . . . . 0.0 112.243 -178.714 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 151' ' ' ALA . . . . . 0.424 ' HA ' HG23 ' A' ' 154' ' ' VAL . . . -73.5 -21.32 60.44 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.087 -0.506 . . . . 0.0 111.219 -177.063 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 152' ' ' ASP . . . . . . . . . . . . . 3.9 t70 -76.58 -17.08 59.4 Favored 'General case' 0 C--N 1.326 -0.455 0 CA-C-O 121.357 0.599 . . . . 0.0 109.865 -179.877 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 153' ' ' TYR . . . . . 0.603 ' HB2' ' HB3' ' A' ' 109' ' ' PRO . 47.3 m-85 -93.45 2.45 56.47 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-N 115.737 -0.665 . . . . 0.0 110.799 179.133 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 154' ' ' VAL . . . . . 0.424 HG23 ' HA ' ' A' ' 151' ' ' ALA . 98.6 t -83.31 115.92 26.53 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.485 0 CA-C-N 116.299 -0.41 . . . . 0.0 110.639 -178.92 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 155' ' ' ARG . . . . . . . . . . . . . 39.8 ttm-85 -77.88 132.94 38.18 Favored 'General case' 0 C--N 1.322 -0.626 0 CA-C-N 115.802 -0.635 . . . . 0.0 110.526 179.406 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 156' ' ' ILE . . . . . 0.588 HD11 ' HB2' ' A' ' 130' ' ' ARG . 45.1 mm -96.85 120.7 61.2 Favored Pre-proline 0 C--N 1.322 -0.59 0 N-CA-C 109.458 -0.571 . . . . 0.0 109.458 174.729 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 157' ' ' PRO . . . . . 0.437 ' HD3' ' HA ' ' A' ' 156' ' ' ILE . 35.7 Cg_exo . . . . . 0 N--CA 1.463 -0.313 0 C-N-CA 122.655 2.237 . . . . 0.0 112.588 -178.034 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 63' ' ' SER . . . . . 0.563 ' HA ' ' HA ' ' A' ' 103' ' ' SER . 87.5 p . . . . . 0 N--CA 1.448 -0.562 0 CA-C-O 120.813 0.339 . . . . 0.0 110.428 . . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 64' ' ' PHE . . . . . 0.585 ' HB2' HD11 ' A' ' 107' ' ' ILE . 64.9 t80 -60.84 -31.82 71.24 Favored 'General case' 0 C--N 1.323 -0.573 0 N-CA-C 109.229 -0.656 . . . . 0.0 109.229 175.647 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 65' ' ' GLY . . . . . . . . . . . . . . . -61.03 -32.67 81.13 Favored Glycine 0 N--CA 1.451 -0.363 0 CA-C-N 115.969 -0.56 . . . . 0.0 112.505 176.934 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 66' ' ' ASP . . . . . . . . . . . . . 24.9 m-20 -68.9 -55.3 11.48 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-O 121.208 0.527 . . . . 0.0 110.18 177.195 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 67' ' ' TRP . . . . . . . . . . . . . 99.4 m95 -68.18 -32.32 72.48 Favored 'General case' 0 C--N 1.326 -0.431 0 CA-C-N 115.705 -0.68 . . . . 0.0 111.869 -176.813 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 68' ' ' ALA . . . . . 0.61 ' O ' ' HG ' ' A' ' 72' ' ' LEU . . . -64.21 -47.43 79.77 Favored 'General case' 0 C--N 1.326 -0.432 0 N-CA-C 110.17 -0.308 . . . . 0.0 110.17 176.706 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 69' ' ' GLU . . . . . . . . . . . . . 7.5 tp10 -63.3 -40.08 96.35 Favored 'General case' 0 C--N 1.329 -0.297 0 N-CA-C 109.497 -0.557 . . . . 0.0 109.497 177.838 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 70' ' ' LYS . . . . . . . . . . . . . 10.7 tppt? -56.12 -49.6 73.43 Favored 'General case' 0 C--N 1.331 -0.223 0 CA-C-N 115.622 -0.717 . . . . 0.0 110.36 174.519 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 71' ' ' PHE . . . . . . . . . . . . . 80.3 t80 -64.71 -46.68 81.29 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 116.123 -0.49 . . . . 0.0 111.477 -179.08 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 72' ' ' LEU . . . . . 0.61 ' HG ' ' O ' ' A' ' 68' ' ' ALA . 85.7 mt -61.02 -43.63 98.61 Favored 'General case' 0 C--N 1.327 -0.396 0 CA-C-O 121.01 0.433 . . . . 0.0 110.422 179.776 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 73' ' ' LYS . . . . . . . . . . . . . 58.3 tttm -67.43 -26.53 66.46 Favored 'General case' 0 C--N 1.326 -0.42 0 CA-C-O 121.192 0.52 . . . . 0.0 110.155 179.015 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 74' ' ' SER . . . . . . . . . . . . . 60.7 m -68.39 -37.8 80.73 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 116.122 -0.49 . . . . 0.0 110.01 174.716 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 75' ' ' LYS . . . . . . . . . . . . . 71.4 mmtt -69.67 -34.03 73.4 Favored 'General case' 0 C--O 1.233 0.19 0 CA-C-N 116.346 -0.388 . . . . 0.0 110.892 177.575 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 76' ' ' GLU . . . . . . . . . . . . . 6.8 tp10 -54.27 -49.55 69.31 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-O 121.095 0.474 . . . . 0.0 109.847 173.591 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 77' ' ' ALA . . . . . . . . . . . . . . . -80.26 -16.66 54.21 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 115.961 -0.563 . . . . 0.0 111.325 179.781 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 78' ' ' ASP . . . . . . . . . . . . . 19.9 t70 -69.57 -34.38 74.08 Favored 'General case' 0 N--CA 1.464 0.24 0 CA-C-O 121.016 0.436 . . . . 0.0 110.196 -179.15 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 79' ' ' GLY . . . . . . . . . . . . . . . 108.09 37.16 2.2 Favored Glycine 0 N--CA 1.449 -0.5 0 C-N-CA 120.497 -0.859 . . . . 0.0 113.375 174.159 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 80' ' ' VAL . . . . . 0.508 ' HB ' ' HB2' ' A' ' 84' ' ' GLN . 17.7 m -88.51 155.73 3.15 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.503 0 CA-C-N 116.973 0.387 . . . . 0.0 110.431 175.511 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 81' ' ' SER . . . . . . . . . . . . . 19.5 m -66.44 159.12 27.76 Favored 'General case' 0 C--N 1.325 -0.49 0 N-CA-C 109.943 -0.391 . . . . 0.0 109.943 177.402 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 82' ' ' VAL . . . . . . . . . . . . . 61.2 t -56.75 -36.71 50.12 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.27 0 CA-C-O 120.905 0.383 . . . . 0.0 110.538 -178.966 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 83' ' ' SER . . . . . . . . . . . . . 14.4 m -57.27 -42.09 80.94 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 115.962 -0.563 . . . . 0.0 110.969 177.352 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 84' ' ' GLN . . . . . 0.508 ' HB2' ' HB ' ' A' ' 80' ' ' VAL . 75.9 mm-40 -64.88 -56.61 12.36 Favored 'General case' 0 CA--C 1.518 -0.269 0 CA-C-N 116.718 -0.219 . . . . 0.0 110.44 -179.951 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 85' ' ' LEU . . . . . . . . . . . . . 53.7 tp -57.82 -39.13 76.9 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.131 -0.486 . . . . 0.0 110.866 -177.657 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 86' ' ' ASN . . . . . . . . . . . . . 24.4 t-20 -61.14 -47.65 85.26 Favored 'General case' 0 C--N 1.327 -0.37 0 CA-C-N 115.864 -0.607 . . . . 0.0 110.074 177.215 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 87' ' ' SER . . . . . . . . . . . . . 49.7 m -64.78 -42.01 95.41 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-N 116.384 -0.371 . . . . 0.0 111.101 179.051 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 88' ' ' TYR . . . . . . . . . . . . . 29.4 m-85 -57.53 -48.68 78.62 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-O 120.976 0.417 . . . . 0.0 110.835 178.683 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 89' ' ' LYS . . . . . . . . . . . . . 22.0 ttmm -72.36 -32.35 66.39 Favored 'General case' 0 C--N 1.326 -0.415 0 CA-C-N 116.131 -0.486 . . . . 0.0 110.82 179.599 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 90' ' ' ASN . . . . . . . . . . . . . 62.0 t30 -66.46 -46.4 76.51 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-O 121.124 0.488 . . . . 0.0 110.447 178.739 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 91' ' ' TYR . . . . . 0.412 ' HD2' HG12 ' A' ' 129' ' ' ILE . 5.1 m-85 -62.42 -37.99 87.96 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.043 -0.526 . . . . 0.0 110.442 177.813 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 92' ' ' CYS . . . . . 0.558 ' HA ' ' HB2' ' A' ' 96' ' ' LEU . 53.2 t -67.59 -36.73 81.45 Favored 'General case' 0 C--N 1.327 -0.412 0 CA-C-N 115.929 -0.578 . . . . 0.0 110.723 177.966 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 93' ' ' ARG . . . . . 0.5 ' O ' ' HB3' ' A' ' 97' ' ' SER . 39.3 ttt180 -71.51 -44.97 63.69 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-O 121.029 0.442 . . . . 0.0 110.815 179.758 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 94' ' ' ASN . . . . . . . . . . . . . 95.1 m-20 -81.19 -61.2 2.02 Favored 'General case' 0 C--N 1.325 -0.499 0 N-CA-C 112.219 0.452 . . . . 0.0 112.219 -175.414 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 95' ' ' HIS . . . . . . . . . . . . . 95.0 m-70 -85.52 -40.34 16.44 Favored 'General case' 0 C--N 1.327 -0.385 0 CA-C-O 120.704 0.288 . . . . 0.0 111.697 -170.272 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 96' ' ' LEU . . . . . 0.558 ' HB2' ' HA ' ' A' ' 92' ' ' CYS . 74.9 mt -91.87 16.99 9.78 Favored 'General case' 0 C--N 1.325 -0.48 0 CA-C-N 116.622 -0.263 . . . . 0.0 111.279 -174.074 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 97' ' ' SER . . . . . 0.586 ' OG ' ' HD3' ' A' ' 98' ' ' PRO . 3.5 p -61.16 -45.7 95.79 Favored Pre-proline 0 CA--C 1.544 0.741 0 N-CA-C 113.123 0.786 . . . . 0.0 113.123 -177.661 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 98' ' ' PRO . . . . . 0.586 ' HD3' ' OG ' ' A' ' 97' ' ' SER . 21.9 Cg_exo -63.6 -33.66 66.56 Favored 'Trans proline' 0 C--N 1.361 1.211 0 C-N-CA 121.657 1.572 . . . . 0.0 111.622 179.133 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 99' ' ' LEU . . . . . 0.451 ' O ' ' HB3' ' A' ' 64' ' ' PHE . 40.4 mt -74.27 -40.22 62.47 Favored 'General case' 0 C--N 1.323 -0.572 0 CA-C-N 115.523 -0.762 . . . . 0.0 109.759 179.849 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 100' ' ' TYR . . . . . . . . . . . . . 36.0 t80 -51.71 -40.89 60.97 Favored 'General case' 0 C--N 1.33 -0.248 0 CA-C-N 115.235 -0.893 . . . . 0.0 111.394 -178.3 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 101' ' ' MET . . . . . . . . . . . . . 24.8 mmt -91.34 11.56 23.3 Favored 'General case' 0 C--N 1.326 -0.425 0 CA-C-N 116.325 -0.398 . . . . 0.0 112.047 -177.13 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 102' ' ' LYS . . . . . . . . . . . . . 66.0 mttt -105.8 150.33 25.65 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-O 120.862 0.363 . . . . 0.0 110.916 176.807 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 103' ' ' SER . . . . . 0.563 ' HA ' ' HA ' ' A' ' 63' ' ' SER . 24.1 t -72.93 150.33 42.64 Favored 'General case' 0 C--N 1.324 -0.526 0 N-CA-C 109.224 -0.658 . . . . 0.0 109.224 171.816 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 104' ' ' LEU . . . . . . . . . . . . . 26.2 tp -56.69 -29.48 62.42 Favored 'General case' 0 C--N 1.324 -0.543 0 CA-C-O 120.933 0.397 . . . . 0.0 112.045 -175.399 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 105' ' ' SER . . . . . . . . . . . . . 40.3 t -83.65 -22.34 32.18 Favored 'General case' 0 C--N 1.326 -0.415 0 N-CA-C 112.211 0.448 . . . . 0.0 112.211 -175.545 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 106' ' ' GLU . . . . . . . . . . . . . 12.1 pt-20 -97.94 6.08 48.13 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-O 120.817 0.341 . . . . 0.0 111.22 -174.298 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 107' ' ' ILE . . . . . 0.594 HG21 ' HZ ' ' A' ' 137' ' ' PHE . 63.4 mt -83.5 121.5 36.34 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.575 0 CA-C-N 116.296 -0.411 . . . . 0.0 110.1 178.93 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 108' ' ' LEU . . . . . . . . . . . . . 84.8 mt -103.44 151.16 38.6 Favored Pre-proline 0 C--N 1.32 -0.698 0 CA-C-N 116.062 -0.517 . . . . 0.0 110.073 179.991 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 109' ' ' PRO . . . . . . . . . . . . . 31.3 Cg_exo -59.88 -27.9 85.97 Favored 'Trans proline' 0 C--N 1.343 0.266 0 C-N-CA 122.27 1.98 . . . . 0.0 111.042 174.47 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 110' ' ' ALA . . . . . . . . . . . . . . . -61.66 -41.14 97.12 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 115.244 -0.889 . . . . 0.0 111.003 178.576 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 111' ' ' ASP . . . . . . . . . . . . . 33.3 m-20 -52.9 -58.41 7.03 Favored 'General case' 0 C--O 1.236 0.351 0 CA-C-O 121.423 0.63 . . . . 0.0 110.547 178.842 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 112' ' ' ILE . . . . . 0.449 HG12 HD11 ' A' ' 99' ' ' LEU . 21.4 mt -66.23 -40.59 87.32 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.557 0 CA-C-N 114.871 -1.059 . . . . 0.0 111.141 -174.651 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 113' ' ' GLN . . . . . . . . . . . . . 17.3 tm0? -65.01 -39.43 93.43 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.404 -0.362 . . . . 0.0 110.401 -178.29 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 114' ' ' SER . . . . . . . . . . . . . 50.0 m -60.57 -38.29 84.08 Favored 'General case' 0 C--O 1.233 0.226 0 CA-C-O 121.041 0.448 . . . . 0.0 110.485 178.039 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 115' ' ' ILE . . . . . . . . . . . . . 78.3 mt -60.12 -46.14 94.84 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.239 0 CA-C-N 115.938 -0.573 . . . . 0.0 110.432 176.592 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 116' ' ' ILE . . . . . . . . . . . . . 51.2 mm -60.33 -37.06 72.72 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.277 0 CA-C-N 115.992 -0.549 . . . . 0.0 111.043 -179.984 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 117' ' ' ASN . . . . . . . . . . . . . 93.6 m-20 -60.79 -44.49 96.75 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.492 -0.322 . . . . 0.0 111.169 179.124 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 118' ' ' GLU . . . . . . . . . . . . . 48.9 mt-10 -80.95 -18.25 47.68 Favored 'General case' 0 C--N 1.327 -0.377 0 CA-C-N 116.292 -0.413 . . . . 0.0 111.506 -176.982 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 119' ' ' THR . . . . . 0.403 ' CG2' HD13 ' A' ' 121' ' ' LEU . 29.2 m -90.86 111.8 23.37 Favored 'General case' 0 C--N 1.324 -0.539 0 CA-C-O 121.054 0.454 . . . . 0.0 110.48 -178.807 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 120' ' ' LYS . . . . . 0.448 ' C ' HD12 ' A' ' 121' ' ' LEU . 48.7 mtpt -106.82 86.9 2.4 Favored 'General case' 0 C--N 1.327 -0.4 0 CA-C-O 120.991 0.424 . . . . 0.0 110.828 -178.491 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 121' ' ' LEU . . . . . 0.448 HD12 ' C ' ' A' ' 120' ' ' LYS . 7.8 mp -132.75 -174.87 3.59 Favored 'General case' 0 C--N 1.323 -0.554 0 CA-C-N 115.547 -0.751 . . . . 0.0 109.622 177.62 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 122' ' ' ALA . . . . . . . . . . . . . . . -65.37 152.69 43.25 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-O 120.629 0.252 . . . . 0.0 111.247 178.927 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 123' ' ' LYS . . . . . 0.468 ' HB2' ' NZ ' ' A' ' 123' ' ' LYS . 9.5 mtmp? -55.85 -43.17 76.79 Favored 'General case' 0 C--N 1.331 -0.235 0 CA-C-N 115.998 -0.546 . . . . 0.0 110.735 -178.428 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 124' ' ' ASN . . . . . . . . . . . . . 3.2 m-20 -61.19 -37.81 84.28 Favored 'General case' 0 C--N 1.327 -0.408 0 CA-C-N 115.362 -0.836 . . . . 0.0 110.774 -178.124 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 125' ' ' THR . . . . . 0.44 ' O ' HG13 ' A' ' 129' ' ' ILE . 10.8 m -69.96 -41.58 74.32 Favored 'General case' 0 C--N 1.325 -0.457 0 CA-C-N 116.201 -0.454 . . . . 0.0 110.532 178.64 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 126' ' ' LEU . . . . . . . . . . . . . 92.5 mt -61.96 -43.68 98.34 Favored 'General case' 0 C--O 1.235 0.292 0 CA-C-N 116.08 -0.509 . . . . 0.0 110.741 179.184 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 127' ' ' LYS . . . . . . . . . . . . . 52.3 mtpt -68.93 -30.99 69.56 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.27 -0.423 . . . . 0.0 110.756 179.133 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 128' ' ' ALA . . . . . . . . . . . . . . . -64.11 -45.74 87.29 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.321 -0.4 . . . . 0.0 110.57 176.94 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 129' ' ' ILE . . . . . 0.44 HG13 ' O ' ' A' ' 125' ' ' THR . 70.1 mt -59.25 -50.25 80.48 Favored 'Isoleucine or valine' 0 C--O 1.235 0.319 0 CA-C-N 116.103 -0.499 . . . . 0.0 110.414 177.865 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 130' ' ' ARG . . . . . . . . . . . . . 45.7 ttt-85 -61.88 -40.97 97.23 Favored 'General case' 0 C--N 1.327 -0.384 0 CA-C-N 115.758 -0.656 . . . . 0.0 111.039 179.427 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 131' ' ' ASN . . . . . . . . . . . . . 4.4 t-20 -62.8 -44.81 95.18 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-O 120.648 0.261 . . . . 0.0 110.45 -179.314 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 132' ' ' THR . . . . . 0.481 ' O ' HG13 ' A' ' 136' ' ' ILE . 39.2 m -55.1 -52.7 62.43 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 115.774 -0.648 . . . . 0.0 110.482 178.695 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 133' ' ' ALA . . . . . . . . . . . . . . . -65.45 -38.98 91.47 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.219 -0.446 . . . . 0.0 110.803 179.098 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 134' ' ' SER . . . . . . . . . . . . . 26.9 t -60.28 -43.23 96.4 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 115.964 -0.562 . . . . 0.0 110.84 -179.45 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 135' ' ' GLN . . . . . . . . . . . . . 45.9 mt-30 -67.55 -30.66 70.35 Favored 'General case' 0 C--N 1.33 -0.28 0 C-N-CA 121.133 -0.227 . . . . 0.0 110.791 179.178 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 136' ' ' ILE . . . . . 0.481 HG13 ' O ' ' A' ' 132' ' ' THR . 86.8 mt -65.13 -45.21 94.8 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.333 0 CA-C-N 116.346 -0.388 . . . . 0.0 110.203 175.959 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 137' ' ' PHE . . . . . 0.594 ' HZ ' HG21 ' A' ' 107' ' ' ILE . 60.0 m-85 -65.35 -44.98 85.98 Favored 'General case' 0 C--N 1.331 -0.208 0 CA-C-N 116.292 -0.413 . . . . 0.0 110.353 175.603 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 138' ' ' ARG . . . . . 0.46 ' O ' ' HG3' ' A' ' 142' ' ' GLU . 29.0 mtp180 -55.39 -41.19 72.31 Favored 'General case' 0 C--O 1.223 -0.31 0 CA-C-N 116.029 -0.532 . . . . 0.0 111.092 177.053 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 139' ' ' LEU . . . . . . . . . . . . . 29.4 tp -59.36 -43.09 92.87 Favored 'General case' 0 C--N 1.321 -0.645 0 CA-C-N 115.999 -0.546 . . . . 0.0 110.525 179.829 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 140' ' ' ALA . . . . . . . . . . . . . . . -68.0 -31.47 71.19 Favored 'General case' 0 C--N 1.331 -0.217 0 CA-C-N 116.348 -0.387 . . . . 0.0 110.255 176.443 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 141' ' ' ILE . . . . . 0.659 ' HA ' ' O ' ' A' ' 146' ' ' ILE . 79.7 mt -66.54 -45.93 87.59 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.236 0 CA-C-N 116.275 -0.42 . . . . 0.0 110.465 175.585 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 142' ' ' GLU . . . . . 0.46 ' HG3' ' O ' ' A' ' 138' ' ' ARG . 43.3 mt-10 -67.73 -21.65 65.28 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-O 121.021 0.439 . . . . 0.0 110.774 -179.843 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 143' ' ' ASN . . . . . . . . . . . . . 4.3 m-20 -94.83 1.42 55.37 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.138 -0.483 . . . . 0.0 110.643 175.991 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 144' ' ' ARG . . . . . 0.414 HH11 ' HD2' ' A' ' 144' ' ' ARG . 29.3 mtp85 59.58 36.91 22.82 Favored 'General case' 0 N--CA 1.465 0.304 0 CA-C-N 115.721 -0.672 . . . . 0.0 112.444 178.37 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 145' ' ' ALA . . . . . . . . . . . . . . . -90.4 -24.68 20.71 Favored 'General case' 0 C--N 1.323 -0.556 0 CA-C-O 121.547 0.689 . . . . 0.0 109.455 173.413 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 146' ' ' ILE . . . . . 0.659 ' O ' ' HA ' ' A' ' 141' ' ' ILE . 11.4 tt -156.84 157.96 3.48 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.569 0 N-CA-C 108.007 -1.108 . . . . 0.0 108.007 177.567 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 147' ' ' ASP . . . . . . . . . . . . . 7.3 p-10 -123.83 21.81 9.04 Favored 'General case' 0 C--N 1.322 -0.604 0 CA-C-O 121.1 0.476 . . . . 0.0 110.862 179.628 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 148' ' ' PHE . . . . . 0.477 ' H ' HG12 ' A' ' 146' ' ' ILE . 73.7 m-85 -121.6 151.06 40.81 Favored 'General case' 0 C--N 1.326 -0.433 0 CA-C-N 115.877 -0.601 . . . . 0.0 109.986 178.537 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 149' ' ' ASN . . . . . . . . . . . . . 53.7 t-20 -124.6 87.77 54.17 Favored Pre-proline 0 C--N 1.321 -0.658 0 N-CA-C 109.682 -0.488 . . . . 0.0 109.682 173.552 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 150' ' ' PRO . . . . . . . . . . . . . 77.6 Cg_exo -52.18 -34.64 59.72 Favored 'Trans proline' 0 C--N 1.344 0.329 0 C-N-CA 122.958 2.439 . . . . 0.0 112.925 177.408 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 151' ' ' ALA . . . . . . . . . . . . . . . -71.39 -26.06 62.62 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.321 -0.399 . . . . 0.0 110.982 -177.31 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 152' ' ' ASP . . . . . . . . . . . . . 39.0 t70 -74.98 -18.25 60.4 Favored 'General case' 0 C--N 1.325 -0.476 0 CA-C-O 120.815 0.341 . . . . 0.0 110.601 -179.59 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 153' ' ' TYR . . . . . . . . . . . . . 96.3 m-85 -83.81 -11.48 56.99 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.284 -0.416 . . . . 0.0 110.863 179.057 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 154' ' ' VAL . . . . . . . . . . . . . 57.4 t -64.63 123.83 18.25 Favored 'Isoleucine or valine' 0 C--O 1.235 0.336 0 CA-C-O 120.876 0.37 . . . . 0.0 111.364 -177.507 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 155' ' ' ARG . . . . . . . . . . . . . 88.7 mtt180 -73.04 117.72 15.11 Favored 'General case' 0 C--N 1.325 -0.488 0 CA-C-N 115.828 -0.624 . . . . 0.0 110.404 174.603 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 156' ' ' ILE . . . . . . . . . . . . . 37.2 mm -92.47 119.6 67.95 Favored Pre-proline 0 C--N 1.318 -0.778 0 N-CA-C 109.317 -0.623 . . . . 0.0 109.317 173.453 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 157' ' ' PRO . . . . . . . . . . . . . 42.1 Cg_endo . . . . . 0 N--CA 1.457 -0.637 0 C-N-CA 122.107 1.871 . . . . 0.0 112.237 -178.851 . . . . . . . . 0 0 . 1 . 015 nuclear build core ' A' A ' 63' ' ' SER . . . . . . . . . . . . . 36.1 t . . . . . 0 C--O 1.237 0.435 0 CA-C-O 120.971 0.415 . . . . 0.0 110.522 . . . . . . . . . 0 0 . 1 . 015 nuclear build core ' A' A ' 64' ' ' PHE . . . . . . . . . . . . . 81.2 t80 -63.74 -30.12 71.26 Favored 'General case' 0 C--N 1.327 -0.411 0 CA-C-N 115.857 -0.61 . . . . 0.0 109.723 177.254 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 65' ' ' GLY . . . . . . . . . . . . . . . -62.93 -36.15 93.03 Favored Glycine 0 N--CA 1.448 -0.559 0 C-N-CA 120.862 -0.685 . . . . 0.0 112.157 178.205 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 66' ' ' ASP . . . . . . . . . . . . . 22.7 t70 -69.6 -43.19 73.27 Favored 'General case' 0 C--N 1.327 -0.398 0 CA-C-O 120.931 0.396 . . . . 0.0 110.371 179.515 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 67' ' ' TRP . . . . . . . . . . . . . 83.8 m95 -72.33 -28.02 62.8 Favored 'General case' 0 C--N 1.325 -0.488 0 CA-C-N 116.153 -0.476 . . . . 0.0 111.392 179.477 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 68' ' ' ALA . . . . . 0.489 ' O ' ' HG ' ' A' ' 72' ' ' LEU . . . -65.82 -44.87 84.28 Favored 'General case' 0 C--N 1.329 -0.302 0 N-CA-C 109.57 -0.53 . . . . 0.0 109.57 173.312 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 69' ' ' GLU . . . . . . . . . . . . . 10.3 tp10 -59.46 -46.39 88.92 Favored 'General case' 0 C--O 1.234 0.244 0 CA-C-N 115.605 -0.725 . . . . 0.0 109.998 175.17 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 70' ' ' LYS . . . . . . . . . . . . . 54.7 mttp -63.35 -34.54 77.94 Favored 'General case' 0 C--N 1.331 -0.228 0 CA-C-N 115.793 -0.639 . . . . 0.0 111.645 178.663 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 71' ' ' PHE . . . . . . . . . . . . . 62.7 t80 -67.17 -43.72 81.53 Favored 'General case' 0 C--N 1.326 -0.421 0 CA-C-O 120.887 0.375 . . . . 0.0 110.578 178.809 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 72' ' ' LEU . . . . . 0.489 ' HG ' ' O ' ' A' ' 68' ' ' ALA . 85.7 mt -62.21 -44.21 97.1 Favored 'General case' 0 C--N 1.324 -0.543 0 CA-C-N 116.111 -0.495 . . . . 0.0 110.397 178.355 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 73' ' ' LYS . . . . . . . . . . . . . 35.6 mttp -72.55 -36.37 68.24 Favored 'General case' 0 C--N 1.327 -0.377 0 CA-C-N 116.001 -0.545 . . . . 0.0 112.233 -178.695 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 74' ' ' SER . . . . . . . . . . . . . 35.1 p -66.27 -34.37 77.84 Favored 'General case' 0 C--N 1.328 -0.336 0 C-N-CA 120.725 -0.39 . . . . 0.0 110.31 178.022 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 75' ' ' LYS . . . . . 0.43 ' HD3' ' HA ' ' A' ' 75' ' ' LYS . 25.8 mmtp -75.07 -32.88 61.6 Favored 'General case' 0 C--N 1.332 -0.187 0 CA-C-O 120.894 0.378 . . . . 0.0 110.903 174.958 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 76' ' ' GLU . . . . . . . . . . . . . 43.1 tt0 -63.46 -38.94 93.06 Favored 'General case' 0 C--N 1.323 -0.56 0 CA-C-O 121.219 0.533 . . . . 0.0 110.098 175.198 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 77' ' ' ALA . . . . . . . . . . . . . . . -76.4 -28.99 56.92 Favored 'General case' 0 C--N 1.325 -0.487 0 CA-C-N 115.841 -0.618 . . . . 0.0 110.741 174.578 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 78' ' ' ASP . . . . . 0.407 ' HB3' ' HA ' ' A' ' 75' ' ' LYS . 16.4 t70 -65.37 -46.3 80.7 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 115.898 -0.592 . . . . 0.0 110.357 178.056 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 79' ' ' GLY . . . . . . . . . . . . . . . 121.77 58.28 0.22 Allowed Glycine 0 N--CA 1.445 -0.714 0 C-N-CA 120.858 -0.687 . . . . 0.0 112.378 177.827 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 80' ' ' VAL . . . . . . . . . . . . . 29.8 m -100.65 141.36 17.59 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.5 0 CA-C-O 120.714 0.292 . . . . 0.0 110.533 177.492 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 81' ' ' SER . . . . . . . . . . . . . 32.0 m -57.56 156.17 8.6 Favored 'General case' 0 C--N 1.326 -0.438 0 CA-C-N 115.815 -0.629 . . . . 0.0 110.932 178.645 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 82' ' ' VAL . . . . . . . . . . . . . 7.1 p -58.2 -44.59 88.13 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.281 0 CA-C-N 116.651 -0.249 . . . . 0.0 111.504 -175.506 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 83' ' ' SER . . . . . . . . . . . . . 22.3 m -66.01 -33.13 75.11 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-O 120.771 0.32 . . . . 0.0 110.258 179.041 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 84' ' ' GLN . . . . . . . . . . . . . 52.6 tp60 -68.47 -39.17 81.5 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 115.798 -0.637 . . . . 0.0 110.26 -179.177 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 85' ' ' LEU . . . . . . . . . . . . . 49.1 tp -68.24 -33.49 74.48 Favored 'General case' 0 C--N 1.325 -0.483 0 CA-C-N 116.12 -0.491 . . . . 0.0 110.2 177.166 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 86' ' ' ASN . . . . . . . . . . . . . 90.5 m-20 -76.76 -30.64 56.61 Favored 'General case' 0 C--N 1.327 -0.4 0 CA-C-N 116.111 -0.495 . . . . 0.0 111.144 -179.791 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 87' ' ' SER . . . . . . . . . . . . . 2.9 p -69.75 -38.89 76.96 Favored 'General case' 0 N--CA 1.453 -0.28 0 C-N-CA 120.535 -0.466 . . . . 0.0 109.959 175.25 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 88' ' ' TYR . . . . . . . . . . . . . 16.3 m-85 -60.5 -43.06 97.43 Favored 'General case' 0 C--O 1.232 0.183 0 N-CA-C 109.491 -0.559 . . . . 0.0 109.491 171.32 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 89' ' ' LYS . . . . . 0.428 ' HD3' HD13 ' A' ' 72' ' ' LEU . 1.5 tppp? -54.81 -43.87 73.3 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 115.01 -0.996 . . . . 0.0 110.004 177.392 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 90' ' ' ASN . . . . . . . . . . . . . 48.1 t30 -63.94 -57.18 10.53 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 115.07 -0.968 . . . . 0.0 111.307 -178.571 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 91' ' ' TYR . . . . . . . . . . . . . 31.3 m-85 -54.48 -45.42 73.19 Favored 'General case' 0 C--O 1.235 0.33 0 CA-C-O 120.614 0.245 . . . . 0.0 111.551 -176.411 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 92' ' ' CYS . . . . . . . . . . . . . 62.1 m -68.13 -42.35 80.32 Favored 'General case' 0 C--N 1.326 -0.416 0 N-CA-C 112.518 0.562 . . . . 0.0 112.518 -175.235 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 93' ' ' ARG . . . . . 0.435 ' O ' ' HB3' ' A' ' 97' ' ' SER . 52.0 ttt180 -94.89 -24.85 16.83 Favored 'General case' 0 C--N 1.326 -0.419 0 C-N-CA 120.158 -0.617 . . . . 0.0 112.133 -172.698 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 94' ' ' ASN . . . . . . . . . . . . . 49.8 t-20 -85.79 -61.64 1.71 Allowed 'General case' 0 C--N 1.324 -0.521 0 C-N-CA 120.816 -0.354 . . . . 0.0 110.709 -178.159 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 95' ' ' HIS . . . . . . . . . . . . . 14.3 m80 -86.94 -40.73 14.54 Favored 'General case' 0 C--N 1.326 -0.415 0 N-CA-C 112.387 0.514 . . . . 0.0 112.387 -176.558 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 96' ' ' LEU . . . . . 0.513 HD22 HD12 ' A' ' 99' ' ' LEU . 89.7 mt -88.31 20.91 3.05 Favored 'General case' 0 C--N 1.327 -0.393 0 CA-C-O 120.828 0.346 . . . . 0.0 111.141 -177.037 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 97' ' ' SER . . . . . 0.527 ' N ' ' HD2' ' A' ' 98' ' ' PRO . 1.6 p -58.51 -45.55 99.66 Favored Pre-proline 0 CA--C 1.543 0.681 0 N-CA-C 112.925 0.713 . . . . 0.0 112.925 -177.901 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 98' ' ' PRO . . . . . 0.527 ' HD2' ' N ' ' A' ' 97' ' ' SER . 18.1 Cg_endo -61.28 -34.44 87.9 Favored 'Trans proline' 0 C--N 1.361 1.186 0 C-N-CA 121.623 1.549 . . . . 0.0 112.215 178.091 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 99' ' ' LEU . . . . . 0.513 HD12 HD22 ' A' ' 96' ' ' LEU . 80.6 mt -74.1 -33.37 63.6 Favored 'General case' 0 C--N 1.326 -0.42 0 CA-C-O 120.968 0.413 . . . . 0.0 110.451 -179.288 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 100' ' ' TYR . . . . . . . . . . . . . 38.2 t80 -60.14 -26.29 66.16 Favored 'General case' 0 CA--C 1.532 0.272 0 CA-C-N 115.688 -0.687 . . . . 0.0 110.301 178.551 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 101' ' ' MET . . . . . . . . . . . . . 55.0 mtt -96.54 6.92 47.74 Favored 'General case' 0 C--O 1.236 0.361 0 CA-C-N 115.666 -0.697 . . . . 0.0 111.005 -178.439 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 102' ' ' LYS . . . . . 0.528 ' HE3' HG12 ' A' ' 107' ' ' ILE . 27.3 mtpp -109.15 166.7 10.65 Favored 'General case' 0 C--N 1.324 -0.518 0 CA-C-N 116.172 -0.467 . . . . 0.0 110.984 -179.068 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 103' ' ' SER . . . . . 0.584 ' HB3' ' HG2' ' A' ' 106' ' ' GLU . 20.0 t -94.13 149.12 21.53 Favored 'General case' 0 N--CA 1.449 -0.495 0 N-CA-C 108.743 -0.836 . . . . 0.0 108.743 176.796 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 104' ' ' LEU . . . . . 0.515 HD21 ' HB1' ' A' ' 140' ' ' ALA . 35.9 tp -52.54 -52.3 55.44 Favored 'General case' 0 C--N 1.322 -0.615 0 N-CA-C 112.78 0.659 . . . . 0.0 112.78 -170.147 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 105' ' ' SER . . . . . . . . . . . . . 38.4 m -82.91 -7.36 59.67 Favored 'General case' 0 C--N 1.322 -0.61 0 N-CA-C 112.905 0.706 . . . . 0.0 112.905 -172.828 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 106' ' ' GLU . . . . . 0.584 ' HG2' ' HB3' ' A' ' 103' ' ' SER . 1.1 pp20? -106.48 15.42 25.95 Favored 'General case' 0 C--O 1.233 0.196 0 CA-C-O 121.233 0.54 . . . . 0.0 111.19 -178.899 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 107' ' ' ILE . . . . . 0.528 HG12 ' HE3' ' A' ' 102' ' ' LYS . 80.0 mt -88.14 134.57 27.69 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.56 0 CA-C-N 115.866 -0.606 . . . . 0.0 109.664 173.061 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 108' ' ' LEU . . . . . . . . . . . . . 97.9 mt -105.21 150.21 38.58 Favored Pre-proline 0 C--N 1.327 -0.413 0 CA-C-N 116.465 -0.334 . . . . 0.0 110.479 178.505 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 109' ' ' PRO . . . . . . . . . . . . . 36.5 Cg_exo -60.88 -26.27 82.8 Favored 'Trans proline' 0 C--N 1.343 0.275 0 C-N-CA 122.491 2.127 . . . . 0.0 111.257 175.136 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 110' ' ' ALA . . . . . . . . . . . . . . . -64.77 -38.94 92.69 Favored 'General case' 0 C--N 1.331 -0.227 0 CA-C-N 115.495 -0.775 . . . . 0.0 110.958 178.786 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 111' ' ' ASP . . . . . . . . . . . . . 41.5 m-20 -61.88 -49.66 75.35 Favored 'General case' 0 CA--C 1.52 -0.209 0 CA-C-O 121.074 0.464 . . . . 0.0 109.935 177.759 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 112' ' ' ILE . . . . . 0.44 ' O ' HG12 ' A' ' 116' ' ' ILE . 39.2 mt -62.31 -43.46 98.08 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.249 0 CA-C-N 115.556 -0.747 . . . . 0.0 110.871 -179.193 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 113' ' ' GLN . . . . . . . . . . . . . 7.8 tp-100 -61.34 -38.61 87.56 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.364 -0.38 . . . . 0.0 110.642 178.908 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 114' ' ' SER . . . . . . . . . . . . . 48.2 m -62.72 -41.32 99.1 Favored 'General case' 0 C--N 1.326 -0.42 0 CA-C-N 116.137 -0.483 . . . . 0.0 110.253 177.14 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 115' ' ' ILE . . . . . 0.433 HD11 ' HG2' ' A' ' 98' ' ' PRO . 74.4 mt -62.53 -44.2 99.1 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.214 0 CA-C-N 116.338 -0.392 . . . . 0.0 110.454 176.982 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 116' ' ' ILE . . . . . 0.44 HG12 ' O ' ' A' ' 112' ' ' ILE . 45.4 mm -58.96 -46.88 91.24 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.337 0 CA-C-N 116.034 -0.53 . . . . 0.0 110.915 178.717 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 117' ' ' ASN . . . . . . . . . . . . . 28.7 t-20 -75.07 -23.16 58.0 Favored 'General case' 0 C--N 1.326 -0.442 0 CA-C-N 116.388 -0.369 . . . . 0.0 111.227 -178.189 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 118' ' ' GLU . . . . . . . . . . . . . 7.6 mm-40 -79.7 -20.71 45.9 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-O 120.755 0.312 . . . . 0.0 110.42 175.075 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 119' ' ' THR . . . . . . . . . . . . . 80.9 m -73.48 112.9 10.0 Favored 'General case' 0 N--CA 1.449 -0.488 0 N-CA-C 109.661 -0.496 . . . . 0.0 109.661 175.456 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 120' ' ' LYS . . . . . . . . . . . . . 6.5 ptmt -93.55 26.55 2.98 Favored 'General case' 0 C--N 1.321 -0.639 0 CA-C-N 115.863 -0.608 . . . . 0.0 111.364 -174.846 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 121' ' ' LEU . . . . . . . . . . . . . 3.8 mm? -95.95 -175.82 3.52 Favored 'General case' 0 C--N 1.327 -0.398 0 CA-C-N 115.763 -0.653 . . . . 0.0 110.374 178.879 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 122' ' ' ALA . . . . . 0.406 ' O ' ' HG ' ' A' ' 126' ' ' LEU . . . -87.58 174.03 8.71 Favored 'General case' 0 C--N 1.327 -0.391 0 N-CA-C 112.38 0.511 . . . . 0.0 112.38 -173.521 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 123' ' ' LYS . . . . . . . . . . . . . 14.4 tttm -48.24 -48.22 35.38 Favored 'General case' 0 N--CA 1.467 0.382 0 CA-C-N 115.198 -0.91 . . . . 0.0 113.037 -178.122 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 124' ' ' ASN . . . . . . . . . . . . . 7.1 m-20 -63.52 -40.78 97.94 Favored 'General case' 0 C--N 1.326 -0.418 0 CA-C-O 120.533 0.206 . . . . 0.0 111.354 -176.204 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 125' ' ' THR . . . . . . . . . . . . . 13.3 m -66.77 -39.59 87.92 Favored 'General case' 0 C--N 1.325 -0.46 0 CA-C-O 120.739 0.304 . . . . 0.0 110.739 179.071 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 126' ' ' LEU . . . . . 0.406 ' HG ' ' O ' ' A' ' 122' ' ' ALA . 94.1 mt -59.93 -45.81 91.39 Favored 'General case' 0 N--CA 1.462 0.165 0 CA-C-O 121.197 0.522 . . . . 0.0 110.644 179.239 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 127' ' ' LYS . . . . . . . . . . . . . 58.0 mttm -71.08 -29.68 65.61 Favored 'General case' 0 C--N 1.326 -0.453 0 CA-C-N 115.712 -0.677 . . . . 0.0 111.274 -178.926 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 128' ' ' ALA . . . . . . . . . . . . . . . -62.48 -47.06 85.64 Favored 'General case' 0 C--N 1.326 -0.444 0 CA-C-N 116.223 -0.444 . . . . 0.0 110.322 175.753 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 129' ' ' ILE . . . . . . . . . . . . . 57.9 mt -65.15 -41.07 90.82 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.332 0 CA-C-N 116.112 -0.494 . . . . 0.0 110.021 176.734 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 130' ' ' ARG . . . . . 0.767 HH12 ' HB1' ' A' ' 151' ' ' ALA . 3.8 tpm_? -57.08 -56.21 24.75 Favored 'General case' 0 C--N 1.33 -0.24 0 CA-C-N 115.57 -0.741 . . . . 0.0 111.102 178.796 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 131' ' ' ASN . . . . . 0.498 ' O ' ' HG2' ' A' ' 135' ' ' GLN . 58.1 t30 -59.22 -46.5 88.3 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.359 -0.382 . . . . 0.0 110.822 -178.174 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 132' ' ' THR . . . . . 0.422 ' O ' HG13 ' A' ' 136' ' ' ILE . 61.0 m -56.67 -53.58 56.0 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.314 -0.403 . . . . 0.0 111.224 -179.312 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 133' ' ' ALA . . . . . . . . . . . . . . . -62.48 -34.7 77.35 Favored 'General case' 0 C--N 1.331 -0.217 0 CA-C-O 121.093 0.473 . . . . 0.0 110.965 -179.808 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 134' ' ' SER . . . . . . . . . . . . . 14.0 t -63.27 -46.58 86.16 Favored 'General case' 0 C--N 1.327 -0.374 0 CA-C-N 115.891 -0.595 . . . . 0.0 110.198 179.534 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 135' ' ' GLN . . . . . 0.498 ' HG2' ' O ' ' A' ' 131' ' ' ASN . 82.6 mm-40 -60.2 -39.73 87.59 Favored 'General case' 0 C--N 1.332 -0.175 0 CA-C-N 116.19 -0.459 . . . . 0.0 111.246 -178.952 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 136' ' ' ILE . . . . . 0.422 HG13 ' O ' ' A' ' 132' ' ' THR . 62.8 mt -59.16 -49.73 82.32 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.253 0 CA-C-N 116.343 -0.39 . . . . 0.0 110.733 -179.881 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 137' ' ' PHE . . . . . 0.562 ' O ' HG13 ' A' ' 141' ' ' ILE . 52.8 m-85 -63.29 -41.69 98.99 Favored 'General case' 0 C--N 1.331 -0.217 0 CA-C-N 116.344 -0.389 . . . . 0.0 110.764 177.625 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 138' ' ' ARG . . . . . 0.453 ' O ' ' HG2' ' A' ' 142' ' ' GLU . 72.9 mtp180 -59.79 -42.98 94.58 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.067 -0.515 . . . . 0.0 111.137 179.571 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 139' ' ' LEU . . . . . . . . . . . . . 50.3 tp -60.21 -39.0 85.06 Favored 'General case' 0 C--N 1.325 -0.481 0 CA-C-N 116.091 -0.504 . . . . 0.0 110.685 178.069 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 140' ' ' ALA . . . . . 0.515 ' HB1' HD21 ' A' ' 104' ' ' LEU . . . -67.57 -39.73 84.88 Favored 'General case' 0 C--N 1.326 -0.434 0 CA-C-N 116.193 -0.458 . . . . 0.0 110.668 178.014 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 141' ' ' ILE . . . . . 0.562 HG13 ' O ' ' A' ' 137' ' ' PHE . 66.5 mt -62.96 -39.42 85.06 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.27 0 CA-C-N 116.064 -0.517 . . . . 0.0 110.662 177.007 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 142' ' ' GLU . . . . . 0.453 ' HG2' ' O ' ' A' ' 138' ' ' ARG . 35.8 mm-40 -54.5 -45.07 73.19 Favored 'General case' 0 N--CA 1.463 0.196 0 CA-C-O 121.161 0.505 . . . . 0.0 111.053 177.521 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 143' ' ' ASN . . . . . . . . . . . . . 41.0 m-80 -85.78 6.55 27.5 Favored 'General case' 0 C--N 1.327 -0.409 0 CA-C-N 115.683 -0.69 . . . . 0.0 110.676 -178.34 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 144' ' ' ARG . . . . . 0.4 HH11 ' HD2' ' A' ' 144' ' ' ARG . 41.1 mtp85 58.02 28.09 15.77 Favored 'General case' 0 N--CA 1.465 0.315 0 CA-C-N 115.706 -0.679 . . . . 0.0 112.106 179.54 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 145' ' ' ALA . . . . . . . . . . . . . . . -76.53 -23.01 53.63 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-O 121.739 0.78 . . . . 0.0 109.496 174.663 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 146' ' ' ILE . . . . . 0.549 ' O ' ' HA ' ' A' ' 141' ' ' ILE . 14.6 tt -149.77 144.01 17.77 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.713 0 CA-C-N 114.772 -1.103 . . . . 0.0 108.169 173.578 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 147' ' ' ASP . . . . . . . . . . . . . 30.4 t70 -116.55 27.3 9.28 Favored 'General case' 0 C--N 1.319 -0.755 0 CA-C-O 122.117 0.961 . . . . 0.0 109.158 -179.233 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 148' ' ' PHE . . . . . 0.484 ' H ' HG12 ' A' ' 146' ' ' ILE . 69.8 t80 -137.39 136.97 38.35 Favored 'General case' 0 C--N 1.318 -0.786 0 CA-C-N 114.603 -1.18 . . . . 0.0 109.032 -175.755 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 149' ' ' ASN . . . . . . . . . . . . . 66.5 t30 -120.19 90.06 44.11 Favored Pre-proline 0 C--N 1.322 -0.616 0 C-N-CA 120.89 -0.324 . . . . 0.0 110.74 -177.318 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 150' ' ' PRO . . . . . . . . . . . . . 21.7 Cg_exo -64.45 -22.85 65.32 Favored 'Trans proline' 0 C--N 1.345 0.35 0 C-N-CA 122.559 2.173 . . . . 0.0 111.108 178.542 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 151' ' ' ALA . . . . . 0.767 ' HB1' HH12 ' A' ' 130' ' ' ARG . . . -66.11 -27.45 68.06 Favored 'General case' 0 N--CA 1.45 -0.428 0 CA-C-N 115.062 -0.972 . . . . 0.0 111.514 -177.819 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 152' ' ' ASP . . . . . . . . . . . . . 14.6 t70 -71.69 -25.35 62.07 Favored 'General case' 0 C--N 1.327 -0.401 0 CA-C-O 121.07 0.462 . . . . 0.0 110.498 -177.354 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 153' ' ' TYR . . . . . . . . . . . . . 92.4 m-85 -87.41 0.15 55.93 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 115.893 -0.594 . . . . 0.0 110.977 -178.464 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 154' ' ' VAL . . . . . . . . . . . . . 55.9 t -88.34 107.24 17.38 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.416 0 N-CA-C 109.967 -0.383 . . . . 0.0 109.967 178.822 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 155' ' ' ARG . . . . . . . . . . . . . 10.4 tpt180 -89.49 130.44 35.83 Favored 'General case' 0 C--N 1.323 -0.554 0 CA-C-N 116.0 -0.545 . . . . 0.0 110.892 -177.374 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 156' ' ' ILE . . . . . . . . . . . . . 48.0 mm -96.81 115.61 65.76 Favored Pre-proline 0 C--N 1.323 -0.545 0 CA-C-N 116.116 -0.493 . . . . 0.0 110.052 175.021 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 157' ' ' PRO . . . . . . . . . . . . . 93.9 Cg_endo . . . . . 0 N--CA 1.458 -0.57 0 C-N-CA 122.708 2.272 . . . . 0.0 112.318 176.933 . . . . . . . . 0 0 . 1 . 016 nuclear build core ' A' A ' 63' ' ' SER . . . . . . . . . . . . . 19.4 m . . . . . 0 C--O 1.234 0.279 0 N-CA-C 110.152 -0.314 . . . . 0.0 110.152 . . . . . . . . . 0 0 . 1 . 016 nuclear build core ' A' A ' 64' ' ' PHE . . . . . . . . . . . . . 77.8 t80 -59.04 -33.01 70.27 Favored 'General case' 0 N--CA 1.464 0.236 0 CA-C-O 120.68 0.276 . . . . 0.0 110.578 -177.491 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 65' ' ' GLY . . . . . . . . . . . . . . . -57.87 -41.21 94.03 Favored Glycine 0 N--CA 1.448 -0.559 0 C-N-CA 120.856 -0.688 . . . . 0.0 112.366 176.495 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 66' ' ' ASP . . . . . 0.59 ' O ' ' HG3' ' A' ' 70' ' ' LYS . 6.8 t0 -72.66 -41.27 65.61 Favored 'General case' 0 C--N 1.327 -0.392 0 N-CA-C 109.618 -0.512 . . . . 0.0 109.618 179.78 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 67' ' ' TRP . . . . . . . . . . . . . 97.6 m95 -59.71 -38.33 81.32 Favored 'General case' 0 N--CA 1.464 0.268 0 CA-C-N 116.344 -0.389 . . . . 0.0 110.751 177.184 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 68' ' ' ALA . . . . . . . . . . . . . . . -61.23 -44.5 97.16 Favored 'General case' 0 C--N 1.326 -0.435 0 CA-C-N 116.293 -0.412 . . . . 0.0 110.081 176.314 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 69' ' ' GLU . . . . . . . . . . . . . 28.7 tt0 -62.26 -41.17 98.21 Favored 'General case' 0 CA--C 1.53 0.175 0 CA-C-N 116.116 -0.493 . . . . 0.0 110.024 176.943 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 70' ' ' LYS . . . . . 0.59 ' HG3' ' O ' ' A' ' 66' ' ' ASP . 51.8 mttm -57.34 -44.31 84.16 Favored 'General case' 0 C--O 1.232 0.158 0 CA-C-N 116.354 -0.385 . . . . 0.0 110.587 177.711 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 71' ' ' PHE . . . . . . . . . . . . . 89.2 t80 -60.4 -52.52 64.89 Favored 'General case' 0 C--N 1.331 -0.22 0 CA-C-N 115.905 -0.589 . . . . 0.0 110.63 -179.709 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 72' ' ' LEU . . . . . 0.468 HD12 HD13 ' A' ' 85' ' ' LEU . 4.2 mm? -59.65 -47.4 85.77 Favored 'General case' 0 C--N 1.331 -0.231 0 CA-C-N 116.292 -0.413 . . . . 0.0 110.755 178.856 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 73' ' ' LYS . . . . . 0.444 ' HB2' ' HE3' ' A' ' 73' ' ' LYS . 36.0 ttmt -56.43 -46.64 80.16 Favored 'General case' 0 C--N 1.325 -0.469 0 CA-C-N 115.556 -0.747 . . . . 0.0 110.547 179.774 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 74' ' ' SER . . . . . . . . . . . . . 42.0 m -68.15 -43.79 77.46 Favored 'General case' 0 C--N 1.327 -0.395 0 CA-C-N 115.778 -0.646 . . . . 0.0 111.186 -179.69 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 75' ' ' LYS . . . . . 0.453 ' O ' HG22 ' A' ' 80' ' ' VAL . 3.6 mmtm -69.18 -32.5 71.85 Favored 'General case' 0 C--N 1.331 -0.215 0 CA-C-N 116.701 -0.227 . . . . 0.0 111.423 -177.64 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 76' ' ' GLU . . . . . . . . . . . . . 39.3 tt0 -58.27 -50.68 72.74 Favored 'General case' 0 C--N 1.327 -0.413 0 CA-C-O 121.009 0.433 . . . . 0.0 109.978 173.975 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 77' ' ' ALA . . . . . . . . . . . . . . . -75.45 -10.06 59.12 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 115.689 -0.687 . . . . 0.0 111.108 179.137 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 78' ' ' ASP . . . . . . . . . . . . . 34.5 t70 -76.13 -11.81 60.0 Favored 'General case' 0 C--N 1.324 -0.502 0 CA-C-N 115.727 -0.67 . . . . 0.0 110.885 -177.925 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 79' ' ' GLY . . . . . . . . . . . . . . . 103.55 33.99 3.99 Favored Glycine 0 N--CA 1.451 -0.366 0 C-N-CA 120.632 -0.794 . . . . 0.0 113.332 174.012 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 80' ' ' VAL . . . . . 0.453 HG22 ' O ' ' A' ' 75' ' ' LYS . 31.4 m -101.09 159.53 3.93 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.411 0 CA-C-N 116.935 0.368 . . . . 0.0 110.549 176.653 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 81' ' ' SER . . . . . . . . . . . . . 7.1 p -81.78 174.95 10.84 Favored 'General case' 0 C--N 1.324 -0.54 0 CA-C-N 116.164 -0.471 . . . . 0.0 110.868 179.195 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 82' ' ' VAL . . . . . . . . . . . . . 61.0 t -68.29 -41.66 83.9 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.397 0 CA-C-N 116.341 -0.391 . . . . 0.0 110.615 -177.707 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 83' ' ' SER . . . . . . . . . . . . . 53.0 p -58.9 -39.19 80.74 Favored 'General case' 0 C--N 1.332 -0.188 0 CA-C-O 121.248 0.547 . . . . 0.0 110.507 177.964 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 84' ' ' GLN . . . . . . . . . . . . . 6.5 tp-100 -66.52 -47.98 71.21 Favored 'General case' 0 C--N 1.325 -0.465 0 CA-C-N 115.65 -0.705 . . . . 0.0 110.146 177.822 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 85' ' ' LEU . . . . . 0.468 HD13 HD12 ' A' ' 72' ' ' LEU . 0.6 OUTLIER -62.47 -43.43 98.84 Favored 'General case' 0 C--N 1.326 -0.432 0 CA-C-N 115.599 -0.728 . . . . 0.0 110.559 -178.364 . . . . . . . . 3 3 . 1 . 016 nuclear build core ' A' A ' 86' ' ' ASN . . . . . . . . . . . . . 11.8 m120 -61.44 -38.85 88.68 Favored 'General case' 0 N--CA 1.465 0.297 0 CA-C-O 120.689 0.28 . . . . 0.0 111.005 179.409 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 87' ' ' SER . . . . . . . . . . . . . 49.6 m -60.2 -44.38 95.16 Favored 'General case' 0 C--N 1.327 -0.378 0 CA-C-N 116.32 -0.4 . . . . 0.0 110.772 -179.707 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 88' ' ' TYR . . . . . 0.441 ' HB2' HD11 ' A' ' 72' ' ' LEU . 25.8 m-85 -62.56 -37.97 88.23 Favored 'General case' 0 C--N 1.331 -0.235 0 CA-C-N 116.452 -0.34 . . . . 0.0 110.495 177.706 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 89' ' ' LYS . . . . . 0.62 ' HA ' ' SG ' ' A' ' 92' ' ' CYS . 56.3 mtpt -66.09 -36.74 83.99 Favored 'General case' 0 C--N 1.331 -0.226 0 CA-C-N 116.201 -0.454 . . . . 0.0 110.589 178.522 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 90' ' ' ASN . . . . . 0.507 ' O ' ' HB2' ' A' ' 94' ' ' ASN . 27.3 t-20 -60.98 -33.34 73.07 Favored 'General case' 0 C--N 1.327 -0.382 0 CA-C-O 121.347 0.594 . . . . 0.0 110.375 176.234 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 91' ' ' TYR . . . . . . . . . . . . . 24.1 m-85 -72.18 -50.58 26.57 Favored 'General case' 0 C--N 1.322 -0.616 0 CA-C-N 116.064 -0.516 . . . . 0.0 110.841 178.783 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 92' ' ' CYS . . . . . 0.62 ' SG ' ' HA ' ' A' ' 89' ' ' LYS . 24.9 p -76.81 -40.82 46.73 Favored 'General case' 0 C--N 1.328 -0.331 0 N-CA-C 112.226 0.454 . . . . 0.0 112.226 -174.593 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 93' ' ' ARG . . . . . . . . . . . . . 35.6 ttt180 -78.17 -52.75 8.23 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-O 120.812 0.339 . . . . 0.0 111.834 -176.68 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 94' ' ' ASN . . . . . 0.507 ' HB2' ' O ' ' A' ' 90' ' ' ASN . 3.9 m-20 -77.88 -50.21 12.7 Favored 'General case' 0 C--N 1.324 -0.508 0 CA-C-O 120.976 0.417 . . . . 0.0 111.161 -173.266 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 95' ' ' HIS . . . . . . . . . . . . . 76.0 m80 -86.9 -54.12 4.52 Favored 'General case' 0 C--N 1.323 -0.564 0 CA-C-N 116.193 -0.458 . . . . 0.0 112.101 -173.827 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 96' ' ' LEU . . . . . 0.559 ' HB2' ' HA ' ' A' ' 92' ' ' CYS . 81.8 mt -87.54 26.81 1.2 Allowed 'General case' 0 C--N 1.326 -0.415 0 N-CA-C 111.789 0.292 . . . . 0.0 111.789 -173.471 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 97' ' ' SER . . . . . 0.534 ' N ' ' HD2' ' A' ' 98' ' ' PRO . 0.0 OUTLIER -56.66 -48.05 97.91 Favored Pre-proline 0 CA--C 1.54 0.595 0 N-CA-C 112.595 0.591 . . . . 0.0 112.595 -179.16 . . . . . . . . 3 3 . 1 . 016 nuclear build core ' A' A ' 98' ' ' PRO . . . . . 0.534 ' HD2' ' N ' ' A' ' 97' ' ' SER . 15.7 Cg_endo -58.62 -36.54 97.12 Favored 'Trans proline' 0 C--N 1.358 1.037 0 C-N-CA 122.032 1.821 . . . . 0.0 112.336 176.409 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 99' ' ' LEU . . . . . 0.434 HD22 HD22 ' A' ' 96' ' ' LEU . 8.1 mp -70.09 -33.65 72.15 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-N 116.304 -0.407 . . . . 0.0 110.503 -179.342 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 100' ' ' TYR . . . . . . . . . . . . . 62.9 t80 -57.42 -29.79 64.44 Favored 'General case' 0 C--N 1.327 -0.391 0 CA-C-N 115.541 -0.754 . . . . 0.0 110.926 179.272 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 101' ' ' MET . . . . . . . . . . . . . 47.4 ttm -86.6 -18.61 30.99 Favored 'General case' 0 C--N 1.325 -0.468 0 CA-C-N 116.008 -0.542 . . . . 0.0 110.88 -177.344 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 102' ' ' LYS . . . . . . . . . . . . . 89.2 mttt -91.02 165.2 13.66 Favored 'General case' 0 C--N 1.325 -0.495 0 CA-C-O 121.453 0.644 . . . . 0.0 111.944 -174.348 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 103' ' ' SER . . . . . 0.472 ' O ' HG13 ' A' ' 107' ' ' ILE . 18.1 t -95.02 172.2 8.29 Favored 'General case' 0 C--N 1.323 -0.582 0 CA-C-N 115.396 -0.82 . . . . 0.0 109.051 169.336 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 104' ' ' LEU . . . . . . . . . . . . . 89.0 mt -59.07 -43.72 91.8 Favored 'General case' 0 C--N 1.325 -0.458 0 N-CA-C 111.993 0.368 . . . . 0.0 111.993 -174.686 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 105' ' ' SER . . . . . . . . . . . . . 24.1 t -85.04 1.97 45.32 Favored 'General case' 0 C--N 1.326 -0.447 0 CA-C-O 121.099 0.476 . . . . 0.0 110.74 -177.315 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 106' ' ' GLU . . . . . . . . . . . . . 19.7 tp10 -102.36 -14.06 17.07 Favored 'General case' 0 C--N 1.322 -0.63 0 CA-C-O 121.268 0.556 . . . . 0.0 110.531 -178.128 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 107' ' ' ILE . . . . . 0.472 HG13 ' O ' ' A' ' 103' ' ' SER . 68.3 mt -83.81 140.38 16.27 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.45 0 CA-C-N 116.09 -0.504 . . . . 0.0 110.953 -178.626 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 108' ' ' LEU . . . . . . . . . . . . . 76.1 mt -110.81 151.22 42.76 Favored Pre-proline 0 C--N 1.324 -0.513 0 CA-C-N 116.023 -0.535 . . . . 0.0 109.71 178.161 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 109' ' ' PRO . . . . . . . . . . . . . 18.9 Cg_endo -61.08 -26.8 83.43 Favored 'Trans proline' 0 N--CA 1.464 -0.212 0 C-N-CA 121.979 1.786 . . . . 0.0 111.166 174.633 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 110' ' ' ALA . . . . . 0.425 ' HA ' ' HB3' ' A' ' 113' ' ' GLN . . . -71.48 -26.34 62.65 Favored 'General case' 0 N--CA 1.453 -0.288 0 CA-C-N 115.351 -0.841 . . . . 0.0 111.683 -178.78 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 111' ' ' ASP . . . . . 0.466 ' O ' HG13 ' A' ' 115' ' ' ILE . 29.7 m-20 -57.74 -57.15 14.02 Favored 'General case' 0 N--CA 1.463 0.223 0 CA-C-O 121.272 0.558 . . . . 0.0 109.648 176.426 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 112' ' ' ILE . . . . . . . . . . . . . 19.5 mt -67.23 -37.49 79.22 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.538 0 CA-C-N 115.449 -0.796 . . . . 0.0 110.337 -179.162 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 113' ' ' GLN . . . . . 0.425 ' HB3' ' HA ' ' A' ' 110' ' ' ALA . 23.4 tp60 -58.27 -50.12 74.71 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 115.864 -0.607 . . . . 0.0 111.446 179.651 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 114' ' ' SER . . . . . . . . . . . . . 31.6 p -64.7 -35.2 80.27 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 116.335 -0.393 . . . . 0.0 110.956 -177.963 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 115' ' ' ILE . . . . . 0.466 HG13 ' O ' ' A' ' 111' ' ' ASP . 92.7 mt -60.44 -53.3 50.69 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.299 0 CA-C-O 120.694 0.283 . . . . 0.0 110.359 175.979 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 116' ' ' ILE . . . . . . . . . . . . . 47.5 mm -60.16 -41.95 88.47 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.289 0 CA-C-N 116.121 -0.49 . . . . 0.0 110.924 -179.435 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 117' ' ' ASN . . . . . . . . . . . . . 27.9 t-20 -65.49 -32.67 74.41 Favored 'General case' 0 C--N 1.326 -0.447 0 CA-C-N 116.066 -0.515 . . . . 0.0 111.926 -176.896 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 118' ' ' GLU . . . . . . . . . . . . . 21.3 mt-10 -103.17 4.18 36.6 Favored 'General case' 0 C--N 1.329 -0.311 0 N-CA-C 112.176 0.436 . . . . 0.0 112.176 -177.663 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 119' ' ' THR . . . . . . . . . . . . . 96.7 m -97.85 112.06 24.12 Favored 'General case' 0 C--N 1.322 -0.596 0 CA-C-O 121.176 0.512 . . . . 0.0 110.239 173.636 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 120' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -93.86 88.62 5.82 Favored 'General case' 0 C--N 1.325 -0.458 0 CA-C-N 115.943 -0.571 . . . . 0.0 110.362 -177.869 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 121' ' ' LEU . . . . . 0.415 HD13 HG21 ' A' ' 125' ' ' THR . 57.6 mt -138.69 -174.7 3.9 Favored 'General case' 0 C--N 1.32 -0.694 0 CA-C-N 115.392 -0.822 . . . . 0.0 110.025 179.541 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 122' ' ' ALA . . . . . . . . . . . . . . . -64.85 147.39 53.36 Favored 'General case' 0 C--N 1.322 -0.612 0 CA-C-N 116.277 -0.42 . . . . 0.0 110.465 178.439 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 123' ' ' LYS . . . . . 0.403 ' O ' ' HG3' ' A' ' 127' ' ' LYS . 52.6 mttp -55.94 -33.96 65.21 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 115.997 -0.547 . . . . 0.0 111.353 -179.345 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 124' ' ' ASN . . . . . . . . . . . . . 65.5 t30 -64.74 -38.49 91.17 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 115.978 -0.555 . . . . 0.0 110.413 -179.987 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 125' ' ' THR . . . . . 0.475 ' O ' HG13 ' A' ' 129' ' ' ILE . 7.3 m -68.25 -37.52 80.85 Favored 'General case' 0 C--N 1.326 -0.417 0 CA-C-N 115.774 -0.648 . . . . 0.0 110.801 -179.444 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 126' ' ' LEU . . . . . . . . . . . . . 88.5 mt -61.84 -41.8 98.26 Favored 'General case' 0 C--O 1.234 0.289 0 CA-C-O 121.144 0.497 . . . . 0.0 110.221 178.595 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 127' ' ' LYS . . . . . 0.403 ' HG3' ' O ' ' A' ' 123' ' ' LYS . 93.5 mttt -63.49 -44.68 93.66 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 115.663 -0.698 . . . . 0.0 110.201 177.142 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 128' ' ' ALA . . . . . . . . . . . . . . . -57.57 -40.45 78.98 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 115.717 -0.674 . . . . 0.0 111.477 -178.404 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 129' ' ' ILE . . . . . 0.475 HG13 ' O ' ' A' ' 125' ' ' THR . 67.3 mt -62.63 -50.19 80.77 Favored 'Isoleucine or valine' 0 C--O 1.235 0.295 0 CA-C-N 116.478 -0.328 . . . . 0.0 110.687 178.809 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 130' ' ' ARG . . . . . . . . . . . . . 13.7 ttt180 -61.63 -45.68 93.02 Favored 'General case' 0 C--O 1.231 0.107 0 CA-C-N 116.467 -0.333 . . . . 0.0 110.782 178.106 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 131' ' ' ASN . . . . . . . . . . . . . 7.1 m-20 -58.29 -49.54 76.77 Favored 'General case' 0 C--N 1.325 -0.457 0 CA-C-N 116.36 -0.382 . . . . 0.0 111.49 -179.061 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 132' ' ' THR . . . . . 0.484 ' O ' HG13 ' A' ' 136' ' ' ILE . 52.9 m -54.76 -50.72 67.76 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 116.227 -0.442 . . . . 0.0 110.594 178.268 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 133' ' ' ALA . . . . . . . . . . . . . . . -61.06 -40.91 95.46 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.209 -0.451 . . . . 0.0 111.103 179.436 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 134' ' ' SER . . . . . 0.455 ' O ' ' HG3' ' A' ' 138' ' ' ARG . 58.7 m -59.29 -45.57 90.9 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.044 -0.526 . . . . 0.0 111.123 -179.884 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 135' ' ' GLN . . . . . . . . . . . . . 12.3 mm100 -66.0 -34.85 79.04 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.399 -0.364 . . . . 0.0 111.071 -177.716 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 136' ' ' ILE . . . . . 0.484 HG13 ' O ' ' A' ' 132' ' ' THR . 64.3 mt -64.68 -43.81 96.61 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.264 0 CA-C-O 120.843 0.354 . . . . 0.0 110.166 177.219 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 137' ' ' PHE . . . . . 0.531 ' O ' HG13 ' A' ' 141' ' ' ILE . 43.5 m-85 -63.9 -39.86 95.16 Favored 'General case' 0 C--N 1.332 -0.18 0 CA-C-N 116.179 -0.464 . . . . 0.0 110.671 176.346 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 138' ' ' ARG . . . . . 0.455 ' HG3' ' O ' ' A' ' 134' ' ' SER . 79.0 mtt180 -64.0 -36.38 83.8 Favored 'General case' 0 C--N 1.332 -0.185 0 CA-C-O 120.738 0.304 . . . . 0.0 110.634 178.605 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 139' ' ' LEU . . . . . . . . . . . . . 54.8 tp -59.22 -41.52 88.84 Favored 'General case' 0 C--N 1.326 -0.423 0 CA-C-N 116.056 -0.52 . . . . 0.0 110.043 176.13 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 140' ' ' ALA . . . . . . . . . . . . . . . -67.0 -36.3 81.86 Favored 'General case' 0 C--N 1.327 -0.385 0 CA-C-N 116.243 -0.435 . . . . 0.0 110.537 176.715 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 141' ' ' ILE . . . . . 0.604 ' HA ' ' O ' ' A' ' 146' ' ' ILE . 77.3 mt -63.51 -45.58 97.4 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.301 0 CA-C-N 116.083 -0.508 . . . . 0.0 110.582 176.776 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 142' ' ' GLU . . . . . . . . . . . . . 46.4 mt-10 -63.16 -27.66 69.52 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.015 -0.539 . . . . 0.0 111.159 179.534 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 143' ' ' ASN . . . . . . . . . . . . . 35.1 m-80 -95.97 11.85 32.48 Favored 'General case' 0 C--N 1.326 -0.421 0 CA-C-N 116.284 -0.416 . . . . 0.0 110.821 179.43 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 144' ' ' ARG . . . . . . . . . . . . . 81.5 mtm180 60.88 25.24 15.19 Favored 'General case' 0 N--CA 1.469 0.498 0 CA-C-N 115.7 -0.682 . . . . 0.0 112.553 174.589 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 145' ' ' ALA . . . . . . . . . . . . . . . -80.41 -42.35 22.92 Favored 'General case' 0 C--N 1.323 -0.553 0 CA-C-O 121.25 0.548 . . . . 0.0 110.309 177.835 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 146' ' ' ILE . . . . . 0.604 ' O ' ' HA ' ' A' ' 141' ' ' ILE . 13.7 tt -147.13 152.19 13.28 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.542 0 CA-C-N 115.677 -0.692 . . . . 0.0 109.336 179.412 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 147' ' ' ASP . . . . . . . . . . . . . 25.9 t70 -125.83 70.06 1.2 Allowed 'General case' 0 C--N 1.321 -0.634 0 N-CA-C 109.314 -0.625 . . . . 0.0 109.314 175.096 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 148' ' ' PHE . . . . . . . . . . . . . 61.5 t80 -169.48 133.8 1.37 Allowed 'General case' 0 C--N 1.324 -0.535 0 CA-C-N 115.618 -0.719 . . . . 0.0 109.647 -177.905 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 149' ' ' ASN . . . . . . . . . . . . . 59.0 t30 -115.7 96.3 46.06 Favored Pre-proline 0 C--N 1.322 -0.591 0 CA-C-N 116.478 -0.328 . . . . 0.0 110.737 179.369 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 150' ' ' PRO . . . . . . . . . . . . . 17.3 Cg_exo -67.4 -21.47 47.03 Favored 'Trans proline' 0 C--N 1.344 0.311 0 C-N-CA 122.852 2.368 . . . . 0.0 112.07 179.682 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 151' ' ' ALA . . . . . 0.407 ' HA ' HG23 ' A' ' 154' ' ' VAL . . . -72.18 -15.8 61.96 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-N 115.972 -0.558 . . . . 0.0 111.246 -178.582 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 152' ' ' ASP . . . . . . . . . . . . . 25.2 t70 -72.01 -19.56 61.84 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-O 121.212 0.53 . . . . 0.0 110.568 179.997 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 153' ' ' TYR . . . . . . . . . . . . . 97.8 m-85 -93.38 1.52 56.87 Favored 'General case' 0 C--N 1.326 -0.435 0 CA-C-N 115.958 -0.565 . . . . 0.0 111.251 -177.573 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 154' ' ' VAL . . . . . 0.407 HG23 ' HA ' ' A' ' 151' ' ' ALA . 48.8 t -77.2 110.82 13.3 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.373 0 CA-C-N 116.374 -0.376 . . . . 0.0 110.334 179.615 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 155' ' ' ARG . . . . . . . . . . . . . 77.0 mtt-85 -77.22 135.39 38.48 Favored 'General case' 0 C--N 1.321 -0.637 0 CA-C-N 116.181 -0.463 . . . . 0.0 110.273 179.279 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 156' ' ' ILE . . . . . . . . . . . . . 49.8 mm -105.06 104.92 49.48 Favored Pre-proline 0 C--N 1.321 -0.646 0 CA-C-N 115.736 -0.665 . . . . 0.0 109.77 -179.113 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 157' ' ' PRO . . . . . . . . . . . . . 58.2 Cg_endo . . . . . 0 N--CA 1.461 -0.394 0 C-N-CA 122.412 2.075 . . . . 0.0 112.227 -177.937 . . . . . . . . 0 0 . 1 . 017 nuclear build core ' A' A ' 63' ' ' SER . . . . . . . . . . . . . 21.9 p . . . . . 0 N--CA 1.451 -0.392 0 N-CA-C 110.077 -0.342 . . . . 0.0 110.077 . . . . . . . . . 0 0 . 1 . 017 nuclear build core ' A' A ' 64' ' ' PHE . . . . . 0.408 ' HB3' ' O ' ' A' ' 99' ' ' LEU . 83.0 t80 -61.84 -42.44 99.04 Favored 'General case' 0 C--N 1.326 -0.445 0 CA-C-N 116.448 -0.342 . . . . 0.0 110.746 -177.055 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 65' ' ' GLY . . . . . . . . . . . . . . . -63.46 -30.64 78.21 Favored Glycine 0 C--N 1.329 0.188 0 C-N-CA 120.898 -0.668 . . . . 0.0 113.019 -178.534 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 66' ' ' ASP . . . . . . . . . . . . . 23.7 t70 -71.31 -45.18 63.64 Favored 'General case' 0 C--N 1.326 -0.434 0 CA-C-O 121.067 0.46 . . . . 0.0 110.574 -179.525 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 67' ' ' TRP . . . . . 0.44 ' HA ' ' HE2' ' A' ' 70' ' ' LYS . 83.2 m95 -74.79 -28.89 60.92 Favored 'General case' 0 C--N 1.325 -0.493 0 CA-C-N 116.285 -0.416 . . . . 0.0 110.942 178.559 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 68' ' ' ALA . . . . . . . . . . . . . . . -64.28 -37.15 86.48 Favored 'General case' 0 C--N 1.331 -0.219 0 CA-C-O 121.008 0.432 . . . . 0.0 110.142 173.971 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 69' ' ' GLU . . . . . . . . . . . . . 43.4 tt0 -59.08 -48.64 80.85 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 115.661 -0.699 . . . . 0.0 109.964 175.661 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 70' ' ' LYS . . . . . 0.44 ' HE2' ' HA ' ' A' ' 67' ' ' TRP . 19.2 mtmm -62.45 -31.63 72.38 Favored 'General case' 0 C--N 1.328 -0.326 0 CA-C-N 115.665 -0.698 . . . . 0.0 111.427 177.428 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 71' ' ' PHE . . . . . 0.417 ' CE2' HG23 ' A' ' 132' ' ' THR . 92.1 t80 -68.14 -45.13 74.44 Favored 'General case' 0 C--O 1.235 0.298 0 CA-C-O 120.578 0.228 . . . . 0.0 111.072 178.78 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 72' ' ' LEU . . . . . . . . . . . . . 8.0 mp -60.07 -42.5 94.69 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-O 121.09 0.471 . . . . 0.0 110.637 177.668 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 73' ' ' LYS . . . . . . . . . . . . . 58.2 mtpt -72.6 -24.6 61.1 Favored 'General case' 0 C--N 1.325 -0.457 0 CA-C-N 115.874 -0.603 . . . . 0.0 110.707 179.207 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 74' ' ' SER . . . . . . . . . . . . . 26.7 t -68.44 -51.32 44.97 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 115.89 -0.596 . . . . 0.0 110.277 177.634 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 75' ' ' LYS . . . . . 0.423 ' O ' HG22 ' A' ' 80' ' ' VAL . 5.2 mptp? -68.42 -27.93 66.62 Favored 'General case' 0 C--O 1.234 0.241 0 CA-C-O 120.865 0.364 . . . . 0.0 110.719 178.741 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 76' ' ' GLU . . . . . . . . . . . . . 36.0 tt0 -56.48 -47.84 78.39 Favored 'General case' 0 C--N 1.324 -0.534 0 CA-C-N 115.803 -0.635 . . . . 0.0 109.772 172.07 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 77' ' ' ALA . . . . . . . . . . . . . . . -75.06 -23.72 58.1 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 115.645 -0.707 . . . . 0.0 111.164 177.904 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 78' ' ' ASP . . . . . . . . . . . . . 20.2 t70 -63.58 -31.61 72.83 Favored 'General case' 0 N--CA 1.464 0.237 0 CA-C-O 121.194 0.521 . . . . 0.0 110.581 178.318 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 79' ' ' GLY . . . . . . . . . . . . . . . 105.14 21.06 9.17 Favored Glycine 0 N--CA 1.446 -0.656 0 C-N-CA 120.636 -0.792 . . . . 0.0 112.795 176.229 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 80' ' ' VAL . . . . . 0.423 HG22 ' O ' ' A' ' 75' ' ' LYS . 25.7 m -71.02 153.5 8.3 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.451 0 CA-C-O 120.838 0.352 . . . . 0.0 110.29 178.986 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 81' ' ' SER . . . . . . . . . . . . . 10.7 p -68.77 160.58 30.16 Favored 'General case' 0 C--N 1.323 -0.573 0 CA-C-N 116.131 -0.486 . . . . 0.0 110.67 179.476 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 82' ' ' VAL . . . . . . . . . . . . . 13.3 p -61.51 -34.35 61.13 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.393 0 CA-C-O 120.735 0.302 . . . . 0.0 110.514 179.6 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 83' ' ' SER . . . . . . . . . . . . . 4.0 p -66.79 -42.29 86.23 Favored 'General case' 0 C--O 1.236 0.387 0 CA-C-O 121.087 0.47 . . . . 0.0 110.282 177.497 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 84' ' ' GLN . . . . . . . . . . . . . 6.3 tp-100 -64.65 -43.87 92.25 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 115.809 -0.632 . . . . 0.0 110.019 176.936 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 85' ' ' LEU . . . . . 0.491 ' O ' ' HG3' ' A' ' 89' ' ' LYS . 52.7 tp -62.68 -45.15 94.12 Favored 'General case' 0 C--N 1.326 -0.431 0 CA-C-N 115.921 -0.581 . . . . 0.0 110.496 178.4 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 86' ' ' ASN . . . . . . . . . . . . . 78.1 m-20 -57.15 -35.49 69.59 Favored 'General case' 0 N--CA 1.464 0.233 0 CA-C-N 116.459 -0.337 . . . . 0.0 110.808 177.325 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 87' ' ' SER . . . . . . . . . . . . . 48.2 m -60.54 -45.36 94.17 Favored 'General case' 0 C--N 1.327 -0.393 0 CA-C-N 116.318 -0.401 . . . . 0.0 110.29 177.827 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 88' ' ' TYR . . . . . . . . . . . . . 54.1 m-85 -66.24 -38.85 88.86 Favored 'General case' 0 C--N 1.331 -0.229 0 CA-C-O 120.926 0.393 . . . . 0.0 110.842 179.126 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 89' ' ' LYS . . . . . 0.491 ' HG3' ' O ' ' A' ' 85' ' ' LEU . 51.7 mtpt -64.29 -40.96 97.02 Favored 'General case' 0 C--N 1.324 -0.504 0 CA-C-N 116.15 -0.477 . . . . 0.0 110.223 178.106 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 90' ' ' ASN . . . . . 0.493 ' O ' ' HB2' ' A' ' 94' ' ' ASN . 7.2 m-20 -66.2 -28.89 69.1 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.073 -0.512 . . . . 0.0 110.897 177.617 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 91' ' ' TYR . . . . . . . . . . . . . 19.7 m-85 -71.88 -50.21 31.31 Favored 'General case' 0 C--N 1.323 -0.574 0 N-CA-C 109.905 -0.405 . . . . 0.0 109.905 174.381 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 92' ' ' CYS . . . . . 0.527 ' HA ' ' HB2' ' A' ' 96' ' ' LEU . 40.5 t -67.25 -54.62 19.29 Favored 'General case' 0 C--N 1.325 -0.458 0 CA-C-N 116.093 -0.503 . . . . 0.0 112.324 -176.601 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 93' ' ' ARG . . . . . 0.527 ' O ' ' HB3' ' A' ' 97' ' ' SER . 7.8 mpt_? -71.33 -36.82 71.7 Favored 'General case' 0 C--N 1.328 -0.361 0 N-CA-C 112.542 0.571 . . . . 0.0 112.542 -172.539 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 94' ' ' ASN . . . . . 0.493 ' HB2' ' O ' ' A' ' 90' ' ' ASN . 3.4 m-20 -93.72 -55.94 3.07 Favored 'General case' 0 C--N 1.324 -0.525 0 CA-C-O 120.871 0.367 . . . . 0.0 111.73 -175.412 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 95' ' ' HIS . . . . . . . . . . . . . 79.6 m80 -84.92 -47.18 10.55 Favored 'General case' 0 C--N 1.323 -0.549 0 CA-C-N 116.212 -0.449 . . . . 0.0 111.515 -170.346 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 96' ' ' LEU . . . . . 0.527 ' HB2' ' HA ' ' A' ' 92' ' ' CYS . 88.6 mt -88.62 19.51 3.91 Favored 'General case' 0 C--N 1.324 -0.536 0 CA-C-N 116.388 -0.369 . . . . 0.0 111.035 -178.237 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 97' ' ' SER . . . . . 0.558 ' OG ' ' HD3' ' A' ' 98' ' ' PRO . 12.4 p -60.76 -42.09 85.79 Favored Pre-proline 0 CA--C 1.542 0.664 0 N-CA-C 113.102 0.778 . . . . 0.0 113.102 -177.986 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 98' ' ' PRO . . . . . 0.558 ' HD3' ' OG ' ' A' ' 97' ' ' SER . 17.3 Cg_exo -65.81 -33.57 43.07 Favored 'Trans proline' 0 C--N 1.359 1.079 0 C-N-CA 121.424 1.416 . . . . 0.0 111.737 178.396 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 99' ' ' LEU . . . . . 0.408 ' O ' ' HB3' ' A' ' 64' ' ' PHE . 68.0 mt -79.72 -29.11 40.55 Favored 'General case' 0 C--N 1.327 -0.382 0 CA-C-N 115.742 -0.663 . . . . 0.0 110.679 -177.221 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 100' ' ' TYR . . . . . . . . . . . . . 46.9 t80 -52.79 -40.31 63.09 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 115.775 -0.648 . . . . 0.0 110.916 179.794 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 101' ' ' MET . . . . . . . . . . . . . 21.0 ptp -95.81 14.16 24.23 Favored 'General case' 0 C--N 1.323 -0.567 0 CA-C-N 115.931 -0.577 . . . . 0.0 111.423 -176.51 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 102' ' ' LYS . . . . . 0.505 ' HG3' ' O ' ' A' ' 98' ' ' PRO . 96.7 mttt -104.33 152.88 21.72 Favored 'General case' 0 C--N 1.324 -0.536 0 CA-C-O 121.054 0.454 . . . . 0.0 111.016 178.442 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 103' ' ' SER . . . . . 0.435 ' O ' ' HG2' ' A' ' 106' ' ' GLU . 37.9 t -70.74 146.37 49.88 Favored 'General case' 0 C--N 1.322 -0.615 0 CA-C-N 115.57 -0.741 . . . . 0.0 109.576 176.416 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 104' ' ' LEU . . . . . . . . . . . . . 30.6 tp -60.47 -31.87 70.87 Favored 'General case' 0 C--N 1.323 -0.574 0 CA-C-N 116.21 -0.45 . . . . 0.0 111.038 -176.56 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 105' ' ' SER . . . . . . . . . . . . . 56.3 p -87.89 -17.35 31.59 Favored 'General case' 0 C--N 1.329 -0.319 0 N-CA-C 112.29 0.478 . . . . 0.0 112.29 -176.019 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 106' ' ' GLU . . . . . 0.435 ' HG2' ' O ' ' A' ' 103' ' ' SER . 8.4 pt-20 -89.03 -18.53 27.14 Favored 'General case' 0 N--CA 1.464 0.234 0 C-N-CA 120.755 -0.378 . . . . 0.0 111.289 -174.263 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 107' ' ' ILE . . . . . 0.434 HG13 ' O ' ' A' ' 103' ' ' SER . 66.3 mt -73.0 111.08 6.87 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.467 0 CA-C-O 120.993 0.425 . . . . 0.0 110.961 -176.412 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 108' ' ' LEU . . . . . 0.44 ' HA ' ' HD3' ' A' ' 109' ' ' PRO . 1.7 pp -97.46 145.4 29.61 Favored Pre-proline 0 C--N 1.323 -0.58 0 CA-C-N 115.83 -0.623 . . . . 0.0 110.102 176.951 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 109' ' ' PRO . . . . . 0.442 ' HG3' ' HA ' ' A' ' 150' ' ' PRO . 52.4 Cg_exo -54.96 -33.19 81.83 Favored 'Trans proline' 0 C--N 1.343 0.283 0 C-N-CA 123.438 2.759 . . . . 0.0 113.74 -174.516 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 110' ' ' ALA . . . . . . . . . . . . . . . -59.62 -32.32 70.31 Favored 'General case' 0 C--N 1.331 -0.209 0 CA-C-O 120.697 0.284 . . . . 0.0 111.43 -178.98 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 111' ' ' ASP . . . . . 0.437 ' H ' HD12 ' A' ' 108' ' ' LEU . 38.7 t70 -73.41 -46.82 46.47 Favored 'General case' 0 C--N 1.325 -0.473 0 CA-C-O 121.05 0.453 . . . . 0.0 110.374 -177.159 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 112' ' ' ILE . . . . . . . . . . . . . 27.9 mt -62.01 -39.93 85.49 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.399 0 CA-C-N 115.686 -0.688 . . . . 0.0 110.223 177.992 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 113' ' ' GLN . . . . . 0.42 ' O ' ' HB ' ' A' ' 116' ' ' ILE . 14.6 tm0? -65.54 -35.12 79.92 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 115.889 -0.596 . . . . 0.0 109.857 179.175 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 114' ' ' SER . . . . . 0.471 ' O ' ' HG2' ' A' ' 118' ' ' GLU . 57.5 m -64.74 -38.95 92.74 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.434 -0.348 . . . . 0.0 110.453 177.225 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 115' ' ' ILE . . . . . . . . . . . . . 67.7 mt -62.42 -36.55 75.38 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.337 0 CA-C-O 121.175 0.512 . . . . 0.0 109.951 176.235 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 116' ' ' ILE . . . . . 0.42 ' HB ' ' O ' ' A' ' 113' ' ' GLN . 42.1 mm -61.69 -42.09 92.96 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.338 0 CA-C-N 115.675 -0.693 . . . . 0.0 110.339 175.21 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 117' ' ' ASN . . . . . . . . . . . . . 83.9 m-20 -66.47 -32.02 73.13 Favored 'General case' 0 N--CA 1.466 0.368 0 CA-C-N 116.121 -0.491 . . . . 0.0 110.908 178.627 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 118' ' ' GLU . . . . . 0.471 ' HG2' ' O ' ' A' ' 114' ' ' SER . 65.9 mm-40 -80.63 -17.84 49.98 Favored 'General case' 0 C--N 1.327 -0.383 0 CA-C-N 116.146 -0.479 . . . . 0.0 111.011 -178.306 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 119' ' ' THR . . . . . . . . . . . . . 36.4 m -87.97 113.71 23.88 Favored 'General case' 0 C--N 1.321 -0.638 0 CA-C-N 116.13 -0.486 . . . . 0.0 109.871 178.69 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 120' ' ' LYS . . . . . . . . . . . . . 59.5 pttt -90.53 29.19 1.33 Allowed 'General case' 0 C--N 1.326 -0.424 0 CA-C-N 116.005 -0.543 . . . . 0.0 111.322 -175.294 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 121' ' ' LEU . . . . . 0.541 HD13 HG21 ' A' ' 125' ' ' THR . 95.9 mt -91.92 162.27 14.48 Favored 'General case' 0 C--N 1.32 -0.707 0 CA-C-N 116.167 -0.47 . . . . 0.0 109.999 179.348 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 122' ' ' ALA . . . . . . . . . . . . . . . -64.81 163.22 14.61 Favored 'General case' 0 C--N 1.326 -0.431 0 CA-C-O 120.979 0.419 . . . . 0.0 111.714 -176.967 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 123' ' ' LYS . . . . . 0.501 ' O ' ' HG3' ' A' ' 127' ' ' LYS . 19.7 pttp -55.05 -35.65 64.72 Favored 'General case' 0 C--N 1.331 -0.197 0 CA-C-N 115.624 -0.717 . . . . 0.0 111.897 -177.804 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 124' ' ' ASN . . . . . . . . . . . . . 48.5 t-20 -56.99 -52.14 66.46 Favored 'General case' 0 C--O 1.234 0.249 0 CA-C-O 121.156 0.503 . . . . 0.0 110.16 178.975 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 125' ' ' THR . . . . . 0.541 HG21 HD13 ' A' ' 121' ' ' LEU . 1.3 m -66.77 -37.2 84.12 Favored 'General case' 0 N--CA 1.449 -0.493 0 CA-C-N 115.801 -0.636 . . . . 0.0 110.809 -178.814 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 126' ' ' LEU . . . . . . . . . . . . . 90.9 mt -61.22 -43.52 98.75 Favored 'General case' 0 C--O 1.234 0.28 0 CA-C-N 116.274 -0.421 . . . . 0.0 110.873 178.52 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 127' ' ' LYS . . . . . 0.532 ' HG2' HG21 ' A' ' 156' ' ' ILE . 47.6 mtpt -64.15 -41.53 97.14 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.307 -0.406 . . . . 0.0 110.455 178.21 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 128' ' ' ALA . . . . . . . . . . . . . . . -60.36 -44.09 95.9 Favored 'General case' 0 C--O 1.234 0.246 0 CA-C-N 116.168 -0.469 . . . . 0.0 111.173 179.855 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 129' ' ' ILE . . . . . 0.463 HG13 ' O ' ' A' ' 125' ' ' THR . 77.6 mt -62.54 -45.79 97.96 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.291 0 CA-C-N 116.249 -0.432 . . . . 0.0 110.27 177.728 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 130' ' ' ARG . . . . . 0.543 ' CZ ' ' HA ' ' A' ' 152' ' ' ASP . 0.3 OUTLIER -65.21 -40.59 94.35 Favored 'General case' 0 C--N 1.331 -0.206 0 CA-C-N 116.056 -0.52 . . . . 0.0 110.485 -179.139 . . . . . . . . 3 3 . 1 . 017 nuclear build core ' A' A ' 131' ' ' ASN . . . . . 0.602 ' O ' ' HG2' ' A' ' 135' ' ' GLN . 83.6 m-20 -59.67 -52.31 66.08 Favored 'General case' 0 CA--C 1.518 -0.26 0 CA-C-N 116.291 -0.413 . . . . 0.0 110.298 177.25 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 132' ' ' THR . . . . . 0.49 ' O ' HG13 ' A' ' 136' ' ' ILE . 55.1 m -51.7 -49.41 62.49 Favored 'General case' 0 C--N 1.329 -0.316 0 O-C-N 123.678 0.611 . . . . 0.0 110.785 178.74 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 133' ' ' ALA . . . . . . . . . . . . . . . -63.81 -44.15 94.12 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.19 -0.459 . . . . 0.0 111.508 -179.744 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 134' ' ' SER . . . . . . . . . . . . . 34.6 p -66.71 -29.51 69.52 Favored 'General case' 0 C--N 1.33 -0.254 0 C-N-CA 121.168 -0.213 . . . . 0.0 111.463 -177.141 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 135' ' ' GLN . . . . . 0.602 ' HG2' ' O ' ' A' ' 131' ' ' ASN . 11.1 mm100 -73.03 -32.68 65.25 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-O 120.784 0.326 . . . . 0.0 110.237 178.094 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 136' ' ' ILE . . . . . 0.49 HG13 ' O ' ' A' ' 132' ' ' THR . 75.2 mt -64.33 -48.06 86.97 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.21 0 CA-C-N 116.159 -0.473 . . . . 0.0 110.058 176.265 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 137' ' ' PHE . . . . . 0.513 ' O ' HG13 ' A' ' 141' ' ' ILE . 62.5 m-85 -62.38 -40.73 97.4 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.147 -0.479 . . . . 0.0 110.532 176.241 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 138' ' ' ARG . . . . . 0.419 HH11 ' HD2' ' A' ' 138' ' ' ARG . 9.7 mtp180 -57.02 -43.1 81.53 Favored 'General case' 0 CA--C 1.519 -0.247 0 CA-C-N 116.331 -0.395 . . . . 0.0 111.109 176.56 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 139' ' ' LEU . . . . . . . . . . . . . 41.2 tp -60.63 -35.76 76.97 Favored 'General case' 0 C--N 1.326 -0.451 0 CA-C-N 116.004 -0.544 . . . . 0.0 110.34 178.938 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 140' ' ' ALA . . . . . . . . . . . . . . . -72.74 -38.76 67.3 Favored 'General case' 0 C--N 1.324 -0.535 0 CA-C-N 116.12 -0.491 . . . . 0.0 110.652 176.555 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 141' ' ' ILE . . . . . 0.637 ' HA ' ' O ' ' A' ' 146' ' ' ILE . 76.1 mt -64.49 -47.37 89.55 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.272 0 CA-C-N 116.535 -0.302 . . . . 0.0 111.502 179.282 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 142' ' ' GLU . . . . . . . . . . . . . 13.0 pt-20 -67.15 -24.6 65.91 Favored 'General case' 0 C--N 1.33 -0.242 0 CA-C-O 120.787 0.327 . . . . 0.0 111.493 -176.796 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 143' ' ' ASN . . . . . . . . . . . . . 37.8 m-80 -99.11 9.45 43.47 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-O 120.823 0.344 . . . . 0.0 110.408 177.791 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 144' ' ' ARG . . . . . . . . . . . . . 25.9 mtm180 59.47 50.93 6.99 Favored 'General case' 0 N--CA 1.463 0.196 0 CA-C-N 115.53 -0.759 . . . . 0.0 112.707 174.827 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 145' ' ' ALA . . . . . . . . . . . . . . . -101.99 -35.36 8.99 Favored 'General case' 0 C--N 1.323 -0.549 0 CA-C-O 121.446 0.641 . . . . 0.0 109.624 170.384 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 146' ' ' ILE . . . . . 0.637 ' O ' ' HA ' ' A' ' 141' ' ' ILE . 13.5 tt -144.32 158.34 15.25 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.458 0 N-CA-C 108.663 -0.865 . . . . 0.0 108.663 176.322 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 147' ' ' ASP . . . . . . . . . . . . . 7.8 p-10 -121.57 16.72 11.22 Favored 'General case' 0 C--N 1.324 -0.536 0 CA-C-O 121.002 0.429 . . . . 0.0 110.766 -177.992 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 148' ' ' PHE . . . . . 0.465 ' H ' HG12 ' A' ' 146' ' ' ILE . 67.6 t80 -135.55 137.6 42.18 Favored 'General case' 0 C--N 1.324 -0.531 0 CA-C-N 116.012 -0.54 . . . . 0.0 109.757 -176.609 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 149' ' ' ASN . . . . . . . . . . . . . 43.0 t-20 -115.47 89.69 22.92 Favored Pre-proline 0 C--N 1.324 -0.538 0 CA-C-N 116.558 -0.292 . . . . 0.0 110.557 -179.311 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 150' ' ' PRO . . . . . 0.442 ' HA ' ' HG3' ' A' ' 109' ' ' PRO . 28.1 Cg_exo -61.71 -32.12 86.48 Favored 'Trans proline' 0 C--N 1.345 0.382 0 C-N-CA 122.78 2.32 . . . . 0.0 111.861 -179.208 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 151' ' ' ALA . . . . . . . . . . . . . . . -67.53 -30.57 70.27 Favored 'General case' 0 C--N 1.326 -0.445 0 CA-C-N 115.768 -0.651 . . . . 0.0 110.969 -177.932 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 152' ' ' ASP . . . . . 0.543 ' HA ' ' CZ ' ' A' ' 130' ' ' ARG . 33.6 t70 -77.03 -22.3 53.24 Favored 'General case' 0 C--N 1.326 -0.447 0 CA-C-O 121.419 0.628 . . . . 0.0 110.159 179.912 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 153' ' ' TYR . . . . . . . . . . . . . 29.6 t80 -85.14 -1.47 56.92 Favored 'General case' 0 C--N 1.324 -0.519 0 CA-C-N 115.562 -0.744 . . . . 0.0 109.786 178.997 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 154' ' ' VAL . . . . . . . . . . . . . 86.8 t -70.82 118.61 15.7 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.316 0 CA-C-N 115.959 -0.564 . . . . 0.0 109.499 173.412 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 155' ' ' ARG . . . . . . . . . . . . . 28.5 ttt85 -84.68 111.57 19.69 Favored 'General case' 0 C--N 1.319 -0.724 0 CA-C-N 116.115 -0.493 . . . . 0.0 110.355 -176.98 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 156' ' ' ILE . . . . . 0.532 HG21 ' HG2' ' A' ' 127' ' ' LYS . 47.6 mm -89.53 120.64 69.6 Favored Pre-proline 0 C--N 1.324 -0.505 0 CA-C-N 115.604 -0.726 . . . . 0.0 110.109 -178.727 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 157' ' ' PRO . . . . . 0.434 ' HD3' ' HA ' ' A' ' 156' ' ' ILE . 6.5 Cg_exo . . . . . 0 N--CA 1.453 -0.861 0 C-N-CA 122.298 1.999 . . . . 0.0 111.123 177.376 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 63' ' ' SER . . . . . 0.56 ' HA ' ' HA ' ' A' ' 103' ' ' SER . 7.6 m . . . . . 0 N--CA 1.454 -0.252 0 N-CA-C 109.844 -0.428 . . . . 0.0 109.844 . . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 64' ' ' PHE . . . . . 0.539 ' HB2' HD11 ' A' ' 107' ' ' ILE . 84.1 t80 -64.42 -42.52 95.99 Favored 'General case' 0 C--N 1.326 -0.455 0 N-CA-C 109.834 -0.432 . . . . 0.0 109.834 178.639 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 65' ' ' GLY . . . . . . . . . . . . . . . -62.8 -29.43 73.97 Favored Glycine 0 N--CA 1.45 -0.424 0 C-N-CA 120.784 -0.722 . . . . 0.0 112.083 176.137 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 66' ' ' ASP . . . . . . . . . . . . . 20.1 t70 -68.04 -48.13 66.5 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-O 120.837 0.351 . . . . 0.0 110.083 177.386 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 67' ' ' TRP . . . . . . . . . . . . . 52.8 m95 -70.99 -30.49 66.76 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 115.94 -0.573 . . . . 0.0 111.573 178.497 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 68' ' ' ALA . . . . . 0.511 ' O ' ' HG ' ' A' ' 72' ' ' LEU . . . -60.01 -49.34 78.04 Favored 'General case' 0 C--N 1.328 -0.359 0 N-CA-C 109.812 -0.44 . . . . 0.0 109.812 173.813 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 69' ' ' GLU . . . . . . . . . . . . . 5.6 mm-40 -58.19 -41.72 84.54 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 115.976 -0.556 . . . . 0.0 110.843 175.918 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 70' ' ' LYS . . . . . . . . . . . . . 61.6 tttm -62.45 -47.93 81.89 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.3 -0.409 . . . . 0.0 110.219 179.299 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 71' ' ' PHE . . . . . . . . . . . . . 33.7 t80 -59.56 -49.61 77.12 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 115.96 -0.564 . . . . 0.0 110.742 176.955 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 72' ' ' LEU . . . . . 0.511 ' HG ' ' O ' ' A' ' 68' ' ' ALA . 91.6 mt -61.01 -35.74 77.67 Favored 'General case' 0 C--N 1.327 -0.401 0 CA-C-N 116.281 -0.418 . . . . 0.0 111.154 -178.918 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 73' ' ' LYS . . . . . 0.401 ' HD3' ' HA ' ' A' ' 73' ' ' LYS . 61.8 mmtt -72.45 -41.64 65.89 Favored 'General case' 0 C--N 1.327 -0.376 0 C-N-CA 121.234 -0.186 . . . . 0.0 111.379 178.52 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 74' ' ' SER . . . . . . . . . . . . . 12.3 p -68.17 -29.43 68.31 Favored 'General case' 0 C--N 1.327 -0.396 0 CA-C-O 120.956 0.408 . . . . 0.0 110.399 177.139 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 75' ' ' LYS . . . . . . . . . . . . . 45.5 tptt -78.22 -31.43 49.36 Favored 'General case' 0 N--CA 1.446 -0.666 0 CA-C-O 121.085 0.469 . . . . 0.0 110.028 177.154 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 76' ' ' GLU . . . . . . . . . . . . . 37.1 tt0 -63.78 -40.34 96.44 Favored 'General case' 0 C--N 1.326 -0.431 0 CA-C-N 115.768 -0.651 . . . . 0.0 109.863 175.485 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 77' ' ' ALA . . . . . . . . . . . . . . . -80.02 -18.02 51.28 Favored 'General case' 0 C--N 1.327 -0.412 0 CA-C-N 115.891 -0.595 . . . . 0.0 111.123 176.318 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 78' ' ' ASP . . . . . . . . . . . . . 28.5 t70 -68.45 -21.41 64.65 Favored 'General case' 0 N--CA 1.465 0.3 0 CA-C-N 115.913 -0.585 . . . . 0.0 110.538 178.771 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 79' ' ' GLY . . . . . . . . . . . . . . . 102.51 71.26 0.89 Allowed Glycine 0 N--CA 1.447 -0.622 0 C-N-CA 120.734 -0.746 . . . . 0.0 112.276 177.387 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 80' ' ' VAL . . . . . . . . . . . . . 28.0 m -123.87 148.62 27.93 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.5 0 CA-C-O 121.083 0.468 . . . . 0.0 110.763 179.765 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 81' ' ' SER . . . . . . . . . . . . . 14.6 m -75.9 162.46 28.1 Favored 'General case' 0 C--N 1.322 -0.618 0 CA-C-N 115.649 -0.705 . . . . 0.0 109.941 177.093 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 82' ' ' VAL . . . . . . . . . . . . . 57.0 t -58.12 -45.23 88.58 Favored 'Isoleucine or valine' 0 C--O 1.222 -0.375 0 CA-C-N 116.414 -0.357 . . . . 0.0 111.195 -176.566 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 83' ' ' SER . . . . . . . . . . . . . 17.2 t -65.46 -32.65 74.37 Favored 'General case' 0 C--N 1.326 -0.419 0 CA-C-O 120.874 0.368 . . . . 0.0 111.272 -177.955 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 84' ' ' GLN . . . . . . . . . . . . . 62.7 tp60 -69.85 -42.61 73.33 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-O 121.074 0.464 . . . . 0.0 110.314 179.258 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 85' ' ' LEU . . . . . . . . . . . . . 25.5 tp -75.07 -26.73 59.57 Favored 'General case' 0 C--N 1.321 -0.641 0 CA-C-O 121.282 0.563 . . . . 0.0 109.924 178.556 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 86' ' ' ASN . . . . . . . . . . . . . 26.5 t-20 -64.54 -47.7 77.81 Favored 'General case' 0 C--N 1.325 -0.464 0 CA-C-N 115.314 -0.857 . . . . 0.0 110.454 176.498 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 87' ' ' SER . . . . . . . . . . . . . 11.3 p -65.14 -35.89 82.55 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.295 -0.411 . . . . 0.0 110.623 179.75 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 88' ' ' TYR . . . . . . . . . . . . . 11.5 m-85 -57.99 -43.77 86.78 Favored 'General case' 0 C--O 1.234 0.28 0 CA-C-O 120.858 0.361 . . . . 0.0 110.393 174.265 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 89' ' ' LYS . . . . . . . . . . . . . 63.9 mttp -62.69 -38.57 90.92 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 116.044 -0.525 . . . . 0.0 110.605 176.617 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 90' ' ' ASN . . . . . 0.415 ' O ' ' HB3' ' A' ' 94' ' ' ASN . 95.4 m-20 -62.64 -42.94 99.88 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.201 -0.454 . . . . 0.0 111.242 -178.9 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 91' ' ' TYR . . . . . . . . . . . . . 43.3 m-85 -59.25 -45.67 90.56 Favored 'General case' 0 C--O 1.235 0.334 0 CA-C-O 121.09 0.471 . . . . 0.0 110.14 177.217 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 92' ' ' CYS . . . . . 0.613 ' HA ' ' HB2' ' A' ' 96' ' ' LEU . 57.9 m -71.45 -43.52 66.53 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 115.626 -0.715 . . . . 0.0 112.014 -175.552 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 93' ' ' ARG . . . . . . . . . . . . . 18.8 mtp180 -84.58 -7.77 59.14 Favored 'General case' 0 C--N 1.325 -0.457 0 N-CA-C 112.454 0.538 . . . . 0.0 112.454 -173.576 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 94' ' ' ASN . . . . . 0.415 ' HB3' ' O ' ' A' ' 90' ' ' ASN . 12.3 t-20 -111.1 -61.26 1.72 Allowed 'General case' 0 C--N 1.328 -0.355 0 CA-C-O 120.769 0.319 . . . . 0.0 111.859 179.006 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 95' ' ' HIS . . . . . . . . . . . . . 0.2 OUTLIER -87.67 -34.57 18.39 Favored 'General case' 0 C--N 1.324 -0.531 0 N-CA-C 112.363 0.505 . . . . 0.0 112.363 -175.473 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 96' ' ' LEU . . . . . 0.613 ' HB2' ' HA ' ' A' ' 92' ' ' CYS . 85.4 mt -91.65 12.45 21.05 Favored 'General case' 0 C--N 1.324 -0.507 0 C-N-CA 121.215 -0.194 . . . . 0.0 111.212 -176.809 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 97' ' ' SER . . . . . 0.511 ' N ' ' HD2' ' A' ' 98' ' ' PRO . 18.6 m -50.85 -50.2 75.46 Favored Pre-proline 0 CA--C 1.539 0.541 0 N-CA-C 112.284 0.476 . . . . 0.0 112.284 179.483 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 98' ' ' PRO . . . . . 0.511 ' HD2' ' N ' ' A' ' 97' ' ' SER . 13.8 Cg_endo -58.09 -41.33 68.85 Favored 'Trans proline' 0 C--N 1.358 1.034 0 C-N-CA 121.962 1.775 . . . . 0.0 112.585 177.622 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 99' ' ' LEU . . . . . 0.406 ' O ' ' HB3' ' A' ' 64' ' ' PHE . 11.2 mp -79.8 -29.74 40.37 Favored 'General case' 0 C--N 1.326 -0.416 0 CA-C-N 116.459 -0.337 . . . . 0.0 111.801 -174.972 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 100' ' ' TYR . . . . . . . . . . . . . 46.3 t80 -52.74 -40.73 63.35 Favored 'General case' 0 C--N 1.328 -0.349 0 C-N-CA 122.795 0.438 . . . . 0.0 111.434 -176.738 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 101' ' ' MET . . . . . . . . . . . . . 64.5 mtt -89.94 -0.53 57.62 Favored 'General case' 0 C--N 1.325 -0.469 0 CA-C-N 116.258 -0.428 . . . . 0.0 111.69 -176.755 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 102' ' ' LYS . . . . . 0.458 ' HG3' ' O ' ' A' ' 98' ' ' PRO . 97.3 mttt -91.13 161.89 14.9 Favored 'General case' 0 C--N 1.326 -0.444 0 CA-C-O 121.047 0.451 . . . . 0.0 110.438 179.493 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 103' ' ' SER . . . . . 0.56 ' HA ' ' HA ' ' A' ' 63' ' ' SER . 29.0 t -82.12 154.87 25.33 Favored 'General case' 0 N--CA 1.447 -0.598 0 N-CA-C 108.881 -0.785 . . . . 0.0 108.881 172.423 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 104' ' ' LEU . . . . . . . . . . . . . 23.6 tp -61.62 -25.35 67.3 Favored 'General case' 0 C--N 1.321 -0.671 0 CA-C-O 121.092 0.473 . . . . 0.0 110.4 -179.041 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 105' ' ' SER . . . . . . . . . . . . . 35.5 t -86.27 -14.4 43.87 Favored 'General case' 0 C--N 1.327 -0.377 0 CA-C-N 116.003 -0.544 . . . . 0.0 111.375 178.855 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 106' ' ' GLU . . . . . 0.525 ' HG3' ' HB3' ' A' ' 103' ' ' SER . 49.4 mt-10 -93.03 4.72 53.52 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-O 120.861 0.362 . . . . 0.0 111.113 -177.258 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 107' ' ' ILE . . . . . 0.55 HG21 ' HZ ' ' A' ' 137' ' ' PHE . 74.7 mt -95.81 118.13 41.42 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.756 0 CA-C-O 121.23 0.538 . . . . 0.0 111.035 -177.456 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 108' ' ' LEU . . . . . . . . . . . . . 7.6 mp -97.05 138.88 21.27 Favored Pre-proline 0 C--N 1.323 -0.582 0 CA-C-N 115.364 -0.835 . . . . 0.0 110.038 -179.992 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 109' ' ' PRO . . . . . . . . . . . . . 11.2 Cg_endo -56.7 -35.74 97.82 Favored 'Trans proline' 0 C--O 1.234 0.322 0 C-N-CA 122.63 2.22 . . . . 0.0 112.268 177.404 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 110' ' ' ALA . . . . . . . . . . . . . . . -70.61 -29.67 66.13 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.236 -0.438 . . . . 0.0 111.232 179.788 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 111' ' ' ASP . . . . . . . . . . . . . 33.2 t70 -68.27 -41.52 80.92 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-O 121.073 0.463 . . . . 0.0 110.048 179.997 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 112' ' ' ILE . . . . . . . . . . . . . 18.7 mt -67.1 -43.04 88.99 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.355 0 CA-C-N 115.809 -0.632 . . . . 0.0 109.698 176.385 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 113' ' ' GLN . . . . . 0.596 ' HG2' ' HA ' ' A' ' 154' ' ' VAL . 0.0 OUTLIER -55.16 -41.62 72.1 Favored 'General case' 0 C--O 1.233 0.211 0 CA-C-N 115.627 -0.715 . . . . 0.0 111.023 176.568 . . . . . . . . 3 3 . 1 . 018 nuclear build core ' A' A ' 114' ' ' SER . . . . . . . . . . . . . 14.3 t -59.75 -46.54 88.85 Favored 'General case' 0 N--CA 1.453 -0.319 0 CA-C-N 116.101 -0.5 . . . . 0.0 110.387 178.889 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 115' ' ' ILE . . . . . . . . . . . . . 69.3 mt -55.88 -51.93 54.91 Favored 'Isoleucine or valine' 0 C--O 1.233 0.225 0 CA-C-O 120.919 0.39 . . . . 0.0 110.918 -179.485 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 116' ' ' ILE . . . . . . . . . . . . . 49.8 mm -62.08 -39.38 83.6 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.322 0 CA-C-N 115.902 -0.59 . . . . 0.0 111.225 -178.421 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 117' ' ' ASN . . . . . . . . . . . . . 34.1 t-20 -69.81 -39.27 76.62 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-O 120.929 0.395 . . . . 0.0 110.503 -178.873 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 118' ' ' GLU . . . . . . . . . . . . . 49.5 mt-10 -80.76 -8.7 59.75 Favored 'General case' 0 C--N 1.327 -0.374 0 CA-C-N 116.368 -0.378 . . . . 0.0 111.271 -177.192 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 119' ' ' THR . . . . . . . . . . . . . 89.5 m -89.88 123.47 33.85 Favored 'General case' 0 C--N 1.326 -0.438 0 CA-C-O 120.834 0.349 . . . . 0.0 110.912 176.17 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 120' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -98.9 80.52 2.51 Favored 'General case' 0 C--N 1.326 -0.443 0 CA-C-O 121.041 0.448 . . . . 0.0 110.692 178.358 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 121' ' ' LEU . . . . . . . . . . . . . 65.1 mt -132.54 -175.77 3.87 Favored 'General case' 0 C--N 1.324 -0.543 0 CA-C-N 115.713 -0.676 . . . . 0.0 109.747 178.463 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 122' ' ' ALA . . . . . . . . . . . . . . . -72.6 146.04 46.92 Favored 'General case' 0 C--N 1.325 -0.499 0 CA-C-N 116.434 -0.348 . . . . 0.0 110.33 177.722 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 123' ' ' LYS . . . . . 0.516 ' O ' ' HG3' ' A' ' 127' ' ' LYS . 59.6 pttt -58.54 -29.53 66.41 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-O 120.844 0.354 . . . . 0.0 110.915 -179.71 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 124' ' ' ASN . . . . . . . . . . . . . 14.4 m120 -68.34 -40.47 81.56 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.178 -0.465 . . . . 0.0 110.48 178.642 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 125' ' ' THR . . . . . . . . . . . . . 6.2 m -67.67 -35.76 79.46 Favored 'General case' 0 C--N 1.327 -0.378 0 CA-C-N 116.095 -0.502 . . . . 0.0 110.219 179.273 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 126' ' ' LEU . . . . . . . . . . . . . 90.7 mt -64.72 -37.17 86.7 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 115.885 -0.598 . . . . 0.0 110.493 178.068 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 127' ' ' LYS . . . . . 0.516 ' HG3' ' O ' ' A' ' 123' ' ' LYS . 97.7 mttt -68.58 -28.87 67.33 Favored 'General case' 0 C--N 1.332 -0.192 0 CA-C-N 116.092 -0.503 . . . . 0.0 110.835 178.032 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 128' ' ' ALA . . . . . . . . . . . . . . . -65.79 -43.86 87.45 Favored 'General case' 0 C--N 1.327 -0.378 0 CA-C-O 120.981 0.42 . . . . 0.0 110.492 176.606 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 129' ' ' ILE . . . . . . . . . . . . . 47.9 mt -64.71 -47.08 90.22 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.221 0 CA-C-N 115.909 -0.587 . . . . 0.0 109.773 176.166 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 130' ' ' ARG . . . . . 0.409 HH11 ' HD3' ' A' ' 130' ' ' ARG . 5.5 tpt180 -52.87 -45.05 67.28 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 115.587 -0.733 . . . . 0.0 110.882 174.768 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 131' ' ' ASN . . . . . . . . . . . . . 26.7 t-20 -61.97 -55.95 24.15 Favored 'General case' 0 C--N 1.326 -0.445 0 CA-C-N 116.144 -0.48 . . . . 0.0 111.744 -176.872 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 132' ' ' THR . . . . . 0.408 ' O ' HG13 ' A' ' 136' ' ' ILE . 14.9 t -65.59 -33.03 74.96 Favored 'General case' 0 CA--C 1.531 0.222 0 C-N-CA 120.84 -0.344 . . . . 0.0 110.938 -175.371 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 133' ' ' ALA . . . . . . . . . . . . . . . -69.75 -46.39 65.97 Favored 'General case' 0 C--N 1.331 -0.205 0 CA-C-O 120.919 0.39 . . . . 0.0 110.515 178.358 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 134' ' ' SER . . . . . . . . . . . . . 22.9 t -61.0 -37.67 83.32 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 115.893 -0.594 . . . . 0.0 110.27 -179.977 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 135' ' ' GLN . . . . . . . . . . . . . 2.7 mp0 -59.08 -45.34 91.08 Favored 'General case' 0 C--N 1.331 -0.232 0 CA-C-N 116.401 -0.363 . . . . 0.0 111.042 176.489 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 136' ' ' ILE . . . . . 0.408 HG13 ' O ' ' A' ' 132' ' ' THR . 73.1 mt -65.03 -47.79 86.55 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.296 0 CA-C-O 120.904 0.383 . . . . 0.0 110.691 179.017 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 137' ' ' PHE . . . . . 0.55 ' HZ ' HG21 ' A' ' 107' ' ' ILE . 41.8 m-85 -62.28 -47.06 85.98 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 116.195 -0.457 . . . . 0.0 111.696 -179.645 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 138' ' ' ARG . . . . . 0.419 ' O ' ' HG2' ' A' ' 142' ' ' GLU . 11.3 ptm180 -74.05 -21.03 60.1 Favored 'General case' 0 C--N 1.327 -0.385 0 C-N-CA 120.538 -0.465 . . . . 0.0 110.853 -176.39 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 139' ' ' LEU . . . . . . . . . . . . . 62.6 tp -63.59 -41.8 98.32 Favored 'General case' 0 C--O 1.234 0.266 0 N-CA-C 109.232 -0.655 . . . . 0.0 109.232 173.256 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 140' ' ' ALA . . . . . 0.501 ' HB1' ' HB3' ' A' ' 145' ' ' ALA . . . -65.24 -32.57 74.31 Favored 'General case' 0 C--N 1.326 -0.429 0 CA-C-N 115.495 -0.775 . . . . 0.0 110.152 176.211 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 141' ' ' ILE . . . . . . . . . . . . . 60.4 mt -64.94 -44.16 96.15 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.29 0 CA-C-N 116.233 -0.44 . . . . 0.0 110.191 175.653 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 142' ' ' GLU . . . . . 0.419 ' HG2' ' O ' ' A' ' 138' ' ' ARG . 34.3 mm-40 -63.33 -29.31 70.64 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-O 121.088 0.471 . . . . 0.0 110.716 177.71 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 143' ' ' ASN . . . . . 0.469 HD22 ' N ' ' A' ' 143' ' ' ASN . 0.9 OUTLIER -93.23 0.85 57.2 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.064 -0.517 . . . . 0.0 111.003 -179.031 . . . . . . . . 3 3 . 1 . 018 nuclear build core ' A' A ' 144' ' ' ARG . . . . . . . . . . . . . 35.1 mtp85 57.47 36.0 26.5 Favored 'General case' 0 N--CA 1.464 0.26 0 CA-C-N 115.752 -0.658 . . . . 0.0 112.272 -178.933 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 145' ' ' ALA . . . . . 0.501 ' HB3' ' HB1' ' A' ' 140' ' ' ALA . . . -82.29 -33.73 28.97 Favored 'General case' 0 C--N 1.325 -0.5 0 N-CA-C 109.268 -0.641 . . . . 0.0 109.268 173.357 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 146' ' ' ILE . . . . . . . . . . . . . 9.8 tt -159.22 125.63 0.54 Allowed 'Isoleucine or valine' 0 C--N 1.324 -0.526 0 CA-C-N 114.873 -1.058 . . . . 0.0 109.433 178.998 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 147' ' ' ASP . . . . . . . . . . . . . 20.9 t70 -99.1 68.46 1.68 Allowed 'General case' 0 C--N 1.319 -0.738 0 CA-C-O 121.662 0.744 . . . . 0.0 109.624 178.575 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 148' ' ' PHE . . . . . 0.482 ' O ' ' HD3' ' A' ' 150' ' ' PRO . 55.8 t80 -169.38 126.44 0.92 Allowed 'General case' 0 C--N 1.321 -0.667 0 CA-C-N 115.086 -0.961 . . . . 0.0 109.178 -179.158 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 149' ' ' ASN . . . . . . . . . . . . . 48.8 t-20 -108.52 95.96 17.85 Favored Pre-proline 0 C--N 1.323 -0.57 0 N-CA-C 110.076 -0.342 . . . . 0.0 110.076 179.272 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 150' ' ' PRO . . . . . 0.482 ' HD3' ' O ' ' A' ' 148' ' ' PHE . 21.6 Cg_exo -65.34 -26.37 56.04 Favored 'Trans proline' 0 C--N 1.342 0.229 0 C-N-CA 122.756 2.304 . . . . 0.0 112.03 -179.626 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 151' ' ' ALA . . . . . . . . . . . . . . . -72.6 -20.38 61.31 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 115.941 -0.572 . . . . 0.0 110.806 -178.032 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 152' ' ' ASP . . . . . . . . . . . . . 28.3 t70 -70.76 -24.91 62.69 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-O 121.089 0.471 . . . . 0.0 110.149 178.488 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 153' ' ' TYR . . . . . . . . . . . . . 58.8 m-85 -83.86 -1.47 54.5 Favored 'General case' 0 C--N 1.327 -0.374 0 CA-C-N 115.772 -0.649 . . . . 0.0 110.51 179.585 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 154' ' ' VAL . . . . . 0.596 ' HA ' ' HG2' ' A' ' 113' ' ' GLN . 55.9 t -88.74 111.52 22.72 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.504 0 CA-C-N 115.807 -0.633 . . . . 0.0 110.311 179.65 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 155' ' ' ARG . . . . . . . . . . . . . 83.9 mtm180 -83.99 141.24 31.35 Favored 'General case' 0 C--N 1.319 -0.742 0 CA-C-N 115.41 -0.814 . . . . 0.0 109.944 179.807 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 156' ' ' ILE . . . . . 0.4 ' HA ' ' HD3' ' A' ' 157' ' ' PRO . 50.7 mm -96.97 113.67 63.35 Favored Pre-proline 0 C--N 1.319 -0.741 0 N-CA-C 109.408 -0.59 . . . . 0.0 109.408 178.704 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 157' ' ' PRO . . . . . 0.4 ' HD3' ' HA ' ' A' ' 156' ' ' ILE . 28.4 Cg_exo . . . . . 0 N--CA 1.46 -0.444 0 C-N-CA 122.53 2.153 . . . . 0.0 112.196 -177.754 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 63' ' ' SER . . . . . . . . . . . . . 78.6 p . . . . . 0 N--CA 1.453 -0.321 0 N-CA-C 109.274 -0.639 . . . . 0.0 109.274 . . . . . . . . . 0 0 . 1 . 019 nuclear build core ' A' A ' 64' ' ' PHE . . . . . 0.476 ' HB3' ' O ' ' A' ' 99' ' ' LEU . 74.6 t80 -63.45 -35.93 82.05 Favored 'General case' 0 C--N 1.327 -0.378 0 C-N-CA 120.862 -0.335 . . . . 0.0 110.384 -177.409 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 65' ' ' GLY . . . . . . . . . . . . . . . -60.0 -38.33 94.05 Favored Glycine 0 N--CA 1.452 -0.249 0 C-N-CA 120.964 -0.636 . . . . 0.0 112.411 178.072 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 66' ' ' ASP . . . . . . . . . . . . . 16.4 m-20 -65.8 -43.57 88.33 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-O 120.917 0.389 . . . . 0.0 110.417 -179.921 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 67' ' ' TRP . . . . . . . . . . . . . 98.7 m95 -73.02 -34.21 66.21 Favored 'General case' 0 C--N 1.326 -0.43 0 CA-C-N 115.938 -0.573 . . . . 0.0 111.026 179.675 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 68' ' ' ALA . . . . . 0.547 ' O ' ' HG ' ' A' ' 72' ' ' LEU . . . -61.02 -44.22 97.73 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-O 120.903 0.382 . . . . 0.0 110.101 175.564 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 69' ' ' GLU . . . . . . . . . . . . . 31.2 tt0 -59.75 -45.98 90.57 Favored 'General case' 0 C--O 1.232 0.14 0 CA-C-N 115.806 -0.634 . . . . 0.0 110.22 175.127 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 70' ' ' LYS . . . . . . . . . . . . . 51.5 tttp -57.69 -42.95 84.69 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-N 115.541 -0.754 . . . . 0.0 110.442 179.326 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 71' ' ' PHE . . . . . . . . . . . . . 77.9 t80 -62.31 -49.99 73.44 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-N 115.77 -0.65 . . . . 0.0 110.627 176.525 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 72' ' ' LEU . . . . . 0.547 ' HG ' ' O ' ' A' ' 68' ' ' ALA . 93.4 mt -56.57 -41.54 77.08 Favored 'General case' 0 C--N 1.327 -0.379 0 CA-C-N 116.163 -0.472 . . . . 0.0 110.794 -179.915 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 73' ' ' LYS . . . . . 0.438 ' HA ' ' HB3' ' A' ' 76' ' ' GLU . 36.9 tttp -77.49 -28.45 52.21 Favored 'General case' 0 C--N 1.324 -0.514 0 CA-C-N 116.024 -0.535 . . . . 0.0 111.441 -175.963 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 74' ' ' SER . . . . . 0.43 ' O ' ' HB2' ' A' ' 78' ' ' ASP . 95.3 p -65.67 -31.43 72.44 Favored 'General case' 0 C--N 1.33 -0.262 0 C-N-CA 120.493 -0.483 . . . . 0.0 109.988 178.254 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 75' ' ' LYS . . . . . . . . . . . . . 0.8 OUTLIER -79.32 -42.0 26.7 Favored 'General case' 0 C--O 1.234 0.262 0 CA-C-N 116.444 -0.344 . . . . 0.0 110.509 173.606 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 76' ' ' GLU . . . . . 0.438 ' HB3' ' HA ' ' A' ' 73' ' ' LYS . 42.8 tt0 -52.43 -50.16 63.12 Favored 'General case' 0 CA--C 1.532 0.261 0 CA-C-N 116.137 -0.483 . . . . 0.0 110.776 175.307 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 77' ' ' ALA . . . . . . . . . . . . . . . -73.79 -30.13 62.57 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 115.958 -0.565 . . . . 0.0 111.726 -178.94 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 78' ' ' ASP . . . . . 0.43 ' HB2' ' O ' ' A' ' 74' ' ' SER . 16.1 t70 -62.03 -40.53 96.03 Favored 'General case' 0 N--CA 1.464 0.237 0 CA-C-O 120.985 0.421 . . . . 0.0 110.436 179.802 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 79' ' ' GLY . . . . . . . . . . . . . . . 121.01 33.26 0.99 Allowed Glycine 0 N--CA 1.447 -0.582 0 C-N-CA 120.702 -0.761 . . . . 0.0 113.269 176.291 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 80' ' ' VAL . . . . . . . . . . . . . 24.3 m -81.22 147.01 6.58 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.451 0 N-CA-C 109.894 -0.41 . . . . 0.0 109.894 176.471 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 81' ' ' SER . . . . . . . . . . . . . 23.2 t -68.14 155.58 39.31 Favored 'General case' 0 C--N 1.321 -0.649 0 CA-C-O 120.939 0.399 . . . . 0.0 110.952 -178.071 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 82' ' ' VAL . . . . . . . . . . . . . 7.5 p -56.8 -33.93 42.27 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.24 0 CA-C-N 115.769 -0.65 . . . . 0.0 111.457 -177.893 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 83' ' ' SER . . . . . . . . . . . . . 16.0 m -60.65 -39.62 89.0 Favored 'General case' 0 C--O 1.235 0.299 0 CA-C-O 121.061 0.458 . . . . 0.0 110.592 178.347 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 84' ' ' GLN . . . . . . . . . . . . . 5.8 tp-100 -76.01 -39.36 55.93 Favored 'General case' 0 C--N 1.327 -0.392 0 CA-C-N 116.175 -0.466 . . . . 0.0 109.912 -179.909 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 85' ' ' LEU . . . . . 0.445 HD22 ' HA ' ' A' ' 85' ' ' LEU . 0.3 OUTLIER -63.03 -40.23 97.12 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.06 -0.518 . . . . 0.0 109.932 178.548 . . . . . . . . 3 3 . 1 . 019 nuclear build core ' A' A ' 86' ' ' ASN . . . . . 0.572 ' HA ' ' HD2' ' A' ' 89' ' ' LYS . 80.2 m-20 -62.58 -37.51 86.46 Favored 'General case' 0 CA--C 1.516 -0.338 0 CA-C-N 116.018 -0.537 . . . . 0.0 110.918 176.201 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 87' ' ' SER . . . . . . . . . . . . . 9.6 t -60.8 -41.82 96.39 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-O 120.888 0.375 . . . . 0.0 110.07 178.435 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 88' ' ' TYR . . . . . . . . . . . . . 34.0 m-85 -60.43 -34.43 73.96 Favored 'General case' 0 C--N 1.332 -0.171 0 CA-C-N 116.05 -0.523 . . . . 0.0 110.755 176.681 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 89' ' ' LYS . . . . . 0.572 ' HD2' ' HA ' ' A' ' 86' ' ' ASN . 56.3 mttm -63.88 -39.35 93.98 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.377 -0.374 . . . . 0.0 110.504 176.255 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 90' ' ' ASN . . . . . . . . . . . . . 23.9 m120 -60.0 -34.84 73.88 Favored 'General case' 0 C--O 1.233 0.228 0 CA-C-O 121.061 0.458 . . . . 0.0 110.495 177.164 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 91' ' ' TYR . . . . . . . . . . . . . 31.3 m-85 -80.75 -62.9 1.53 Allowed 'General case' 0 C--N 1.325 -0.467 0 CA-C-N 116.251 -0.431 . . . . 0.0 110.841 179.295 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 92' ' ' CYS . . . . . 0.454 ' HA ' ' HB2' ' A' ' 96' ' ' LEU . 70.2 m -68.54 -49.53 58.79 Favored 'General case' 0 C--N 1.324 -0.502 0 N-CA-C 112.595 0.591 . . . . 0.0 112.595 -171.4 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 93' ' ' ARG . . . . . 0.55 ' O ' ' HD3' ' A' ' 93' ' ' ARG . 0.7 OUTLIER -83.21 -38.41 22.3 Favored 'General case' 0 C--N 1.32 -0.708 0 C-N-CA 120.681 -0.408 . . . . 0.0 111.069 -171.639 . . . . . . . . 3 3 . 1 . 019 nuclear build core ' A' A ' 94' ' ' ASN . . . . . . . . . . . . . 6.7 t30 -91.8 -41.49 10.63 Favored 'General case' 0 C--N 1.326 -0.431 0 N-CA-C 112.172 0.434 . . . . 0.0 112.172 -172.72 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 95' ' ' HIS . . . . . . . . . . . . . 45.6 m80 -88.7 -49.43 6.86 Favored 'General case' 0 C--N 1.328 -0.343 0 N-CA-C 112.069 0.396 . . . . 0.0 112.069 178.678 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 96' ' ' LEU . . . . . 0.56 ' HG ' HD12 ' A' ' 99' ' ' LEU . 9.9 mp -84.91 26.69 0.82 Allowed 'General case' 0 C--N 1.324 -0.507 0 CA-C-N 116.318 -0.401 . . . . 0.0 111.214 -175.743 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 97' ' ' SER . . . . . 0.501 ' N ' ' HD2' ' A' ' 98' ' ' PRO . 5.2 m -53.96 -52.05 71.58 Favored Pre-proline 0 CA--C 1.538 0.498 0 CA-C-N 116.174 -0.467 . . . . 0.0 112.167 -178.762 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 98' ' ' PRO . . . . . 0.501 ' HD2' ' N ' ' A' ' 97' ' ' SER . 18.8 Cg_endo -59.6 -38.27 83.15 Favored 'Trans proline' 0 C--N 1.355 0.92 0 C-N-CA 121.814 1.676 . . . . 0.0 112.142 178.162 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 99' ' ' LEU . . . . . 0.56 HD12 ' HG ' ' A' ' 96' ' ' LEU . 65.4 mt -69.26 -25.31 64.21 Favored 'General case' 0 C--N 1.327 -0.391 0 CA-C-N 116.103 -0.499 . . . . 0.0 111.157 -176.094 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 100' ' ' TYR . . . . . . . . . . . . . 0.2 OUTLIER -58.05 -34.13 69.76 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.361 -0.381 . . . . 0.0 111.449 179.784 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 101' ' ' MET . . . . . . . . . . . . . 23.8 ttt -98.08 2.99 49.28 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-O 121.499 0.666 . . . . 0.0 110.472 -178.773 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 102' ' ' LYS . . . . . 0.579 ' HB3' ' OE2' ' A' ' 106' ' ' GLU . 8.5 mtpm? -102.98 167.67 9.69 Favored 'General case' 0 C--N 1.322 -0.6 0 CA-C-N 115.872 -0.604 . . . . 0.0 110.277 -179.133 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 103' ' ' SER . . . . . 0.541 ' O ' HG13 ' A' ' 107' ' ' ILE . 44.3 m -110.14 136.03 50.0 Favored 'General case' 0 C--N 1.319 -0.723 0 N-CA-C 109.248 -0.649 . . . . 0.0 109.248 178.936 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 104' ' ' LEU . . . . . . . . . . . . . 1.6 pp -60.58 -13.43 14.18 Favored 'General case' 0 C--N 1.325 -0.487 0 N-CA-C 112.541 0.571 . . . . 0.0 112.541 -175.167 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 105' ' ' SER . . . . . . . . . . . . . 35.3 t -87.08 -14.61 40.92 Favored 'General case' 0 C--N 1.327 -0.404 0 CA-C-N 116.518 -0.31 . . . . 0.0 110.882 178.296 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 106' ' ' GLU . . . . . 0.579 ' OE2' ' HB3' ' A' ' 102' ' ' LYS . 0.8 OUTLIER -123.02 12.44 9.66 Favored 'General case' 0 CA--C 1.532 0.271 0 CA-C-O 121.162 0.506 . . . . 0.0 111.077 179.283 . . . . . . . . 3 3 . 1 . 019 nuclear build core ' A' A ' 107' ' ' ILE . . . . . 0.541 HG13 ' O ' ' A' ' 103' ' ' SER . 77.4 mt -90.06 121.66 40.55 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.276 0 CA-C-N 116.018 -0.537 . . . . 0.0 109.884 173.607 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 108' ' ' LEU . . . . . . . . . . . . . 7.6 mp -85.48 147.52 47.02 Favored Pre-proline 0 C--N 1.323 -0.576 0 CA-C-N 116.105 -0.498 . . . . 0.0 110.723 -178.997 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 109' ' ' PRO . . . . . 0.455 ' HB3' ' HB2' ' A' ' 153' ' ' TYR . 35.2 Cg_exo -59.32 -31.61 95.33 Favored 'Trans proline' 0 N--CA 1.465 -0.191 0 C-N-CA 122.551 2.167 . . . . 0.0 111.249 174.136 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 110' ' ' ALA . . . . . 0.403 ' HA ' ' HB3' ' A' ' 113' ' ' GLN . . . -75.82 -20.91 57.81 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 115.742 -0.663 . . . . 0.0 111.108 179.129 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 111' ' ' ASP . . . . . . . . . . . . . 23.5 t0 -71.83 -48.49 45.8 Favored 'General case' 0 C--N 1.327 -0.413 0 N-CA-C 109.009 -0.737 . . . . 0.0 109.009 178.222 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 112' ' ' ILE . . . . . . . . . . . . . 46.4 mt -63.76 -38.49 82.44 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.284 0 CA-C-N 115.345 -0.843 . . . . 0.0 109.624 173.895 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 113' ' ' GLN . . . . . 0.403 ' HB3' ' HA ' ' A' ' 110' ' ' ALA . 27.2 tp60 -53.86 -44.49 70.4 Favored 'General case' 0 C--N 1.33 -0.241 0 CA-C-N 115.32 -0.855 . . . . 0.0 110.584 176.743 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 114' ' ' SER . . . . . . . . . . . . . 45.0 m -59.11 -46.61 87.86 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 115.821 -0.627 . . . . 0.0 110.509 178.898 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 115' ' ' ILE . . . . . . . . . . . . . 66.2 mt -56.86 -49.64 78.13 Favored 'Isoleucine or valine' 0 C--O 1.234 0.248 0 CA-C-O 120.967 0.413 . . . . 0.0 110.855 177.921 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 116' ' ' ILE . . . . . 0.448 HG13 HG11 ' A' ' 154' ' ' VAL . 47.6 mm -57.59 -42.44 81.27 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.262 0 CA-C-N 115.892 -0.594 . . . . 0.0 111.245 -179.886 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 117' ' ' ASN . . . . . . . . . . . . . 93.4 m-20 -71.37 -30.93 66.74 Favored 'General case' 0 C--N 1.326 -0.451 0 CA-C-N 116.328 -0.396 . . . . 0.0 111.438 -176.991 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 118' ' ' GLU . . . . . . . . . . . . . 43.0 mt-10 -89.33 -5.26 57.67 Favored 'General case' 0 C--N 1.326 -0.428 0 CA-C-O 120.735 0.303 . . . . 0.0 111.279 -178.362 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 119' ' ' THR . . . . . . . . . . . . . 98.3 m -79.32 112.37 16.48 Favored 'General case' 0 C--N 1.323 -0.587 0 CA-C-O 121.078 0.466 . . . . 0.0 111.009 176.59 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 120' ' ' LYS . . . . . . . . . . . . . 69.6 mmtt -94.37 83.03 4.11 Favored 'General case' 0 C--N 1.325 -0.487 0 CA-C-N 116.31 -0.405 . . . . 0.0 110.121 176.289 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 121' ' ' LEU . . . . . 0.457 HD13 HG21 ' A' ' 125' ' ' THR . 77.8 mt -145.46 -175.35 4.68 Favored 'General case' 0 C--N 1.323 -0.564 0 CA-C-N 115.744 -0.662 . . . . 0.0 109.768 179.938 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 122' ' ' ALA . . . . . . . . . . . . . . . -62.66 149.49 43.43 Favored 'General case' 0 C--N 1.324 -0.525 0 CA-C-N 116.488 -0.324 . . . . 0.0 110.978 178.565 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 123' ' ' LYS . . . . . . . . . . . . . 17.8 ptpt -61.65 -30.96 71.06 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.132 -0.485 . . . . 0.0 111.475 -177.174 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 124' ' ' ASN . . . . . . . . . . . . . 9.6 t30 -66.29 -40.46 90.05 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-O 120.69 0.281 . . . . 0.0 110.436 176.15 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 125' ' ' THR . . . . . 0.589 ' O ' HG13 ' A' ' 129' ' ' ILE . 53.9 m -64.14 -39.13 93.37 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 116.197 -0.456 . . . . 0.0 110.678 179.151 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 126' ' ' LEU . . . . . . . . . . . . . 89.3 mt -56.58 -48.73 76.77 Favored 'General case' 0 C--O 1.234 0.25 0 CA-C-O 121.254 0.55 . . . . 0.0 110.24 177.253 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 127' ' ' LYS . . . . . . . . . . . . . 98.4 mttt -63.76 -40.03 95.72 Favored 'General case' 0 C--N 1.327 -0.37 0 CA-C-N 115.434 -0.803 . . . . 0.0 110.614 177.535 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 128' ' ' ALA . . . . . . . . . . . . . . . -64.65 -34.66 78.81 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.104 -0.498 . . . . 0.0 111.661 -178.872 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 129' ' ' ILE . . . . . 0.589 HG13 ' O ' ' A' ' 125' ' ' THR . 78.0 mt -62.47 -50.45 79.8 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.282 0 CA-C-O 121.052 0.453 . . . . 0.0 109.951 176.254 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 130' ' ' ARG . . . . . 0.505 ' HD2' ' HB ' ' A' ' 154' ' ' VAL . 47.8 ttt180 -60.72 -44.3 96.78 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 115.693 -0.685 . . . . 0.0 110.472 176.072 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 131' ' ' ASN . . . . . . . . . . . . . 56.0 t30 -56.24 -48.45 76.5 Favored 'General case' 0 C--N 1.326 -0.413 0 CA-C-N 115.889 -0.596 . . . . 0.0 110.518 178.295 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 132' ' ' THR . . . . . . . . . . . . . 96.7 m -57.41 -51.4 69.55 Favored 'General case' 0 C--N 1.327 -0.404 0 CA-C-N 115.973 -0.558 . . . . 0.0 110.802 177.414 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 133' ' ' ALA . . . . . . . . . . . . . . . -61.1 -42.9 99.36 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 115.909 -0.587 . . . . 0.0 111.446 -178.634 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 134' ' ' SER . . . . . . . . . . . . . 51.1 p -64.18 -30.16 71.23 Favored 'General case' 0 C--N 1.33 -0.263 0 N-CA-C 111.755 0.28 . . . . 0.0 111.755 -176.73 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 135' ' ' GLN . . . . . . . . . . . . . 41.4 mt-30 -71.35 -38.37 71.63 Favored 'General case' 0 C--N 1.328 -0.329 0 C-N-CA 120.924 -0.31 . . . . 0.0 110.298 176.101 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 136' ' ' ILE . . . . . . . . . . . . . 65.7 mt -61.1 -46.11 97.28 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.251 0 CA-C-N 116.196 -0.456 . . . . 0.0 110.452 177.818 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 137' ' ' PHE . . . . . 0.484 ' O ' HG13 ' A' ' 141' ' ' ILE . 64.4 m-85 -66.03 -38.31 88.09 Favored 'General case' 0 C--N 1.33 -0.245 0 CA-C-N 116.355 -0.384 . . . . 0.0 110.827 177.745 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 138' ' ' ARG . . . . . 0.491 ' O ' ' HG3' ' A' ' 142' ' ' GLU . 19.9 mtp85 -59.19 -45.55 90.78 Favored 'General case' 0 CA--C 1.518 -0.279 0 CA-C-O 120.725 0.298 . . . . 0.0 110.739 175.952 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 139' ' ' LEU . . . . . . . . . . . . . 48.4 tp -55.81 -36.4 67.39 Favored 'General case' 0 C--N 1.327 -0.386 0 CA-C-N 115.753 -0.658 . . . . 0.0 110.42 178.697 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 140' ' ' ALA . . . . . 0.518 ' HB1' ' HB3' ' A' ' 145' ' ' ALA . . . -69.88 -45.14 68.33 Favored 'General case' 0 C--N 1.324 -0.518 0 CA-C-N 115.858 -0.61 . . . . 0.0 110.748 176.032 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 141' ' ' ILE . . . . . 0.575 ' HA ' ' O ' ' A' ' 146' ' ' ILE . 78.5 mt -55.86 -46.94 80.28 Favored 'Isoleucine or valine' 0 C--O 1.234 0.275 0 CA-C-O 120.997 0.427 . . . . 0.0 110.94 177.606 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 142' ' ' GLU . . . . . 0.491 ' HG3' ' O ' ' A' ' 138' ' ' ARG . 91.7 mt-10 -63.24 -27.55 69.43 Favored 'General case' 0 C--N 1.326 -0.416 0 CA-C-N 115.844 -0.616 . . . . 0.0 111.373 -177.564 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 143' ' ' ASN . . . . . . . . . . . . . 29.0 m-80 -99.49 14.64 29.14 Favored 'General case' 0 C--N 1.327 -0.402 0 CA-C-N 116.329 -0.396 . . . . 0.0 111.418 -178.704 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 144' ' ' ARG . . . . . . . . . . . . . 16.7 mmm180 65.68 27.94 11.23 Favored 'General case' 0 N--CA 1.468 0.462 0 N-CA-C 112.424 0.527 . . . . 0.0 112.424 176.409 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 145' ' ' ALA . . . . . 0.518 ' HB3' ' HB1' ' A' ' 140' ' ' ALA . . . -84.76 -39.66 18.17 Favored 'General case' 0 C--N 1.323 -0.568 0 CA-C-O 121.157 0.503 . . . . 0.0 110.51 177.918 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 146' ' ' ILE . . . . . 0.575 ' O ' ' HA ' ' A' ' 141' ' ' ILE . 15.5 tt -145.36 155.41 13.5 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.423 0 CA-C-N 115.688 -0.687 . . . . 0.0 109.217 -179.154 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 147' ' ' ASP . . . . . . . . . . . . . 3.8 m-20 -105.01 -1.56 25.58 Favored 'General case' 0 C--N 1.327 -0.401 0 N-CA-C 112.381 0.512 . . . . 0.0 112.381 -175.448 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 148' ' ' PHE . . . . . 0.461 ' H ' HG12 ' A' ' 146' ' ' ILE . 50.0 p90 -142.13 165.34 27.7 Favored 'General case' 0 C--N 1.322 -0.614 0 CA-C-O 120.76 0.314 . . . . 0.0 110.998 -176.569 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 149' ' ' ASN . . . . . . . . . . . . . 44.9 t-20 -119.11 101.8 49.44 Favored Pre-proline 0 C--N 1.322 -0.616 0 CA-C-N 116.021 -0.536 . . . . 0.0 110.549 -176.306 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 150' ' ' PRO . . . . . . . . . . . . . 35.2 Cg_exo -59.35 -32.69 97.1 Favored 'Trans proline' 0 C--N 1.342 0.197 0 C-N-CA 122.838 2.359 . . . . 0.0 112.724 178.915 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 151' ' ' ALA . . . . . 0.529 ' HA ' HG23 ' A' ' 154' ' ' VAL . . . -74.81 -19.47 60.18 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-O 121.047 0.451 . . . . 0.0 110.968 -178.466 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 152' ' ' ASP . . . . . . . . . . . . . 24.8 t70 -71.74 -19.81 61.98 Favored 'General case' 0 C--N 1.325 -0.46 0 CA-C-N 115.762 -0.653 . . . . 0.0 110.033 178.662 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 153' ' ' TYR . . . . . 0.455 ' HB2' ' HB3' ' A' ' 109' ' ' PRO . 68.6 m-85 -95.77 1.77 53.49 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 115.744 -0.662 . . . . 0.0 111.513 -178.238 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 154' ' ' VAL . . . . . 0.529 HG23 ' HA ' ' A' ' 151' ' ' ALA . 98.0 t -72.32 123.53 27.1 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.514 0 CA-C-O 121.043 0.449 . . . . 0.0 110.514 -178.954 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 155' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -86.12 101.58 13.11 Favored 'General case' 0 C--N 1.32 -0.711 0 N-CA-C 109.251 -0.648 . . . . 0.0 109.251 179.279 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 156' ' ' ILE . . . . . 0.415 HD13 ' HD3' ' A' ' 130' ' ' ARG . 0.9 OUTLIER -71.12 131.31 87.17 Favored Pre-proline 0 C--N 1.325 -0.469 0 N-CA-C 109.275 -0.639 . . . . 0.0 109.275 176.146 . . . . . . . . 3 3 . 1 . 019 nuclear build core ' A' A ' 157' ' ' PRO . . . . . . . . . . . . . 92.4 Cg_endo . . . . . 0 N--CA 1.456 -0.685 0 C-N-CA 122.522 2.148 . . . . 0.0 112.856 -176.088 . . . . . . . . 0 0 . 1 . 020 nuclear build core ' A' A ' 63' ' ' SER . . . . . 0.564 ' HA ' ' HA ' ' A' ' 103' ' ' SER . 39.5 t . . . . . 0 N--CA 1.449 -0.525 0 CA-C-O 121.011 0.434 . . . . 0.0 110.341 . . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 64' ' ' PHE . . . . . 0.48 ' HB2' HD11 ' A' ' 107' ' ' ILE . 78.9 t80 -59.85 -31.82 70.12 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 115.82 -0.627 . . . . 0.0 109.999 178.37 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 65' ' ' GLY . . . . . . . . . . . . . . . -59.24 -31.7 70.14 Favored Glycine 0 N--CA 1.447 -0.582 0 CA-C-N 115.685 -0.689 . . . . 0.0 112.571 178.894 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 66' ' ' ASP . . . . . . . . . . . . . 39.0 t70 -79.66 -48.38 13.81 Favored 'General case' 0 C--N 1.329 -0.308 0 C-N-CA 120.911 -0.316 . . . . 0.0 110.491 -179.959 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 67' ' ' TRP . . . . . . . . . . . . . 83.8 m95 -62.16 -36.59 82.31 Favored 'General case' 0 N--CA 1.465 0.282 0 CA-C-N 116.474 -0.33 . . . . 0.0 111.32 179.582 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 68' ' ' ALA . . . . . 0.595 ' O ' ' HG ' ' A' ' 72' ' ' LEU . . . -63.93 -50.92 66.77 Favored 'General case' 0 C--N 1.325 -0.495 0 CA-C-N 116.273 -0.421 . . . . 0.0 110.535 177.28 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 69' ' ' GLU . . . . . . . . . . . . . 14.9 tp10 -61.88 -35.18 77.58 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.083 -0.508 . . . . 0.0 110.07 178.055 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 70' ' ' LYS . . . . . . . . . . . . . 48.5 tttp -59.17 -44.97 92.16 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 115.932 -0.577 . . . . 0.0 110.325 177.145 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 71' ' ' PHE . . . . . . . . . . . . . 79.5 t80 -69.28 -41.22 77.14 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-O 120.98 0.419 . . . . 0.0 110.441 178.912 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 72' ' ' LEU . . . . . 0.595 ' HG ' ' O ' ' A' ' 68' ' ' ALA . 86.1 mt -63.9 -34.28 77.6 Favored 'General case' 0 C--N 1.325 -0.478 0 CA-C-N 116.14 -0.482 . . . . 0.0 110.526 179.647 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 73' ' ' LYS . . . . . 0.452 ' O ' ' HB3' ' A' ' 76' ' ' GLU . 14.0 ttmm -84.08 -33.33 24.43 Favored 'General case' 0 C--N 1.324 -0.543 0 CA-C-N 116.138 -0.483 . . . . 0.0 111.238 -176.505 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 74' ' ' SER . . . . . . . . . . . . . 15.4 p -71.47 -30.58 66.16 Favored 'General case' 0 C--N 1.324 -0.501 0 N-CA-C 110.051 -0.352 . . . . 0.0 110.051 175.982 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 75' ' ' LYS . . . . . 0.506 ' O ' ' HB3' ' A' ' 78' ' ' ASP . 22.0 tptp -76.62 -32.05 57.8 Favored 'General case' 0 N--CA 1.447 -0.612 0 CA-C-O 121.302 0.572 . . . . 0.0 109.475 174.589 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 76' ' ' GLU . . . . . 0.452 ' HB3' ' O ' ' A' ' 73' ' ' LYS . 30.3 tt0 -58.88 -47.87 83.43 Favored 'General case' 0 C--N 1.327 -0.407 0 CA-C-N 115.377 -0.829 . . . . 0.0 110.072 172.921 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 77' ' ' ALA . . . . . . . . . . . . . . . -76.08 -16.24 59.96 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 115.808 -0.633 . . . . 0.0 111.018 178.584 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 78' ' ' ASP . . . . . 0.506 ' HB3' ' O ' ' A' ' 75' ' ' LYS . 3.8 t70 -65.57 -53.78 37.09 Favored 'General case' 0 C--N 1.331 -0.218 0 CA-C-N 116.014 -0.539 . . . . 0.0 110.519 177.101 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 79' ' ' GLY . . . . . . . . . . . . . . . 142.34 63.97 0.03 OUTLIER Glycine 0 N--CA 1.446 -0.69 0 C-N-CA 120.506 -0.854 . . . . 0.0 112.26 178.495 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 80' ' ' VAL . . . . . . . . . . . . . 36.0 m -115.5 158.43 15.86 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.644 0 CA-C-O 120.759 0.314 . . . . 0.0 110.808 179.634 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 81' ' ' SER . . . . . . . . . . . . . 47.5 t -78.72 151.48 32.11 Favored 'General case' 0 C--N 1.321 -0.665 0 N-CA-C 109.487 -0.56 . . . . 0.0 109.487 174.777 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 82' ' ' VAL . . . . . . . . . . . . . 8.3 p -56.68 -34.4 42.57 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.329 0 CA-C-O 120.834 0.35 . . . . 0.0 110.667 177.631 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 83' ' ' SER . . . . . . . . . . . . . 3.4 m -62.98 -42.42 99.83 Favored 'General case' 0 C--O 1.235 0.291 0 CA-C-O 121.425 0.631 . . . . 0.0 110.181 178.199 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 84' ' ' GLN . . . . . 0.431 ' HG3' ' CE2' ' A' ' 88' ' ' TYR . 23.4 tp60 -74.78 -33.78 62.32 Favored 'General case' 0 C--N 1.325 -0.486 0 CA-C-N 115.497 -0.774 . . . . 0.0 110.389 -179.519 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 85' ' ' LEU . . . . . . . . . . . . . 36.7 tp -68.99 -42.97 75.79 Favored 'General case' 0 C--N 1.323 -0.562 0 CA-C-N 116.084 -0.507 . . . . 0.0 110.607 178.966 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 86' ' ' ASN . . . . . . . . . . . . . 86.3 m-20 -60.36 -44.83 95.21 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.32 -0.4 . . . . 0.0 111.075 178.78 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 87' ' ' SER . . . . . . . . . . . . . 2.0 p -63.58 -38.31 90.65 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 116.649 -0.25 . . . . 0.0 111.201 -179.489 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 88' ' ' TYR . . . . . 0.451 ' HB3' HD22 ' A' ' 72' ' ' LEU . 10.7 m-85 -60.48 -47.95 83.9 Favored 'General case' 0 N--CA 1.465 0.282 0 CA-C-O 121.037 0.446 . . . . 0.0 110.515 175.082 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 89' ' ' LYS . . . . . 0.525 ' HG2' HD13 ' A' ' 72' ' ' LEU . 68.4 mttm -63.38 -37.66 88.12 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 115.787 -0.642 . . . . 0.0 110.767 179.64 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 90' ' ' ASN . . . . . 0.516 ' O ' ' HB3' ' A' ' 94' ' ' ASN . 7.4 m-80 -62.48 -47.65 83.05 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.302 -0.408 . . . . 0.0 111.008 177.354 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 91' ' ' TYR . . . . . . . . . . . . . 14.0 m-85 -57.23 -45.36 83.95 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-O 120.991 0.424 . . . . 0.0 110.507 175.693 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 92' ' ' CYS . . . . . 0.56 ' SG ' ' HB1' ' A' ' 68' ' ' ALA . 47.8 t -66.54 -54.08 27.63 Favored 'General case' 0 C--N 1.321 -0.668 0 CA-C-N 115.507 -0.769 . . . . 0.0 112.407 -175.561 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 93' ' ' ARG . . . . . . . . . . . . . 31.7 ttm-85 -82.45 -35.02 27.91 Favored 'General case' 0 C--N 1.326 -0.451 0 N-CA-C 111.965 0.357 . . . . 0.0 111.965 -171.751 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 94' ' ' ASN . . . . . 0.516 ' HB3' ' O ' ' A' ' 90' ' ' ASN . 22.0 t-20 -83.97 -51.6 7.01 Favored 'General case' 0 C--N 1.326 -0.43 0 CA-C-O 120.651 0.262 . . . . 0.0 111.582 -176.583 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 95' ' ' HIS . . . . . . . . . . . . . 64.7 m80 -85.49 -42.91 14.03 Favored 'General case' 0 C--N 1.327 -0.371 0 CA-C-O 120.701 0.286 . . . . 0.0 111.452 -174.207 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 96' ' ' LEU . . . . . 0.454 HD21 ' HB2' ' A' ' 133' ' ' ALA . 10.1 mp -91.56 26.73 2.21 Favored 'General case' 0 C--N 1.326 -0.435 0 CA-C-O 120.864 0.364 . . . . 0.0 110.464 -179.794 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 97' ' ' SER . . . . . 0.526 ' OG ' ' HD3' ' A' ' 98' ' ' PRO . 0.5 OUTLIER -55.44 -47.12 99.35 Favored Pre-proline 0 CA--C 1.539 0.526 0 N-CA-C 113.02 0.748 . . . . 0.0 113.02 -178.481 . . . . . . . . 3 3 . 1 . 020 nuclear build core ' A' A ' 98' ' ' PRO . . . . . 0.526 ' HD3' ' OG ' ' A' ' 97' ' ' SER . 38.8 Cg_exo -58.08 -34.91 98.99 Favored 'Trans proline' 0 C--N 1.358 1.066 0 C-N-CA 121.663 1.575 . . . . 0.0 111.967 178.095 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 99' ' ' LEU . . . . . 0.455 HD22 HG23 ' A' ' 107' ' ' ILE . 33.2 mt -79.02 -36.82 40.5 Favored 'General case' 0 C--N 1.327 -0.391 0 CA-C-N 115.874 -0.603 . . . . 0.0 110.282 -177.275 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 100' ' ' TYR . . . . . . . . . . . . . 25.8 t80 -60.47 -24.82 65.56 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 115.509 -0.769 . . . . 0.0 111.072 -177.112 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 101' ' ' MET . . . . . . . . . . . . . 65.4 mtt -97.72 -2.58 40.94 Favored 'General case' 0 C--N 1.327 -0.375 0 CA-C-N 116.21 -0.45 . . . . 0.0 111.784 -177.153 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 102' ' ' LYS . . . . . . . . . . . . . 87.7 mttt -102.53 167.35 9.99 Favored 'General case' 0 C--O 1.237 0.402 0 CA-C-O 121.026 0.441 . . . . 0.0 111.012 -179.312 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 103' ' ' SER . . . . . 0.564 ' HA ' ' HA ' ' A' ' 63' ' ' SER . 5.2 m -83.13 156.77 23.1 Favored 'General case' 0 C--N 1.323 -0.569 0 CA-C-N 115.82 -0.627 . . . . 0.0 109.69 174.702 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 104' ' ' LEU . . . . . . . . . . . . . 52.1 tp -55.83 -45.11 78.44 Favored 'General case' 0 C--N 1.325 -0.457 0 CA-C-N 116.501 -0.318 . . . . 0.0 111.525 -176.828 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 105' ' ' SER . . . . . . . . . . . . . 14.8 m -87.12 0.38 55.36 Favored 'General case' 0 C--N 1.325 -0.493 0 CA-C-N 116.453 -0.34 . . . . 0.0 111.896 -174.572 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 106' ' ' GLU . . . . . . . . . . . . . 44.3 mt-10 -104.02 -2.46 25.98 Favored 'General case' 0 C--N 1.327 -0.377 0 O-C-N 122.247 -0.283 . . . . 0.0 111.624 -178.372 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 107' ' ' ILE . . . . . 0.48 HD11 ' HB2' ' A' ' 64' ' ' PHE . 66.9 mt -81.15 126.82 39.87 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.556 0 CA-C-O 121.133 0.492 . . . . 0.0 111.303 -178.116 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 108' ' ' LEU . . . . . . . . . . . . . 62.9 mt -97.61 147.28 32.78 Favored Pre-proline 0 C--N 1.323 -0.583 0 CA-C-N 115.724 -0.671 . . . . 0.0 110.444 -179.488 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 109' ' ' PRO . . . . . . . . . . . . . 19.1 Cg_endo -60.18 -30.33 91.06 Favored 'Trans proline' 0 N--CA 1.464 -0.241 0 C-N-CA 122.351 2.034 . . . . 0.0 111.352 174.977 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 110' ' ' ALA . . . . . . . . . . . . . . . -65.17 -29.85 70.71 Favored 'General case' 0 N--CA 1.454 -0.257 0 CA-C-N 115.868 -0.605 . . . . 0.0 111.043 178.662 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 111' ' ' ASP . . . . . 0.414 ' O ' HG13 ' A' ' 115' ' ' ILE . 79.2 m-20 -64.91 -51.26 62.85 Favored 'General case' 0 CA--C 1.519 -0.244 0 CA-C-O 121.141 0.496 . . . . 0.0 110.025 179.226 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 112' ' ' ILE . . . . . 0.485 ' O ' HG12 ' A' ' 116' ' ' ILE . 30.6 mt -65.16 -40.61 89.36 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.491 0 CA-C-N 115.67 -0.696 . . . . 0.0 110.15 179.741 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 113' ' ' GLN . . . . . . . . . . . . . 6.7 tp-100 -59.01 -42.54 90.35 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.018 -0.537 . . . . 0.0 110.514 175.663 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 114' ' ' SER . . . . . . . . . . . . . 7.4 t -60.25 -45.58 92.78 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-N 116.257 -0.429 . . . . 0.0 109.862 178.304 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 115' ' ' ILE . . . . . 0.414 HG13 ' O ' ' A' ' 111' ' ' ASP . 75.8 mt -56.69 -47.23 82.76 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.221 0 CA-C-N 116.434 -0.348 . . . . 0.0 110.822 178.401 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 116' ' ' ILE . . . . . 0.485 HG12 ' O ' ' A' ' 112' ' ' ILE . 50.3 mm -61.09 -40.99 87.61 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.36 0 CA-C-O 121.108 0.48 . . . . 0.0 110.876 179.165 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 117' ' ' ASN . . . . . . . . . . . . . 46.8 t-20 -71.6 -42.03 68.21 Favored 'General case' 0 C--N 1.324 -0.515 0 CA-C-N 115.797 -0.638 . . . . 0.0 111.067 -177.032 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 118' ' ' GLU . . . . . . . . . . . . . 46.9 mt-10 -80.65 -16.76 53.21 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.253 -0.43 . . . . 0.0 112.035 -174.467 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 119' ' ' THR . . . . . . . . . . . . . 94.8 m -82.0 112.86 19.46 Favored 'General case' 0 C--N 1.325 -0.481 0 CA-C-O 121.331 0.586 . . . . 0.0 110.96 179.985 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 120' ' ' LYS . . . . . . . . . . . . . 24.1 mtmt -93.47 63.24 3.47 Favored 'General case' 0 C--N 1.323 -0.548 0 CA-C-N 115.441 -0.799 . . . . 0.0 110.544 -177.959 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 121' ' ' LEU . . . . . . . . . . . . . 88.8 mt -126.92 -175.75 3.51 Favored 'General case' 0 C--N 1.322 -0.62 0 CA-C-N 115.16 -0.927 . . . . 0.0 109.939 178.305 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 122' ' ' ALA . . . . . . . . . . . . . . . -64.01 157.12 25.97 Favored 'General case' 0 C--N 1.327 -0.37 0 CA-C-O 120.964 0.411 . . . . 0.0 111.808 -176.729 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 123' ' ' LYS . . . . . . . . . . . . . 48.3 mmtm -62.01 -38.39 88.47 Favored 'General case' 0 C--N 1.331 -0.237 0 CA-C-N 115.979 -0.555 . . . . 0.0 111.12 -177.926 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 124' ' ' ASN . . . . . . . . . . . . . 28.9 p30 -65.45 -27.31 68.42 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.321 -0.399 . . . . 0.0 111.064 179.453 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 125' ' ' THR . . . . . 0.495 ' O ' HG13 ' A' ' 129' ' ' ILE . 10.2 m -76.18 -39.2 55.38 Favored 'General case' 0 C--N 1.325 -0.47 0 CA-C-N 116.257 -0.429 . . . . 0.0 110.061 179.125 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 126' ' ' LEU . . . . . 0.433 ' HB3' HG23 ' A' ' 116' ' ' ILE . 84.5 mt -62.42 -44.83 95.5 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.008 -0.542 . . . . 0.0 110.141 177.289 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 127' ' ' LYS . . . . . . . . . . . . . 98.6 mttt -59.7 -43.53 94.04 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 115.774 -0.648 . . . . 0.0 110.18 177.384 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 128' ' ' ALA . . . . . . . . . . . . . . . -60.71 -39.12 87.36 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 115.7 -0.682 . . . . 0.0 111.308 -178.861 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 129' ' ' ILE . . . . . 0.495 HG13 ' O ' ' A' ' 125' ' ' THR . 87.6 mt -58.36 -51.65 68.73 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.245 0 CA-C-N 116.462 -0.336 . . . . 0.0 110.654 178.394 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 130' ' ' ARG . . . . . 0.705 HH21 ' HA ' ' A' ' 152' ' ' ASP . 33.4 ttt-85 -65.15 -45.97 82.8 Favored 'General case' 0 C--N 1.331 -0.206 0 C-N-CA 120.885 -0.326 . . . . 0.0 110.92 179.079 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 131' ' ' ASN . . . . . . . . . . . . . 94.2 m-20 -53.15 -53.06 56.06 Favored 'General case' 0 N--CA 1.466 0.343 0 O-C-N 123.184 0.302 . . . . 0.0 110.833 179.654 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 132' ' ' THR . . . . . 0.533 ' O ' HG12 ' A' ' 136' ' ' ILE . 29.7 m -55.7 -45.23 77.9 Favored 'General case' 0 C--N 1.327 -0.401 0 CA-C-N 116.303 -0.408 . . . . 0.0 110.824 -179.997 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 133' ' ' ALA . . . . . 0.454 ' HB2' HD21 ' A' ' 96' ' ' LEU . . . -64.3 -42.84 96.17 Favored 'General case' 0 C--N 1.331 -0.207 0 CA-C-N 116.21 -0.45 . . . . 0.0 111.388 -179.356 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 134' ' ' SER . . . . . 0.45 ' O ' ' HG3' ' A' ' 138' ' ' ARG . 70.5 p -64.4 -32.69 74.41 Favored 'General case' 0 C--N 1.33 -0.246 0 C-N-CA 121.033 -0.267 . . . . 0.0 110.959 -178.704 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 135' ' ' GLN . . . . . . . . . . . . . 1.2 mp0 -62.88 -41.18 99.3 Favored 'General case' 0 C--N 1.331 -0.206 0 CA-C-O 120.779 0.323 . . . . 0.0 110.245 175.169 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 136' ' ' ILE . . . . . 0.561 HD12 ' HA ' ' A' ' 68' ' ' ALA . 23.1 mm -61.63 -50.77 78.93 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.25 0 CA-C-N 116.014 -0.539 . . . . 0.0 110.402 178.737 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 137' ' ' PHE . . . . . 0.492 ' O ' HG13 ' A' ' 141' ' ' ILE . 62.2 m-85 -62.14 -38.15 87.88 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 115.843 -0.617 . . . . 0.0 111.405 -179.529 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 138' ' ' ARG . . . . . 0.587 ' O ' ' HG2' ' A' ' 142' ' ' GLU . 68.2 mtp180 -64.7 -37.54 87.94 Favored 'General case' 0 C--N 1.329 -0.314 0 C-N-CA 120.823 -0.351 . . . . 0.0 110.877 179.356 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 139' ' ' LEU . . . . . . . . . . . . . 63.4 tp -57.54 -41.77 81.59 Favored 'General case' 0 C--N 1.327 -0.387 0 CA-C-O 121.107 0.479 . . . . 0.0 109.975 176.301 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 140' ' ' ALA . . . . . . . . . . . . . . . -66.6 -38.74 87.63 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 115.716 -0.675 . . . . 0.0 110.711 177.355 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 141' ' ' ILE . . . . . 0.546 ' HA ' ' O ' ' A' ' 146' ' ' ILE . 75.7 mt -64.07 -43.74 97.58 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.268 0 CA-C-N 116.3 -0.409 . . . . 0.0 110.73 177.168 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 142' ' ' GLU . . . . . 0.587 ' HG2' ' O ' ' A' ' 138' ' ' ARG . 39.7 mm-40 -62.77 -30.43 71.44 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.274 -0.421 . . . . 0.0 110.955 179.434 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 143' ' ' ASN . . . . . . . . . . . . . 5.3 m-20 -91.23 1.9 56.76 Favored 'General case' 0 N--CA 1.464 0.229 0 CA-C-N 116.269 -0.423 . . . . 0.0 110.919 179.987 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 144' ' ' ARG . . . . . . . . . . . . . 24.5 mtp85 57.68 40.92 26.1 Favored 'General case' 0 C--O 1.233 0.233 0 CA-C-N 115.633 -0.712 . . . . 0.0 112.054 -177.892 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 145' ' ' ALA . . . . . . . . . . . . . . . -88.41 -28.78 20.7 Favored 'General case' 0 C--N 1.324 -0.508 0 N-CA-C 109.338 -0.616 . . . . 0.0 109.338 172.435 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 146' ' ' ILE . . . . . 0.546 ' O ' ' HA ' ' A' ' 141' ' ' ILE . 13.4 tt -155.07 146.49 13.18 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.479 0 CA-C-N 115.237 -0.892 . . . . 0.0 108.941 177.493 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 147' ' ' ASP . . . . . . . . . . . . . 7.6 m-20 -110.48 24.02 13.51 Favored 'General case' 0 C--N 1.323 -0.548 0 CA-C-O 121.283 0.563 . . . . 0.0 110.192 179.53 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 148' ' ' PHE . . . . . 0.48 ' H ' HG12 ' A' ' 146' ' ' ILE . 1.2 m-85 -129.97 143.95 51.07 Favored 'General case' 0 C--N 1.323 -0.572 0 CA-C-N 115.631 -0.713 . . . . 0.0 110.336 -178.712 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 149' ' ' ASN . . . . . . . . . . . . . 48.0 t-20 -126.36 91.14 48.39 Favored Pre-proline 0 C--N 1.321 -0.664 0 CA-C-N 116.131 -0.486 . . . . 0.0 110.003 178.494 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 150' ' ' PRO . . . . . . . . . . . . . 35.8 Cg_exo -62.19 -26.52 77.78 Favored 'Trans proline' 0 C--N 1.343 0.258 0 C-N-CA 122.798 2.332 . . . . 0.0 112.082 -179.582 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 151' ' ' ALA . . . . . . . . . . . . . . . -70.21 -27.6 64.62 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 116.124 -0.489 . . . . 0.0 111.179 -177.635 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 152' ' ' ASP . . . . . 0.705 ' HA ' HH21 ' A' ' 130' ' ' ARG . 19.3 t70 -75.58 -17.65 59.98 Favored 'General case' 0 C--N 1.323 -0.552 0 CA-C-O 120.887 0.375 . . . . 0.0 110.514 -179.53 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 153' ' ' TYR . . . . . . . . . . . . . 43.7 m-85 -83.35 -10.84 58.23 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.243 -0.435 . . . . 0.0 110.653 178.819 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 154' ' ' VAL . . . . . . . . . . . . . 41.9 t -72.7 117.77 16.79 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.396 0 CA-C-N 116.101 -0.5 . . . . 0.0 110.945 -178.987 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 155' ' ' ARG . . . . . . . . . . . . . 3.8 mmp_? -89.91 131.68 35.7 Favored 'General case' 0 C--N 1.319 -0.719 0 CA-C-N 116.133 -0.485 . . . . 0.0 110.326 174.016 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 156' ' ' ILE . . . . . 0.427 ' HA ' ' HD2' ' A' ' 157' ' ' PRO . 1.9 mp -91.96 117.08 67.54 Favored Pre-proline 0 C--N 1.31 -1.109 0 N-CA-C 107.988 -1.116 . . . . 0.0 107.988 173.481 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 157' ' ' PRO . . . . . 0.427 ' HD2' ' HA ' ' A' ' 156' ' ' ILE . 5.7 Cg_endo . . . . . 0 C--N 1.345 0.368 0 C-N-CA 123.22 2.613 . . . . 0.0 112.488 -173.657 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 61' ' ' ARG . . . . . . . . . . . . . 9.9 mmm180 . . . . . 0 N--CA 1.484 1.244 0 N-CA-C 111.388 0.144 . . . . 0.0 111.388 . . . . . . . . . 0 0 . 1 . 001 nuclear build full ' A' A ' 62' ' ' ASP . . . . . . . . . . . . . 5.5 m-20 -117.37 106.28 13.05 Favored 'General case' 0 C--N 1.327 -0.399 0 CA-C-O 120.801 0.334 . . . . 0.0 111.177 -175.918 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 63' ' ' SER . . . . . 0.608 ' HA ' ' HA ' ' A' ' 103' ' ' SER . 29.4 p -82.23 145.22 30.15 Favored 'General case' 0 C--N 1.321 -0.662 0 CA-C-N 116.182 -0.463 . . . . 0.0 110.518 -179.138 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 64' ' ' PHE . . . . . 0.504 ' HB2' HD11 ' A' ' 107' ' ' ILE . 83.2 t80 -62.32 -35.62 79.62 Favored 'General case' 0 C--N 1.327 -0.372 0 N-CA-C 109.852 -0.425 . . . . 0.0 109.852 179.174 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 65' ' ' GLY . . . . . . . . . . . . . . . -60.92 -37.57 94.0 Favored Glycine 0 N--CA 1.449 -0.483 0 CA-C-N 115.904 -0.589 . . . . 0.0 112.329 176.964 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 66' ' ' ASP . . . . . . . . . . . . . 9.4 t70 -59.84 -54.39 46.77 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-O 120.894 0.378 . . . . 0.0 110.603 178.063 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 67' ' ' TRP . . . . . . . . . . . . . 87.5 m95 -72.44 -31.38 65.42 Favored 'General case' 0 C--N 1.325 -0.464 0 CA-C-N 115.941 -0.572 . . . . 0.0 111.94 -176.953 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 68' ' ' ALA . . . . . 0.512 ' O ' HD13 ' A' ' 72' ' ' LEU . . . -64.03 -44.87 91.24 Favored 'General case' 0 C--N 1.327 -0.408 0 CA-C-O 120.872 0.368 . . . . 0.0 110.325 176.336 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 69' ' ' GLU . . . . . . . . . . . . . 15.7 tm-20 -62.47 -38.68 90.77 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 115.981 -0.554 . . . . 0.0 110.05 178.916 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 70' ' ' LYS . . . . . . . . . . . . . 90.0 mttt -68.07 -38.49 82.46 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.244 -0.434 . . . . 0.0 111.055 177.399 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 71' ' ' PHE . . . . . . . . . . . . . 87.8 t80 -64.04 -44.15 93.36 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-O 120.958 0.408 . . . . 0.0 110.355 176.786 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 72' ' ' LEU . . . . . 0.518 ' HG ' ' HG2' ' A' ' 89' ' ' LYS . 3.9 mp -56.6 -51.55 68.24 Favored 'General case' 0 C--N 1.327 -0.387 0 CA-C-N 115.735 -0.666 . . . . 0.0 110.421 175.866 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 73' ' ' LYS . . . . . . . . . . . . . 39.9 ttmt -63.01 -37.8 88.63 Favored 'General case' 0 C--N 1.326 -0.423 0 CA-C-N 115.968 -0.56 . . . . 0.0 110.635 179.229 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 74' ' ' SER . . . . . . . . . . . . . 31.4 t -57.68 -51.87 67.75 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.144 -0.48 . . . . 0.0 110.949 177.819 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 75' ' ' LYS . . . . . 0.547 ' HA ' ' HB2' ' A' ' 78' ' ' ASP . 25.9 mmtm -69.84 -30.21 67.65 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-O 120.862 0.363 . . . . 0.0 111.119 -178.044 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 76' ' ' GLU . . . . . . . . . . . . . 35.5 tt0 -64.68 -38.55 91.37 Favored 'General case' 0 C--N 1.323 -0.561 0 CA-C-N 116.105 -0.498 . . . . 0.0 110.195 175.332 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 77' ' ' ALA . . . . . . . . . . . . . . . -80.15 -23.72 40.91 Favored 'General case' 0 C--N 1.325 -0.461 0 CA-C-N 115.83 -0.623 . . . . 0.0 111.158 176.058 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 78' ' ' ASP . . . . . 0.547 ' HB2' ' HA ' ' A' ' 75' ' ' LYS . 11.2 m-20 -67.6 -33.38 74.87 Favored 'General case' 0 CA--C 1.517 -0.294 0 CA-C-N 116.443 -0.344 . . . . 0.0 110.795 177.43 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 79' ' ' GLY . . . . . . . . . . . . . . . 105.7 41.2 1.89 Allowed Glycine 0 N--CA 1.446 -0.669 0 C-N-CA 120.557 -0.83 . . . . 0.0 112.934 176.208 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 80' ' ' VAL . . . . . . . . . . . . . 30.0 m -87.26 158.25 3.15 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.567 0 N-CA-C 109.674 -0.491 . . . . 0.0 109.674 174.549 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 81' ' ' SER . . . . . . . . . . . . . 61.1 m -61.43 146.16 49.33 Favored 'General case' 0 C--N 1.323 -0.561 0 CA-C-N 116.581 -0.282 . . . . 0.0 110.546 177.636 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 82' ' ' VAL . . . . . . . . . . . . . 60.3 t -57.05 -43.17 80.7 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.378 0 CA-C-N 116.384 -0.371 . . . . 0.0 111.03 -178.345 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 83' ' ' SER . . . . . . . . . . . . . 27.9 m -59.65 -39.11 83.3 Favored 'General case' 0 C--N 1.326 -0.441 0 CA-C-N 116.374 -0.375 . . . . 0.0 110.545 176.889 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 84' ' ' GLN . . . . . . . . . . . . . 6.7 tp-100 -69.15 -44.24 72.69 Favored 'General case' 0 C--N 1.326 -0.423 0 CA-C-N 115.964 -0.562 . . . . 0.0 110.091 179.154 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 85' ' ' LEU . . . . . 0.527 ' O ' ' HG3' ' A' ' 89' ' ' LYS . 2.4 tm? -62.64 -43.76 97.98 Favored 'General case' 0 C--N 1.326 -0.438 0 CA-C-N 115.849 -0.614 . . . . 0.0 109.933 178.953 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 86' ' ' ASN . . . . . . . . . . . . . 77.4 m-20 -64.18 -26.94 68.74 Favored 'General case' 0 C--N 1.332 -0.182 0 CA-C-N 116.116 -0.493 . . . . 0.0 111.259 177.564 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 87' ' ' SER . . . . . . . . . . . . . 60.5 m -64.92 -47.27 78.3 Favored 'General case' 0 C--N 1.33 -0.263 0 N-CA-C 109.896 -0.409 . . . . 0.0 109.896 176.403 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 88' ' ' TYR . . . . . . . . . . . . . 44.2 m-85 -58.7 -45.92 88.46 Favored 'General case' 0 C--O 1.232 0.168 0 CA-C-N 116.252 -0.431 . . . . 0.0 110.215 177.298 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 89' ' ' LYS . . . . . 0.527 ' HG3' ' O ' ' A' ' 85' ' ' LEU . 46.5 mtpt -58.71 -44.05 90.27 Favored 'General case' 0 C--N 1.332 -0.19 0 CA-C-N 115.747 -0.661 . . . . 0.0 110.549 179.85 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 90' ' ' ASN . . . . . . . . . . . . . 8.8 t30 -63.66 -39.41 94.26 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 116.196 -0.456 . . . . 0.0 110.832 -179.532 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 91' ' ' TYR . . . . . . . . . . . . . 18.4 m-85 -60.59 -48.65 80.83 Favored 'General case' 0 C--N 1.331 -0.215 0 CA-C-N 116.615 -0.266 . . . . 0.0 111.054 179.895 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 92' ' ' CYS . . . . . 0.619 ' HA ' ' HB2' ' A' ' 96' ' ' LEU . 24.2 p -76.42 -27.47 56.28 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-O 120.711 0.291 . . . . 0.0 111.748 -176.465 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 93' ' ' ARG . . . . . . . . . . . . . 56.0 ttp180 -81.84 -42.9 18.98 Favored 'General case' 0 C--N 1.327 -0.406 0 CA-C-O 120.772 0.32 . . . . 0.0 111.833 -175.914 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 94' ' ' ASN . . . . . . . . . . . . . 13.5 m120 -95.46 -57.27 2.44 Favored 'General case' 0 C--N 1.325 -0.485 0 CA-C-N 116.305 -0.407 . . . . 0.0 111.909 -173.644 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 95' ' ' HIS . . . . . . . . . . . . . 36.6 m80 -78.59 -48.58 14.88 Favored 'General case' 0 C--N 1.327 -0.4 0 CA-C-O 120.849 0.357 . . . . 0.0 111.249 -174.355 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 96' ' ' LEU . . . . . 0.619 ' HB2' ' HA ' ' A' ' 92' ' ' CYS . 66.3 mt -88.82 21.98 2.85 Favored 'General case' 0 C--N 1.324 -0.536 0 CA-C-N 116.342 -0.39 . . . . 0.0 110.253 -179.504 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 97' ' ' SER . . . . . 0.546 ' N ' ' HD2' ' A' ' 98' ' ' PRO . 4.3 t -55.3 -48.26 96.64 Favored Pre-proline 0 CA--C 1.541 0.607 0 CA-C-N 115.881 -0.599 . . . . 0.0 111.477 -178.822 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 98' ' ' PRO . . . . . 0.546 ' HD2' ' N ' ' A' ' 97' ' ' SER . 17.3 Cg_endo -58.97 -33.0 98.57 Favored 'Trans proline' 0 C--N 1.358 1.054 0 C-N-CA 121.988 1.792 . . . . 0.0 112.264 176.314 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 99' ' ' LEU . . . . . 0.545 HD13 HD11 ' A' ' 115' ' ' ILE . 2.5 mp -78.51 -33.57 47.96 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 116.512 -0.313 . . . . 0.0 111.015 -179.129 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 100' ' ' TYR . . . . . . . . . . . . . 19.1 t80 -59.27 -28.07 66.4 Favored 'General case' 0 C--N 1.327 -0.374 0 CA-C-N 115.972 -0.558 . . . . 0.0 111.295 -176.325 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 101' ' ' MET . . . . . . . . . . . . . 27.0 ptt? -95.23 -0.68 52.82 Favored 'General case' 0 C--N 1.327 -0.374 0 CA-C-N 116.161 -0.472 . . . . 0.0 111.379 -179.329 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 102' ' ' LYS . . . . . 0.543 ' HG3' ' O ' ' A' ' 98' ' ' PRO . 91.5 mttt -101.69 162.6 12.78 Favored 'General case' 0 C--N 1.326 -0.45 0 CA-C-O 121.004 0.431 . . . . 0.0 110.562 -178.838 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 103' ' ' SER . . . . . 0.608 ' HA ' ' HA ' ' A' ' 63' ' ' SER . 39.4 t -91.27 158.72 16.41 Favored 'General case' 0 C--N 1.319 -0.722 0 N-CA-C 108.969 -0.752 . . . . 0.0 108.969 172.68 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 104' ' ' LEU . . . . . . . . . . . . . 93.5 mt -56.83 -35.26 68.6 Favored 'General case' 0 C--N 1.325 -0.465 0 CA-C-O 120.824 0.345 . . . . 0.0 111.269 -177.877 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 105' ' ' SER . . . . . . . . . . . . . 25.5 p -77.41 -16.58 58.76 Favored 'General case' 0 C--N 1.324 -0.513 0 CA-C-O 120.968 0.413 . . . . 0.0 111.144 -178.994 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 106' ' ' GLU . . . . . 0.552 ' OE1' ' HB3' ' A' ' 103' ' ' SER . 1.0 OUTLIER -97.08 2.73 51.64 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.119 -0.491 . . . . 0.0 110.875 -178.945 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 107' ' ' ILE . . . . . 0.504 HD11 ' HB2' ' A' ' 64' ' ' PHE . 86.2 mt -96.28 128.92 47.05 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.538 0 CA-C-O 121.101 0.477 . . . . 0.0 110.658 179.749 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 108' ' ' LEU . . . . . 0.708 ' HB2' ' HB2' ' A' ' 111' ' ' ASP . 2.5 mm? -103.48 144.44 28.65 Favored Pre-proline 0 C--N 1.32 -0.682 0 CA-C-N 115.574 -0.739 . . . . 0.0 110.157 -177.937 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 109' ' ' PRO . . . . . . . . . . . . . 32.0 Cg_exo -59.35 -40.73 65.19 Favored 'Trans proline' 0 C--O 1.233 0.26 0 C-N-CA 122.429 2.086 . . . . 0.0 112.035 177.365 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 110' ' ' ALA . . . . . . . . . . . . . . . -75.92 -19.83 58.48 Favored 'General case' 0 C--N 1.332 -0.188 0 CA-C-N 116.295 -0.412 . . . . 0.0 110.794 179.247 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 111' ' ' ASP . . . . . 0.708 ' HB2' ' HB2' ' A' ' 108' ' ' LEU . 33.8 t70 -71.06 -40.83 71.42 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-O 121.299 0.571 . . . . 0.0 109.753 178.769 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 112' ' ' ILE . . . . . 0.52 HG12 HD21 ' A' ' 99' ' ' LEU . 47.9 mt -66.12 -39.34 84.14 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.41 0 CA-C-N 115.71 -0.677 . . . . 0.0 109.759 174.859 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 113' ' ' GLN . . . . . . . . . . . . . 29.6 tp60 -60.83 -31.11 70.54 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 115.388 -0.824 . . . . 0.0 110.095 176.611 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 114' ' ' SER . . . . . . . . . . . . . 22.9 t -67.82 -40.64 83.78 Favored 'General case' 0 C--N 1.33 -0.246 0 CA-C-N 115.866 -0.606 . . . . 0.0 110.29 178.35 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 115' ' ' ILE . . . . . 0.545 HD11 HD13 ' A' ' 99' ' ' LEU . 74.8 mt -59.5 -39.12 78.47 Favored 'Isoleucine or valine' 0 C--O 1.233 0.231 0 CA-C-O 121.012 0.434 . . . . 0.0 110.565 177.105 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 116' ' ' ILE . . . . . . . . . . . . . 47.6 mm -66.44 -31.81 55.24 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.455 0 CA-C-N 115.866 -0.606 . . . . 0.0 110.594 178.143 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 117' ' ' ASN . . . . . . . . . . . . . 8.2 t30 -70.09 -38.08 75.57 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-O 121.069 0.462 . . . . 0.0 110.7 178.269 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 118' ' ' GLU . . . . . . . . . . . . . 39.4 mm-40 -80.14 -30.27 38.97 Favored 'General case' 0 C--N 1.325 -0.494 0 CA-C-N 116.092 -0.503 . . . . 0.0 111.219 -177.677 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 119' ' ' THR . . . . . . . . . . . . . 51.4 m -79.67 110.87 15.42 Favored 'General case' 0 C--N 1.322 -0.591 0 CA-C-O 121.271 0.558 . . . . 0.0 109.851 176.117 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 120' ' ' LYS . . . . . . . . . . . . . 47.4 mttp -111.28 76.83 1.0 Allowed 'General case' 0 C--N 1.317 -0.806 0 CA-C-O 121.46 0.648 . . . . 0.0 110.268 -177.182 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 121' ' ' LEU . . . . . . . . . . . . . 97.9 mt -129.3 -174.88 3.4 Favored 'General case' 0 C--N 1.323 -0.576 0 CA-C-N 114.996 -1.002 . . . . 0.0 109.86 -178.666 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 122' ' ' ALA . . . . . . . . . . . . . . . -62.35 158.2 18.04 Favored 'General case' 0 C--N 1.327 -0.388 0 CA-C-O 120.997 0.427 . . . . 0.0 111.925 -179.001 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 123' ' ' LYS . . . . . . . . . . . . . 93.7 mttt -54.29 -49.6 69.27 Favored 'General case' 0 N--CA 1.464 0.252 0 CA-C-N 115.62 -0.718 . . . . 0.0 111.418 -177.823 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 124' ' ' ASN . . . . . . . . . . . . . 27.8 t-20 -55.13 -40.8 70.96 Favored 'General case' 0 C--N 1.331 -0.234 0 CA-C-N 115.607 -0.724 . . . . 0.0 111.265 -179.038 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 125' ' ' THR . . . . . 0.494 ' O ' HG13 ' A' ' 129' ' ' ILE . 6.5 m -69.13 -44.26 72.71 Favored 'General case' 0 C--N 1.327 -0.393 0 CA-C-N 116.075 -0.512 . . . . 0.0 110.717 -178.447 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 126' ' ' LEU . . . . . . . . . . . . . 87.2 mt -60.26 -45.42 93.36 Favored 'General case' 0 C--O 1.234 0.278 0 CA-C-N 116.26 -0.427 . . . . 0.0 110.907 -179.184 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 127' ' ' LYS . . . . . 0.785 ' HG2' HG13 ' A' ' 156' ' ' ILE . 96.5 mttt -68.28 -36.81 79.95 Favored 'General case' 0 C--N 1.326 -0.44 0 CA-C-N 116.062 -0.517 . . . . 0.0 110.707 179.725 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 128' ' ' ALA . . . . . . . . . . . . . . . -60.34 -41.32 93.35 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.419 -0.355 . . . . 0.0 110.912 179.196 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 129' ' ' ILE . . . . . 0.494 HG13 ' O ' ' A' ' 125' ' ' THR . 80.2 mt -59.87 -49.88 82.21 Favored 'Isoleucine or valine' 0 C--O 1.235 0.301 0 CA-C-N 116.15 -0.477 . . . . 0.0 110.239 177.485 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 130' ' ' ARG . . . . . 0.584 ' NH1' ' HA ' ' A' ' 152' ' ' ASP . 23.3 ttp85 -63.67 -46.11 87.06 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 115.845 -0.616 . . . . 0.0 110.606 -179.216 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 131' ' ' ASN . . . . . . . . . . . . . 92.5 m-20 -58.57 -40.17 82.35 Favored 'General case' 0 N--CA 1.464 0.242 0 CA-C-N 116.302 -0.408 . . . . 0.0 111.086 179.818 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 132' ' ' THR . . . . . 0.424 ' O ' HG13 ' A' ' 136' ' ' ILE . 53.8 m -61.8 -46.61 88.79 Favored 'General case' 0 C--N 1.33 -0.248 0 CA-C-O 120.813 0.34 . . . . 0.0 110.42 177.214 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 133' ' ' ALA . . . . . . . . . . . . . . . -61.15 -44.4 97.38 Favored 'General case' 0 C--N 1.331 -0.233 0 CA-C-N 116.012 -0.54 . . . . 0.0 110.64 178.938 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 134' ' ' SER . . . . . 0.473 ' O ' ' HG3' ' A' ' 138' ' ' ARG . 74.3 m -54.45 -45.9 73.2 Favored 'General case' 0 C--N 1.331 -0.227 0 CA-C-N 116.236 -0.438 . . . . 0.0 111.197 178.665 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 135' ' ' GLN . . . . . . . . . . . . . 75.2 mt-30 -64.9 -38.55 91.35 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-O 120.603 0.24 . . . . 0.0 110.969 -178.855 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 136' ' ' ILE . . . . . 0.424 HG13 ' O ' ' A' ' 132' ' ' THR . 72.4 mt -63.91 -47.01 92.51 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.269 0 CA-C-N 116.485 -0.325 . . . . 0.0 110.704 177.813 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 137' ' ' PHE . . . . . 0.541 ' O ' HG13 ' A' ' 141' ' ' ILE . 46.6 m-85 -63.03 -36.83 84.87 Favored 'General case' 0 C--N 1.331 -0.214 0 CA-C-N 116.303 -0.408 . . . . 0.0 111.004 178.2 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 138' ' ' ARG . . . . . 0.497 ' O ' ' HG3' ' A' ' 142' ' ' GLU . 91.4 mtt180 -61.5 -41.89 97.96 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.742 -0.208 . . . . 0.0 110.819 178.472 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 139' ' ' LEU . . . . . . . . . . . . . 58.2 tp -59.4 -43.02 93.03 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-O 121.147 0.498 . . . . 0.0 110.125 175.213 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 140' ' ' ALA . . . . . . . . . . . . . . . -62.22 -43.64 98.37 Favored 'General case' 0 C--N 1.324 -0.505 0 CA-C-N 115.885 -0.598 . . . . 0.0 110.527 177.201 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 141' ' ' ILE . . . . . 0.541 HG13 ' O ' ' A' ' 137' ' ' PHE . 75.0 mt -61.61 -34.0 59.88 Favored 'Isoleucine or valine' 0 CA--C 1.531 0.238 0 CA-C-N 116.466 -0.334 . . . . 0.0 111.26 176.225 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 142' ' ' GLU . . . . . 0.497 ' HG3' ' O ' ' A' ' 138' ' ' ARG . 43.6 mt-10 -60.37 -41.31 93.48 Favored 'General case' 0 C--N 1.332 -0.17 0 CA-C-O 120.874 0.369 . . . . 0.0 110.692 177.907 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 143' ' ' ASN . . . . . . . . . . . . . 3.1 m-20 -88.75 -1.58 58.15 Favored 'General case' 0 C--N 1.327 -0.403 0 CA-C-O 121.015 0.436 . . . . 0.0 110.189 176.754 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 144' ' ' ARG . . . . . . . . . . . . . 69.2 mtt180 65.02 27.78 12.54 Favored 'General case' 0 N--CA 1.462 0.155 0 CA-C-N 115.228 -0.897 . . . . 0.0 111.668 177.515 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 145' ' ' ALA . . . . . . . . . . . . . . . -66.62 -43.89 83.51 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 115.685 -0.689 . . . . 0.0 109.508 174.859 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 146' ' ' ILE . . . . . . . . . . . . . 20.5 tt -120.75 151.73 23.72 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.477 0 N-CA-C 108.586 -0.894 . . . . 0.0 108.586 172.632 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 147' ' ' ASP . . . . . . . . . . . . . 39.0 t70 -96.66 -5.86 37.92 Favored 'General case' 0 C--N 1.322 -0.617 0 N-CA-C 112.326 0.491 . . . . 0.0 112.326 -169.723 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 148' ' ' PHE . . . . . . . . . . . . . 47.6 p90 -154.63 171.19 19.89 Favored 'General case' 0 C--N 1.323 -0.558 0 O-C-N 122.18 -0.325 . . . . 0.0 110.783 -173.934 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 149' ' ' ASN . . . . . 0.415 ' HA ' ' HD2' ' A' ' 150' ' ' PRO . 42.9 t-20 -118.51 95.39 48.73 Favored Pre-proline 0 C--N 1.327 -0.393 0 CA-C-N 116.292 -0.413 . . . . 0.0 110.299 -179.011 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 150' ' ' PRO . . . . . 0.415 ' HD2' ' HA ' ' A' ' 149' ' ' ASN . 39.2 Cg_endo -66.61 -22.33 51.02 Favored 'Trans proline' 0 C--N 1.341 0.178 0 C-N-CA 122.817 2.345 . . . . 0.0 112.166 -178.433 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 151' ' ' ALA . . . . . . . . . . . . . . . -70.52 -28.91 65.31 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.227 -0.442 . . . . 0.0 110.564 -179.51 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 152' ' ' ASP . . . . . 0.584 ' HA ' ' NH1' ' A' ' 130' ' ' ARG . 85.6 m-20 -80.01 -10.84 59.8 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-O 121.2 0.524 . . . . 0.0 110.621 179.226 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 153' ' ' TYR . . . . . . . . . . . . . 60.3 t80 -88.9 -16.98 30.55 Favored 'General case' 0 C--N 1.321 -0.661 0 CA-C-N 115.572 -0.74 . . . . 0.0 109.216 174.566 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 154' ' ' VAL . . . . . . . . . . . . . 90.5 t -73.61 130.8 35.67 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.291 0 CA-C-N 115.656 -0.702 . . . . 0.0 109.997 177.535 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 155' ' ' ARG . . . . . . . . . . . . . 71.4 ttt180 -110.7 142.49 42.55 Favored 'General case' 0 C--N 1.318 -0.766 0 N-CA-C 109.523 -0.547 . . . . 0.0 109.523 178.81 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 156' ' ' ILE . . . . . 0.785 HG13 ' HG2' ' A' ' 127' ' ' LYS . 42.3 mm -87.86 116.0 64.81 Favored Pre-proline 0 C--N 1.32 -0.694 0 N-CA-C 109.476 -0.564 . . . . 0.0 109.476 -179.664 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 157' ' ' PRO . . . . . 0.435 ' HD3' ' HA ' ' A' ' 156' ' ' ILE . 24.0 Cg_exo -62.71 130.55 29.98 Favored 'Trans proline' 0 N--CA 1.463 -0.269 0 C-N-CA 122.48 2.12 . . . . 0.0 112.144 -176.561 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 158' ' ' LYS . . . . . . . . . . . . . 10.2 mtmp? -109.13 67.51 0.65 Allowed 'General case' 0 C--N 1.323 -0.563 0 CA-C-N 116.312 -0.404 . . . . 0.0 110.154 179.09 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 159' ' ' ILE . . . . . . . . . . . . . 53.6 mt -78.68 92.57 1.45 Allowed 'Isoleucine or valine' 0 C--N 1.321 -0.638 0 N-CA-C 108.888 -0.782 . . . . 0.0 108.888 176.062 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 160' ' ' ALA . . . . . . . . . . . . . . . -136.33 115.51 12.48 Favored 'General case' 0 C--N 1.318 -0.765 0 CA-C-N 116.001 -0.545 . . . . 0.0 111.257 -172.02 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 161' ' ' LEU . . . . . . . . . . . . . 4.9 mp -106.87 138.56 42.81 Favored 'General case' 0 C--N 1.317 -0.847 0 CA-C-N 115.644 -0.707 . . . . 0.0 109.524 174.332 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 162' ' ' GLU . . . . . . . . . . . . . 4.3 tm-20 -68.93 -27.5 65.81 Favored 'General case' 0 C--N 1.323 -0.577 0 CA-C-N 115.748 -0.66 . . . . 0.0 110.334 -179.252 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 163' ' ' HIS . . . . . . . . . . . . . 33.1 m170 -84.71 139.62 31.87 Favored 'General case' 0 C--N 1.323 -0.563 0 CA-C-N 116.051 -0.522 . . . . 0.0 109.848 175.127 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 164' ' ' HIS . . . . . . . . . . . . . 15.7 m-70 -74.37 151.16 39.77 Favored 'General case' 0 C--N 1.322 -0.629 0 CA-C-N 115.762 -0.654 . . . . 0.0 110.481 -174.743 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 165' ' ' HIS . . . . . 0.418 ' HB2' ' H ' ' A' ' 166' ' ' HIS . 24.2 m80 -91.96 -97.76 0.12 Allowed 'General case' 0 C--N 1.328 -0.358 0 CA-C-O 121.121 0.486 . . . . 0.0 110.892 -173.192 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 166' ' ' HIS . . . . . 0.418 ' H ' ' HB2' ' A' ' 165' ' ' HIS . 89.5 m-70 -110.86 -46.28 3.37 Favored 'General case' 0 CA--C 1.514 -0.406 0 N-CA-C 108.761 -0.829 . . . . 0.0 108.761 177.794 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 167' ' ' HIS . . . . . . . . . . . . . 18.1 m-70 -73.25 114.53 11.55 Favored 'General case' 0 N--CA 1.45 -0.44 0 CA-C-N 115.327 -0.852 . . . . 0.0 108.89 171.485 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 168' ' ' HIS . . . . . . . . . . . . . 56.3 p-80 . . . . . 0 C--O 1.245 0.827 0 CA-C-O 118.231 -0.89 . . . . 0.0 109.562 179.372 . . . . . . . . 0 0 . 1 . 002 nuclear build full ' A' A ' 61' ' ' ARG . . . . . . . . . . . . . 32.5 mmt180 . . . . . 0 N--CA 1.477 0.885 0 N-CA-C 109.978 -0.378 . . . . 0.0 109.978 . . . . . . . . . 0 0 . 1 . 002 nuclear build full ' A' A ' 62' ' ' ASP . . . . . . . . . . . . . 5.0 m-20 -99.65 122.29 42.46 Favored 'General case' 0 C--N 1.322 -0.607 0 CA-C-O 121.081 0.467 . . . . 0.0 110.62 -178.801 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 63' ' ' SER . . . . . . . . . . . . . 22.9 t -89.48 178.33 6.33 Favored 'General case' 0 C--N 1.318 -0.797 0 N-CA-C 109.001 -0.741 . . . . 0.0 109.001 176.869 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 64' ' ' PHE . . . . . 0.433 ' HB2' HD11 ' A' ' 107' ' ' ILE . 73.8 t80 -66.18 -32.53 74.03 Favored 'General case' 0 C--N 1.328 -0.332 0 N-CA-C 109.149 -0.686 . . . . 0.0 109.149 177.386 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 65' ' ' GLY . . . . . . . . . . . . . . . -59.76 -40.21 96.32 Favored Glycine 0 N--CA 1.448 -0.508 0 CA-C-N 115.775 -0.648 . . . . 0.0 111.666 175.427 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 66' ' ' ASP . . . . . 0.424 ' O ' ' HB2' ' A' ' 70' ' ' LYS . 9.1 m-20 -61.96 -45.06 95.3 Favored 'General case' 0 CA--C 1.519 -0.239 0 CA-C-O 120.83 0.347 . . . . 0.0 110.628 178.682 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 67' ' ' TRP . . . . . 0.517 ' HA ' ' HB2' ' A' ' 70' ' ' LYS . 90.2 m95 -78.13 -31.92 50.14 Favored 'General case' 0 C--N 1.327 -0.383 0 CA-C-N 116.275 -0.42 . . . . 0.0 111.861 -176.856 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 68' ' ' ALA . . . . . 0.557 ' HB1' ' HB3' ' A' ' 92' ' ' CYS . . . -63.08 -44.2 96.42 Favored 'General case' 0 C--N 1.325 -0.474 0 N-CA-C 109.687 -0.486 . . . . 0.0 109.687 174.955 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 69' ' ' GLU . . . . . . . . . . . . . 3.7 tp10 -68.56 -38.12 80.49 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 115.639 -0.71 . . . . 0.0 109.885 174.9 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 70' ' ' LYS . . . . . 0.517 ' HB2' ' HA ' ' A' ' 67' ' ' TRP . 1.7 tppt? -57.51 -45.52 84.85 Favored 'General case' 0 C--N 1.331 -0.201 0 CA-C-N 115.86 -0.609 . . . . 0.0 110.343 179.303 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 71' ' ' PHE . . . . . . . . . . . . . 70.1 t80 -62.5 -44.45 96.34 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 115.834 -0.621 . . . . 0.0 110.593 179.651 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 72' ' ' LEU . . . . . 0.529 HD21 ' HA ' ' A' ' 89' ' ' LYS . 8.5 mp -60.33 -48.86 79.92 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.076 -0.511 . . . . 0.0 110.56 177.226 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 73' ' ' LYS . . . . . . . . . . . . . 59.1 mtpt -59.77 -38.52 82.05 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 116.284 -0.416 . . . . 0.0 110.943 178.335 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 74' ' ' SER . . . . . 0.428 ' O ' ' HB2' ' A' ' 78' ' ' ASP . 58.5 m -61.61 -45.03 95.83 Favored 'General case' 0 C--N 1.327 -0.371 0 CA-C-N 116.431 -0.349 . . . . 0.0 110.947 179.36 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 75' ' ' LYS . . . . . . . . . . . . . 72.3 mmtt -71.29 -42.93 68.09 Favored 'General case' 0 C--N 1.327 -0.377 0 CA-C-O 120.757 0.313 . . . . 0.0 111.071 178.774 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 76' ' ' GLU . . . . . . . . . . . . . 9.4 tp10 -57.48 -46.08 84.1 Favored 'General case' 0 C--N 1.327 -0.383 0 CA-C-N 115.825 -0.625 . . . . 0.0 110.513 179.205 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 77' ' ' ALA . . . . . . . . . . . . . . . -79.25 -21.97 45.4 Favored 'General case' 0 C--N 1.327 -0.405 0 CA-C-N 116.022 -0.535 . . . . 0.0 111.497 -178.582 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 78' ' ' ASP . . . . . 0.428 ' HB2' ' O ' ' A' ' 74' ' ' SER . 24.3 t70 -68.8 -54.5 15.49 Favored 'General case' 0 C--N 1.327 -0.378 0 CA-C-O 121.051 0.453 . . . . 0.0 110.28 179.907 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 79' ' ' GLY . . . . . . . . . . . . . . . 137.61 65.22 0.05 OUTLIER Glycine 0 N--CA 1.445 -0.76 0 CA-C-N 115.688 -0.687 . . . . 0.0 112.194 179.482 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 80' ' ' VAL . . . . . . . . . . . . . 35.0 m -119.0 160.01 19.17 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.523 0 N-CA-C 109.882 -0.414 . . . . 0.0 109.882 176.03 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 81' ' ' SER . . . . . . . . . . . . . 8.7 t -72.35 159.56 33.81 Favored 'General case' 0 C--N 1.322 -0.591 0 N-CA-C 110.08 -0.341 . . . . 0.0 110.08 179.693 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 82' ' ' VAL . . . . . . . . . . . . . 48.2 t -59.91 -46.07 94.37 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.322 0 CA-C-O 120.785 0.326 . . . . 0.0 110.699 -177.793 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 83' ' ' SER . . . . . . . . . . . . . 52.7 p -57.09 -40.83 77.72 Favored 'General case' 0 C--N 1.326 -0.414 0 CA-C-N 115.961 -0.563 . . . . 0.0 110.591 178.252 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 84' ' ' GLN . . . . . . . . . . . . . 6.6 tp-100 -65.5 -45.72 82.51 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 115.644 -0.707 . . . . 0.0 110.336 -179.382 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 85' ' ' LEU . . . . . 0.441 HD21 ' O ' ' A' ' 72' ' ' LEU . 1.3 tm? -64.28 -42.36 96.47 Favored 'General case' 0 C--N 1.325 -0.458 0 CA-C-N 116.059 -0.519 . . . . 0.0 109.618 178.767 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 86' ' ' ASN . . . . . . . . . . . . . 5.8 m-20 -66.82 -21.83 66.02 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.259 -0.428 . . . . 0.0 111.426 178.407 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 87' ' ' SER . . . . . . . . . . . . . 50.5 m -67.08 -48.54 67.91 Favored 'General case' 0 C--N 1.326 -0.445 0 N-CA-C 109.466 -0.568 . . . . 0.0 109.466 174.222 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 88' ' ' TYR . . . . . 0.418 ' HA ' ' CD2' ' A' ' 91' ' ' TYR . 47.8 m-85 -66.06 -35.78 81.46 Favored 'General case' 0 C--N 1.334 -0.107 0 CA-C-O 121.324 0.583 . . . . 0.0 109.832 176.689 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 89' ' ' LYS . . . . . 0.529 ' HA ' HD21 ' A' ' 72' ' ' LEU . 34.5 ttmt -60.14 -43.68 95.51 Favored 'General case' 0 C--N 1.325 -0.492 0 CA-C-N 115.208 -0.906 . . . . 0.0 110.389 177.862 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 90' ' ' ASN . . . . . 0.438 ' O ' ' HB2' ' A' ' 94' ' ' ASN . 36.1 t30 -63.46 -33.39 75.46 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 115.929 -0.578 . . . . 0.0 110.749 177.829 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 91' ' ' TYR . . . . . 0.418 ' CD2' ' HA ' ' A' ' 88' ' ' TYR . 23.2 m-85 -69.88 -59.76 2.72 Favored 'General case' 0 C--N 1.324 -0.52 0 CA-C-N 116.462 -0.335 . . . . 0.0 110.36 177.395 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 92' ' ' CYS . . . . . 0.557 ' HB3' ' HB1' ' A' ' 68' ' ' ALA . 82.0 m -66.53 -47.68 72.14 Favored 'General case' 0 C--N 1.326 -0.423 0 N-CA-C 112.778 0.658 . . . . 0.0 112.778 -173.086 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 93' ' ' ARG . . . . . 0.417 HH11 ' HD3' ' A' ' 93' ' ' ARG . 10.4 mmm180 -77.17 -49.12 15.89 Favored 'General case' 0 C--N 1.326 -0.449 0 N-CA-C 111.966 0.358 . . . . 0.0 111.966 -173.669 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 94' ' ' ASN . . . . . 0.438 ' HB2' ' O ' ' A' ' 90' ' ' ASN . 2.6 m-20 -84.8 -50.73 7.32 Favored 'General case' 0 C--N 1.325 -0.496 0 CA-C-N 116.167 -0.47 . . . . 0.0 111.819 -172.209 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 95' ' ' HIS . . . . . . . . . . . . . 78.5 m80 -86.24 -40.93 15.05 Favored 'General case' 0 C--N 1.325 -0.497 0 N-CA-C 112.017 0.377 . . . . 0.0 112.017 -172.391 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 96' ' ' LEU . . . . . 0.518 HD12 ' HA ' ' A' ' 92' ' ' CYS . 96.0 mt -89.17 22.26 2.89 Favored 'General case' 0 C--N 1.323 -0.586 0 CA-C-O 120.956 0.407 . . . . 0.0 110.699 -179.765 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 97' ' ' SER . . . . . 0.488 ' OG ' ' HD3' ' A' ' 98' ' ' PRO . 3.1 p -57.36 -41.49 91.11 Favored Pre-proline 0 CA--C 1.545 0.771 0 N-CA-C 113.188 0.81 . . . . 0.0 113.188 -179.183 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 98' ' ' PRO . . . . . 0.488 ' HD3' ' OG ' ' A' ' 97' ' ' SER . 31.5 Cg_exo -58.46 -35.74 98.32 Favored 'Trans proline' 0 C--N 1.363 1.33 0 C-N-CA 121.631 1.554 . . . . 0.0 112.109 176.965 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 99' ' ' LEU . . . . . . . . . . . . . 49.2 mt -84.63 -30.07 25.22 Favored 'General case' 0 C--N 1.326 -0.45 0 CA-C-N 116.263 -0.426 . . . . 0.0 110.657 -176.85 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 100' ' ' TYR . . . . . . . . . . . . . 17.4 t80 -57.82 -26.69 62.34 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 115.811 -0.631 . . . . 0.0 111.297 -176.495 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 101' ' ' MET . . . . . . . . . . . . . 26.8 ptt? -97.81 1.92 48.81 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.215 -0.448 . . . . 0.0 111.44 -178.115 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 102' ' ' LYS . . . . . . . . . . . . . 95.5 mttt -109.23 149.29 29.62 Favored 'General case' 0 C--N 1.326 -0.435 0 CA-C-O 120.732 0.301 . . . . 0.0 110.527 -178.285 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 103' ' ' SER . . . . . 0.422 ' O ' HG13 ' A' ' 107' ' ' ILE . 62.5 m -70.04 146.95 50.62 Favored 'General case' 0 C--N 1.323 -0.579 0 CA-C-N 116.226 -0.443 . . . . 0.0 110.238 178.867 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 104' ' ' LEU . . . . . . . . . . . . . 26.5 tp -55.28 -33.6 63.36 Favored 'General case' 0 C--N 1.326 -0.419 0 CA-C-N 115.816 -0.629 . . . . 0.0 111.861 -177.272 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 105' ' ' SER . . . . . . . . . . . . . 2.9 p -81.74 -16.59 50.63 Favored 'General case' 0 C--N 1.323 -0.571 0 N-CA-C 112.769 0.655 . . . . 0.0 112.769 -173.756 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 106' ' ' GLU . . . . . . . . . . . . . 20.3 pt-20 -108.21 9.32 28.11 Favored 'General case' 0 C--N 1.329 -0.325 0 C-N-CA 120.798 -0.361 . . . . 0.0 111.884 -172.388 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 107' ' ' ILE . . . . . 0.433 HD11 ' HB2' ' A' ' 64' ' ' PHE . 69.1 mt -88.03 102.68 12.86 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.5 0 CA-C-O 121.152 0.501 . . . . 0.0 110.707 -179.873 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 108' ' ' LEU . . . . . 0.626 ' H ' HD23 ' A' ' 108' ' ' LEU . 2.5 pt? -75.4 143.25 75.9 Favored Pre-proline 0 C--N 1.324 -0.519 0 CA-C-N 115.86 -0.609 . . . . 0.0 110.391 177.104 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 109' ' ' PRO . . . . . 0.456 ' HG3' ' HB3' ' A' ' 150' ' ' PRO . 32.5 Cg_exo -57.13 -31.41 90.33 Favored 'Trans proline' 0 C--N 1.347 0.479 0 C-N-CA 123.053 2.502 . . . . 0.0 112.347 -177.714 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 110' ' ' ALA . . . . . . . . . . . . . . . -61.55 -35.42 77.73 Favored 'General case' 0 C--N 1.327 -0.375 0 CA-C-N 115.677 -0.692 . . . . 0.0 111.375 -178.859 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 111' ' ' ASP . . . . . . . . . . . . . 26.0 t70 -72.06 -37.89 69.56 Favored 'General case' 0 C--O 1.234 0.289 0 CA-C-O 121.031 0.443 . . . . 0.0 110.338 -176.357 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 112' ' ' ILE . . . . . 0.442 ' HB ' HG21 ' A' ' 154' ' ' VAL . 34.9 mt -66.36 -38.39 81.71 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.363 0 CA-C-N 115.928 -0.578 . . . . 0.0 109.444 175.678 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 113' ' ' GLN . . . . . . . . . . . . . 27.3 tp60 -62.19 -37.46 85.36 Favored 'General case' 0 C--N 1.331 -0.216 0 CA-C-N 115.472 -0.786 . . . . 0.0 110.032 177.002 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 114' ' ' SER . . . . . . . . . . . . . 33.8 m -59.72 -40.67 88.8 Favored 'General case' 0 C--N 1.334 -0.09 0 CA-C-N 116.155 -0.475 . . . . 0.0 110.786 177.031 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 115' ' ' ILE . . . . . . . . . . . . . 69.4 mt -61.75 -47.89 91.19 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.303 0 CA-C-N 116.252 -0.431 . . . . 0.0 110.478 178.934 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 116' ' ' ILE . . . . . . . . . . . . . 38.9 mm -70.68 -18.18 20.89 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.31 0 CA-C-O 121.279 0.562 . . . . 0.0 110.653 -179.365 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 117' ' ' ASN . . . . . . . . . . . . . 1.9 m-20 -77.43 -51.29 11.03 Favored 'General case' 0 C--N 1.326 -0.421 0 CA-C-N 116.006 -0.543 . . . . 0.0 111.253 178.646 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 118' ' ' GLU . . . . . . . . . . . . . 25.3 mt-10 -82.93 -30.23 28.54 Favored 'General case' 0 C--O 1.236 0.346 0 N-CA-C 111.957 0.355 . . . . 0.0 111.957 -175.657 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 119' ' ' THR . . . . . . . . . . . . . 62.0 m -70.26 111.55 5.95 Favored 'General case' 0 C--N 1.325 -0.459 0 N-CA-C 109.474 -0.565 . . . . 0.0 109.474 177.031 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 120' ' ' LYS . . . . . . . . . . . . . 35.2 mtmm -111.91 78.29 1.11 Allowed 'General case' 0 C--N 1.323 -0.585 0 CA-C-O 121.658 0.742 . . . . 0.0 111.027 -176.68 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 121' ' ' LEU . . . . . 0.412 ' H ' HD21 ' A' ' 126' ' ' LEU . 4.6 mm? -108.79 -174.84 2.61 Favored 'General case' 0 C--N 1.318 -0.796 0 CA-C-N 114.357 -1.292 . . . . 0.0 108.402 172.949 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 122' ' ' ALA . . . . . . . . . . . . . . . -56.04 134.03 52.24 Favored 'General case' 0 C--N 1.324 -0.523 0 N-CA-C 109.643 -0.503 . . . . 0.0 109.643 172.164 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 123' ' ' LYS . . . . . 0.597 ' HD2' HD11 ' A' ' 159' ' ' ILE . 35.1 mtmm -54.07 -35.53 62.16 Favored 'General case' 0 C--N 1.327 -0.403 0 CA-C-N 116.482 -0.326 . . . . 0.0 111.392 -178.644 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 124' ' ' ASN . . . . . . . . . . . . . 36.7 t30 -57.32 -43.39 83.27 Favored 'General case' 0 C--N 1.327 -0.407 0 CA-C-O 121.115 0.484 . . . . 0.0 110.455 175.961 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 125' ' ' THR . . . . . 0.47 ' O ' HG13 ' A' ' 129' ' ' ILE . 33.4 m -73.32 -34.75 65.85 Favored 'General case' 0 C--N 1.326 -0.432 0 CA-C-N 115.852 -0.613 . . . . 0.0 110.764 179.58 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 126' ' ' LEU . . . . . 0.412 HD21 ' H ' ' A' ' 121' ' ' LEU . 92.2 mt -60.96 -42.17 97.74 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-O 120.981 0.42 . . . . 0.0 110.348 177.061 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 127' ' ' LYS . . . . . 0.53 ' HG3' ' O ' ' A' ' 123' ' ' LYS . 44.7 mtpt -60.12 -45.9 91.45 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 115.703 -0.68 . . . . 0.0 109.996 175.16 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 128' ' ' ALA . . . . . . . . . . . . . . . -58.04 -45.86 86.27 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 115.719 -0.673 . . . . 0.0 111.355 -179.421 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 129' ' ' ILE . . . . . 0.47 HG13 ' O ' ' A' ' 125' ' ' THR . 71.9 mt -59.02 -48.32 87.05 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.228 0 CA-C-O 121.122 0.487 . . . . 0.0 110.439 178.155 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 130' ' ' ARG . . . . . 0.428 ' HD3' ' O ' ' A' ' 151' ' ' ALA . 1.5 tmm_? -62.81 -49.56 74.47 Favored 'General case' 0 C--N 1.326 -0.431 0 CA-C-N 115.672 -0.694 . . . . 0.0 110.333 -178.851 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 131' ' ' ASN . . . . . . . . . . . . . 95.9 m-20 -62.55 -39.25 93.03 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-N 116.165 -0.47 . . . . 0.0 111.195 -176.945 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 132' ' ' THR . . . . . 0.496 ' O ' HG13 ' A' ' 136' ' ' ILE . 56.5 m -59.5 -42.16 91.53 Favored 'General case' 0 C--N 1.327 -0.407 0 CA-C-O 120.796 0.331 . . . . 0.0 110.188 176.941 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 133' ' ' ALA . . . . . . . . . . . . . . . -65.37 -44.09 88.69 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 116.162 -0.472 . . . . 0.0 111.207 179.613 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 134' ' ' SER . . . . . 0.457 ' HA ' ' HB3' ' A' ' 151' ' ' ALA . 10.9 p -64.88 -30.31 71.3 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-O 120.651 0.262 . . . . 0.0 111.123 179.916 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 135' ' ' GLN . . . . . 0.541 ' HA ' ' HG2' ' A' ' 138' ' ' ARG . 2.1 mp0 -71.79 -34.96 69.84 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.423 -0.353 . . . . 0.0 110.515 175.813 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 136' ' ' ILE . . . . . 0.496 HG13 ' O ' ' A' ' 132' ' ' THR . 77.8 mt -63.11 -47.36 92.87 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.459 0 CA-C-N 116.128 -0.487 . . . . 0.0 110.492 175.737 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 137' ' ' PHE . . . . . 0.429 ' O ' HG13 ' A' ' 141' ' ' ILE . 48.7 m-85 -64.81 -38.36 90.72 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 116.18 -0.464 . . . . 0.0 111.712 -179.911 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 138' ' ' ARG . . . . . 0.541 ' HG2' ' HA ' ' A' ' 135' ' ' GLN . 9.4 ptm180 -73.73 -25.87 60.4 Favored 'General case' 0 C--N 1.329 -0.307 0 C-N-CA 120.622 -0.431 . . . . 0.0 110.377 -179.393 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 139' ' ' LEU . . . . . . . . . . . . . 55.9 tp -67.51 -32.56 73.45 Favored 'General case' 0 C--N 1.332 -0.153 0 CA-C-O 121.58 0.705 . . . . 0.0 109.391 173.712 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 140' ' ' ALA . . . . . 0.415 ' HB1' ' HB3' ' A' ' 145' ' ' ALA . . . -72.55 -38.33 68.01 Favored 'General case' 0 C--N 1.322 -0.61 0 CA-C-N 115.46 -0.791 . . . . 0.0 110.452 175.408 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 141' ' ' ILE . . . . . 0.429 HG13 ' O ' ' A' ' 137' ' ' PHE . 75.5 mt -56.93 -47.69 82.78 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.286 0 CA-C-N 116.118 -0.492 . . . . 0.0 111.455 177.335 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 142' ' ' GLU . . . . . . . . . . . . . 11.3 pt-20 -70.44 -6.71 37.79 Favored 'General case' 0 CA--C 1.533 0.302 0 CA-C-O 120.924 0.393 . . . . 0.0 111.671 -177.401 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 143' ' ' ASN . . . . . . . . . . . . . 45.4 m-80 -110.99 9.46 22.18 Favored 'General case' 0 C--N 1.326 -0.456 0 CA-C-O 120.857 0.36 . . . . 0.0 110.399 174.678 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 144' ' ' ARG . . . . . . . . . . . . . 41.1 mtm105 62.18 23.23 13.7 Favored 'General case' 0 N--CA 1.463 0.21 0 CA-C-N 115.346 -0.843 . . . . 0.0 111.427 177.429 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 145' ' ' ALA . . . . . 0.415 ' HB3' ' HB1' ' A' ' 140' ' ' ALA . . . -77.94 -35.48 50.35 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-O 120.981 0.419 . . . . 0.0 110.285 179.407 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 146' ' ' ILE . . . . . 0.449 HG12 ' H ' ' A' ' 148' ' ' PHE . 15.6 tt -144.0 152.0 16.08 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.509 0 CA-C-N 115.783 -0.644 . . . . 0.0 109.313 178.093 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 147' ' ' ASP . . . . . . . . . . . . . 33.4 t70 -113.03 14.93 19.71 Favored 'General case' 0 C--N 1.323 -0.573 0 CA-C-O 121.549 0.69 . . . . 0.0 110.495 -176.416 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 148' ' ' PHE . . . . . 0.449 ' H ' HG12 ' A' ' 146' ' ' ILE . 61.2 t80 -145.13 144.3 30.84 Favored 'General case' 0 C--N 1.321 -0.669 0 CA-C-N 115.643 -0.708 . . . . 0.0 109.576 -174.972 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 149' ' ' ASN . . . . . . . . . . . . . 48.0 t-20 -119.18 88.71 37.94 Favored Pre-proline 0 C--N 1.325 -0.467 0 CA-C-O 120.963 0.411 . . . . 0.0 110.413 179.14 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 150' ' ' PRO . . . . . 0.456 ' HB3' ' HG3' ' A' ' 109' ' ' PRO . 35.8 Cg_exo -59.95 -29.25 88.94 Favored 'Trans proline' 0 C--N 1.342 0.195 0 C-N-CA 122.612 2.208 . . . . 0.0 112.154 -178.549 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 151' ' ' ALA . . . . . 0.457 ' HB3' ' HA ' ' A' ' 134' ' ' SER . . . -70.33 -27.78 64.63 Favored 'General case' 0 N--CA 1.449 -0.483 0 CA-C-N 115.69 -0.687 . . . . 0.0 112.164 -173.218 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 152' ' ' ASP . . . . . . . . . . . . . 0.0 OUTLIER -79.03 -14.37 59.22 Favored 'General case' 0 C--N 1.331 -0.232 0 C-N-CA 119.531 -0.868 . . . . 0.0 109.889 -176.953 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 153' ' ' TYR . . . . . . . . . . . . . 86.3 m-85 -88.46 -1.0 57.81 Favored 'General case' 0 C--N 1.331 -0.227 0 CA-C-N 116.036 -0.529 . . . . 0.0 110.522 176.768 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 154' ' ' VAL . . . . . 0.442 HG21 ' HB ' ' A' ' 112' ' ' ILE . 73.5 t -85.87 126.36 40.56 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.436 0 CA-C-N 115.861 -0.608 . . . . 0.0 109.793 175.788 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 155' ' ' ARG . . . . . . . . . . . . . 38.7 ttt180 -103.63 140.59 37.36 Favored 'General case' 0 C--N 1.323 -0.585 0 CA-C-N 116.222 -0.445 . . . . 0.0 111.127 -173.421 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 156' ' ' ILE . . . . . 0.408 HG12 ' HG2' ' A' ' 127' ' ' LYS . 1.9 mp -88.32 140.7 30.4 Favored Pre-proline 0 C--N 1.328 -0.346 0 CA-C-N 115.656 -0.702 . . . . 0.0 110.135 177.904 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 157' ' ' PRO . . . . . . . . . . . . . 52.0 Cg_exo -56.98 128.63 30.68 Favored 'Trans proline' 0 N--CA 1.459 -0.541 0 C-N-CA 122.083 1.855 . . . . 0.0 111.818 173.221 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 158' ' ' LYS . . . . . 0.605 ' HB2' HD13 ' A' ' 159' ' ' ILE . 41.8 mttm 68.7 -48.21 0.57 Allowed 'General case' 0 N--CA 1.466 0.347 0 C-N-CA 124.04 0.936 . . . . 0.0 113.424 175.739 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 159' ' ' ILE . . . . . 0.605 HD13 ' HB2' ' A' ' 158' ' ' LYS . 0.4 OUTLIER -88.52 126.31 41.75 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.51 0 CA-C-O 120.937 0.399 . . . . 0.0 111.469 -169.003 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 160' ' ' ALA . . . . . . . . . . . . . . . -135.2 -164.76 1.57 Allowed 'General case' 0 C--N 1.321 -0.642 0 CA-C-N 115.594 -0.73 . . . . 0.0 109.655 176.733 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 161' ' ' LEU . . . . . . . . . . . . . 95.2 mt -96.78 -179.44 4.58 Favored 'General case' 0 C--N 1.321 -0.64 0 N-CA-C 110.324 -0.25 . . . . 0.0 110.324 177.989 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 162' ' ' GLU . . . . . . . . . . . . . 37.2 mt-10 66.67 -171.53 0.19 Allowed 'General case' 0 N--CA 1.463 0.187 0 O-C-N 123.645 0.59 . . . . 0.0 111.28 179.587 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 163' ' ' HIS . . . . . . . . . . . . . 28.0 p80 -107.8 117.52 34.32 Favored 'General case' 0 C--N 1.325 -0.46 0 CA-C-O 121.305 0.574 . . . . 0.0 110.045 176.752 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 164' ' ' HIS . . . . . . . . . . . . . 4.5 m-70 -132.67 -13.92 2.87 Favored 'General case' 0 C--N 1.323 -0.549 0 CA-C-N 115.386 -0.825 . . . . 0.0 110.372 179.005 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 165' ' ' HIS . . . . . 0.402 ' O ' ' HB3' ' A' ' 166' ' ' HIS . 42.9 t60 -131.07 -8.53 3.86 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.33 -0.396 . . . . 0.0 111.133 -176.435 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 166' ' ' HIS . . . . . 0.402 ' HB3' ' O ' ' A' ' 165' ' ' HIS . 19.9 t-80 67.1 49.28 1.12 Allowed 'General case' 0 N--CA 1.468 0.434 0 CA-C-O 121.945 0.878 . . . . 0.0 109.825 -176.509 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 167' ' ' HIS . . . . . . . . . . . . . 57.1 t-80 -156.17 122.45 5.07 Favored 'General case' 0 C--N 1.323 -0.57 0 CA-C-N 115.381 -0.827 . . . . 0.0 109.973 178.706 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 168' ' ' HIS . . . . . . . . . . . . . 5.6 p-80 . . . . . 0 C--O 1.244 0.787 0 CA-C-O 119.01 -0.519 . . . . 0.0 110.671 177.887 . . . . . . . . 0 0 . 1 . 003 nuclear build full ' A' A ' 61' ' ' ARG . . . . . . . . . . . . . 42.0 ttt85 . . . . . 0 N--CA 1.48 1.069 0 N-CA-C 110.69 -0.115 . . . . 0.0 110.69 . . . . . . . . . 0 0 . 1 . 003 nuclear build full ' A' A ' 62' ' ' ASP . . . . . . . . . . . . . 26.6 m-20 46.95 80.07 0.05 Allowed 'General case' 0 N--CA 1.47 0.548 0 CA-C-O 121.457 0.646 . . . . 0.0 112.214 178.736 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 63' ' ' SER . . . . . 0.437 ' HA ' ' HA ' ' A' ' 103' ' ' SER . 32.3 m -92.54 145.05 24.74 Favored 'General case' 0 C--N 1.318 -0.763 0 CA-C-N 115.85 -0.614 . . . . 0.0 110.035 179.008 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 64' ' ' PHE . . . . . 0.411 ' HB3' ' O ' ' A' ' 99' ' ' LEU . 88.6 t80 -60.72 -44.71 96.29 Favored 'General case' 0 C--N 1.326 -0.438 0 CA-C-N 116.366 -0.379 . . . . 0.0 110.812 -177.888 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 65' ' ' GLY . . . . . . . . . . . . . . . -68.47 -23.83 75.15 Favored Glycine 0 N--CA 1.451 -0.365 0 C-N-CA 120.765 -0.731 . . . . 0.0 112.374 179.622 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 66' ' ' ASP . . . . . . . . . . . . . 29.9 t70 -74.64 -47.65 30.82 Favored 'General case' 0 C--N 1.322 -0.598 0 N-CA-C 109.512 -0.551 . . . . 0.0 109.512 177.221 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 67' ' ' TRP . . . . . 0.498 ' HA ' ' HG3' ' A' ' 70' ' ' LYS . 64.3 m95 -65.29 -31.37 72.47 Favored 'General case' 0 C--N 1.33 -0.243 0 CA-C-N 115.91 -0.586 . . . . 0.0 110.906 175.361 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 68' ' ' ALA . . . . . 0.552 ' O ' ' HG ' ' A' ' 72' ' ' LEU . . . -61.93 -41.69 98.25 Favored 'General case' 0 C--N 1.327 -0.403 0 CA-C-N 116.171 -0.468 . . . . 0.0 110.239 174.935 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 69' ' ' GLU . . . . . . . . . . . . . 76.8 tt0 -63.74 -41.44 98.03 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.106 -0.497 . . . . 0.0 109.884 177.2 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 70' ' ' LYS . . . . . 0.498 ' HG3' ' HA ' ' A' ' 67' ' ' TRP . 14.1 mmmt -55.72 -47.29 77.12 Favored 'General case' 0 C--N 1.333 -0.122 0 CA-C-N 115.696 -0.684 . . . . 0.0 109.695 174.919 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 71' ' ' PHE . . . . . . . . . . . . . 91.9 t80 -63.97 -44.54 92.44 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 115.378 -0.828 . . . . 0.0 111.219 179.421 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 72' ' ' LEU . . . . . 0.552 ' HG ' ' O ' ' A' ' 68' ' ' ALA . 96.4 mt -60.36 -49.11 78.88 Favored 'General case' 0 C--N 1.327 -0.405 0 CA-C-O 120.735 0.303 . . . . 0.0 111.05 -178.914 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 73' ' ' LYS . . . . . . . . . . . . . 55.7 tptt -65.26 -37.56 87.6 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-O 121.032 0.444 . . . . 0.0 110.331 179.607 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 74' ' ' SER . . . . . . . . . . . . . 27.3 t -66.11 -41.7 90.23 Favored 'General case' 0 C--N 1.326 -0.436 0 CA-C-N 116.07 -0.514 . . . . 0.0 110.277 177.994 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 75' ' ' LYS . . . . . 0.444 ' HA ' ' HD2' ' A' ' 75' ' ' LYS . 38.7 tptt -72.13 -30.8 65.41 Favored 'General case' 0 N--CA 1.447 -0.622 0 CA-C-O 121.011 0.434 . . . . 0.0 110.687 -177.927 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 76' ' ' GLU . . . . . . . . . . . . . 37.2 tt0 -58.82 -50.14 75.07 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.202 -0.454 . . . . 0.0 109.811 171.591 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 77' ' ' ALA . . . . . . . . . . . . . . . -69.3 -27.34 65.31 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 115.935 -0.575 . . . . 0.0 110.748 178.348 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 78' ' ' ASP . . . . . 0.407 ' HB3' ' O ' ' A' ' 75' ' ' LYS . 24.1 t70 -59.27 -31.15 68.84 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 115.752 -0.658 . . . . 0.0 110.009 175.823 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 79' ' ' GLY . . . . . . . . . . . . . . . 105.17 53.22 0.8 Allowed Glycine 0 N--CA 1.451 -0.319 0 C-N-CA 120.715 -0.755 . . . . 0.0 113.238 172.466 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 80' ' ' VAL . . . . . . . . . . . . . 30.2 m -99.73 161.38 3.26 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.519 0 CA-C-O 120.685 0.279 . . . . 0.0 111.001 178.644 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 81' ' ' SER . . . . . . . . . . . . . 5.5 m -66.09 154.61 39.13 Favored 'General case' 0 C--N 1.325 -0.496 0 CA-C-N 115.767 -0.651 . . . . 0.0 110.379 178.164 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 82' ' ' VAL . . . . . . . . . . . . . 8.7 p -59.78 -40.21 81.93 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.297 0 CA-C-O 120.542 0.21 . . . . 0.0 111.199 -178.433 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 83' ' ' SER . . . . . . . . . . . . . 69.2 m -74.09 -22.29 59.56 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-O 120.662 0.267 . . . . 0.0 110.725 178.59 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 84' ' ' GLN . . . . . . . . . . . . . 50.8 tt0 -71.96 -44.33 63.74 Favored 'General case' 0 N--CA 1.455 -0.189 0 N-CA-C 109.336 -0.616 . . . . 0.0 109.336 178.228 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 85' ' ' LEU . . . . . 0.447 ' HA ' HD22 ' A' ' 85' ' ' LEU . 0.3 OUTLIER -63.4 -36.14 82.75 Favored 'General case' 0 C--N 1.327 -0.409 0 N-CA-C 109.12 -0.696 . . . . 0.0 109.12 175.869 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 86' ' ' ASN . . . . . . . . . . . . . 8.1 m-80 -66.74 -37.52 84.82 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 115.612 -0.722 . . . . 0.0 111.707 178.392 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 87' ' ' SER . . . . . . . . . . . . . 66.6 p -67.1 -29.74 69.57 Favored 'General case' 0 C--N 1.332 -0.189 0 C-N-CA 120.667 -0.413 . . . . 0.0 110.694 178.846 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 88' ' ' TYR . . . . . . . . . . . . . 26.1 m-85 -66.68 -35.63 80.61 Favored 'General case' 0 N--CA 1.454 -0.227 0 N-CA-C 109.755 -0.461 . . . . 0.0 109.755 174.827 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 89' ' ' LYS . . . . . . . . . . . . . 62.9 mttm -63.89 -38.68 91.99 Favored 'General case' 0 CA--C 1.529 0.167 0 CA-C-N 116.063 -0.517 . . . . 0.0 110.113 173.873 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 90' ' ' ASN . . . . . 0.562 ' O ' ' HB3' ' A' ' 94' ' ' ASN . 6.8 m120 -57.88 -35.68 71.33 Favored 'General case' 0 N--CA 1.467 0.389 0 CA-C-N 116.055 -0.521 . . . . 0.0 111.012 177.441 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 91' ' ' TYR . . . . . 0.505 ' CD1' HG12 ' A' ' 129' ' ' ILE . 23.1 m-85 -84.54 -49.14 8.86 Favored 'General case' 0 C--N 1.318 -0.781 0 CA-C-N 116.325 -0.398 . . . . 0.0 111.121 -179.773 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 92' ' ' CYS . . . . . 0.53 ' HA ' ' HB2' ' A' ' 96' ' ' LEU . 50.3 t -70.22 -48.72 55.79 Favored 'General case' 0 C--N 1.323 -0.564 0 N-CA-C 112.236 0.458 . . . . 0.0 112.236 -174.524 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 93' ' ' ARG . . . . . 0.533 ' O ' ' HB3' ' A' ' 97' ' ' SER . 54.7 ttt180 -80.95 -25.13 37.62 Favored 'General case' 0 C--N 1.325 -0.464 0 CA-C-O 120.741 0.305 . . . . 0.0 111.63 -172.669 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 94' ' ' ASN . . . . . 0.562 ' HB3' ' O ' ' A' ' 90' ' ' ASN . 24.0 t-20 -100.18 -61.36 1.38 Allowed 'General case' 0 C--N 1.325 -0.467 0 C-N-CA 120.66 -0.416 . . . . 0.0 111.397 -178.514 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 95' ' ' HIS . . . . . . . . . . . . . 60.5 m80 -85.82 -14.46 45.0 Favored 'General case' 0 C--N 1.326 -0.453 0 N-CA-C 112.494 0.553 . . . . 0.0 112.494 -170.987 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 96' ' ' LEU . . . . . 0.53 ' HB2' ' HA ' ' A' ' 92' ' ' CYS . 93.5 mt -119.61 17.2 12.84 Favored 'General case' 0 C--N 1.321 -0.661 0 CA-C-O 120.796 0.332 . . . . 0.0 110.449 -179.606 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 97' ' ' SER . . . . . 0.536 ' N ' ' HD2' ' A' ' 98' ' ' PRO . 22.2 p -61.88 -42.19 81.13 Favored Pre-proline 0 CA--C 1.543 0.675 0 N-CA-C 113.073 0.768 . . . . 0.0 113.073 -176.251 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 98' ' ' PRO . . . . . 0.536 ' HD2' ' N ' ' A' ' 97' ' ' SER . 36.3 Cg_endo -65.42 -26.09 55.62 Favored 'Trans proline' 0 C--N 1.36 1.137 0 C-N-CA 121.431 1.421 . . . . 0.0 112.037 178.378 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 99' ' ' LEU . . . . . 0.414 HD22 HG23 ' A' ' 107' ' ' ILE . 80.9 mt -89.93 -21.67 22.36 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 115.978 -0.555 . . . . 0.0 110.673 -178.45 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 100' ' ' TYR . . . . . . . . . . . . . 28.1 t80 -55.06 -43.15 73.59 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 115.858 -0.61 . . . . 0.0 110.825 -179.07 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 101' ' ' MET . . . . . . . . . . . . . 23.1 ptt? -94.63 14.12 22.06 Favored 'General case' 0 C--N 1.319 -0.723 0 CA-C-N 115.807 -0.633 . . . . 0.0 111.52 -175.727 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 102' ' ' LYS . . . . . . . . . . . . . 64.6 mttm -108.77 165.99 11.14 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-O 120.962 0.41 . . . . 0.0 110.997 178.092 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 103' ' ' SER . . . . . 0.494 ' O ' ' HG2' ' A' ' 106' ' ' GLU . 3.1 m -79.91 143.06 34.58 Favored 'General case' 0 C--N 1.323 -0.559 0 N-CA-C 108.821 -0.807 . . . . 0.0 108.821 172.138 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 104' ' ' LEU . . . . . . . . . . . . . 1.9 pt? -68.14 -18.92 64.76 Favored 'General case' 0 C--N 1.322 -0.618 0 C-N-CA 120.898 -0.321 . . . . 0.0 111.748 -174.103 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 105' ' ' SER . . . . . . . . . . . . . 16.7 p -87.79 -22.17 24.67 Favored 'General case' 0 C--N 1.327 -0.411 0 N-CA-C 111.813 0.301 . . . . 0.0 111.813 -179.171 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 106' ' ' GLU . . . . . 0.494 ' HG2' ' O ' ' A' ' 103' ' ' SER . 11.5 pt-20 -89.66 -7.63 54.24 Favored 'General case' 0 C--N 1.331 -0.199 0 CA-C-O 120.963 0.411 . . . . 0.0 110.583 -177.633 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 107' ' ' ILE . . . . . 0.474 HG13 ' O ' ' A' ' 103' ' ' SER . 73.4 mt -70.41 135.16 28.73 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.48 0 CA-C-N 115.885 -0.598 . . . . 0.0 110.566 179.826 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 108' ' ' LEU . . . . . 0.451 ' HB2' ' HB2' ' A' ' 111' ' ' ASP . 54.3 mt -97.43 129.52 31.61 Favored Pre-proline 0 C--N 1.325 -0.49 0 CA-C-N 116.175 -0.466 . . . . 0.0 110.776 -176.434 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 109' ' ' PRO . . . . . . . . . . . . . 50.6 Cg_exo -56.95 -38.24 96.45 Favored 'Trans proline' 0 CA--C 1.529 0.274 0 C-N-CA 122.752 2.301 . . . . 0.0 112.032 177.213 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 110' ' ' ALA . . . . . . . . . . . . . . . -70.83 -32.37 69.4 Favored 'General case' 0 C--N 1.332 -0.192 0 CA-C-N 116.204 -0.453 . . . . 0.0 110.776 178.751 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 111' ' ' ASP . . . . . 0.451 ' HB2' ' HB2' ' A' ' 108' ' ' LEU . 36.6 t70 -64.93 -45.72 84.62 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.079 -0.51 . . . . 0.0 109.925 179.038 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 112' ' ' ILE . . . . . . . . . . . . . 36.4 mt -64.25 -39.37 85.29 Favored 'Isoleucine or valine' 0 C--O 1.234 0.277 0 CA-C-N 115.589 -0.732 . . . . 0.0 110.511 176.823 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 113' ' ' GLN . . . . . . . . . . . . . 6.5 tp-100 -58.3 -44.73 88.66 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 115.774 -0.648 . . . . 0.0 110.791 178.232 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 114' ' ' SER . . . . . . . . . . . . . 53.5 m -62.57 -36.0 81.29 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.667 -0.242 . . . . 0.0 110.911 178.097 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 115' ' ' ILE . . . . . 0.419 HG13 ' O ' ' A' ' 111' ' ' ASP . 72.4 mt -64.86 -48.63 83.53 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.193 0 CA-C-O 120.686 0.279 . . . . 0.0 110.384 177.707 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 116' ' ' ILE . . . . . . . . . . . . . 40.8 mm -61.45 -43.42 96.76 Favored 'Isoleucine or valine' 0 N--CA 1.463 0.209 0 CA-C-N 116.265 -0.425 . . . . 0.0 110.53 177.833 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 117' ' ' ASN . . . . . . . . . . . . . 40.3 t30 -60.17 -37.0 78.84 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 115.689 -0.687 . . . . 0.0 111.203 179.964 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 118' ' ' GLU . . . . . . . . . . . . . 48.4 mt-10 -93.8 0.76 56.44 Favored 'General case' 0 C--N 1.326 -0.417 0 CA-C-N 116.382 -0.372 . . . . 0.0 111.713 -178.513 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 119' ' ' THR . . . . . . . . . . . . . 94.2 m -88.04 110.02 20.29 Favored 'General case' 0 N--CA 1.447 -0.6 0 N-CA-C 108.067 -1.086 . . . . 0.0 108.067 168.876 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 120' ' ' LYS . . . . . . . . . . . . . 66.4 mttm -107.69 64.98 0.63 Allowed 'General case' 0 C--N 1.322 -0.601 0 CA-C-O 121.919 0.866 . . . . 0.0 110.471 -172.401 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 121' ' ' LEU . . . . . . . . . . . . . 87.5 mt -119.5 -174.19 2.68 Favored 'General case' 0 C--N 1.321 -0.634 0 CA-C-N 114.567 -1.197 . . . . 0.0 109.639 -179.526 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 122' ' ' ALA . . . . . . . . . . . . . . . -61.2 149.3 38.04 Favored 'General case' 0 C--N 1.325 -0.476 0 CA-C-N 116.337 -0.392 . . . . 0.0 111.364 -179.832 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 123' ' ' LYS . . . . . . . . . . . . . 55.5 pttt -56.14 -33.01 64.77 Favored 'General case' 0 C--N 1.327 -0.378 0 CA-C-N 115.802 -0.635 . . . . 0.0 111.217 178.473 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 124' ' ' ASN . . . . . . . . . . . . . 95.0 m-20 -62.18 -39.96 94.44 Favored 'General case' 0 C--N 1.331 -0.219 0 CA-C-N 116.069 -0.514 . . . . 0.0 110.472 177.944 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 125' ' ' THR . . . . . 0.555 ' O ' HG13 ' A' ' 129' ' ' ILE . 8.6 m -68.29 -41.41 81.01 Favored 'General case' 0 C--N 1.326 -0.424 0 CA-C-N 116.031 -0.532 . . . . 0.0 110.489 -179.895 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 126' ' ' LEU . . . . . . . . . . . . . 92.6 mt -59.99 -45.54 92.38 Favored 'General case' 0 C--O 1.235 0.324 0 CA-C-N 116.071 -0.513 . . . . 0.0 110.755 179.691 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 127' ' ' LYS . . . . . . . . . . . . . 98.8 mttt -67.29 -34.83 78.22 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.018 -0.537 . . . . 0.0 110.766 178.844 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 128' ' ' ALA . . . . . . . . . . . . . . . -65.82 -43.65 87.95 Favored 'General case' 0 C--N 1.327 -0.391 0 CA-C-N 116.162 -0.472 . . . . 0.0 111.059 -179.273 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 129' ' ' ILE . . . . . 0.555 HG13 ' O ' ' A' ' 125' ' ' THR . 59.1 mt -61.2 -41.82 90.98 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.185 0 CA-C-O 121.154 0.502 . . . . 0.0 109.795 176.998 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 130' ' ' ARG . . . . . 0.608 HH21 HG11 ' A' ' 154' ' ' VAL . 3.2 tpp180 -64.5 -48.1 76.45 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 115.843 -0.617 . . . . 0.0 110.723 179.032 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 131' ' ' ASN . . . . . . . . . . . . . 4.9 m-20 -57.83 -52.67 64.51 Favored 'General case' 0 C--N 1.328 -0.345 0 O-C-N 123.341 0.4 . . . . 0.0 110.899 -179.887 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 132' ' ' THR . . . . . 0.479 ' O ' HG13 ' A' ' 136' ' ' ILE . 33.3 m -54.55 -54.06 46.29 Favored 'General case' 0 C--N 1.327 -0.384 0 CA-C-N 116.098 -0.501 . . . . 0.0 110.94 -179.451 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 133' ' ' ALA . . . . . . . . . . . . . . . -62.9 -39.32 94.14 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 116.284 -0.416 . . . . 0.0 111.932 -176.929 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 134' ' ' SER . . . . . . . . . . . . . 79.4 p -65.46 -32.53 74.19 Favored 'General case' 0 C--O 1.233 0.188 0 CA-C-O 120.55 0.214 . . . . 0.0 111.259 -176.514 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 135' ' ' GLN . . . . . 0.484 ' O ' ' HG2' ' A' ' 138' ' ' ARG . 36.1 mt-30 -79.73 -26.11 40.9 Favored 'General case' 0 N--CA 1.453 -0.306 0 C-N-CA 120.946 -0.302 . . . . 0.0 110.808 -179.919 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 136' ' ' ILE . . . . . 0.479 HG13 ' O ' ' A' ' 132' ' ' THR . 73.5 mt -65.34 -46.59 89.94 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.323 0 N-CA-C 109.823 -0.436 . . . . 0.0 109.823 173.791 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 137' ' ' PHE . . . . . 0.424 ' O ' HG13 ' A' ' 141' ' ' ILE . 53.3 m-85 -64.87 -40.5 95.23 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 116.078 -0.51 . . . . 0.0 111.102 177.33 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 138' ' ' ARG . . . . . 0.484 ' HG2' ' O ' ' A' ' 135' ' ' GLN . 0.2 OUTLIER -67.5 -26.07 66.17 Favored 'General case' 0 CA--C 1.53 0.203 0 CA-C-O 120.805 0.336 . . . . 0.0 110.391 -177.751 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 139' ' ' LEU . . . . . 0.413 ' HA ' ' HG2' ' A' ' 142' ' ' GLU . 62.2 tp -67.65 -34.3 76.67 Favored 'General case' 0 C--N 1.332 -0.195 0 CA-C-O 121.28 0.562 . . . . 0.0 109.561 176.706 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 140' ' ' ALA . . . . . . . . . . . . . . . -74.61 -33.78 62.68 Favored 'General case' 0 C--N 1.325 -0.459 0 CA-C-N 115.907 -0.588 . . . . 0.0 110.081 175.697 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 141' ' ' ILE . . . . . 0.634 ' HA ' ' O ' ' A' ' 146' ' ' ILE . 75.9 mt -62.3 -47.94 90.73 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.28 0 CA-C-N 115.947 -0.569 . . . . 0.0 111.069 176.795 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 142' ' ' GLU . . . . . 0.413 ' HG2' ' HA ' ' A' ' 139' ' ' LEU . 5.3 pt-20 -69.56 -16.55 63.44 Favored 'General case' 0 C--N 1.331 -0.229 0 CA-C-O 120.917 0.389 . . . . 0.0 110.975 -179.52 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 143' ' ' ASN . . . . . . . . . . . . . 18.3 m-80 -98.41 2.9 48.31 Favored 'General case' 0 C--N 1.326 -0.435 0 CA-C-N 116.399 -0.364 . . . . 0.0 110.485 175.68 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 144' ' ' ARG . . . . . 0.434 HH11 ' HD2' ' A' ' 144' ' ' ARG . 25.6 mtm180 63.43 20.55 12.31 Favored 'General case' 0 N--CA 1.464 0.271 0 CA-C-N 115.649 -0.705 . . . . 0.0 112.146 175.663 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 145' ' ' ALA . . . . . . . . . . . . . . . -75.12 -37.58 61.38 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-O 121.367 0.604 . . . . 0.0 109.418 176.421 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 146' ' ' ILE . . . . . 0.634 ' O ' ' HA ' ' A' ' 141' ' ' ILE . 13.7 tt -146.85 137.9 18.17 Favored 'Isoleucine or valine' 0 N--CA 1.449 -0.513 0 CA-C-N 115.254 -0.885 . . . . 0.0 108.823 175.192 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 147' ' ' ASP . . . . . . . . . . . . . 7.9 p-10 -106.04 19.71 20.1 Favored 'General case' 0 C--N 1.321 -0.639 0 CA-C-O 121.19 0.519 . . . . 0.0 110.188 -178.947 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 148' ' ' PHE . . . . . 0.497 ' H ' HG12 ' A' ' 146' ' ' ILE . 70.6 t80 -132.12 123.35 26.96 Favored 'General case' 0 C--N 1.32 -0.689 0 CA-C-N 115.353 -0.84 . . . . 0.0 109.846 -175.058 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 149' ' ' ASN . . . . . 0.528 ' HB2' HD11 ' A' ' 141' ' ' ILE . 31.5 t-20 -107.58 98.12 22.79 Favored Pre-proline 0 C--N 1.325 -0.494 0 N-CA-C 110.058 -0.349 . . . . 0.0 110.058 -179.656 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 150' ' ' PRO . . . . . . . . . . . . . 55.2 Cg_endo -70.44 -13.89 33.41 Favored 'Trans proline' 0 C--N 1.344 0.338 0 C-N-CA 122.765 2.31 . . . . 0.0 112.661 -176.51 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 151' ' ' ALA . . . . . . . . . . . . . . . -71.24 -20.02 62.29 Favored 'General case' 0 C--N 1.326 -0.414 0 CA-C-N 116.206 -0.452 . . . . 0.0 110.987 -179.374 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 152' ' ' ASP . . . . . . . . . . . . . 31.0 t70 -71.99 -21.74 61.53 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-O 121.186 0.517 . . . . 0.0 110.902 -179.82 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 153' ' ' TYR . . . . . . . . . . . . . 99.2 m-85 -92.58 1.73 57.1 Favored 'General case' 0 C--N 1.324 -0.532 0 CA-C-N 115.893 -0.594 . . . . 0.0 110.81 -177.962 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 154' ' ' VAL . . . . . 0.608 HG11 HH21 ' A' ' 130' ' ' ARG . 60.6 t -88.11 106.52 16.56 Favored 'Isoleucine or valine' 0 N--CA 1.448 -0.529 0 N-CA-C 109.529 -0.545 . . . . 0.0 109.529 175.949 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 155' ' ' ARG . . . . . . . . . . . . . 12.0 tpp180 -77.01 121.6 23.75 Favored 'General case' 0 C--N 1.32 -0.675 0 CA-C-N 115.853 -0.612 . . . . 0.0 109.891 -178.982 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 156' ' ' ILE . . . . . . . . . . . . . 48.5 mm -90.0 120.2 69.31 Favored Pre-proline 0 C--N 1.325 -0.499 0 CA-C-N 116.272 -0.422 . . . . 0.0 110.213 179.932 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 157' ' ' PRO . . . . . . . . . . . . . 55.5 Cg_endo -70.32 138.18 35.47 Favored 'Trans proline' 0 N--CA 1.461 -0.402 0 C-N-CA 122.349 2.033 . . . . 0.0 111.819 178.372 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 158' ' ' LYS . . . . . . . . . . . . . 33.6 mtmt -103.44 4.91 36.64 Favored 'General case' 0 C--N 1.321 -0.651 0 CA-C-O 121.111 0.481 . . . . 0.0 110.799 -179.796 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 159' ' ' ILE . . . . . . . . . . . . . 2.7 mp 72.54 -60.29 0.28 Allowed 'Isoleucine or valine' 0 N--CA 1.463 0.208 0 CA-C-N 114.907 -1.042 . . . . 0.0 112.229 171.359 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 160' ' ' ALA . . . . . . . . . . . . . . . -131.36 175.08 9.44 Favored 'General case' 0 C--N 1.317 -0.84 0 N-CA-C 111.616 0.228 . . . . 0.0 111.616 -170.883 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 161' ' ' LEU . . . . . . . . . . . . . 89.2 mt 60.9 36.17 18.98 Favored 'General case' 0 C--O 1.234 0.263 0 O-C-N 123.791 0.682 . . . . 0.0 110.563 -177.031 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 162' ' ' GLU . . . . . . . . . . . . . 12.5 pt-20 -67.89 167.95 12.62 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 115.541 -0.754 . . . . 0.0 110.241 179.159 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 163' ' ' HIS . . . . . . . . . . . . . 9.2 t-160 -119.29 51.66 1.13 Allowed 'General case' 0 C--N 1.323 -0.562 0 C-N-CA 120.695 -0.402 . . . . 0.0 110.23 -176.276 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 164' ' ' HIS . . . . . . . . . . . . . 0.9 OUTLIER 166.41 60.8 0.0 OUTLIER 'General case' 0 N--CA 1.471 0.608 0 O-C-N 124.353 1.033 . . . . 0.0 109.752 177.958 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 165' ' ' HIS . . . . . . . . . . . . . 70.0 t60 -73.49 -45.98 50.79 Favored 'General case' 0 C--N 1.327 -0.413 0 C-N-CA 120.561 -0.456 . . . . 0.0 110.63 -174.995 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 166' ' ' HIS . . . . . . . . . . . . . 5.5 p80 -85.37 114.6 22.56 Favored 'General case' 0 C--N 1.325 -0.496 0 CA-C-O 121.221 0.534 . . . . 0.0 109.822 173.103 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 167' ' ' HIS . . . . . . . . . . . . . 4.5 p-80 -155.15 157.9 38.13 Favored 'General case' 0 C--N 1.324 -0.522 0 CA-C-N 116.263 -0.426 . . . . 0.0 111.442 -173.27 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 168' ' ' HIS . . . . . . . . . . . . . 24.5 m80 . . . . . 0 C--O 1.246 0.885 0 CA-C-O 118.561 -0.733 . . . . 0.0 109.491 170.678 . . . . . . . . 0 0 . 1 . 004 nuclear build full ' A' A ' 61' ' ' ARG . . . . . . . . . . . . . 18.2 mtt180 . . . . . 0 N--CA 1.48 1.062 0 CA-C-O 120.807 0.336 . . . . 0.0 111.148 . . . . . . . . . 0 0 . 1 . 004 nuclear build full ' A' A ' 62' ' ' ASP . . . . . . . . . . . . . 19.6 m-20 -79.69 -176.03 5.15 Favored 'General case' 0 C--O 1.235 0.327 0 CA-C-O 121.708 0.766 . . . . 0.0 112.6 -171.07 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 63' ' ' SER . . . . . . . . . . . . . 36.5 t -116.89 150.32 38.66 Favored 'General case' 0 C--N 1.324 -0.508 0 CA-C-N 114.774 -1.103 . . . . 0.0 109.744 179.224 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 64' ' ' PHE . . . . . 0.453 ' HB3' ' O ' ' A' ' 99' ' ' LEU . 87.4 t80 -59.07 -38.61 79.85 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-N 116.207 -0.451 . . . . 0.0 110.357 179.753 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 65' ' ' GLY . . . . . . . . . . . . . . . -65.38 -32.32 83.21 Favored Glycine 0 N--CA 1.45 -0.38 0 C-N-CA 120.91 -0.662 . . . . 0.0 112.745 179.99 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 66' ' ' ASP . . . . . . . . . . . . . 20.3 t70 -68.33 -41.45 80.78 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-O 121.043 0.449 . . . . 0.0 110.154 -179.645 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 67' ' ' TRP . . . . . . . . . . . . . 80.4 m95 -74.84 -31.56 61.69 Favored 'General case' 0 C--N 1.327 -0.399 0 CA-C-N 116.027 -0.533 . . . . 0.0 110.979 178.061 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 68' ' ' ALA . . . . . . . . . . . . . . . -62.07 -41.66 98.39 Favored 'General case' 0 C--N 1.33 -0.243 0 N-CA-C 109.874 -0.417 . . . . 0.0 109.874 174.342 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 69' ' ' GLU . . . . . . . . . . . . . 3.3 tm-20 -54.32 -51.09 65.79 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 115.607 -0.724 . . . . 0.0 110.246 175.034 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 70' ' ' LYS . . . . . . . . . . . . . 48.3 mttp -72.81 -25.44 61.14 Favored 'General case' 0 C--N 1.324 -0.531 0 CA-C-N 115.904 -0.589 . . . . 0.0 111.828 -176.688 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 71' ' ' PHE . . . . . . . . . . . . . 69.5 t80 -70.36 -49.38 49.78 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-O 120.876 0.37 . . . . 0.0 110.29 175.337 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 72' ' ' LEU . . . . . 0.442 HD13 ' HA ' ' A' ' 72' ' ' LEU . 4.0 mm? -65.42 -34.71 78.93 Favored 'General case' 0 C--N 1.326 -0.446 0 CA-C-O 120.882 0.373 . . . . 0.0 110.222 177.065 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 73' ' ' LYS . . . . . . . . . . . . . 3.9 tppp? -64.05 -45.9 86.77 Favored 'General case' 0 C--N 1.325 -0.469 0 CA-C-N 115.84 -0.618 . . . . 0.0 110.513 178.43 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 74' ' ' SER . . . . . 0.435 ' O ' ' HB2' ' A' ' 78' ' ' ASP . 13.1 p -70.33 -27.73 64.6 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 116.333 -0.394 . . . . 0.0 111.037 -179.023 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 75' ' ' LYS . . . . . 0.467 ' HA ' ' HD3' ' A' ' 75' ' ' LYS . 67.9 mmtt -74.83 -34.18 62.28 Favored 'General case' 0 C--O 1.236 0.346 0 CA-C-O 120.929 0.395 . . . . 0.0 110.842 174.462 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 76' ' ' GLU . . . . . . . . . . . . . 7.5 tp10 -63.06 -41.54 99.49 Favored 'General case' 0 C--N 1.324 -0.526 0 CA-C-O 121.369 0.604 . . . . 0.0 109.608 173.842 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 77' ' ' ALA . . . . . . . . . . . . . . . -81.18 -10.09 59.69 Favored 'General case' 0 C--N 1.327 -0.404 0 CA-C-N 115.755 -0.657 . . . . 0.0 110.92 177.033 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 78' ' ' ASP . . . . . 0.435 ' HB2' ' O ' ' A' ' 74' ' ' SER . 17.9 t70 -77.23 -49.48 15.0 Favored 'General case' 0 C--N 1.327 -0.4 0 CA-C-N 115.999 -0.546 . . . . 0.0 110.101 178.824 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 79' ' ' GLY . . . . . . . . . . . . . . . 121.43 25.54 2.17 Favored Glycine 0 N--CA 1.449 -0.489 0 C-N-CA 120.573 -0.822 . . . . 0.0 113.052 177.227 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 80' ' ' VAL . . . . . . . . . . . . . 15.9 m -67.67 157.39 6.24 Favored 'Isoleucine or valine' 0 C--O 1.234 0.262 0 CA-C-N 117.088 0.444 . . . . 0.0 110.559 176.734 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 81' ' ' SER . . . . . . . . . . . . . 28.7 t -58.67 138.39 57.02 Favored 'General case' 0 N--CA 1.451 -0.418 0 CA-C-N 115.985 -0.552 . . . . 0.0 109.755 174.812 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 82' ' ' VAL . . . . . . . . . . . . . 14.0 p -58.39 -34.07 49.49 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.583 0 CA-C-O 120.732 0.301 . . . . 0.0 110.786 -179.44 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 83' ' ' SER . . . . . . . . . . . . . 23.3 t -69.38 -43.16 74.09 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-O 121.17 0.509 . . . . 0.0 109.861 177.715 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 84' ' ' GLN . . . . . . . . . . . . . 24.6 tp60 -64.58 -37.62 88.17 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 115.757 -0.656 . . . . 0.0 110.085 178.008 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 85' ' ' LEU . . . . . . . . . . . . . 41.1 tp -66.02 -43.07 88.73 Favored 'General case' 0 C--N 1.327 -0.403 0 CA-C-N 115.646 -0.706 . . . . 0.0 110.564 177.781 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 86' ' ' ASN . . . . . . . . . . . . . 12.3 m-80 -59.6 -38.66 81.86 Favored 'General case' 0 N--CA 1.463 0.189 0 CA-C-N 116.452 -0.34 . . . . 0.0 110.405 176.469 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 87' ' ' SER . . . . . . . . . . . . . 33.1 t -60.62 -48.22 82.75 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 115.903 -0.589 . . . . 0.0 110.4 177.341 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 88' ' ' TYR . . . . . . . . . . . . . 21.8 m-85 -61.58 -45.16 95.32 Favored 'General case' 0 C--O 1.234 0.28 0 CA-C-O 120.786 0.327 . . . . 0.0 110.745 178.311 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 89' ' ' LYS . . . . . . . . . . . . . 97.4 mttt -61.27 -39.33 90.0 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 116.127 -0.488 . . . . 0.0 111.066 179.328 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 90' ' ' ASN . . . . . . . . . . . . . 8.7 t30 -65.26 -41.95 93.73 Favored 'General case' 0 C--N 1.327 -0.37 0 CA-C-O 120.762 0.315 . . . . 0.0 110.578 -179.399 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 91' ' ' TYR . . . . . . . . . . . . . 21.4 m-30 -64.63 -43.22 94.42 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.392 -0.367 . . . . 0.0 111.221 179.93 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 92' ' ' CYS . . . . . 0.527 ' HA ' HD12 ' A' ' 96' ' ' LEU . 58.4 m -76.37 -42.89 43.05 Favored 'General case' 0 C--N 1.323 -0.564 0 CA-C-N 116.5 -0.318 . . . . 0.0 111.844 -175.846 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 93' ' ' ARG . . . . . . . . . . . . . 63.8 ttt180 -79.25 -36.4 39.98 Favored 'General case' 0 C--N 1.326 -0.426 0 CA-C-O 120.669 0.271 . . . . 0.0 111.478 -174.46 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 94' ' ' ASN . . . . . . . . . . . . . 4.1 m-20 -101.03 -49.96 3.95 Favored 'General case' 0 C--N 1.328 -0.337 0 N-CA-C 111.997 0.369 . . . . 0.0 111.997 -174.509 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 95' ' ' HIS . . . . . . . . . . . . . 0.6 OUTLIER -82.25 -32.53 29.63 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-O 120.943 0.402 . . . . 0.0 111.248 -174.0 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 96' ' ' LEU . . . . . 0.554 HD21 ' NH2' ' A' ' 130' ' ' ARG . 93.3 mt -98.68 22.48 9.92 Favored 'General case' 0 C--N 1.324 -0.524 0 CA-C-N 116.115 -0.493 . . . . 0.0 110.741 179.746 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 97' ' ' SER . . . . . 0.551 ' OG ' ' HD3' ' A' ' 98' ' ' PRO . 2.5 p -53.86 -45.1 99.01 Favored Pre-proline 0 CA--C 1.544 0.742 0 N-CA-C 113.29 0.848 . . . . 0.0 113.29 -177.98 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 98' ' ' PRO . . . . . 0.551 ' HD3' ' OG ' ' A' ' 97' ' ' SER . 33.8 Cg_exo -60.3 -43.77 32.59 Favored 'Trans proline' 0 C--N 1.361 1.224 0 C-N-CA 121.593 1.528 . . . . 0.0 111.938 178.454 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 99' ' ' LEU . . . . . 0.453 ' O ' ' HB3' ' A' ' 64' ' ' PHE . 61.1 mt -76.29 -32.45 58.78 Favored 'General case' 0 C--N 1.326 -0.456 0 CA-C-N 115.818 -0.628 . . . . 0.0 110.592 -176.399 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 100' ' ' TYR . . . . . . . . . . . . . 42.8 t80 -57.84 -33.22 68.4 Favored 'General case' 0 C--N 1.326 -0.433 0 CA-C-N 115.73 -0.668 . . . . 0.0 110.801 -179.652 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 101' ' ' MET . . . . . . . . . . . . . 65.8 mtt -102.32 14.29 32.35 Favored 'General case' 0 C--N 1.324 -0.508 0 CA-C-N 116.206 -0.452 . . . . 0.0 110.889 -178.244 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 102' ' ' LYS . . . . . 0.437 ' HG3' ' O ' ' A' ' 98' ' ' PRO . 64.6 mttt -99.05 163.14 12.7 Favored 'General case' 0 C--N 1.326 -0.444 0 CA-C-O 121.24 0.543 . . . . 0.0 111.162 179.104 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 103' ' ' SER . . . . . . . . . . . . . 20.3 m -80.3 137.06 36.54 Favored 'General case' 0 N--CA 1.446 -0.662 0 CA-C-N 115.307 -0.86 . . . . 0.0 109.134 173.533 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 104' ' ' LEU . . . . . 0.563 ' HG ' HD12 ' A' ' 146' ' ' ILE . 50.3 tp -55.07 -43.82 74.25 Favored 'General case' 0 C--N 1.327 -0.409 0 N-CA-C 112.65 0.611 . . . . 0.0 112.65 -171.293 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 105' ' ' SER . . . . . . . . . . . . . 15.5 m -84.01 -9.72 58.44 Favored 'General case' 0 C--N 1.321 -0.665 0 N-CA-C 112.702 0.631 . . . . 0.0 112.702 -171.171 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 106' ' ' GLU . . . . . . . . . . . . . 0.2 OUTLIER -86.95 -22.12 25.8 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-O 120.871 0.367 . . . . 0.0 110.229 -177.082 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 107' ' ' ILE . . . . . . . . . . . . . 62.9 mt -60.66 126.25 18.2 Favored 'Isoleucine or valine' 0 C--O 1.236 0.35 0 CA-C-N 115.747 -0.66 . . . . 0.0 111.491 -174.939 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 108' ' ' LEU . . . . . 0.482 ' H ' HD23 ' A' ' 108' ' ' LEU . 1.4 pt? -112.25 149.32 40.81 Favored Pre-proline 0 C--N 1.325 -0.488 0 CA-C-N 115.432 -0.804 . . . . 0.0 110.31 -179.541 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 109' ' ' PRO . . . . . . . . . . . . . 50.9 Cg_exo -55.01 -39.77 89.25 Favored 'Trans proline' 0 C--N 1.344 0.324 0 C-N-CA 122.952 2.435 . . . . 0.0 112.906 179.674 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 110' ' ' ALA . . . . . 0.47 ' HB3' HD12 ' A' ' 108' ' ' LEU . . . -58.85 -38.67 79.28 Favored 'General case' 0 N--CA 1.464 0.243 0 N-CA-C 111.779 0.289 . . . . 0.0 111.779 -178.209 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 111' ' ' ASP . . . . . . . . . . . . . 28.2 t70 -66.49 -45.91 78.05 Favored 'General case' 0 C--N 1.327 -0.379 0 CA-C-O 121.246 0.546 . . . . 0.0 110.155 -178.172 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 112' ' ' ILE . . . . . 0.58 HD12 ' HB2' ' A' ' 150' ' ' PRO . 58.4 mt -65.74 -38.6 82.63 Favored 'Isoleucine or valine' 0 C--O 1.239 0.519 0 CA-C-N 115.564 -0.744 . . . . 0.0 110.581 177.486 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 113' ' ' GLN . . . . . . . . . . . . . 27.1 tp60 -61.91 -40.57 95.93 Favored 'General case' 0 C--N 1.327 -0.384 0 CA-C-N 115.266 -0.879 . . . . 0.0 110.348 179.597 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 114' ' ' SER . . . . . . . . . . . . . 19.0 t -60.18 -43.95 95.45 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 116.088 -0.506 . . . . 0.0 110.152 177.687 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 115' ' ' ILE . . . . . . . . . . . . . 69.0 mt -54.88 -39.52 48.93 Favored 'Isoleucine or valine' 0 CA--C 1.53 0.195 0 CA-C-O 120.8 0.333 . . . . 0.0 110.677 178.491 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 116' ' ' ILE . . . . . 0.503 HG12 HH11 ' A' ' 130' ' ' ARG . 23.3 mm -70.02 -40.0 77.99 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.238 0 CA-C-N 116.425 -0.352 . . . . 0.0 111.332 177.905 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 117' ' ' ASN . . . . . . . . . . . . . 6.4 t30 -67.39 -32.82 73.98 Favored 'General case' 0 C--N 1.324 -0.51 0 CA-C-O 120.948 0.404 . . . . 0.0 110.501 -178.772 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 118' ' ' GLU . . . . . . . . . . . . . 36.9 mt-10 -83.7 -30.61 26.63 Favored 'General case' 0 C--N 1.327 -0.391 0 CA-C-N 115.808 -0.633 . . . . 0.0 111.564 -178.848 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 119' ' ' THR . . . . . . . . . . . . . 97.9 m -83.77 121.06 26.79 Favored 'General case' 0 C--N 1.325 -0.467 0 CA-C-O 120.977 0.417 . . . . 0.0 111.399 -177.584 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 120' ' ' LYS . . . . . . . . . . . . . 74.6 mmtt -109.09 86.11 2.22 Favored 'General case' 0 C--N 1.321 -0.666 0 CA-C-O 121.293 0.568 . . . . 0.0 110.868 176.716 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 121' ' ' LEU . . . . . . . . . . . . . 85.8 mt -120.52 -175.2 2.97 Favored 'General case' 0 C--N 1.319 -0.755 0 CA-C-N 115.235 -0.893 . . . . 0.0 108.841 174.727 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 122' ' ' ALA . . . . . . . . . . . . . . . -58.5 139.42 55.69 Favored 'General case' 0 C--N 1.324 -0.529 0 N-CA-C 109.325 -0.62 . . . . 0.0 109.325 173.871 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 123' ' ' LYS . . . . . . . . . . . . . 91.6 mttt -62.33 -33.04 73.93 Favored 'General case' 0 C--N 1.322 -0.618 0 CA-C-O 121.141 0.495 . . . . 0.0 110.832 -174.432 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 124' ' ' ASN . . . . . . . . . . . . . 42.9 m-80 -65.56 -39.07 91.26 Favored 'General case' 0 C--N 1.325 -0.49 0 CA-C-N 115.666 -0.697 . . . . 0.0 110.312 175.09 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 125' ' ' THR . . . . . 0.475 ' O ' HG13 ' A' ' 129' ' ' ILE . 17.3 m -69.75 -37.39 76.42 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 116.001 -0.545 . . . . 0.0 110.691 179.48 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 126' ' ' LEU . . . . . . . . . . . . . 98.2 mt -56.8 -51.45 68.88 Favored 'General case' 0 C--O 1.237 0.442 0 CA-C-N 116.27 -0.423 . . . . 0.0 110.949 179.364 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 127' ' ' LYS . . . . . 0.56 ' HB3' HG21 ' A' ' 156' ' ' ILE . 12.7 ptmm? -71.29 -21.29 62.1 Favored 'General case' 0 C--N 1.327 -0.41 0 CA-C-N 116.269 -0.423 . . . . 0.0 111.254 179.593 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 128' ' ' ALA . . . . . . . . . . . . . . . -69.08 -43.02 75.4 Favored 'General case' 0 C--N 1.331 -0.222 0 CA-C-O 120.859 0.362 . . . . 0.0 110.654 175.353 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 129' ' ' ILE . . . . . 0.475 HG13 ' O ' ' A' ' 125' ' ' THR . 51.9 mt -66.07 -29.45 46.83 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.235 0 CA-C-O 121.177 0.513 . . . . 0.0 110.03 177.779 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 130' ' ' ARG . . . . . 0.866 ' HE ' ' HA ' ' A' ' 130' ' ' ARG . 0.4 OUTLIER -76.09 -43.31 44.06 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.397 -0.365 . . . . 0.0 110.932 175.69 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 131' ' ' ASN . . . . . 0.576 ' O ' ' HG2' ' A' ' 135' ' ' GLN . 27.2 t-20 -55.86 -51.51 67.29 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-O 120.889 0.376 . . . . 0.0 110.259 177.649 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 132' ' ' THR . . . . . . . . . . . . . 28.5 m -54.81 -48.57 72.61 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 115.569 -0.741 . . . . 0.0 110.966 178.454 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 133' ' ' ALA . . . . . . . . . . . . . . . -63.15 -39.27 94.18 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.122 -0.49 . . . . 0.0 111.04 179.654 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 134' ' ' SER . . . . . . . . . . . . . 11.1 t -63.98 -38.56 91.53 Favored 'General case' 0 C--N 1.327 -0.406 0 CA-C-N 116.372 -0.376 . . . . 0.0 110.429 -179.613 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 135' ' ' GLN . . . . . 0.576 ' HG2' ' O ' ' A' ' 131' ' ' ASN . 78.1 mm-40 -61.04 -37.81 83.92 Favored 'General case' 0 C--N 1.331 -0.229 0 CA-C-O 121.016 0.436 . . . . 0.0 110.198 177.474 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 136' ' ' ILE . . . . . . . . . . . . . 69.9 mt -64.57 -46.62 92.02 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.357 0 CA-C-N 115.71 -0.677 . . . . 0.0 110.683 177.998 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 137' ' ' PHE . . . . . 0.473 ' O ' HG13 ' A' ' 141' ' ' ILE . 53.4 m-85 -61.0 -42.27 98.11 Favored 'General case' 0 N--CA 1.462 0.14 0 CA-C-O 120.908 0.385 . . . . 0.0 110.548 176.192 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 138' ' ' ARG . . . . . 0.522 ' O ' ' HG3' ' A' ' 142' ' ' GLU . 25.9 mtp180 -57.88 -47.11 83.73 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 115.895 -0.593 . . . . 0.0 111.207 177.699 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 139' ' ' LEU . . . . . . . . . . . . . 61.7 tp -56.55 -37.34 70.38 Favored 'General case' 0 C--N 1.327 -0.392 0 CA-C-O 121.28 0.562 . . . . 0.0 110.637 178.67 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 140' ' ' ALA . . . . . 0.518 ' HB1' HD21 ' A' ' 104' ' ' LEU . . . -68.92 -43.09 75.85 Favored 'General case' 0 C--N 1.324 -0.511 0 CA-C-N 115.775 -0.648 . . . . 0.0 110.551 176.955 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 141' ' ' ILE . . . . . 0.473 HG13 ' O ' ' A' ' 137' ' ' PHE . 81.7 mt -60.3 -39.11 79.85 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.254 0 CA-C-N 116.109 -0.496 . . . . 0.0 110.911 177.094 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 142' ' ' GLU . . . . . 0.522 ' HG3' ' O ' ' A' ' 138' ' ' ARG . 42.5 mt-10 -61.5 -32.58 72.61 Favored 'General case' 0 C--N 1.33 -0.243 0 CA-C-N 116.419 -0.355 . . . . 0.0 111.16 179.624 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 143' ' ' ASN . . . . . . . . . . . . . 44.9 m-80 -95.34 6.58 48.63 Favored 'General case' 0 C--N 1.326 -0.42 0 CA-C-N 116.365 -0.38 . . . . 0.0 110.477 178.58 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 144' ' ' ARG . . . . . . . . . . . . . 47.7 mtp85 59.81 30.67 20.23 Favored 'General case' 0 N--CA 1.466 0.333 0 CA-C-N 115.525 -0.761 . . . . 0.0 111.426 179.309 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 145' ' ' ALA . . . . . . . . . . . . . . . -85.5 -9.43 57.43 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 115.897 -0.592 . . . . 0.0 110.237 177.703 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 146' ' ' ILE . . . . . 0.563 HD12 ' HG ' ' A' ' 104' ' ' LEU . 14.8 tt -160.08 150.4 6.0 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.454 0 CA-C-N 115.545 -0.752 . . . . 0.0 109.069 174.992 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 147' ' ' ASP . . . . . . . . . . . . . 21.2 t70 -116.76 19.83 14.28 Favored 'General case' 0 C--N 1.326 -0.447 0 CA-C-O 121.864 0.84 . . . . 0.0 109.469 -177.81 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 148' ' ' PHE . . . . . 0.46 ' H ' HG12 ' A' ' 146' ' ' ILE . 61.4 t80 -141.93 134.26 27.92 Favored 'General case' 0 C--N 1.321 -0.653 0 CA-C-N 115.321 -0.854 . . . . 0.0 109.985 -171.532 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 149' ' ' ASN . . . . . . . . . . . . . 54.7 t-20 -117.19 95.96 48.25 Favored Pre-proline 0 C--N 1.324 -0.539 0 N-CA-C 109.64 -0.504 . . . . 0.0 109.64 176.816 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 150' ' ' PRO . . . . . 0.58 ' HB2' HD12 ' A' ' 112' ' ' ILE . 23.3 Cg_exo -63.54 -32.26 70.26 Favored 'Trans proline' 0 CA--C 1.528 0.191 0 C-N-CA 122.604 2.202 . . . . 0.0 112.324 -177.692 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 151' ' ' ALA . . . . . . . . . . . . . . . -71.91 -20.09 61.83 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.114 -0.494 . . . . 0.0 111.163 -177.073 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 152' ' ' ASP . . . . . . . . . . . . . 31.9 t70 -68.85 -25.48 64.67 Favored 'General case' 0 C--N 1.326 -0.422 0 CA-C-N 116.196 -0.457 . . . . 0.0 110.854 -179.63 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 153' ' ' TYR . . . . . . . . . . . . . 78.8 m-85 -93.5 -7.29 44.74 Favored 'General case' 0 C--N 1.327 -0.373 0 CA-C-N 115.981 -0.554 . . . . 0.0 111.203 -176.857 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 154' ' ' VAL . . . . . . . . . . . . . 99.3 t -76.33 117.31 20.79 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.42 0 CA-C-O 121.033 0.444 . . . . 0.0 111.346 -175.284 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 155' ' ' ARG . . . . . . . . . . . . . 32.7 ptt85 -80.43 144.05 32.94 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 115.882 -0.599 . . . . 0.0 110.112 177.912 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 156' ' ' ILE . . . . . 0.624 HD11 ' HG3' ' A' ' 130' ' ' ARG . 24.3 mm -115.55 131.89 23.41 Favored Pre-proline 0 C--N 1.323 -0.546 0 CA-C-N 116.133 -0.485 . . . . 0.0 110.653 -179.024 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 157' ' ' PRO . . . . . . . . . . . . . 55.7 Cg_endo -71.13 130.07 17.1 Favored 'Trans proline' 0 N--CA 1.459 -0.5 0 C-N-CA 122.186 1.924 . . . . 0.0 111.278 174.068 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 158' ' ' LYS . . . . . . . . . . . . . 22.9 pttm -150.17 25.13 0.81 Allowed 'General case' 0 C--N 1.32 -0.677 0 CA-C-O 121.519 0.676 . . . . 0.0 110.138 -178.348 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 159' ' ' ILE . . . . . . . . . . . . . 60.1 mt -84.12 122.06 37.35 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.467 0 CA-C-N 115.041 -0.981 . . . . 0.0 109.899 -178.216 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 160' ' ' ALA . . . . . . . . . . . . . . . -132.22 148.26 52.45 Favored 'General case' 0 C--N 1.319 -0.724 0 CA-C-N 116.456 -0.338 . . . . 0.0 110.621 -178.583 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 161' ' ' LEU . . . . . . . . . . . . . 81.7 mt -102.03 7.72 41.15 Favored 'General case' 0 C--N 1.324 -0.501 0 CA-C-O 121.701 0.762 . . . . 0.0 109.485 177.801 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 162' ' ' GLU . . . . . . . . . . . . . 4.3 mp0 -93.09 179.8 5.32 Favored 'General case' 0 C--N 1.319 -0.743 0 CA-C-N 114.783 -1.099 . . . . 0.0 109.636 178.338 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 163' ' ' HIS . . . . . . . . . . . . . 38.0 p-80 -67.16 93.44 0.3 Allowed 'General case' 0 C--N 1.324 -0.528 0 CA-C-O 121.5 0.667 . . . . 0.0 110.828 175.308 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 164' ' ' HIS . . . . . . . . . . . . . 81.2 t60 -98.78 -0.95 41.6 Favored 'General case' 0 C--N 1.325 -0.469 0 CA-C-N 115.804 -0.635 . . . . 0.0 110.344 -177.07 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 165' ' ' HIS . . . . . . . . . . . . . 62.3 m-70 -86.54 160.18 19.04 Favored 'General case' 0 C--N 1.327 -0.402 0 N-CA-C 109.179 -0.674 . . . . 0.0 109.179 174.759 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 166' ' ' HIS . . . . . . . . . . . . . 9.1 p80 -139.93 169.9 16.85 Favored 'General case' 0 C--N 1.321 -0.632 0 CA-C-O 120.709 0.29 . . . . 0.0 110.401 178.978 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 167' ' ' HIS . . . . . . . . . . . . . 74.0 m-70 -77.99 149.52 34.07 Favored 'General case' 0 C--N 1.322 -0.596 0 CA-C-O 121.438 0.637 . . . . 0.0 111.489 -176.854 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 168' ' ' HIS . . . . . . . . . . . . . 60.2 m-70 . . . . . 0 C--O 1.249 1.034 0 CA-C-O 118.194 -0.907 . . . . 0.0 108.835 174.195 . . . . . . . . 0 0 . 1 . 005 nuclear build full ' A' A ' 61' ' ' ARG . . . . . . . . . . . . . 45.3 ttt180 . . . . . 0 N--CA 1.479 0.981 0 CA-C-O 120.72 0.295 . . . . 0.0 111.014 . . . . . . . . . 0 0 . 1 . 005 nuclear build full ' A' A ' 62' ' ' ASP . . . . . . . . . . . . . 0.0 OUTLIER -91.81 173.85 7.65 Favored 'General case' 0 C--N 1.327 -0.371 0 CA-C-N 116.161 -0.472 . . . . 0.0 110.79 -177.067 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 63' ' ' SER . . . . . . . . . . . . . 93.9 p -106.01 169.53 8.44 Favored 'General case' 0 C--N 1.327 -0.385 0 CA-C-N 116.335 -0.393 . . . . 0.0 110.258 179.197 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 64' ' ' PHE . . . . . 0.474 ' HB2' HD11 ' A' ' 107' ' ' ILE . 64.0 t80 -64.78 -29.91 70.9 Favored 'General case' 0 C--N 1.327 -0.382 0 N-CA-C 109.634 -0.506 . . . . 0.0 109.634 178.587 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 65' ' ' GLY . . . . . . . . . . . . . . . -61.4 -39.37 97.18 Favored Glycine 0 C--N 1.332 0.342 0 CA-C-N 115.885 -0.598 . . . . 0.0 112.133 176.664 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 66' ' ' ASP . . . . . . . . . . . . . 20.5 m-20 -62.57 -51.68 66.39 Favored 'General case' 0 N--CA 1.463 0.187 0 CA-C-O 121.106 0.479 . . . . 0.0 110.162 178.263 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 67' ' ' TRP . . . . . . . . . . . . . 95.7 m95 -68.78 -29.32 67.66 Favored 'General case' 0 C--N 1.326 -0.451 0 CA-C-N 115.577 -0.738 . . . . 0.0 111.937 -177.777 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 68' ' ' ALA . . . . . 0.629 ' HB1' ' SG ' ' A' ' 92' ' ' CYS . . . -61.23 -48.78 79.9 Favored 'General case' 0 C--N 1.324 -0.517 0 CA-C-O 121.086 0.469 . . . . 0.0 110.282 175.725 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 69' ' ' GLU . . . . . . . . . . . . . 5.1 mm-40 -59.71 -44.14 93.82 Favored 'General case' 0 C--N 1.326 -0.416 0 CA-C-N 115.525 -0.761 . . . . 0.0 111.055 176.218 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 70' ' ' LYS . . . . . . . . . . . . . 57.0 mtpt -66.28 -33.97 76.95 Favored 'General case' 0 C--N 1.327 -0.388 0 CA-C-N 115.936 -0.575 . . . . 0.0 110.825 -179.872 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 71' ' ' PHE . . . . . 0.552 ' CE1' ' HB3' ' A' ' 135' ' ' GLN . 65.9 t80 -66.91 -49.35 65.84 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-O 120.843 0.354 . . . . 0.0 110.657 176.683 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 72' ' ' LEU . . . . . 0.456 ' HG ' ' O ' ' A' ' 68' ' ' ALA . 89.9 mt -59.89 -40.58 89.22 Favored 'General case' 0 C--N 1.324 -0.526 0 CA-C-N 116.238 -0.437 . . . . 0.0 110.681 -179.047 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 73' ' ' LYS . . . . . 0.729 ' HA ' ' HG2' ' A' ' 76' ' ' GLU . 28.1 tttp -78.34 -27.0 46.97 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.412 -0.358 . . . . 0.0 111.549 -175.989 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 74' ' ' SER . . . . . . . . . . . . . 22.1 p -75.89 -26.08 56.67 Favored 'General case' 0 C--N 1.321 -0.64 0 C-N-CA 120.197 -0.601 . . . . 0.0 110.226 176.355 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 75' ' ' LYS . . . . . 0.438 ' HG2' ' O ' ' A' ' 71' ' ' PHE . 28.8 mmmt -77.52 -43.25 32.69 Favored 'General case' 0 C--O 1.234 0.251 0 CA-C-N 116.554 -0.293 . . . . 0.0 110.835 177.368 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 76' ' ' GLU . . . . . 0.729 ' HG2' ' HA ' ' A' ' 73' ' ' LYS . 12.2 pt-20 -62.05 -35.39 78.48 Favored 'General case' 0 N--CA 1.462 0.167 0 CA-C-O 120.84 0.353 . . . . 0.0 110.223 176.709 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 77' ' ' ALA . . . . . . . . . . . . . . . -73.8 -32.7 63.88 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.21 -0.45 . . . . 0.0 110.85 176.987 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 78' ' ' ASP . . . . . . . . . . . . . 19.3 t70 -61.68 -54.77 38.26 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.099 -0.5 . . . . 0.0 110.787 178.47 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 79' ' ' GLY . . . . . . . . . . . . . . . 145.89 50.43 0.03 OUTLIER Glycine 0 N--CA 1.45 -0.427 0 C-N-CA 120.275 -0.964 . . . . 0.0 113.068 177.076 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 80' ' ' VAL . . . . . 0.452 HG21 HD23 ' A' ' 85' ' ' LEU . 31.0 m -106.56 155.48 7.34 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.514 0 O-C-N 122.652 -0.322 . . . . 0.0 110.334 177.055 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 81' ' ' SER . . . . . . . . . . . . . 13.0 m -70.73 150.55 45.8 Favored 'General case' 0 C--N 1.32 -0.682 0 CA-C-N 116.137 -0.483 . . . . 0.0 109.789 175.162 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 82' ' ' VAL . . . . . . . . . . . . . 14.1 p -60.75 -35.61 65.37 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.402 0 CA-C-O 120.597 0.237 . . . . 0.0 110.556 179.274 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 83' ' ' SER . . . . . . . . . . . . . 8.5 m -65.29 -37.49 87.31 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-O 121.081 0.467 . . . . 0.0 110.57 177.419 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 84' ' ' GLN . . . . . . . . . . . . . 6.1 tp-100 -68.42 -40.08 81.35 Favored 'General case' 0 C--N 1.332 -0.179 0 CA-C-N 115.971 -0.559 . . . . 0.0 109.609 177.031 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 85' ' ' LEU . . . . . 0.46 ' HA ' HD22 ' A' ' 85' ' ' LEU . 0.7 OUTLIER -65.12 -36.73 85.2 Favored 'General case' 0 C--N 1.327 -0.385 0 CA-C-N 115.59 -0.732 . . . . 0.0 109.486 177.35 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 86' ' ' ASN . . . . . . . . . . . . . 11.6 m120 -57.64 -39.47 77.06 Favored 'General case' 0 CA--C 1.519 -0.221 0 CA-C-N 116.046 -0.524 . . . . 0.0 110.622 175.261 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 87' ' ' SER . . . . . . . . . . . . . 49.0 m -65.23 -46.3 81.17 Favored 'General case' 0 C--N 1.326 -0.42 0 CA-C-N 116.407 -0.36 . . . . 0.0 110.547 178.588 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 88' ' ' TYR . . . . . . . . . . . . . 49.2 m-85 -57.5 -46.45 83.75 Favored 'General case' 0 N--CA 1.463 0.198 0 CA-C-O 121.01 0.433 . . . . 0.0 110.404 175.495 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 89' ' ' LYS . . . . . . . . . . . . . 38.4 ttmt -66.44 -35.6 80.69 Favored 'General case' 0 C--N 1.324 -0.528 0 CA-C-N 115.652 -0.704 . . . . 0.0 110.734 -178.951 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 90' ' ' ASN . . . . . . . . . . . . . 25.9 t-20 -62.29 -47.86 82.46 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-O 120.943 0.401 . . . . 0.0 110.207 178.553 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 91' ' ' TYR . . . . . . . . . . . . . 31.0 m-85 -62.3 -50.94 69.65 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.085 -0.507 . . . . 0.0 110.185 177.361 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 92' ' ' CYS . . . . . 0.629 ' SG ' ' HB1' ' A' ' 68' ' ' ALA . 42.0 t -63.96 -48.56 76.0 Favored 'General case' 0 C--N 1.323 -0.579 0 N-CA-C 112.368 0.507 . . . . 0.0 112.368 -175.262 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 93' ' ' ARG . . . . . . . . . . . . . 72.5 ttt180 -70.93 -38.5 72.91 Favored 'General case' 0 C--N 1.324 -0.504 0 N-CA-C 111.914 0.338 . . . . 0.0 111.914 -173.293 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 94' ' ' ASN . . . . . . . . . . . . . 73.1 m-20 -102.96 -58.12 1.93 Allowed 'General case' 0 C--N 1.324 -0.527 0 C-N-CA 120.912 -0.315 . . . . 0.0 111.718 -172.437 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 95' ' ' HIS . . . . . . . . . . . . . 78.0 m-70 -74.05 -42.7 59.84 Favored 'General case' 0 C--N 1.326 -0.425 0 CA-C-O 120.73 0.3 . . . . 0.0 111.086 -174.572 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 96' ' ' LEU . . . . . 0.568 ' HB2' ' HA ' ' A' ' 92' ' ' CYS . 96.0 mt -93.16 16.88 11.98 Favored 'General case' 0 C--N 1.325 -0.471 0 CA-C-N 116.475 -0.329 . . . . 0.0 110.63 179.414 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 97' ' ' SER . . . . . 0.575 ' N ' ' HD2' ' A' ' 98' ' ' PRO . 18.6 t -54.37 -47.55 97.28 Favored Pre-proline 0 CA--C 1.537 0.476 0 CA-C-N 115.811 -0.632 . . . . 0.0 111.427 178.665 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 98' ' ' PRO . . . . . 0.586 ' O ' ' HG3' ' A' ' 102' ' ' LYS . 10.3 Cg_endo -53.56 -32.38 63.6 Favored 'Trans proline' 0 C--N 1.36 1.143 0 C-N-CA 122.329 2.019 . . . . 0.0 112.758 175.554 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 99' ' ' LEU . . . . . 0.583 HD21 HG12 ' A' ' 112' ' ' ILE . 10.7 mp -81.22 -39.76 24.87 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-O 120.766 0.317 . . . . 0.0 110.865 178.243 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 100' ' ' TYR . . . . . . . . . . . . . 33.4 t80 -54.03 -33.69 57.98 Favored 'General case' 0 C--N 1.331 -0.225 0 CA-C-N 115.642 -0.708 . . . . 0.0 110.531 179.062 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 101' ' ' MET . . . . . . . . . . . . . 65.0 mtt -91.15 6.41 45.16 Favored 'General case' 0 C--N 1.327 -0.401 0 CA-C-N 115.539 -0.755 . . . . 0.0 111.652 -177.586 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 102' ' ' LYS . . . . . 0.586 ' HG3' ' O ' ' A' ' 98' ' ' PRO . 59.3 mttp -108.92 166.52 10.76 Favored 'General case' 0 C--N 1.326 -0.456 0 CA-C-O 121.555 0.693 . . . . 0.0 111.148 178.942 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 103' ' ' SER . . . . . 0.492 ' O ' HG13 ' A' ' 107' ' ' ILE . 28.6 t -96.93 160.38 14.38 Favored 'General case' 0 C--N 1.32 -0.703 0 CA-C-N 115.199 -0.909 . . . . 0.0 109.312 174.218 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 104' ' ' LEU . . . . . 0.513 ' HB3' HD12 ' A' ' 146' ' ' ILE . 84.9 mt -50.21 -59.57 3.81 Favored 'General case' 0 N--CA 1.468 0.469 0 N-CA-C 113.407 0.891 . . . . 0.0 113.407 -171.087 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 105' ' ' SER . . . . . . . . . . . . . 29.4 t -81.02 -0.47 39.85 Favored 'General case' 0 C--N 1.325 -0.483 0 CA-C-O 121.061 0.457 . . . . 0.0 111.046 -174.115 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 106' ' ' GLU . . . . . . . . . . . . . 3.4 mp0 -99.46 -1.8 37.62 Favored 'General case' 0 C--N 1.325 -0.481 0 CA-C-N 116.131 -0.486 . . . . 0.0 110.702 -175.962 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 107' ' ' ILE . . . . . 0.492 HG13 ' O ' ' A' ' 103' ' ' SER . 76.0 mt -87.13 129.0 39.31 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.455 0 CA-C-N 115.889 -0.596 . . . . 0.0 110.596 179.83 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 108' ' ' LEU . . . . . . . . . . . . . 91.9 mt -97.44 136.63 21.25 Favored Pre-proline 0 C--N 1.321 -0.636 0 CA-C-N 116.093 -0.503 . . . . 0.0 110.206 178.311 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 109' ' ' PRO . . . . . . . . . . . . . 32.5 Cg_exo -59.03 -32.94 98.42 Favored 'Trans proline' 0 CA--C 1.528 0.215 0 C-N-CA 122.738 2.292 . . . . 0.0 111.892 177.06 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 110' ' ' ALA . . . . . . . . . . . . . . . -67.04 -30.72 70.87 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 115.77 -0.65 . . . . 0.0 110.988 178.651 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 111' ' ' ASP . . . . . 0.431 ' O ' HG13 ' A' ' 115' ' ' ILE . 32.5 t70 -65.92 -39.61 90.7 Favored 'General case' 0 C--N 1.331 -0.218 0 N-CA-C 109.448 -0.575 . . . . 0.0 109.448 179.975 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 112' ' ' ILE . . . . . 0.583 HG12 HD21 ' A' ' 99' ' ' LEU . 15.6 mt -68.39 -40.95 83.09 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.308 0 CA-C-N 115.358 -0.837 . . . . 0.0 110.238 177.474 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 113' ' ' GLN . . . . . 0.517 ' HA ' HG23 ' A' ' 154' ' ' VAL . 0.0 OUTLIER -63.14 -40.63 98.13 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 115.911 -0.586 . . . . 0.0 109.988 -179.514 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 114' ' ' SER . . . . . . . . . . . . . 58.2 m -59.59 -41.47 90.36 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 116.358 -0.383 . . . . 0.0 110.862 176.921 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 115' ' ' ILE . . . . . 0.504 HD11 ' HG2' ' A' ' 98' ' ' PRO . 78.1 mt -57.65 -50.38 77.56 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.211 0 CA-C-O 120.81 0.338 . . . . 0.0 110.52 176.547 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 116' ' ' ILE . . . . . 0.404 HG23 ' HB3' ' A' ' 126' ' ' LEU . 49.5 mm -60.56 -43.2 94.0 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.343 0 CA-C-N 115.897 -0.592 . . . . 0.0 111.017 179.784 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 117' ' ' ASN . . . . . . . . . . . . . 55.1 t30 -67.18 -36.55 82.02 Favored 'General case' 0 C--N 1.324 -0.503 0 CA-C-N 115.925 -0.579 . . . . 0.0 111.492 -177.492 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 118' ' ' GLU . . . . . . . . . . . . . 43.2 mt-10 -84.19 -19.89 33.27 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 116.496 -0.32 . . . . 0.0 111.813 -177.43 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 119' ' ' THR . . . . . 0.412 HG23 HD23 ' A' ' 121' ' ' LEU . 96.1 m -70.82 126.29 29.18 Favored 'General case' 0 C--N 1.323 -0.563 0 N-CA-C 109.817 -0.438 . . . . 0.0 109.817 176.202 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 120' ' ' LYS . . . . . . . . . . . . . 21.8 mtpp -102.44 35.75 2.35 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-O 120.862 0.363 . . . . 0.0 111.591 -174.659 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 121' ' ' LEU . . . . . 0.412 HD23 HG23 ' A' ' 119' ' ' THR . 3.9 mm? -100.92 -175.92 3.02 Favored 'General case' 0 C--N 1.323 -0.574 0 CA-C-N 116.215 -0.448 . . . . 0.0 109.919 177.105 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 122' ' ' ALA . . . . . 0.422 ' O ' ' HG ' ' A' ' 126' ' ' LEU . . . -69.65 162.68 27.2 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-O 121.072 0.463 . . . . 0.0 111.67 -177.228 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 123' ' ' LYS . . . . . . . . . . . . . 53.2 mtmt -62.84 -34.2 76.82 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 115.764 -0.653 . . . . 0.0 111.073 -179.043 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 124' ' ' ASN . . . . . 0.743 ' HA ' ' HE3' ' A' ' 127' ' ' LYS . 65.2 t30 -64.4 -39.45 93.88 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-O 121.06 0.457 . . . . 0.0 109.911 176.937 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 125' ' ' THR . . . . . 0.44 ' O ' HG13 ' A' ' 129' ' ' ILE . 3.5 m -65.98 -39.0 89.97 Favored 'General case' 0 C--N 1.327 -0.399 0 CA-C-N 115.665 -0.698 . . . . 0.0 110.29 178.6 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 126' ' ' LEU . . . . . 0.422 ' HG ' ' O ' ' A' ' 122' ' ' ALA . 85.0 mt -62.33 -43.16 99.47 Favored 'General case' 0 C--O 1.234 0.26 0 CA-C-N 115.862 -0.608 . . . . 0.0 110.563 177.151 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 127' ' ' LYS . . . . . 0.743 ' HE3' ' HA ' ' A' ' 124' ' ' ASN . 27.0 mtmt -59.92 -41.35 91.54 Favored 'General case' 0 C--N 1.331 -0.237 0 CA-C-N 116.132 -0.486 . . . . 0.0 110.766 177.328 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 128' ' ' ALA . . . . . . . . . . . . . . . -60.99 -34.78 75.32 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.148 -0.478 . . . . 0.0 111.327 -179.308 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 129' ' ' ILE . . . . . 0.44 HG13 ' O ' ' A' ' 125' ' ' THR . 64.6 mt -65.69 -50.55 70.51 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.304 0 CA-C-N 116.519 -0.31 . . . . 0.0 110.397 178.424 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 130' ' ' ARG . . . . . . . . . . . . . 24.5 ttt180 -60.68 -42.85 97.93 Favored 'General case' 0 N--CA 1.462 0.14 0 CA-C-N 116.455 -0.339 . . . . 0.0 110.336 176.23 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 131' ' ' ASN . . . . . . . . . . . . . 7.7 t30 -55.91 -52.31 64.56 Favored 'General case' 0 C--N 1.327 -0.384 0 CA-C-N 115.816 -0.629 . . . . 0.0 110.519 -179.768 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 132' ' ' THR . . . . . 0.571 ' O ' HG13 ' A' ' 136' ' ' ILE . 37.7 m -57.43 -48.88 77.95 Favored 'General case' 0 C--N 1.326 -0.442 0 CA-C-N 115.714 -0.675 . . . . 0.0 110.814 178.898 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 133' ' ' ALA . . . . . . . . . . . . . . . -63.3 -46.99 84.14 Favored 'General case' 0 C--N 1.331 -0.213 0 CA-C-N 116.109 -0.496 . . . . 0.0 111.601 -177.859 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 134' ' ' SER . . . . . . . . . . . . . 9.5 t -62.98 -38.78 92.53 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-O 120.73 0.3 . . . . 0.0 110.519 -177.596 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 135' ' ' GLN . . . . . 0.552 ' HB3' ' CE1' ' A' ' 71' ' ' PHE . 0.8 OUTLIER -61.73 -39.97 93.44 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.255 -0.43 . . . . 0.0 110.967 176.67 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 136' ' ' ILE . . . . . 0.571 HG13 ' O ' ' A' ' 132' ' ' THR . 66.3 mt -65.7 -48.52 82.11 Favored 'Isoleucine or valine' 0 C--O 1.233 0.213 0 CA-C-N 116.344 -0.389 . . . . 0.0 110.635 178.336 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 137' ' ' PHE . . . . . 0.457 ' O ' HG13 ' A' ' 141' ' ' ILE . 40.6 m-85 -58.19 -43.92 87.81 Favored 'General case' 0 CA--C 1.521 -0.143 0 CA-C-N 116.179 -0.464 . . . . 0.0 110.748 178.321 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 138' ' ' ARG . . . . . 0.595 ' O ' ' HG3' ' A' ' 142' ' ' GLU . 62.3 mtt85 -59.51 -42.3 91.88 Favored 'General case' 0 C--O 1.222 -0.354 0 CA-C-N 116.278 -0.419 . . . . 0.0 111.163 178.673 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 139' ' ' LEU . . . . . . . . . . . . . 57.4 tp -56.95 -41.89 79.1 Favored 'General case' 0 C--N 1.326 -0.456 0 CA-C-O 120.942 0.401 . . . . 0.0 110.398 178.301 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 140' ' ' ALA . . . . . . . . . . . . . . . -66.84 -40.46 87.96 Favored 'General case' 0 C--N 1.327 -0.389 0 CA-C-N 116.144 -0.48 . . . . 0.0 110.475 176.693 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 141' ' ' ILE . . . . . 0.457 HG13 ' O ' ' A' ' 137' ' ' PHE . 80.1 mt -63.3 -40.5 89.28 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.301 0 CA-C-N 116.207 -0.451 . . . . 0.0 110.831 178.428 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 142' ' ' GLU . . . . . 0.595 ' HG3' ' O ' ' A' ' 138' ' ' ARG . 50.2 mt-10 -63.47 -29.99 71.19 Favored 'General case' 0 C--N 1.331 -0.228 0 CA-C-O 120.812 0.339 . . . . 0.0 111.049 179.971 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 143' ' ' ASN . . . . . . . . . . . . . 3.4 m-20 -92.98 6.18 48.82 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-O 120.95 0.405 . . . . 0.0 110.32 176.927 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 144' ' ' ARG . . . . . 0.409 ' HD3' ' HA ' ' A' ' 144' ' ' ARG . 3.8 mmt180 59.52 28.33 17.7 Favored 'General case' 0 N--CA 1.464 0.26 0 CA-C-N 115.545 -0.752 . . . . 0.0 112.096 179.087 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 145' ' ' ALA . . . . . . . . . . . . . . . -78.51 -31.25 47.56 Favored 'General case' 0 C--N 1.327 -0.395 0 CA-C-O 121.074 0.464 . . . . 0.0 109.965 176.874 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 146' ' ' ILE . . . . . 0.513 HD12 ' HB3' ' A' ' 104' ' ' LEU . 14.8 tt -141.75 142.48 28.37 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.464 0 CA-C-N 115.641 -0.708 . . . . 0.0 109.165 175.503 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 147' ' ' ASP . . . . . . . . . . . . . 33.1 t70 -108.28 25.66 11.37 Favored 'General case' 0 C--N 1.322 -0.626 0 CA-C-O 121.681 0.753 . . . . 0.0 110.394 -175.999 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 148' ' ' PHE . . . . . 0.445 ' H ' HG12 ' A' ' 146' ' ' ILE . 80.7 t80 -148.81 141.96 24.98 Favored 'General case' 0 C--N 1.325 -0.498 0 CA-C-N 115.909 -0.587 . . . . 0.0 110.498 -177.393 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 149' ' ' ASN . . . . . . . . . . . . . 47.3 t-20 -116.73 99.61 52.95 Favored Pre-proline 0 C--N 1.326 -0.427 0 N-CA-C 110.111 -0.329 . . . . 0.0 110.111 177.83 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 150' ' ' PRO . . . . . . . . . . . . . 24.1 Cg_exo -64.54 -21.69 65.68 Favored 'Trans proline' 0 C--N 1.342 0.229 0 C-N-CA 122.892 2.395 . . . . 0.0 112.757 -178.593 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 151' ' ' ALA . . . . . 0.466 ' O ' HG12 ' A' ' 154' ' ' VAL . . . -73.62 -14.35 61.16 Favored 'General case' 0 C--N 1.327 -0.39 0 CA-C-O 120.875 0.369 . . . . 0.0 111.322 -176.719 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 152' ' ' ASP . . . . . . . . . . . . . 24.1 t70 -64.87 -27.89 69.17 Favored 'General case' 0 C--N 1.324 -0.54 0 CA-C-O 121.044 0.45 . . . . 0.0 110.395 178.201 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 153' ' ' TYR . . . . . . . . . . . . . 63.2 m-85 -97.26 0.81 48.78 Favored 'General case' 0 C--N 1.328 -0.343 0 N-CA-C 112.787 0.662 . . . . 0.0 112.787 -175.275 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 154' ' ' VAL . . . . . 0.517 HG23 ' HA ' ' A' ' 113' ' ' GLN . 6.3 p -94.21 106.7 18.39 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.384 0 C-N-CA 119.667 -0.813 . . . . 0.0 110.224 177.146 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 155' ' ' ARG . . . . . . . . . . . . . 18.2 ptt180 -93.04 144.55 25.15 Favored 'General case' 0 C--N 1.322 -0.622 0 CA-C-N 115.666 -0.697 . . . . 0.0 111.015 -177.249 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 156' ' ' ILE . . . . . . . . . . . . . 44.4 mm -89.25 116.82 67.34 Favored Pre-proline 0 C--N 1.323 -0.555 0 CA-C-N 115.655 -0.702 . . . . 0.0 109.803 179.616 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 157' ' ' PRO . . . . . . . . . . . . . 13.0 Cg_exo -70.01 130.75 19.57 Favored 'Trans proline' 0 N--CA 1.464 -0.264 0 C-N-CA 122.613 2.209 . . . . 0.0 111.867 -179.613 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 158' ' ' LYS . . . . . . . . . . . . . 9.9 mtmp? -93.34 67.64 4.11 Favored 'General case' 0 C--N 1.322 -0.629 0 CA-C-N 116.051 -0.522 . . . . 0.0 110.138 179.441 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 159' ' ' ILE . . . . . . . . . . . . . 64.4 mt -89.11 108.45 19.08 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.55 0 CA-C-N 115.651 -0.704 . . . . 0.0 111.198 -178.075 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 160' ' ' ALA . . . . . . . . . . . . . . . -126.27 22.76 7.12 Favored 'General case' 0 C--N 1.325 -0.488 0 CA-C-O 121.817 0.817 . . . . 0.0 109.667 175.883 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 161' ' ' LEU . . . . . . . . . . . . . 67.2 mt -79.58 -36.82 37.57 Favored 'General case' 0 C--N 1.318 -0.799 0 CA-C-N 114.584 -1.189 . . . . 0.0 111.726 -175.172 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 162' ' ' GLU . . . . . . . . . . . . . 0.2 OUTLIER -85.51 -63.4 1.33 Allowed 'General case' 0 C--N 1.327 -0.408 0 CA-C-N 116.415 -0.357 . . . . 0.0 110.526 -176.098 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 163' ' ' HIS . . . . . . . . . . . . . 0.6 OUTLIER -67.11 118.31 10.36 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-O 121.085 0.469 . . . . 0.0 110.871 -178.834 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 164' ' ' HIS . . . . . . . . . . . . . 32.6 m170 -82.12 -162.62 0.57 Allowed 'General case' 0 C--N 1.325 -0.479 0 CA-C-N 115.423 -0.808 . . . . 0.0 110.904 -177.946 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 165' ' ' HIS . . . . . . . . . . . . . 7.1 p80 -68.56 -0.23 4.87 Favored 'General case' 0 N--CA 1.472 0.643 0 N-CA-C 113.286 0.847 . . . . 0.0 113.286 -170.316 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 166' ' ' HIS . . . . . . . . . . . . . 57.8 t-80 -91.25 110.64 21.93 Favored 'General case' 0 C--N 1.325 -0.47 0 O-C-N 121.982 -0.449 . . . . 0.0 109.921 177.182 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 167' ' ' HIS . . . . . . . . . . . . . 65.0 t-80 -104.03 132.97 49.75 Favored 'General case' 0 C--N 1.325 -0.49 0 CA-C-N 116.179 -0.464 . . . . 0.0 110.736 -175.892 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 168' ' ' HIS . . . . . . . . . . . . . 51.5 t-80 . . . . . 0 C--O 1.249 1.032 0 CA-C-O 118.442 -0.789 . . . . 0.0 109.083 173.302 . . . . . . . . 0 0 . 1 . 006 nuclear build full ' A' A ' 61' ' ' ARG . . . . . . . . . . . . . 98.9 mtt180 . . . . . 0 N--CA 1.482 1.146 0 CA-C-O 120.566 0.222 . . . . 0.0 110.418 . . . . . . . . . 0 0 . 1 . 006 nuclear build full ' A' A ' 62' ' ' ASP . . . . . 0.482 ' HB3' ' NE1' ' A' ' 67' ' ' TRP . 6.9 m-20 67.8 88.7 0.11 Allowed 'General case' 0 C--O 1.235 0.297 0 CA-C-N 115.529 -0.76 . . . . 0.0 111.238 178.763 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 63' ' ' SER . . . . . 0.513 ' HA ' ' HA ' ' A' ' 103' ' ' SER . 10.7 p -84.26 160.37 20.77 Favored 'General case' 0 C--N 1.322 -0.608 0 CA-C-N 115.528 -0.76 . . . . 0.0 110.259 177.131 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 64' ' ' PHE . . . . . 0.54 ' HB2' HD11 ' A' ' 107' ' ' ILE . 86.6 t80 -60.99 -34.55 74.96 Favored 'General case' 0 C--N 1.33 -0.249 0 N-CA-C 109.933 -0.395 . . . . 0.0 109.933 179.693 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 65' ' ' GLY . . . . . . . . . . . . . . . -58.5 -44.82 95.19 Favored Glycine 0 N--CA 1.447 -0.6 0 CA-C-N 115.901 -0.59 . . . . 0.0 112.256 176.326 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 66' ' ' ASP . . . . . . . . . . . . . 36.9 t70 -65.08 -40.98 95.42 Favored 'General case' 0 C--N 1.327 -0.393 0 CA-C-O 120.819 0.342 . . . . 0.0 110.324 178.273 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 67' ' ' TRP . . . . . 0.482 ' NE1' ' HB3' ' A' ' 62' ' ' ASP . 87.0 m95 -62.36 -42.02 99.07 Favored 'General case' 0 C--N 1.332 -0.18 0 CA-C-N 116.278 -0.419 . . . . 0.0 110.967 177.011 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 68' ' ' ALA . . . . . 0.519 ' O ' ' HG ' ' A' ' 72' ' ' LEU . . . -59.73 -44.69 93.65 Favored 'General case' 0 C--N 1.327 -0.373 0 CA-C-N 116.287 -0.415 . . . . 0.0 110.669 177.8 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 69' ' ' GLU . . . . . . . . . . . . . 80.6 mt-10 -61.57 -42.85 99.44 Favored 'General case' 0 C--N 1.325 -0.461 0 CA-C-N 116.242 -0.436 . . . . 0.0 111.177 178.51 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 70' ' ' LYS . . . . . . . . . . . . . 43.2 mtmt -69.63 -28.64 66.09 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.272 -0.422 . . . . 0.0 110.731 179.639 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 71' ' ' PHE . . . . . . . . . . . . . 87.8 t80 -74.53 -40.12 61.94 Favored 'General case' 0 C--N 1.325 -0.488 0 CA-C-N 116.07 -0.514 . . . . 0.0 110.216 176.371 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 72' ' ' LEU . . . . . 0.519 ' HG ' ' O ' ' A' ' 68' ' ' ALA . 91.1 mt -65.93 -36.48 83.48 Favored 'General case' 0 C--N 1.327 -0.37 0 CA-C-O 120.883 0.373 . . . . 0.0 110.307 176.773 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 73' ' ' LYS . . . . . . . . . . . . . 39.4 ttmt -63.11 -45.8 90.31 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 115.943 -0.571 . . . . 0.0 110.642 178.472 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 74' ' ' SER . . . . . . . . . . . . . 6.4 p -73.75 -39.8 63.97 Favored 'General case' 0 C--N 1.326 -0.456 0 CA-C-N 115.847 -0.615 . . . . 0.0 111.323 -178.023 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 75' ' ' LYS . . . . . 0.492 ' O ' ' HB3' ' A' ' 78' ' ' ASP . 10.8 tptp -69.61 -21.93 63.54 Favored 'General case' 0 N--CA 1.454 -0.268 0 CA-C-O 120.811 0.338 . . . . 0.0 111.074 179.29 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 76' ' ' GLU . . . . . . . . . . . . . 31.1 tt0 -73.15 -43.5 61.44 Favored 'General case' 0 C--N 1.324 -0.532 0 N-CA-C 109.304 -0.628 . . . . 0.0 109.304 174.183 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 77' ' ' ALA . . . . . . . . . . . . . . . -65.65 -27.18 68.19 Favored 'General case' 0 C--N 1.331 -0.213 0 CA-C-N 115.668 -0.696 . . . . 0.0 110.672 175.714 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 78' ' ' ASP . . . . . 0.492 ' HB3' ' O ' ' A' ' 75' ' ' LYS . 18.5 t0 -51.98 -44.1 63.87 Favored 'General case' 0 C--O 1.235 0.295 0 CA-C-N 115.555 -0.748 . . . . 0.0 109.605 173.712 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 79' ' ' GLY . . . . . . . . . . . . . . . 107.31 29.06 4.65 Favored Glycine 0 N--CA 1.448 -0.521 0 CA-C-N 115.44 -0.8 . . . . 0.0 112.141 -179.315 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 80' ' ' VAL . . . . . . . . . . . . . 33.1 m -69.63 150.35 10.34 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.347 0 CA-C-O 120.956 0.407 . . . . 0.0 110.675 179.758 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 81' ' ' SER . . . . . . . . . . . . . 14.0 m -72.92 168.34 19.16 Favored 'General case' 0 C--N 1.324 -0.518 0 CA-C-N 115.849 -0.614 . . . . 0.0 111.016 -179.383 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 82' ' ' VAL . . . . . . . . . . . . . 48.9 t -57.44 -52.37 57.88 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.187 0 CA-C-N 116.259 -0.428 . . . . 0.0 111.425 -176.523 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 83' ' ' SER . . . . . . . . . . . . . 59.8 m -62.42 -27.6 69.21 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-O 120.891 0.377 . . . . 0.0 111.113 -179.095 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 84' ' ' GLN . . . . . . . . . . . . . 51.5 tp60 -69.18 -54.55 14.25 Favored 'General case' 0 C--N 1.327 -0.396 0 CA-C-N 116.152 -0.476 . . . . 0.0 109.812 -179.74 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 85' ' ' LEU . . . . . . . . . . . . . 31.7 tp -69.17 -30.33 68.53 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.22 -0.446 . . . . 0.0 110.216 179.835 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 86' ' ' ASN . . . . . . . . . . . . . 27.2 t-20 -58.03 -44.65 87.45 Favored 'General case' 0 C--O 1.235 0.3 0 CA-C-N 116.094 -0.503 . . . . 0.0 110.195 176.018 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 87' ' ' SER . . . . . . . . . . . . . 8.7 t -66.83 -39.24 87.58 Favored 'General case' 0 N--CA 1.452 -0.327 0 CA-C-N 115.66 -0.7 . . . . 0.0 110.1 178.821 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 88' ' ' TYR . . . . . . . . . . . . . 30.9 m-85 -59.17 -46.32 88.71 Favored 'General case' 0 C--O 1.231 0.101 0 CA-C-N 116.321 -0.399 . . . . 0.0 111.106 177.053 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 89' ' ' LYS . . . . . . . . . . . . . 88.3 mttt -62.82 -44.38 96.3 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.5 -0.318 . . . . 0.0 110.45 179.09 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 90' ' ' ASN . . . . . . . . . . . . . 27.1 t-20 -57.98 -50.35 73.71 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.095 -0.502 . . . . 0.0 110.913 -179.5 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 91' ' ' TYR . . . . . . . . . . . . . 22.3 m-30 -58.68 -52.1 67.11 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.321 -0.4 . . . . 0.0 110.909 -179.492 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 92' ' ' CYS . . . . . 0.478 ' HA ' ' HB2' ' A' ' 96' ' ' LEU . 61.5 m -67.52 -44.9 77.26 Favored 'General case' 0 C--N 1.325 -0.461 0 CA-C-N 116.173 -0.467 . . . . 0.0 112.117 -173.771 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 93' ' ' ARG . . . . . . . . . . . . . 23.9 mmm-85 -81.08 -28.97 35.07 Favored 'General case' 0 C--N 1.329 -0.318 0 N-CA-C 112.194 0.442 . . . . 0.0 112.194 -173.123 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 94' ' ' ASN . . . . . . . . . . . . . 4.4 m-20 -105.54 -61.95 1.42 Allowed 'General case' 0 C--N 1.328 -0.366 0 C-N-CA 120.407 -0.517 . . . . 0.0 112.115 -176.409 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 95' ' ' HIS . . . . . . . . . . . . . 38.9 t-80 -75.84 -26.21 56.95 Favored 'General case' 0 C--N 1.326 -0.416 0 CA-C-O 120.826 0.346 . . . . 0.0 111.148 -172.37 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 96' ' ' LEU . . . . . 0.478 ' HB2' ' HA ' ' A' ' 92' ' ' CYS . 86.7 mt -108.37 14.95 24.4 Favored 'General case' 0 C--N 1.324 -0.504 0 CA-C-N 116.334 -0.394 . . . . 0.0 110.69 -179.793 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 97' ' ' SER . . . . . 0.585 ' N ' ' HD2' ' A' ' 98' ' ' PRO . 8.1 t -57.76 -46.03 99.77 Favored Pre-proline 0 CA--C 1.541 0.632 0 CA-C-N 116.342 -0.39 . . . . 0.0 111.897 -179.249 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 98' ' ' PRO . . . . . 0.585 ' HD2' ' N ' ' A' ' 97' ' ' SER . 10.2 Cg_endo -55.13 -28.19 59.65 Favored 'Trans proline' 0 C--N 1.357 0.992 0 C-N-CA 122.306 2.004 . . . . 0.0 112.591 175.604 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 99' ' ' LEU . . . . . 0.503 HD11 HG12 ' A' ' 112' ' ' ILE . 72.8 mt -89.29 -30.48 18.44 Favored 'General case' 0 C--N 1.326 -0.413 0 CA-C-N 116.251 -0.431 . . . . 0.0 110.219 -179.895 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 100' ' ' TYR . . . . . . . . . . . . . 16.4 t80 -57.11 -39.84 75.88 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 115.473 -0.785 . . . . 0.0 110.577 -179.519 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 101' ' ' MET . . . . . . . . . . . . . 24.7 ttt -76.47 -23.23 53.83 Favored 'General case' 0 C--O 1.233 0.222 0 CA-C-N 115.764 -0.653 . . . . 0.0 110.751 179.706 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 102' ' ' LYS . . . . . . . . . . . . . 50.0 mttm -75.72 146.46 40.1 Favored 'General case' 0 C--N 1.323 -0.573 0 CA-C-O 121.298 0.57 . . . . 0.0 111.63 -177.945 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 103' ' ' SER . . . . . 0.513 ' HA ' ' HA ' ' A' ' 63' ' ' SER . 7.4 m -76.4 160.73 29.29 Favored 'General case' 0 N--CA 1.445 -0.698 0 N-CA-C 108.109 -1.071 . . . . 0.0 108.109 169.788 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 104' ' ' LEU . . . . . 0.556 ' HG ' HD12 ' A' ' 146' ' ' ILE . 18.0 tp -56.5 -33.48 66.03 Favored 'General case' 0 C--N 1.323 -0.568 0 N-CA-C 111.914 0.339 . . . . 0.0 111.914 -174.007 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 105' ' ' SER . . . . . . . . . . . . . 12.1 p -87.77 -2.11 58.4 Favored 'General case' 0 CA--C 1.536 0.437 0 N-CA-C 112.416 0.524 . . . . 0.0 112.416 -177.698 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 106' ' ' GLU . . . . . 0.404 ' HG3' ' HB2' ' A' ' 103' ' ' SER . 43.3 mt-10 -94.41 -6.11 44.82 Favored 'General case' 0 C--O 1.234 0.268 0 CA-C-O 120.93 0.395 . . . . 0.0 111.17 -178.519 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 107' ' ' ILE . . . . . 0.54 HD11 ' HB2' ' A' ' 64' ' ' PHE . 74.8 mt -95.19 120.13 44.19 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.685 0 CA-C-N 116.147 -0.479 . . . . 0.0 111.456 -173.341 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 108' ' ' LEU . . . . . . . . . . . . . 85.7 mt -101.47 152.47 38.02 Favored Pre-proline 0 C--N 1.323 -0.549 0 CA-C-N 115.726 -0.67 . . . . 0.0 109.618 176.744 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 109' ' ' PRO . . . . . . . . . . . . . 18.4 Cg_endo -61.77 -24.39 77.38 Favored 'Trans proline' 0 C--O 1.233 0.235 0 C-N-CA 122.235 1.957 . . . . 0.0 111.516 176.446 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 110' ' ' ALA . . . . . . . . . . . . . . . -69.42 -38.44 77.9 Favored 'General case' 0 N--CA 1.452 -0.354 0 CA-C-N 115.612 -0.722 . . . . 0.0 111.011 179.761 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 111' ' ' ASP . . . . . 0.42 ' O ' HG13 ' A' ' 115' ' ' ILE . 54.6 m-20 -57.7 -52.94 63.37 Favored 'General case' 0 N--CA 1.464 0.228 0 CA-C-O 121.129 0.49 . . . . 0.0 110.437 -179.508 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 112' ' ' ILE . . . . . 0.503 HG12 HD11 ' A' ' 99' ' ' LEU . 28.4 mt -62.58 -47.39 93.16 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.51 0 CA-C-N 115.388 -0.824 . . . . 0.0 111.015 -177.745 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 113' ' ' GLN . . . . . . . . . . . . . 12.2 tm0? -64.97 -40.11 94.5 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.166 -0.47 . . . . 0.0 110.653 -176.2 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 114' ' ' SER . . . . . . . . . . . . . 27.9 t -57.11 -49.47 75.8 Favored 'General case' 0 C--O 1.237 0.438 0 CA-C-O 120.842 0.354 . . . . 0.0 110.477 179.034 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 115' ' ' ILE . . . . . 0.42 HG13 ' O ' ' A' ' 111' ' ' ASP . 60.9 mt -59.4 -49.34 83.89 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.179 0 CA-C-N 115.943 -0.571 . . . . 0.0 109.969 179.015 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 116' ' ' ILE . . . . . 0.47 HG21 HD12 ' A' ' 156' ' ' ILE . 33.4 mm -56.16 -44.29 78.59 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.227 0 CA-C-N 116.033 -0.531 . . . . 0.0 111.024 178.462 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 117' ' ' ASN . . . . . . . . . . . . . 10.1 t30 -55.62 -40.73 72.51 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 115.826 -0.624 . . . . 0.0 112.207 -177.494 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 118' ' ' GLU . . . . . . . . . . . . . 10.9 pt-20 -92.29 -9.22 42.79 Favored 'General case' 0 C--N 1.325 -0.462 0 N-CA-C 112.308 0.484 . . . . 0.0 112.308 -178.572 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 119' ' ' THR . . . . . . . . . . . . . 84.4 m -76.25 132.73 40.04 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-O 120.731 0.301 . . . . 0.0 110.844 178.91 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 120' ' ' LYS . . . . . 0.452 ' HE3' ' HB2' ' A' ' 120' ' ' LYS . 39.3 mtmt -106.91 89.55 3.04 Favored 'General case' 0 C--N 1.328 -0.364 0 N-CA-C 110.247 -0.279 . . . . 0.0 110.247 179.619 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 121' ' ' LEU . . . . . . . . . . . . . 86.8 mt -135.44 173.23 11.95 Favored 'General case' 0 C--N 1.322 -0.598 0 CA-C-N 116.565 -0.289 . . . . 0.0 110.265 178.27 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 122' ' ' ALA . . . . . . . . . . . . . . . -68.4 157.19 36.3 Favored 'General case' 0 C--N 1.327 -0.384 0 CA-C-N 116.359 -0.382 . . . . 0.0 110.543 178.906 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 123' ' ' LYS . . . . . . . . . . . . . 59.2 pttt -57.56 -36.41 71.63 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.2 -0.454 . . . . 0.0 110.83 -179.556 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 124' ' ' ASN . . . . . . . . . . . . . 52.9 t30 -64.82 -46.25 82.76 Favored 'General case' 0 C--N 1.332 -0.161 0 CA-C-N 116.235 -0.439 . . . . 0.0 110.405 177.591 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 125' ' ' THR . . . . . 0.476 ' O ' HG13 ' A' ' 129' ' ' ILE . 2.3 m -66.39 -45.31 80.46 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 115.573 -0.739 . . . . 0.0 111.187 -176.246 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 126' ' ' LEU . . . . . 0.638 ' HB3' HD11 ' A' ' 156' ' ' ILE . 83.8 mt -61.84 -48.01 82.48 Favored 'General case' 0 C--O 1.234 0.246 0 CA-C-N 116.286 -0.415 . . . . 0.0 111.248 -179.144 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 127' ' ' LYS . . . . . . . . . . . . . 98.1 mttt -63.56 -35.11 79.4 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.378 -0.374 . . . . 0.0 110.782 177.81 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 128' ' ' ALA . . . . . . . . . . . . . . . -62.18 -43.28 99.18 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-N 116.57 -0.286 . . . . 0.0 110.969 179.517 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 129' ' ' ILE . . . . . 0.476 HG13 ' O ' ' A' ' 125' ' ' THR . 68.4 mt -61.28 -47.52 93.13 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.33 0 CA-C-O 120.878 0.37 . . . . 0.0 110.499 178.491 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 130' ' ' ARG . . . . . 0.451 ' HD2' ' HB ' ' A' ' 154' ' ' VAL . 9.7 ttt180 -65.31 -45.89 82.52 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.258 -0.428 . . . . 0.0 111.213 -179.666 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 131' ' ' ASN . . . . . . . . . . . . . 92.9 m-20 -63.94 -33.39 75.61 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-O 120.65 0.262 . . . . 0.0 111.094 -179.755 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 132' ' ' THR . . . . . . . . . . . . . 98.0 m -65.53 -45.35 83.81 Favored 'General case' 0 C--N 1.325 -0.493 0 CA-C-O 120.887 0.375 . . . . 0.0 110.331 174.823 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 133' ' ' ALA . . . . . . . . . . . . . . . -64.4 -43.88 93.04 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 115.923 -0.58 . . . . 0.0 111.111 -179.386 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 134' ' ' SER . . . . . 0.534 ' O ' ' HG3' ' A' ' 138' ' ' ARG . 23.6 p -64.3 -35.51 81.1 Favored 'General case' 0 C--N 1.331 -0.196 0 CA-C-N 116.667 -0.242 . . . . 0.0 110.797 -179.373 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 135' ' ' GLN . . . . . . . . . . . . . 13.1 mm100 -59.63 -42.06 91.88 Favored 'General case' 0 C--N 1.331 -0.236 0 CA-C-O 120.803 0.335 . . . . 0.0 110.794 175.034 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 136' ' ' ILE . . . . . . . . . . . . . 69.3 mt -65.07 -42.98 95.89 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.365 0 CA-C-N 115.938 -0.573 . . . . 0.0 110.508 178.045 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 137' ' ' PHE . . . . . 0.437 ' O ' HG13 ' A' ' 141' ' ' ILE . 35.3 m-85 -66.92 -37.83 85.06 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.213 -0.449 . . . . 0.0 110.927 178.207 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 138' ' ' ARG . . . . . 0.534 ' HG3' ' O ' ' A' ' 134' ' ' SER . 54.1 mtp180 -59.32 -43.33 92.69 Favored 'General case' 0 CA--C 1.517 -0.324 0 N-CA-C 110.022 -0.362 . . . . 0.0 110.022 174.92 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 139' ' ' LEU . . . . . . . . . . . . . 49.9 tp -58.87 -41.18 86.47 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 115.75 -0.659 . . . . 0.0 110.075 178.205 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 140' ' ' ALA . . . . . 0.466 ' HB1' HD21 ' A' ' 104' ' ' LEU . . . -64.99 -41.63 95.23 Favored 'General case' 0 C--N 1.327 -0.391 0 CA-C-N 116.086 -0.506 . . . . 0.0 110.62 177.16 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 141' ' ' ILE . . . . . 0.437 HG13 ' O ' ' A' ' 137' ' ' PHE . 74.7 mt -61.81 -46.11 97.23 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.374 0 CA-C-N 116.14 -0.482 . . . . 0.0 110.902 176.299 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 142' ' ' GLU . . . . . . . . . . . . . 44.5 mt-10 -60.61 -36.77 79.41 Favored 'General case' 0 N--CA 1.465 0.282 0 CA-C-O 120.79 0.329 . . . . 0.0 111.012 178.548 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 143' ' ' ASN . . . . . . . . . . . . . 40.4 m-80 -88.23 10.44 19.56 Favored 'General case' 0 C--N 1.331 -0.225 0 CA-C-N 116.154 -0.475 . . . . 0.0 110.719 178.934 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 144' ' ' ARG . . . . . . . . . . . . . 61.6 mtt-85 64.23 21.71 12.61 Favored 'General case' 0 N--CA 1.466 0.334 0 CA-C-N 115.621 -0.718 . . . . 0.0 112.389 171.246 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 145' ' ' ALA . . . . . . . . . . . . . . . -85.26 -27.6 25.91 Favored 'General case' 0 C--N 1.323 -0.552 0 CA-C-O 120.806 0.336 . . . . 0.0 111.595 -176.678 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 146' ' ' ILE . . . . . 0.556 HD12 ' HG ' ' A' ' 104' ' ' LEU . 13.8 tt -143.88 149.58 17.72 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.536 0 CA-C-O 120.906 0.384 . . . . 0.0 110.452 -179.79 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 147' ' ' ASP . . . . . . . . . . . . . 0.9 OUTLIER -114.92 25.03 11.24 Favored 'General case' 0 C--N 1.325 -0.46 0 CA-C-O 121.254 0.549 . . . . 0.0 110.249 179.524 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 148' ' ' PHE . . . . . 0.441 ' H ' HG12 ' A' ' 146' ' ' ILE . 60.1 t80 -144.29 134.01 23.67 Favored 'General case' 0 C--N 1.323 -0.582 0 CA-C-N 115.581 -0.736 . . . . 0.0 109.589 -174.434 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 149' ' ' ASN . . . . . . . . . . . . . 53.6 t-20 -115.19 95.66 43.05 Favored Pre-proline 0 C--N 1.324 -0.525 0 N-CA-C 109.987 -0.375 . . . . 0.0 109.987 178.5 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 150' ' ' PRO . . . . . . . . . . . . . 32.9 Cg_exo -58.62 -33.18 98.01 Favored 'Trans proline' 0 C--N 1.342 0.225 0 C-N-CA 122.937 2.425 . . . . 0.0 112.769 -178.575 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 151' ' ' ALA . . . . . 0.507 ' HA ' HG23 ' A' ' 154' ' ' VAL . . . -73.38 -20.73 60.69 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 116.442 -0.345 . . . . 0.0 111.502 -176.327 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 152' ' ' ASP . . . . . . . . . . . . . 29.9 t70 -70.15 -23.72 63.05 Favored 'General case' 0 C--N 1.325 -0.5 0 CA-C-O 121.123 0.487 . . . . 0.0 110.62 178.942 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 153' ' ' TYR . . . . . . . . . . . . . 77.0 m-85 -96.59 -2.88 43.97 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.114 -0.493 . . . . 0.0 110.763 -178.571 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 154' ' ' VAL . . . . . 0.507 HG23 ' HA ' ' A' ' 151' ' ' ALA . 61.0 t -77.64 117.66 23.15 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.391 0 CA-C-N 116.384 -0.371 . . . . 0.0 110.374 179.19 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 155' ' ' ARG . . . . . . . . . . . . . 51.1 mtp85 -92.12 141.9 28.09 Favored 'General case' 0 C--N 1.318 -0.802 0 CA-C-O 120.972 0.415 . . . . 0.0 110.514 176.32 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 156' ' ' ILE . . . . . 0.638 HD11 ' HB3' ' A' ' 126' ' ' LEU . 2.9 tp -106.97 129.31 24.55 Favored Pre-proline 0 C--N 1.318 -0.789 0 CA-C-N 115.456 -0.793 . . . . 0.0 109.609 -176.889 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 157' ' ' PRO . . . . . . . . . . . . . 86.1 Cg_endo -89.51 140.79 3.78 Favored 'Trans proline' 0 N--CA 1.454 -0.8 0 C-N-CA 122.631 2.221 . . . . 0.0 113.08 -179.426 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 158' ' ' LYS . . . . . . . . . . . . . 39.8 mtmt -105.77 3.05 28.41 Favored 'General case' 0 C--N 1.327 -0.398 0 N-CA-C 109.156 -0.683 . . . . 0.0 109.156 171.817 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 159' ' ' ILE . . . . . . . . . . . . . 66.6 mt -82.06 94.78 2.89 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.446 0 CA-C-N 115.296 -0.865 . . . . 0.0 111.134 -172.707 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 160' ' ' ALA . . . . . . . . . . . . . . . -89.11 170.87 10.26 Favored 'General case' 0 C--N 1.319 -0.719 0 CA-C-N 115.555 -0.748 . . . . 0.0 109.288 172.379 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 161' ' ' LEU . . . . . 0.598 HD21 ' HB3' ' A' ' 167' ' ' HIS . 5.6 mp -66.44 109.63 2.81 Favored 'General case' 0 C--N 1.322 -0.617 0 CA-C-O 120.995 0.426 . . . . 0.0 110.601 -176.484 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 162' ' ' GLU . . . . . . . . . . . . . 42.7 tt0 -70.45 -51.59 28.22 Favored 'General case' 0 C--N 1.325 -0.482 0 CA-C-N 115.84 -0.618 . . . . 0.0 109.993 179.214 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 163' ' ' HIS . . . . . . . . . . . . . 15.0 m-70 -85.62 173.55 10.07 Favored 'General case' 0 C--N 1.323 -0.579 0 CA-C-N 115.901 -0.59 . . . . 0.0 110.513 177.923 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 164' ' ' HIS . . . . . . . . . . . . . 41.8 m-70 -100.52 154.28 18.68 Favored 'General case' 0 C--N 1.322 -0.627 0 CA-C-N 116.069 -0.514 . . . . 0.0 110.715 -176.95 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 165' ' ' HIS . . . . . . . . . . . . . 90.6 m-70 47.79 79.34 0.07 Allowed 'General case' 0 N--CA 1.467 0.392 0 O-C-N 124.066 0.854 . . . . 0.0 112.732 173.756 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 166' ' ' HIS . . . . . . . . . . . . . 28.5 m80 -141.23 -41.01 0.38 Allowed 'General case' 0 C--N 1.319 -0.742 0 CA-C-N 115.448 -0.796 . . . . 0.0 109.355 174.564 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 167' ' ' HIS . . . . . 0.598 ' HB3' HD21 ' A' ' 161' ' ' LEU . 33.2 t60 -123.27 85.35 2.41 Favored 'General case' 0 C--N 1.32 -0.678 0 N-CA-C 107.438 -1.319 . . . . 0.0 107.438 172.236 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 168' ' ' HIS . . . . . 0.442 ' HB2' ' O ' ' A' ' 167' ' ' HIS . 5.9 m80 . . . . . 0 C--O 1.249 1.037 0 O-C-N 123.911 0.757 . . . . 0.0 109.865 -166.541 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 61' ' ' ARG . . . . . . . . . . . . . 23.6 mtm180 . . . . . 0 N--CA 1.477 0.903 0 N-CA-C 109.517 -0.549 . . . . 0.0 109.517 . . . . . . . . . 0 0 . 1 . 007 nuclear build full ' A' A ' 62' ' ' ASP . . . . . 0.413 ' HB2' ' HE1' ' A' ' 67' ' ' TRP . 30.8 m-20 -77.14 -176.92 4.26 Favored 'General case' 0 C--N 1.326 -0.452 0 CA-C-O 121.185 0.517 . . . . 0.0 110.849 -179.192 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 63' ' ' SER . . . . . 0.6 ' HA ' ' HA ' ' A' ' 103' ' ' SER . 47.0 m -114.71 159.68 20.26 Favored 'General case' 0 N--CA 1.444 -0.77 0 CA-C-N 115.824 -0.625 . . . . 0.0 110.54 -178.825 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 64' ' ' PHE . . . . . 0.517 ' HB2' HD11 ' A' ' 107' ' ' ILE . 80.6 t80 -58.47 -34.4 70.84 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 115.865 -0.607 . . . . 0.0 111.145 -176.171 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 65' ' ' GLY . . . . . . . . . . . . . . . -61.68 -40.78 99.23 Favored Glycine 0 N--CA 1.453 -0.224 0 C-N-CA 120.898 -0.668 . . . . 0.0 112.636 179.901 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 66' ' ' ASP . . . . . . . . . . . . . 24.7 t70 -61.11 -52.16 66.08 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-O 120.936 0.398 . . . . 0.0 110.163 177.635 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 67' ' ' TRP . . . . . 0.413 ' HE1' ' HB2' ' A' ' 62' ' ' ASP . 98.7 m95 -65.51 -34.47 78.33 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-N 115.58 -0.737 . . . . 0.0 111.403 -179.204 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 68' ' ' ALA . . . . . 0.592 ' O ' ' HG ' ' A' ' 72' ' ' LEU . . . -61.96 -50.85 70.46 Favored 'General case' 0 C--N 1.327 -0.377 0 CA-C-O 120.665 0.269 . . . . 0.0 110.827 178.598 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 69' ' ' GLU . . . . . . . . . . . . . 33.3 tt0 -69.87 -34.37 73.48 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-O 120.769 0.319 . . . . 0.0 110.213 -179.791 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 70' ' ' LYS . . . . . . . . . . . . . 48.9 tttm -61.72 -42.93 99.6 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-O 121.298 0.57 . . . . 0.0 109.556 176.264 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 71' ' ' PHE . . . . . . . . . . . . . 71.4 t80 -64.31 -45.15 89.17 Favored 'General case' 0 C--N 1.326 -0.423 0 CA-C-N 115.244 -0.889 . . . . 0.0 111.056 176.82 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 72' ' ' LEU . . . . . 0.592 ' HG ' ' O ' ' A' ' 68' ' ' ALA . 89.2 mt -61.44 -42.41 98.72 Favored 'General case' 0 C--N 1.327 -0.396 0 CA-C-O 121.017 0.436 . . . . 0.0 110.38 178.706 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 73' ' ' LYS . . . . . 0.511 ' HD2' ' HA ' ' A' ' 73' ' ' LYS . 18.2 tptt -70.0 -38.22 75.91 Favored 'General case' 0 C--N 1.326 -0.434 0 CA-C-N 115.842 -0.617 . . . . 0.0 111.15 -176.023 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 74' ' ' SER . . . . . . . . . . . . . 8.1 p -70.06 -32.4 70.48 Favored 'General case' 0 C--N 1.327 -0.376 0 C-N-CA 121.077 -0.249 . . . . 0.0 110.877 179.987 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 75' ' ' LYS . . . . . . . . . . . . . 30.8 mmtp -73.09 -37.28 66.81 Favored 'General case' 0 C--O 1.234 0.273 0 CA-C-O 120.775 0.322 . . . . 0.0 110.478 174.634 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 76' ' ' GLU . . . . . . . . . . . . . 42.0 tt0 -61.84 -46.12 90.83 Favored 'General case' 0 C--N 1.327 -0.379 0 CA-C-N 116.053 -0.521 . . . . 0.0 110.251 177.474 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 77' ' ' ALA . . . . . . . . . . . . . . . -70.54 -33.41 71.12 Favored 'General case' 0 C--N 1.325 -0.466 0 CA-C-N 115.816 -0.629 . . . . 0.0 111.072 177.644 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 78' ' ' ASP . . . . . . . . . . . . . 20.1 t70 -57.9 -47.05 83.95 Favored 'General case' 0 CA--C 1.518 -0.286 0 CA-C-N 116.142 -0.481 . . . . 0.0 110.431 177.449 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 79' ' ' GLY . . . . . . . . . . . . . . . 114.98 41.17 0.85 Allowed Glycine 0 N--CA 1.443 -0.835 0 C-N-CA 120.436 -0.887 . . . . 0.0 112.966 176.288 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 80' ' ' VAL . . . . . . . . . . . . . 29.0 m -77.33 157.53 5.29 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.442 0 N-CA-C 110.137 -0.319 . . . . 0.0 110.137 174.649 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 81' ' ' SER . . . . . . . . . . . . . 18.4 m -62.07 150.3 38.7 Favored 'General case' 0 C--N 1.324 -0.534 0 N-CA-C 110.239 -0.282 . . . . 0.0 110.239 177.925 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 82' ' ' VAL . . . . . . . . . . . . . 55.4 t -58.97 -42.82 87.24 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.495 0 CA-C-N 116.356 -0.384 . . . . 0.0 110.453 -177.348 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 83' ' ' SER . . . . . . . . . . . . . 13.4 m -59.44 -39.19 82.76 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 116.311 -0.404 . . . . 0.0 111.131 179.054 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 84' ' ' GLN . . . . . . . . . . . . . 59.2 tp60 -63.32 -45.03 93.2 Favored 'General case' 0 C--O 1.234 0.274 0 CA-C-O 121.107 0.48 . . . . 0.0 110.298 177.407 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 85' ' ' LEU . . . . . . . . . . . . . 46.8 tp -67.88 -36.18 79.79 Favored 'General case' 0 C--N 1.327 -0.408 0 CA-C-N 115.936 -0.575 . . . . 0.0 110.428 179.455 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 86' ' ' ASN . . . . . . . . . . . . . 11.8 m120 -60.83 -47.2 87.45 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.233 -0.44 . . . . 0.0 110.563 178.215 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 87' ' ' SER . . . . . . . . . . . . . 3.5 p -63.36 -36.32 83.3 Favored 'General case' 0 CA--C 1.531 0.243 0 C-N-CA 121.038 -0.265 . . . . 0.0 111.319 179.396 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 88' ' ' TYR . . . . . . . . . . . . . 6.6 m-85 -59.62 -54.49 45.86 Favored 'General case' 0 C--O 1.233 0.232 0 CA-C-O 121.707 0.765 . . . . 0.0 110.167 174.236 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 89' ' ' LYS . . . . . 0.403 ' HE3' ' HB2' ' A' ' 89' ' ' LYS . 34.6 ttmt -65.59 -32.97 74.84 Favored 'General case' 0 C--N 1.325 -0.467 0 CA-C-N 114.597 -1.183 . . . . 0.0 110.88 -175.741 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 90' ' ' ASN . . . . . . . . . . . . . 27.6 t-20 -64.43 -52.18 59.41 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 116.02 -0.536 . . . . 0.0 111.324 179.708 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 91' ' ' TYR . . . . . . . . . . . . . 22.3 m-85 -61.06 -39.72 90.91 Favored 'General case' 0 C--O 1.234 0.259 0 CA-C-O 121.033 0.444 . . . . 0.0 110.233 179.756 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 92' ' ' CYS . . . . . 0.614 ' HA ' ' HB2' ' A' ' 96' ' ' LEU . 42.7 t -64.63 -49.57 70.56 Favored 'General case' 0 C--N 1.325 -0.474 0 CA-C-N 115.31 -0.859 . . . . 0.0 111.094 -178.09 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 93' ' ' ARG . . . . . . . . . . . . . 28.9 mmt180 -73.09 -6.56 46.47 Favored 'General case' 0 C--N 1.328 -0.35 0 N-CA-C 112.94 0.718 . . . . 0.0 112.94 -175.099 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 94' ' ' ASN . . . . . . . . . . . . . 52.7 m-80 -118.9 -64.66 1.25 Allowed 'General case' 0 C--N 1.327 -0.403 0 C-N-CA 119.537 -0.865 . . . . 0.0 112.721 -179.402 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 95' ' ' HIS . . . . . . . . . . . . . 82.7 m-70 -88.98 -20.49 24.39 Favored 'General case' 0 C--N 1.325 -0.469 0 N-CA-C 112.617 0.599 . . . . 0.0 112.617 -173.838 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 96' ' ' LEU . . . . . 0.614 ' HB2' ' HA ' ' A' ' 92' ' ' CYS . 83.4 mt -99.05 7.14 46.22 Favored 'General case' 0 C--N 1.325 -0.463 0 C-N-CA 120.946 -0.302 . . . . 0.0 111.065 -178.751 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 97' ' ' SER . . . . . 0.545 ' N ' ' HD2' ' A' ' 98' ' ' PRO . 50.2 m -57.63 -49.26 94.78 Favored Pre-proline 0 CA--C 1.537 0.453 0 CA-C-N 116.383 -0.371 . . . . 0.0 111.896 178.907 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 98' ' ' PRO . . . . . 0.545 ' HD2' ' N ' ' A' ' 97' ' ' SER . 9.5 Cg_endo -53.9 -40.07 82.13 Favored 'Trans proline' 0 C--N 1.358 1.037 0 C-N-CA 122.047 1.831 . . . . 0.0 112.458 176.727 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 99' ' ' LEU . . . . . 0.558 HD23 ' HD2' ' A' ' 102' ' ' LYS . 90.6 mt -75.28 -29.53 60.16 Favored 'General case' 0 C--N 1.332 -0.188 0 CA-C-N 116.255 -0.43 . . . . 0.0 111.107 -178.736 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 100' ' ' TYR . . . . . . . . . . . . . 23.4 t80 -55.74 -29.82 60.19 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 115.759 -0.655 . . . . 0.0 111.701 -174.318 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 101' ' ' MET . . . . . . . . . . . . . 65.2 mtt -106.77 10.75 30.72 Favored 'General case' 0 C--N 1.326 -0.44 0 CA-C-O 120.663 0.268 . . . . 0.0 111.571 -178.16 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 102' ' ' LYS . . . . . 0.558 ' HD2' HD23 ' A' ' 99' ' ' LEU . 68.3 mttm -97.03 134.41 40.42 Favored 'General case' 0 C--N 1.326 -0.424 0 N-CA-C 110.217 -0.29 . . . . 0.0 110.217 177.628 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 103' ' ' SER . . . . . 0.6 ' HA ' ' HA ' ' A' ' 63' ' ' SER . 68.0 m -73.52 152.28 40.72 Favored 'General case' 0 C--N 1.323 -0.568 0 N-CA-C 109.298 -0.631 . . . . 0.0 109.298 172.823 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 104' ' ' LEU . . . . . 0.442 ' HA ' HD12 ' A' ' 107' ' ' ILE . 82.2 mt -53.51 -35.9 61.16 Favored 'General case' 0 C--N 1.33 -0.276 0 N-CA-C 112.265 0.469 . . . . 0.0 112.265 -174.64 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 105' ' ' SER . . . . . . . . . . . . . 2.7 p -79.55 -6.81 57.79 Favored 'General case' 0 C--N 1.325 -0.474 0 N-CA-C 111.95 0.352 . . . . 0.0 111.95 -177.748 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 106' ' ' GLU . . . . . 0.532 ' OE1' ' HB2' ' A' ' 103' ' ' SER . 1.9 mp0 -112.21 7.21 19.4 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-O 120.746 0.308 . . . . 0.0 110.974 178.704 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 107' ' ' ILE . . . . . 0.517 HD11 ' HB2' ' A' ' 64' ' ' PHE . 81.8 mt -88.99 117.02 31.54 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.46 0 CA-C-O 121.106 0.479 . . . . 0.0 110.464 179.553 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 108' ' ' LEU . . . . . . . . . . . . . 85.6 mt -95.25 134.34 24.69 Favored Pre-proline 0 C--N 1.322 -0.609 0 CA-C-N 115.877 -0.601 . . . . 0.0 110.273 -179.868 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 109' ' ' PRO . . . . . . . . . . . . . 40.1 Cg_exo -58.79 -34.4 98.98 Favored 'Trans proline' 0 C--N 1.343 0.264 0 C-N-CA 122.643 2.229 . . . . 0.0 111.735 176.771 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 110' ' ' ALA . . . . . . . . . . . . . . . -70.64 -23.4 62.53 Favored 'General case' 0 C--N 1.33 -0.243 0 CA-C-N 115.624 -0.716 . . . . 0.0 111.106 178.702 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 111' ' ' ASP . . . . . 0.537 ' OD2' ' HE3' ' A' ' 102' ' ' LYS . 31.1 t70 -71.86 -42.97 66.25 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-O 121.181 0.515 . . . . 0.0 109.631 -179.932 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 112' ' ' ILE . . . . . 0.471 HD12 ' HB2' ' A' ' 150' ' ' PRO . 37.4 mt -67.89 -39.7 82.21 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.437 0 CA-C-N 115.69 -0.686 . . . . 0.0 110.186 176.689 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 113' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -59.86 -47.19 86.76 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 115.607 -0.724 . . . . 0.0 110.055 179.081 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 114' ' ' SER . . . . . . . . . . . . . 13.1 p -65.91 -27.56 68.28 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 116.261 -0.427 . . . . 0.0 111.148 -179.261 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 115' ' ' ILE . . . . . 0.519 HG13 ' O ' ' A' ' 111' ' ' ASP . 76.7 mt -61.19 -43.33 96.19 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.231 0 CA-C-O 121.198 0.523 . . . . 0.0 110.399 173.515 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 116' ' ' ILE . . . . . . . . . . . . . 50.7 mm -63.18 -33.35 60.42 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.599 0 CA-C-O 121.22 0.534 . . . . 0.0 110.17 177.228 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 117' ' ' ASN . . . . . . . . . . . . . 0.2 OUTLIER -75.56 -29.18 59.27 Favored 'General case' 0 C--N 1.326 -0.429 0 CA-C-N 115.799 -0.637 . . . . 0.0 110.77 -179.151 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 118' ' ' GLU . . . . . 0.488 ' HG3' ' HA ' ' A' ' 115' ' ' ILE . 3.1 pp20? -87.81 -8.99 55.19 Favored 'General case' 0 C--N 1.33 -0.245 0 C-N-CA 120.599 -0.441 . . . . 0.0 110.887 179.587 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 119' ' ' THR . . . . . . . . . . . . . 34.6 m -80.83 117.77 21.77 Favored 'General case' 0 N--CA 1.449 -0.5 0 N-CA-C 109.472 -0.566 . . . . 0.0 109.472 174.307 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 120' ' ' LYS . . . . . . . . . . . . . 67.3 mttm -98.29 32.14 2.57 Favored 'General case' 0 C--N 1.324 -0.534 0 CA-C-O 121.37 0.605 . . . . 0.0 110.77 -175.734 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 121' ' ' LEU . . . . . 0.414 HD23 HG21 ' A' ' 125' ' ' THR . 10.8 mp -100.86 -175.57 2.92 Favored 'General case' 0 C--N 1.322 -0.619 0 CA-C-N 115.642 -0.708 . . . . 0.0 110.266 178.998 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 122' ' ' ALA . . . . . 0.533 ' O ' ' HG ' ' A' ' 126' ' ' LEU . . . -75.03 164.56 26.41 Favored 'General case' 0 C--N 1.325 -0.495 0 CA-C-O 121.142 0.496 . . . . 0.0 111.888 -175.462 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 123' ' ' LYS . . . . . . . . . . . . . 64.6 tttp -59.86 -42.16 93.06 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 115.28 -0.873 . . . . 0.0 111.879 -175.784 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 124' ' ' ASN . . . . . . . . . . . . . 26.8 p-10 -63.29 -34.3 77.39 Favored 'General case' 0 C--N 1.326 -0.436 0 CA-C-O 120.822 0.344 . . . . 0.0 110.988 179.947 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 125' ' ' THR . . . . . 0.414 HG21 HD23 ' A' ' 121' ' ' LEU . 17.2 m -73.1 -38.02 66.51 Favored 'General case' 0 C--N 1.326 -0.428 0 CA-C-O 120.794 0.33 . . . . 0.0 110.358 177.989 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 126' ' ' LEU . . . . . 0.533 ' HG ' ' O ' ' A' ' 122' ' ' ALA . 89.5 mt -58.96 -49.01 79.49 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-O 121.146 0.498 . . . . 0.0 110.686 178.556 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 127' ' ' LYS . . . . . 0.534 ' HA ' ' HB3' ' A' ' 130' ' ' ARG . 16.4 ptmt -74.91 -20.25 59.79 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-N 116.072 -0.513 . . . . 0.0 110.93 -177.089 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 128' ' ' ALA . . . . . . . . . . . . . . . -66.57 -41.76 88.08 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-O 120.757 0.313 . . . . 0.0 110.62 174.822 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 129' ' ' ILE . . . . . . . . . . . . . 46.9 mt -64.86 -40.28 88.53 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.24 0 N-CA-C 109.192 -0.67 . . . . 0.0 109.192 175.057 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 130' ' ' ARG . . . . . 0.534 ' HB3' ' HA ' ' A' ' 127' ' ' LYS . 13.5 tpt85 -55.02 -45.41 75.16 Favored 'General case' 0 CA--C 1.533 0.314 0 CA-C-N 115.13 -0.941 . . . . 0.0 111.092 173.427 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 131' ' ' ASN . . . . . . . . . . . . . 12.9 m-80 -66.84 -47.04 73.2 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.366 -0.379 . . . . 0.0 111.251 178.637 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 132' ' ' THR . . . . . . . . . . . . . 40.3 m -57.9 -53.18 61.1 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.28 -0.418 . . . . 0.0 111.201 -178.786 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 133' ' ' ALA . . . . . . . . . . . . . . . -60.67 -36.25 78.27 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.234 -0.439 . . . . 0.0 111.034 -178.82 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 134' ' ' SER . . . . . 0.519 ' O ' ' HG3' ' A' ' 138' ' ' ARG . 39.0 t -60.31 -50.0 75.38 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.252 -0.431 . . . . 0.0 110.798 179.925 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 135' ' ' GLN . . . . . . . . . . . . . 75.4 mt-30 -59.47 -37.28 77.78 Favored 'General case' 0 C--N 1.331 -0.216 0 CA-C-N 116.384 -0.371 . . . . 0.0 110.832 -177.993 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 136' ' ' ILE . . . . . . . . . . . . . 71.0 mt -64.55 -47.35 89.49 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.386 0 CA-C-N 116.034 -0.53 . . . . 0.0 110.769 178.879 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 137' ' ' PHE . . . . . 0.459 ' O ' HG13 ' A' ' 141' ' ' ILE . 41.7 m-85 -65.98 -35.08 79.6 Favored 'General case' 0 C--N 1.331 -0.224 0 CA-C-N 116.544 -0.298 . . . . 0.0 111.41 179.543 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 138' ' ' ARG . . . . . 0.519 ' HG3' ' O ' ' A' ' 134' ' ' SER . 45.0 mtp-105 -61.9 -38.84 89.87 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-O 120.888 0.375 . . . . 0.0 110.492 178.157 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 139' ' ' LEU . . . . . . . . . . . . . 50.2 tp -60.55 -36.88 79.54 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-N 115.878 -0.601 . . . . 0.0 110.355 178.072 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 140' ' ' ALA . . . . . . . . . . . . . . . -69.6 -37.75 77.03 Favored 'General case' 0 C--N 1.327 -0.37 0 CA-C-N 115.961 -0.563 . . . . 0.0 110.365 177.353 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 141' ' ' ILE . . . . . 0.459 HG13 ' O ' ' A' ' 137' ' ' PHE . 70.2 mt -63.26 -44.46 99.21 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.277 0 CA-C-N 116.061 -0.518 . . . . 0.0 110.403 175.955 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 142' ' ' GLU . . . . . . . . . . . . . 51.8 mt-10 -62.14 -27.99 69.33 Favored 'General case' 0 C--N 1.331 -0.224 0 CA-C-N 116.129 -0.487 . . . . 0.0 111.59 178.632 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 143' ' ' ASN . . . . . 0.514 ' C ' ' HD2' ' A' ' 144' ' ' ARG . 34.9 m-80 -97.26 21.18 10.33 Favored 'General case' 0 C--N 1.324 -0.511 0 CA-C-N 116.143 -0.481 . . . . 0.0 110.783 178.439 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 144' ' ' ARG . . . . . 0.514 ' HD2' ' C ' ' A' ' 143' ' ' ASN . 0.0 OUTLIER 38.48 39.18 0.29 Allowed 'General case' 0 N--CA 1.472 0.648 0 C-N-CA 124.347 1.059 . . . . 0.0 112.496 -177.497 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 145' ' ' ALA . . . . . . . . . . . . . . . -88.33 -32.88 18.2 Favored 'General case' 0 C--N 1.325 -0.466 0 CA-C-N 115.808 -0.633 . . . . 0.0 109.613 176.983 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 146' ' ' ILE . . . . . 0.511 HG12 ' H ' ' A' ' 148' ' ' PHE . 16.6 tt -149.47 133.56 8.69 Favored 'Isoleucine or valine' 0 N--CA 1.449 -0.514 0 CA-C-N 115.283 -0.871 . . . . 0.0 109.439 177.506 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 147' ' ' ASP . . . . . . . . . . . . . 35.2 t70 -102.56 24.18 10.83 Favored 'General case' 0 C--N 1.325 -0.496 0 CA-C-O 122.09 0.948 . . . . 0.0 109.484 179.636 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 148' ' ' PHE . . . . . 0.511 ' H ' HG12 ' A' ' 146' ' ' ILE . 68.7 t80 -132.7 133.26 43.31 Favored 'General case' 0 C--N 1.319 -0.718 0 CA-C-N 114.927 -1.033 . . . . 0.0 109.64 -174.312 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 149' ' ' ASN . . . . . . . . . . . . . 18.5 t-20 -116.16 99.57 52.78 Favored Pre-proline 0 C--N 1.323 -0.571 0 N-CA-C 110.283 -0.266 . . . . 0.0 110.283 -179.84 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 150' ' ' PRO . . . . . 0.471 ' HB2' HD12 ' A' ' 112' ' ' ILE . 22.0 Cg_exo -65.67 -26.08 53.75 Favored 'Trans proline' 0 C--O 1.23 0.124 0 C-N-CA 122.68 2.253 . . . . 0.0 112.283 -178.818 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 151' ' ' ALA . . . . . . . . . . . . . . . -69.92 -20.89 63.33 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 115.995 -0.548 . . . . 0.0 111.333 -177.469 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 152' ' ' ASP . . . . . . . . . . . . . 25.2 t70 -64.15 -29.79 70.89 Favored 'General case' 0 C--O 1.234 0.253 0 CA-C-N 116.122 -0.49 . . . . 0.0 110.863 179.807 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 153' ' ' TYR . . . . . . . . . . . . . 78.7 m-85 -87.73 -5.19 58.78 Favored 'General case' 0 C--N 1.327 -0.383 0 CA-C-N 115.709 -0.678 . . . . 0.0 111.17 -176.175 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 154' ' ' VAL . . . . . . . . . . . . . 66.0 t -79.5 107.42 11.91 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.445 0 CA-C-O 120.929 0.395 . . . . 0.0 110.214 -179.399 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 155' ' ' ARG . . . . . . . . . . . . . 89.4 mtt180 -91.09 133.75 35.08 Favored 'General case' 0 C--N 1.323 -0.585 0 CA-C-N 116.104 -0.498 . . . . 0.0 110.54 -178.432 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 156' ' ' ILE . . . . . . . . . . . . . 50.6 mm -91.94 116.49 66.56 Favored Pre-proline 0 C--N 1.325 -0.495 0 CA-C-N 116.114 -0.494 . . . . 0.0 110.491 -176.951 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 157' ' ' PRO . . . . . . . . . . . . . 31.9 Cg_endo -64.0 159.11 44.01 Favored 'Trans proline' 0 C--O 1.235 0.355 0 C-N-CA 122.97 2.447 . . . . 0.0 113.219 -175.86 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 158' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -126.14 -7.13 6.54 Favored 'General case' 0 C--N 1.326 -0.427 0 CA-C-N 115.448 -0.797 . . . . 0.0 109.761 179.002 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 159' ' ' ILE . . . . . . . . . . . . . 4.4 mp -123.74 141.56 43.56 Favored 'Isoleucine or valine' 0 N--CA 1.438 -1.025 0 N-CA-C 108.326 -0.99 . . . . 0.0 108.326 -170.39 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 160' ' ' ALA . . . . . . . . . . . . . . . -58.44 114.96 2.69 Favored 'General case' 0 C--N 1.305 -1.331 0 CA-C-N 115.582 -0.736 . . . . 0.0 110.642 175.226 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 161' ' ' LEU . . . . . . . . . . . . . 80.7 mt -90.79 -137.34 0.14 Allowed 'General case' 0 C--N 1.322 -0.59 0 CA-C-N 115.792 -0.64 . . . . 0.0 109.846 -177.627 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 162' ' ' GLU . . . . . . . . . . . . . 28.4 mt-10 73.17 11.97 4.99 Favored 'General case' 0 C--O 1.234 0.268 0 CA-C-O 121.095 0.474 . . . . 0.0 111.053 175.202 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 163' ' ' HIS . . . . . . . . . . . . . 51.9 t-80 -94.78 96.86 9.64 Favored 'General case' 0 C--N 1.323 -0.546 0 N-CA-C 108.42 -0.956 . . . . 0.0 108.42 174.837 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 164' ' ' HIS . . . . . . . . . . . . . 25.8 t60 -100.7 98.65 9.17 Favored 'General case' 0 C--N 1.321 -0.662 0 CA-C-N 115.954 -0.566 . . . . 0.0 111.527 -169.224 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 165' ' ' HIS . . . . . 0.414 ' O ' ' HB2' ' A' ' 166' ' ' HIS . 21.3 t60 66.72 -85.15 0.03 OUTLIER 'General case' 0 N--CA 1.468 0.433 0 O-C-N 123.691 0.62 . . . . 0.0 111.328 175.379 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 166' ' ' HIS . . . . . 0.414 ' HB2' ' O ' ' A' ' 165' ' ' HIS . 23.6 t-80 167.05 111.1 0.01 OUTLIER 'General case' 0 C--N 1.325 -0.499 0 N-CA-C 107.561 -1.274 . . . . 0.0 107.561 -175.525 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 167' ' ' HIS . . . . . . . . . . . . . 1.3 t-80 -71.79 105.61 3.83 Favored 'General case' 0 C--N 1.322 -0.61 0 CA-C-O 120.981 0.42 . . . . 0.0 111.187 -172.311 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 168' ' ' HIS . . . . . . . . . . . . . 46.2 t-80 . . . . . 0 C--N 1.318 -0.78 0 CA-C-O 118.218 -0.896 . . . . 0.0 109.154 176.694 . . . . . . . . 0 0 . 1 . 008 nuclear build full ' A' A ' 61' ' ' ARG . . . . . . . . . . . . . 85.9 mtt180 . . . . . 0 N--CA 1.481 1.108 0 CA-C-O 121.196 0.522 . . . . 0.0 109.796 . . . . . . . . . 0 0 . 1 . 008 nuclear build full ' A' A ' 62' ' ' ASP . . . . . . . . . . . . . 2.5 p-10 -69.83 128.58 36.9 Favored 'General case' 0 C--N 1.325 -0.472 0 CA-C-N 115.49 -0.777 . . . . 0.0 110.87 178.535 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 63' ' ' SER . . . . . . . . . . . . . 72.4 p -110.64 -179.14 3.67 Favored 'General case' 0 C--N 1.317 -0.814 0 CA-C-N 115.627 -0.715 . . . . 0.0 109.565 176.975 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 64' ' ' PHE . . . . . 0.491 ' HB2' HD11 ' A' ' 107' ' ' ILE . 87.1 t80 -60.25 -35.71 76.12 Favored 'General case' 0 C--N 1.329 -0.299 0 N-CA-C 109.896 -0.409 . . . . 0.0 109.896 176.642 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 65' ' ' GLY . . . . . . . . . . . . . . . -62.01 -39.32 97.42 Favored Glycine 0 N--CA 1.452 -0.267 0 C-N-CA 121.13 -0.557 . . . . 0.0 112.106 176.964 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 66' ' ' ASP . . . . . 0.401 ' O ' ' HG3' ' A' ' 70' ' ' LYS . 8.6 m-20 -63.39 -52.08 63.14 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-O 120.908 0.385 . . . . 0.0 110.445 177.958 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 67' ' ' TRP . . . . . . . . . . . . . 95.9 m95 -67.19 -35.3 79.33 Favored 'General case' 0 C--N 1.326 -0.433 0 CA-C-N 115.921 -0.582 . . . . 0.0 111.37 -178.011 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 68' ' ' ALA . . . . . 0.671 ' O ' ' HG ' ' A' ' 72' ' ' LEU . . . -61.07 -51.09 70.62 Favored 'General case' 0 C--N 1.326 -0.449 0 N-CA-C 110.065 -0.346 . . . . 0.0 110.065 175.806 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 69' ' ' GLU . . . . . . . . . . . . . 11.9 tp10 -61.29 -37.86 84.72 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.099 -0.5 . . . . 0.0 110.665 -179.379 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 70' ' ' LYS . . . . . 0.401 ' HG3' ' O ' ' A' ' 66' ' ' ASP . 57.2 mtpt -66.57 -45.8 78.11 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.465 -0.334 . . . . 0.0 110.79 176.956 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 71' ' ' PHE . . . . . . . . . . . . . 89.9 t80 -61.77 -42.29 98.79 Favored 'General case' 0 C--N 1.327 -0.381 0 CA-C-N 116.241 -0.436 . . . . 0.0 110.384 179.215 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 72' ' ' LEU . . . . . 0.671 ' HG ' ' O ' ' A' ' 68' ' ' ALA . 91.7 mt -62.82 -44.23 96.7 Favored 'General case' 0 C--N 1.326 -0.439 0 CA-C-N 115.978 -0.555 . . . . 0.0 110.751 178.335 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 73' ' ' LYS . . . . . . . . . . . . . 22.7 tptp -65.67 -37.16 85.72 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-O 121.137 0.494 . . . . 0.0 110.057 179.794 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 74' ' ' SER . . . . . . . . . . . . . 9.8 t -65.44 -44.57 86.88 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 115.688 -0.687 . . . . 0.0 110.183 177.766 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 75' ' ' LYS . . . . . . . . . . . . . 20.6 mmtt -68.17 -31.55 71.18 Favored 'General case' 0 C--N 1.331 -0.204 0 CA-C-N 116.371 -0.377 . . . . 0.0 110.983 178.796 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 76' ' ' GLU . . . . . . . . . . . . . 38.9 tt0 -57.64 -49.13 77.47 Favored 'General case' 0 C--N 1.324 -0.51 0 CA-C-N 115.92 -0.582 . . . . 0.0 110.097 174.947 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 77' ' ' ALA . . . . . . . . . . . . . . . -74.69 -29.13 61.11 Favored 'General case' 0 C--N 1.327 -0.382 0 CA-C-N 115.705 -0.68 . . . . 0.0 111.34 178.824 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 78' ' ' ASP . . . . . . . . . . . . . 19.8 t70 -55.34 -45.45 76.42 Favored 'General case' 0 N--CA 1.465 0.32 0 CA-C-N 116.098 -0.501 . . . . 0.0 110.564 177.058 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 79' ' ' GLY . . . . . . . . . . . . . . . 128.41 62.46 0.12 Allowed Glycine 0 N--CA 1.446 -0.697 0 C-N-CA 120.679 -0.772 . . . . 0.0 112.308 176.906 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 80' ' ' VAL . . . . . . . . . . . . . 34.4 m -115.66 155.17 17.02 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.589 0 CA-C-O 120.677 0.275 . . . . 0.0 110.562 177.403 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 81' ' ' SER . . . . . . . . . . . . . 31.0 t -65.06 153.75 39.82 Favored 'General case' 0 C--N 1.324 -0.532 0 CA-C-N 115.817 -0.629 . . . . 0.0 110.261 175.818 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 82' ' ' VAL . . . . . . . . . . . . . 10.2 p -60.03 -36.83 69.79 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.318 0 CA-C-O 120.818 0.342 . . . . 0.0 110.325 177.453 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 83' ' ' SER . . . . . . . . . . . . . 34.2 t -69.43 -34.48 74.51 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-O 121.185 0.517 . . . . 0.0 109.973 178.254 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 84' ' ' GLN . . . . . . . . . . . . . 55.5 tp60 -65.97 -40.63 91.41 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 115.825 -0.625 . . . . 0.0 109.852 178.23 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 85' ' ' LEU . . . . . 0.42 HD11 ' HB3' ' A' ' 72' ' ' LEU . 54.4 tp -70.41 -43.65 69.53 Favored 'General case' 0 C--N 1.326 -0.42 0 CA-C-N 115.987 -0.551 . . . . 0.0 110.831 178.229 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 86' ' ' ASN . . . . . . . . . . . . . 97.3 m-20 -60.45 -44.34 95.96 Favored 'General case' 0 C--N 1.332 -0.16 0 CA-C-N 116.437 -0.347 . . . . 0.0 110.922 179.498 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 87' ' ' SER . . . . . . . . . . . . . 8.4 p -61.58 -38.2 86.66 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.669 -0.241 . . . . 0.0 110.798 -179.735 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 88' ' ' TYR . . . . . 0.408 ' HA ' ' CD2' ' A' ' 91' ' ' TYR . 18.0 m-30 -57.89 -46.05 85.5 Favored 'General case' 0 C--O 1.231 0.1 0 CA-C-O 120.983 0.421 . . . . 0.0 110.32 173.81 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 89' ' ' LYS . . . . . 0.593 ' HA ' ' SG ' ' A' ' 92' ' ' CYS . 60.0 mttm -63.24 -38.1 89.85 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 115.681 -0.69 . . . . 0.0 110.872 179.264 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 90' ' ' ASN . . . . . . . . . . . . . 28.6 m-80 -60.02 -32.49 70.94 Favored 'General case' 0 C--N 1.327 -0.401 0 CA-C-O 120.753 0.311 . . . . 0.0 111.085 177.408 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 91' ' ' TYR . . . . . 0.408 ' CD2' ' HA ' ' A' ' 88' ' ' TYR . 21.1 m-85 -70.38 -52.6 21.27 Favored 'General case' 0 C--O 1.235 0.327 0 CA-C-O 120.735 0.302 . . . . 0.0 110.619 178.17 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 92' ' ' CYS . . . . . 0.704 ' HA ' ' HB2' ' A' ' 96' ' ' LEU . 21.2 p -75.79 -39.18 57.4 Favored 'General case' 0 C--N 1.33 -0.253 0 N-CA-C 112.256 0.465 . . . . 0.0 112.256 -172.903 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 93' ' ' ARG . . . . . . . . . . . . . 43.8 ttt-85 -69.87 -47.92 60.72 Favored 'General case' 0 C--N 1.324 -0.51 0 CA-C-O 120.866 0.365 . . . . 0.0 111.502 -176.902 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 94' ' ' ASN . . . . . . . . . . . . . 17.7 m120 -87.54 -57.63 2.88 Favored 'General case' 0 C--N 1.325 -0.469 0 N-CA-C 112.205 0.446 . . . . 0.0 112.205 -173.282 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 95' ' ' HIS . . . . . . . . . . . . . 8.5 m80 -86.46 -40.57 15.19 Favored 'General case' 0 C--N 1.327 -0.389 0 N-CA-C 113.263 0.838 . . . . 0.0 113.263 -173.292 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 96' ' ' LEU . . . . . 0.704 ' HB2' ' HA ' ' A' ' 92' ' ' CYS . 76.6 mt -87.0 21.45 2.3 Favored 'General case' 0 C--N 1.325 -0.459 0 C-N-CA 120.704 -0.398 . . . . 0.0 110.69 -179.276 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 97' ' ' SER . . . . . 0.565 ' OG ' ' HD3' ' A' ' 98' ' ' PRO . 1.8 p -55.65 -45.29 99.9 Favored Pre-proline 0 CA--C 1.54 0.56 0 N-CA-C 113.003 0.742 . . . . 0.0 113.003 -179.006 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 98' ' ' PRO . . . . . 0.565 ' HD3' ' OG ' ' A' ' 97' ' ' SER . 32.2 Cg_exo -58.28 -38.23 91.75 Favored 'Trans proline' 0 C--N 1.36 1.18 0 C-N-CA 121.581 1.521 . . . . 0.0 111.688 177.488 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 99' ' ' LEU . . . . . 0.576 HD22 HG23 ' A' ' 107' ' ' ILE . 34.9 mt -77.44 -34.34 54.57 Favored 'General case' 0 C--N 1.325 -0.459 0 CA-C-N 115.809 -0.632 . . . . 0.0 110.34 -178.055 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 100' ' ' TYR . . . . . . . . . . . . . 5.7 t80 -55.5 -30.55 60.86 Favored 'General case' 0 C--N 1.326 -0.436 0 CA-C-N 115.279 -0.873 . . . . 0.0 111.226 -175.922 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 101' ' ' MET . . . . . . . . . . . . . 21.6 mmt -100.69 4.2 42.99 Favored 'General case' 0 C--N 1.326 -0.438 0 CA-C-N 116.346 -0.388 . . . . 0.0 111.403 -177.044 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 102' ' ' LYS . . . . . 0.487 ' HG3' ' O ' ' A' ' 98' ' ' PRO . 99.0 mttt -107.39 160.88 15.3 Favored 'General case' 0 C--N 1.325 -0.49 0 CA-C-O 121.055 0.455 . . . . 0.0 111.193 -178.309 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 103' ' ' SER . . . . . 0.408 ' O ' HG13 ' A' ' 107' ' ' ILE . 27.9 t -88.55 162.51 16.35 Favored 'General case' 0 C--N 1.325 -0.48 0 CA-C-N 115.862 -0.608 . . . . 0.0 109.998 176.531 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 104' ' ' LEU . . . . . 0.412 ' HB3' HD12 ' A' ' 146' ' ' ILE . 67.0 mt -61.61 -29.72 70.23 Favored 'General case' 0 C--N 1.326 -0.421 0 CA-C-N 116.039 -0.528 . . . . 0.0 111.81 -174.646 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 105' ' ' SER . . . . . . . . . . . . . 19.9 p -84.84 -15.86 43.31 Favored 'General case' 0 C--N 1.325 -0.462 0 CA-C-N 116.38 -0.373 . . . . 0.0 111.332 -178.318 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 106' ' ' GLU . . . . . . . . . . . . . 47.5 mt-10 -94.97 -24.23 17.04 Favored 'General case' 0 C--N 1.327 -0.393 0 CA-C-O 121.09 0.471 . . . . 0.0 110.719 -176.319 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 107' ' ' ILE . . . . . 0.576 HG23 HD22 ' A' ' 99' ' ' LEU . 82.4 mt -71.2 113.97 8.55 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.58 0 CA-C-N 115.624 -0.716 . . . . 0.0 110.695 -179.917 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 108' ' ' LEU . . . . . . . . . . . . . 88.5 mt -96.49 147.74 33.41 Favored Pre-proline 0 C--N 1.321 -0.646 0 CA-C-N 115.573 -0.739 . . . . 0.0 110.434 -179.985 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 109' ' ' PRO . . . . . 0.745 ' HB3' ' HB3' ' A' ' 153' ' ' TYR . 15.8 Cg_endo -58.55 -35.73 98.28 Favored 'Trans proline' 0 C--N 1.343 0.24 0 C-N-CA 122.653 2.236 . . . . 0.0 112.068 178.514 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 110' ' ' ALA . . . . . . . . . . . . . . . -68.51 -31.45 70.71 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 116.041 -0.527 . . . . 0.0 110.892 179.829 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 111' ' ' ASP . . . . . . . . . . . . . 24.6 t70 -68.9 -46.98 66.96 Favored 'General case' 0 C--N 1.327 -0.396 0 CA-C-O 121.22 0.533 . . . . 0.0 109.631 179.534 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 112' ' ' ILE . . . . . . . . . . . . . 30.7 mt -62.34 -41.17 90.6 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.291 0 CA-C-N 115.633 -0.712 . . . . 0.0 109.926 175.505 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 113' ' ' GLN . . . . . . . . . . . . . 24.3 tp60 -57.09 -42.8 81.42 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-N 115.524 -0.762 . . . . 0.0 110.207 178.002 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 114' ' ' SER . . . . . . . . . . . . . 36.5 m -59.19 -38.79 80.71 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 115.971 -0.559 . . . . 0.0 110.778 179.342 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 115' ' ' ILE . . . . . . . . . . . . . 73.3 mt -64.08 -47.99 87.83 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.358 0 CA-C-N 116.238 -0.437 . . . . 0.0 110.759 176.938 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 116' ' ' ILE . . . . . . . . . . . . . 48.1 mm -59.99 -41.72 87.13 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.442 0 CA-C-O 121.001 0.429 . . . . 0.0 110.79 179.78 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 117' ' ' ASN . . . . . . . . . . . . . 9.2 m-20 -65.82 -38.96 90.32 Favored 'General case' 0 C--N 1.327 -0.408 0 CA-C-N 115.707 -0.679 . . . . 0.0 112.111 -177.321 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 118' ' ' GLU . . . . . . . . . . . . . 10.8 pt-20 -80.74 -22.09 40.55 Favored 'General case' 0 C--O 1.234 0.285 0 C-N-CA 120.973 -0.291 . . . . 0.0 111.649 -176.454 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 119' ' ' THR . . . . . 0.469 HG22 ' H ' ' A' ' 121' ' ' LEU . 86.9 m -68.0 112.76 5.18 Favored 'General case' 0 C--N 1.325 -0.459 0 CA-C-O 121.137 0.494 . . . . 0.0 110.788 -177.95 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 120' ' ' LYS . . . . . . . . . . . . . 21.5 ptmt -91.08 26.46 2.14 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 115.896 -0.593 . . . . 0.0 111.263 -177.236 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 121' ' ' LEU . . . . . 0.469 ' H ' HG22 ' A' ' 119' ' ' THR . 85.7 mt -90.28 173.4 8.16 Favored 'General case' 0 C--N 1.32 -0.712 0 N-CA-C 109.571 -0.529 . . . . 0.0 109.571 179.307 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 122' ' ' ALA . . . . . . . . . . . . . . . -61.29 151.25 32.44 Favored 'General case' 0 C--N 1.326 -0.439 0 CA-C-O 120.78 0.324 . . . . 0.0 111.125 -178.015 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 123' ' ' LYS . . . . . . . . . . . . . 85.9 tttt -57.26 -36.5 71.07 Favored 'General case' 0 C--N 1.327 -0.41 0 CA-C-N 115.999 -0.546 . . . . 0.0 111.215 -178.932 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 124' ' ' ASN . . . . . . . . . . . . . 31.3 p30 -64.87 -25.21 67.8 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-O 121.084 0.468 . . . . 0.0 111.092 177.38 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 125' ' ' THR . . . . . 0.453 ' O ' HG13 ' A' ' 129' ' ' ILE . 16.6 m -81.92 -36.99 27.48 Favored 'General case' 0 N--CA 1.45 -0.464 0 CA-C-N 116.061 -0.518 . . . . 0.0 109.814 178.681 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 126' ' ' LEU . . . . . . . . . . . . . 94.2 mt -58.79 -45.89 88.82 Favored 'General case' 0 C--N 1.33 -0.246 0 CA-C-N 116.002 -0.545 . . . . 0.0 109.622 174.083 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 127' ' ' LYS . . . . . . . . . . . . . 50.1 mttm -62.16 -35.08 77.72 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-N 115.382 -0.827 . . . . 0.0 111.219 176.785 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 128' ' ' ALA . . . . . . . . . . . . . . . -65.72 -47.8 74.11 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.367 -0.379 . . . . 0.0 110.806 178.554 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 129' ' ' ILE . . . . . 0.453 HG13 ' O ' ' A' ' 125' ' ' THR . 58.3 mt -62.02 -45.68 98.17 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.226 0 CA-C-N 116.289 -0.414 . . . . 0.0 109.92 178.032 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 130' ' ' ARG . . . . . . . . . . . . . 8.9 tpt85 -55.95 -54.27 46.74 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-N 115.512 -0.767 . . . . 0.0 111.19 177.057 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 131' ' ' ASN . . . . . . . . . . . . . 8.8 t30 -57.71 -47.41 82.47 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 116.478 -0.328 . . . . 0.0 111.289 -177.312 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 132' ' ' THR . . . . . 0.478 ' O ' HG13 ' A' ' 136' ' ' ILE . 30.8 m -57.77 -51.79 68.12 Favored 'General case' 0 C--N 1.324 -0.517 0 CA-C-N 115.971 -0.559 . . . . 0.0 110.855 -178.993 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 133' ' ' ALA . . . . . . . . . . . . . . . -61.96 -41.07 97.59 Favored 'General case' 0 C--N 1.331 -0.206 0 CA-C-N 116.183 -0.462 . . . . 0.0 111.103 -179.96 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 134' ' ' SER . . . . . 0.621 ' O ' ' HG3' ' A' ' 138' ' ' ARG . 50.0 m -58.24 -49.59 76.55 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.022 -0.536 . . . . 0.0 111.284 -178.327 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 135' ' ' GLN . . . . . . . . . . . . . 22.0 mt-30 -66.62 -32.25 73.46 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.517 -0.31 . . . . 0.0 111.205 -177.162 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 136' ' ' ILE . . . . . 0.478 HG13 ' O ' ' A' ' 132' ' ' THR . 82.9 mt -61.57 -47.11 94.89 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.231 0 CA-C-O 120.799 0.333 . . . . 0.0 110.518 177.155 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 137' ' ' PHE . . . . . 0.436 ' HZ ' HG21 ' A' ' 107' ' ' ILE . 54.3 m-85 -64.99 -39.74 93.93 Favored 'General case' 0 C--N 1.327 -0.401 0 CA-C-N 116.325 -0.398 . . . . 0.0 111.432 178.53 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 138' ' ' ARG . . . . . 0.621 ' HG3' ' O ' ' A' ' 134' ' ' SER . 41.0 mtp180 -67.67 -31.25 71.09 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-O 120.779 0.323 . . . . 0.0 110.409 -179.761 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 139' ' ' LEU . . . . . . . . . . . . . 60.8 tp -62.8 -40.73 98.27 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-O 121.245 0.545 . . . . 0.0 109.852 174.994 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 140' ' ' ALA . . . . . . . . . . . . . . . -64.34 -35.28 80.36 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-N 115.652 -0.704 . . . . 0.0 110.682 177.637 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 141' ' ' ILE . . . . . 0.544 ' HA ' ' O ' ' A' ' 146' ' ' ILE . 70.4 mt -63.3 -44.04 98.92 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.224 0 CA-C-O 120.858 0.361 . . . . 0.0 110.462 175.126 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 142' ' ' GLU . . . . . . . . . . . . . 19.1 mm-40 -67.57 -25.47 65.8 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.148 -0.478 . . . . 0.0 111.538 179.796 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 143' ' ' ASN . . . . . . . . . . . . . 4.6 m-20 -94.12 5.04 52.99 Favored 'General case' 0 C--N 1.323 -0.58 0 CA-C-N 116.278 -0.419 . . . . 0.0 110.446 176.423 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 144' ' ' ARG . . . . . . . . . . . . . 57.5 mtp85 64.62 25.22 13.1 Favored 'General case' 0 N--CA 1.465 0.313 0 CA-C-N 115.517 -0.765 . . . . 0.0 112.787 174.001 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 145' ' ' ALA . . . . . . . . . . . . . . . -83.43 -27.52 29.48 Favored 'General case' 0 C--N 1.325 -0.46 0 CA-C-O 121.294 0.569 . . . . 0.0 109.993 176.384 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 146' ' ' ILE . . . . . 0.544 ' O ' ' HA ' ' A' ' 141' ' ' ILE . 18.1 tt -145.91 154.56 13.05 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.461 0 CA-C-N 115.653 -0.703 . . . . 0.0 109.185 178.728 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 147' ' ' ASP . . . . . . . . . . . . . 4.9 p-10 -103.44 -5.2 23.11 Favored 'General case' 0 N--CA 1.467 0.393 0 N-CA-C 111.963 0.357 . . . . 0.0 111.963 -174.455 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 148' ' ' PHE . . . . . 0.423 ' H ' HG12 ' A' ' 146' ' ' ILE . 76.2 t80 -155.66 145.23 21.11 Favored 'General case' 0 C--N 1.324 -0.513 0 N-CA-C 110.166 -0.309 . . . . 0.0 110.166 -176.7 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 149' ' ' ASN . . . . . 0.415 ' HA ' ' HD2' ' A' ' 150' ' ' PRO . 20.0 p-10 -107.28 112.27 62.87 Favored Pre-proline 0 C--N 1.323 -0.563 0 CA-C-O 121.053 0.454 . . . . 0.0 110.943 178.99 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 150' ' ' PRO . . . . . 0.415 ' HD2' ' HA ' ' A' ' 149' ' ' ASN . 35.6 Cg_endo -65.34 -11.0 28.17 Favored 'Trans proline' 0 N--CA 1.473 0.323 0 C-N-CA 122.969 2.446 . . . . 0.0 112.291 179.31 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 151' ' ' ALA . . . . . . . . . . . . . . . -67.5 -31.85 72.26 Favored 'General case' 0 C--N 1.327 -0.387 0 CA-C-N 115.968 -0.56 . . . . 0.0 110.775 178.088 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 152' ' ' ASP . . . . . . . . . . . . . 25.9 t70 -72.91 -15.77 61.57 Favored 'General case' 0 N--CA 1.464 0.262 0 CA-C-O 121.589 0.709 . . . . 0.0 110.04 179.594 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 153' ' ' TYR . . . . . 0.745 ' HB3' ' HB3' ' A' ' 109' ' ' PRO . 3.1 t80 -84.26 -20.82 31.56 Favored 'General case' 0 C--N 1.325 -0.48 0 CA-C-N 115.234 -0.894 . . . . 0.0 109.458 179.444 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 154' ' ' VAL . . . . . . . . . . . . . 59.1 t -72.85 129.54 35.92 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.423 0 CA-C-N 115.726 -0.67 . . . . 0.0 110.812 -178.768 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 155' ' ' ARG . . . . . 0.406 ' HE ' ' HB2' ' A' ' 155' ' ' ARG . 59.2 mtm180 -86.6 146.99 26.12 Favored 'General case' 0 C--N 1.324 -0.538 0 CA-C-N 116.218 -0.446 . . . . 0.0 110.675 -178.3 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 156' ' ' ILE . . . . . . . . . . . . . 37.8 mm -108.36 113.49 60.27 Favored Pre-proline 0 C--N 1.317 -0.823 0 CA-C-N 115.669 -0.696 . . . . 0.0 109.517 172.754 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 157' ' ' PRO . . . . . . . . . . . . . 51.1 Cg_exo -54.47 130.35 39.58 Favored 'Trans proline' 0 C--N 1.344 0.325 0 C-N-CA 122.542 2.162 . . . . 0.0 111.62 -179.982 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 158' ' ' LYS . . . . . . . . . . . . . 51.2 mttp -94.25 -47.89 6.42 Favored 'General case' 0 C--N 1.319 -0.742 0 CA-C-N 115.906 -0.588 . . . . 0.0 109.42 -176.434 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 159' ' ' ILE . . . . . . . . . . . . . 51.8 mm 71.48 -59.22 0.28 Allowed 'Isoleucine or valine' 0 N--CA 1.465 0.309 0 O-C-N 124.223 0.952 . . . . 0.0 111.883 173.887 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 160' ' ' ALA . . . . . . . . . . . . . . . -70.47 107.09 3.67 Favored 'General case' 0 C--N 1.323 -0.55 0 CA-C-N 116.433 -0.349 . . . . 0.0 111.021 -178.239 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 161' ' ' LEU . . . . . . . . . . . . . 69.1 mt 60.11 31.7 20.67 Favored 'General case' 0 C--O 1.233 0.229 0 CA-C-N 115.718 -0.674 . . . . 0.0 111.102 178.715 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 162' ' ' GLU . . . . . . . . . . . . . 32.8 tt0 -77.6 91.26 3.98 Favored 'General case' 0 C--N 1.324 -0.514 0 N-CA-C 109.744 -0.465 . . . . 0.0 109.744 178.418 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 163' ' ' HIS . . . . . . . . . . . . . 97.1 m-70 -92.75 126.58 37.9 Favored 'General case' 0 C--N 1.322 -0.6 0 CA-C-N 116.219 -0.446 . . . . 0.0 110.07 -178.374 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 164' ' ' HIS . . . . . . . . . . . . . 36.0 m80 -88.31 -51.25 5.85 Favored 'General case' 0 C--N 1.322 -0.598 0 N-CA-C 109.533 -0.543 . . . . 0.0 109.533 -179.895 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 165' ' ' HIS . . . . . . . . . . . . . 48.8 t-80 65.67 8.87 5.49 Favored 'General case' 0 N--CA 1.471 0.597 0 N-CA-C 112.445 0.535 . . . . 0.0 112.445 166.787 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 166' ' ' HIS . . . . . . . . . . . . . 66.4 m80 59.6 88.87 0.07 Allowed 'General case' 0 C--O 1.234 0.279 0 CA-C-O 121.506 0.67 . . . . 0.0 110.337 -172.324 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 167' ' ' HIS . . . . . . . . . . . . . 27.1 t-80 -80.15 118.47 21.87 Favored 'General case' 0 C--N 1.321 -0.65 0 CA-C-N 115.237 -0.892 . . . . 0.0 111.063 -175.822 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 168' ' ' HIS . . . . . . . . . . . . . 64.3 m-70 . . . . . 0 C--O 1.245 0.823 0 CA-C-O 118.305 -0.855 . . . . 0.0 110.172 177.493 . . . . . . . . 0 0 . 1 . 009 nuclear build full ' A' A ' 61' ' ' ARG . . . . . . . . . . . . . 87.9 mtt180 . . . . . 0 N--CA 1.478 0.962 0 N-CA-C 109.802 -0.444 . . . . 0.0 109.802 . . . . . . . . . 0 0 . 1 . 009 nuclear build full ' A' A ' 62' ' ' ASP . . . . . 0.815 ' HA ' ' HE1' ' A' ' 67' ' ' TRP . 37.0 m-20 65.6 22.48 11.72 Favored 'General case' 0 N--CA 1.47 0.531 0 CA-C-N 115.94 -0.573 . . . . 0.0 110.916 -179.934 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 63' ' ' SER . . . . . 0.55 ' HA ' ' HA ' ' A' ' 103' ' ' SER . 1.3 m -95.43 152.25 18.57 Favored 'General case' 0 C--N 1.32 -0.695 0 N-CA-C 109.366 -0.605 . . . . 0.0 109.366 179.772 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 64' ' ' PHE . . . . . 0.583 ' HB2' HD11 ' A' ' 107' ' ' ILE . 56.0 t80 -63.44 -44.58 94.15 Favored 'General case' 0 C--N 1.324 -0.504 0 C-N-CA 120.959 -0.297 . . . . 0.0 110.434 -179.319 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 65' ' ' GLY . . . . . . . . . . . . . . . -65.35 -29.76 76.02 Favored Glycine 0 C--N 1.331 0.289 0 C-N-CA 120.845 -0.693 . . . . 0.0 112.062 177.654 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 66' ' ' ASP . . . . . . . . . . . . . 12.2 t0 -65.89 -54.16 30.21 Favored 'General case' 0 C--O 1.24 0.579 0 CA-C-O 121.475 0.655 . . . . 0.0 110.209 177.91 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 67' ' ' TRP . . . . . 0.815 ' HE1' ' HA ' ' A' ' 62' ' ' ASP . 96.3 m95 -70.62 -23.78 62.61 Favored 'General case' 0 C--N 1.325 -0.463 0 CA-C-N 115.802 -0.635 . . . . 0.0 110.91 178.162 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 68' ' ' ALA . . . . . . . . . . . . . . . -62.61 -48.81 77.77 Favored 'General case' 0 C--O 1.225 -0.208 0 CA-C-N 116.406 -0.361 . . . . 0.0 110.671 176.419 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 69' ' ' GLU . . . . . . . . . . . . . 43.6 tt0 -59.05 -44.57 91.82 Favored 'General case' 0 C--O 1.234 0.281 0 C-N-CA 120.856 -0.338 . . . . 0.0 110.114 177.382 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 70' ' ' LYS . . . . . . . . . . . . . 24.5 ttmm -58.91 -43.02 91.0 Favored 'General case' 0 CA--C 1.535 0.399 0 CA-C-N 116.105 -0.498 . . . . 0.0 110.955 179.151 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 71' ' ' PHE . . . . . . . . . . . . . 82.3 t80 -72.11 -44.56 62.99 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-O 120.88 0.371 . . . . 0.0 111.332 -179.626 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 72' ' ' LEU . . . . . 0.505 HD23 ' HG2' ' A' ' 89' ' ' LYS . 7.3 mp -61.38 -39.44 90.67 Favored 'General case' 0 C--N 1.325 -0.472 0 CA-C-N 116.332 -0.395 . . . . 0.0 111.32 -178.297 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 73' ' ' LYS . . . . . 0.486 ' O ' ' HB3' ' A' ' 76' ' ' GLU . 57.3 tttp -77.21 -33.32 56.27 Favored 'General case' 0 C--N 1.326 -0.429 0 C-N-CA 120.644 -0.422 . . . . 0.0 111.416 -178.403 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 74' ' ' SER . . . . . . . . . . . . . 12.3 p -68.76 -29.34 67.71 Favored 'General case' 0 C--N 1.324 -0.513 0 C-N-CA 120.268 -0.573 . . . . 0.0 109.847 176.679 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 75' ' ' LYS . . . . . 0.517 ' O ' HG22 ' A' ' 80' ' ' VAL . 43.3 mmtt -77.39 -34.73 54.84 Favored 'General case' 0 C--N 1.331 -0.217 0 CA-C-N 116.267 -0.424 . . . . 0.0 110.529 173.14 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 76' ' ' GLU . . . . . 0.486 ' HB3' ' O ' ' A' ' 73' ' ' LYS . 34.6 tt0 -51.75 -47.61 64.03 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 116.018 -0.537 . . . . 0.0 110.057 172.444 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 77' ' ' ALA . . . . . . . . . . . . . . . -84.56 -12.65 53.71 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 115.677 -0.692 . . . . 0.0 111.751 178.847 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 78' ' ' ASP . . . . . . . . . . . . . 29.5 t70 -65.99 -35.85 81.7 Favored 'General case' 0 N--CA 1.467 0.386 0 CA-C-O 120.876 0.369 . . . . 0.0 110.473 178.773 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 79' ' ' GLY . . . . . . . . . . . . . . . 133.76 2.07 3.61 Favored Glycine 0 N--CA 1.447 -0.567 0 C-N-CA 120.073 -1.06 . . . . 0.0 113.447 176.047 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 80' ' ' VAL . . . . . 0.517 HG22 ' O ' ' A' ' 75' ' ' LYS . 28.4 m -70.15 136.96 25.0 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.339 0 CA-C-N 117.324 0.562 . . . . 0.0 110.377 179.499 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 81' ' ' SER . . . . . . . . . . . . . 23.3 t -72.62 164.7 26.07 Favored 'General case' 0 C--N 1.322 -0.607 0 CA-C-O 121.147 0.498 . . . . 0.0 110.224 179.947 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 82' ' ' VAL . . . . . . . . . . . . . 28.8 m -57.08 -29.69 32.35 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.609 0 CA-C-N 115.305 -0.861 . . . . 0.0 111.7 -177.177 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 83' ' ' SER . . . . . . . . . . . . . 5.9 p -62.71 -48.01 81.13 Favored 'General case' 0 C--N 1.326 -0.432 0 CA-C-O 121.173 0.511 . . . . 0.0 110.701 177.337 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 84' ' ' GLN . . . . . . . . . . . . . 6.8 tp-100 -73.83 -37.13 64.94 Favored 'General case' 0 C--N 1.325 -0.484 0 CA-C-N 115.793 -0.64 . . . . 0.0 110.074 -179.954 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 85' ' ' LEU . . . . . . . . . . . . . 43.5 tp -62.49 -44.79 95.54 Favored 'General case' 0 C--N 1.326 -0.442 0 CA-C-N 115.836 -0.62 . . . . 0.0 110.655 178.734 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 86' ' ' ASN . . . . . . . . . . . . . 83.5 m-20 -61.52 -37.02 82.18 Favored 'General case' 0 CA--C 1.519 -0.214 0 CA-C-N 116.487 -0.324 . . . . 0.0 110.377 176.265 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 87' ' ' SER . . . . . . . . . . . . . 27.2 t -56.1 -49.34 74.14 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 116.176 -0.466 . . . . 0.0 110.284 178.753 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 88' ' ' TYR . . . . . . . . . . . . . 32.3 m-85 -58.47 -41.28 84.85 Favored 'General case' 0 C--O 1.233 0.188 0 CA-C-O 120.87 0.366 . . . . 0.0 110.895 178.908 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 89' ' ' LYS . . . . . 0.566 ' HA ' ' SG ' ' A' ' 92' ' ' CYS . 85.1 mttt -70.76 -31.65 68.53 Favored 'General case' 0 C--N 1.327 -0.386 0 CA-C-N 116.197 -0.456 . . . . 0.0 111.294 -177.675 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 90' ' ' ASN . . . . . . . . . . . . . 27.6 m-80 -64.55 -36.17 83.36 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-O 120.97 0.414 . . . . 0.0 110.384 175.61 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 91' ' ' TYR . . . . . . . . . . . . . 42.4 m-85 -67.01 -48.9 66.97 Favored 'General case' 0 C--N 1.326 -0.415 0 CA-C-N 116.279 -0.419 . . . . 0.0 111.306 179.43 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 92' ' ' CYS . . . . . 0.611 ' HA ' ' HB2' ' A' ' 96' ' ' LEU . 26.1 p -72.56 -32.99 66.49 Favored 'General case' 0 C--N 1.331 -0.238 0 N-CA-C 111.849 0.315 . . . . 0.0 111.849 -175.63 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 93' ' ' ARG . . . . . . . . . . . . . 99.7 mtt180 -78.53 -38.99 39.23 Favored 'General case' 0 C--N 1.328 -0.365 0 N-CA-C 112.022 0.378 . . . . 0.0 112.022 -178.358 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 94' ' ' ASN . . . . . . . . . . . . . 17.4 m120 -99.62 -60.4 1.54 Allowed 'General case' 0 C--N 1.327 -0.384 0 N-CA-C 112.539 0.57 . . . . 0.0 112.539 -175.19 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 95' ' ' HIS . . . . . . . . . . . . . 6.1 m80 -78.79 -47.73 16.17 Favored 'General case' 0 C--N 1.325 -0.463 0 N-CA-C 112.502 0.556 . . . . 0.0 112.502 -172.4 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 96' ' ' LEU . . . . . 0.611 ' HB2' ' HA ' ' A' ' 92' ' ' CYS . 86.6 mt -91.59 21.53 4.6 Favored 'General case' 0 C--N 1.32 -0.698 0 CA-C-N 116.718 -0.219 . . . . 0.0 111.188 -175.386 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 97' ' ' SER . . . . . 0.525 ' N ' ' HD2' ' A' ' 98' ' ' PRO . 3.1 p -59.94 -43.22 94.06 Favored Pre-proline 0 CA--C 1.544 0.739 0 N-CA-C 112.667 0.617 . . . . 0.0 112.667 -179.719 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 98' ' ' PRO . . . . . 0.525 ' HD2' ' N ' ' A' ' 97' ' ' SER . 22.9 Cg_endo -63.41 -32.03 71.97 Favored 'Trans proline' 0 C--N 1.362 1.241 0 C-N-CA 121.59 1.527 . . . . 0.0 112.195 175.951 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 99' ' ' LEU . . . . . 0.65 ' HA ' ' HD2' ' A' ' 102' ' ' LYS . 10.8 mp -80.1 -31.45 39.2 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.407 -0.36 . . . . 0.0 110.51 179.682 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 100' ' ' TYR . . . . . . . . . . . . . 36.1 t80 -54.39 -34.63 61.66 Favored 'General case' 0 C--N 1.327 -0.374 0 CA-C-N 115.673 -0.694 . . . . 0.0 111.193 -178.258 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 101' ' ' MET . . . . . . . . . . . . . 22.5 mmt -91.83 -4.29 55.04 Favored 'General case' 0 C--N 1.331 -0.228 0 CA-C-N 115.791 -0.64 . . . . 0.0 111.06 -176.661 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 102' ' ' LYS . . . . . 0.65 ' HD2' ' HA ' ' A' ' 99' ' ' LEU . 51.8 mttm -87.93 150.01 23.73 Favored 'General case' 0 C--N 1.323 -0.566 0 CA-C-N 116.132 -0.485 . . . . 0.0 110.71 179.662 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 103' ' ' SER . . . . . 0.55 ' HA ' ' HA ' ' A' ' 63' ' ' SER . 8.7 m -82.52 162.98 21.83 Favored 'General case' 0 C--N 1.322 -0.597 0 N-CA-C 107.972 -1.121 . . . . 0.0 107.972 167.622 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 104' ' ' LEU . . . . . . . . . . . . . 95.2 mt -52.54 -39.31 61.28 Favored 'General case' 0 C--N 1.324 -0.535 0 N-CA-C 111.983 0.364 . . . . 0.0 111.983 -177.53 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 105' ' ' SER . . . . . . . . . . . . . 9.0 m -83.65 0.24 47.76 Favored 'General case' 0 C--N 1.326 -0.446 0 N-CA-C 111.933 0.345 . . . . 0.0 111.933 -177.641 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 106' ' ' GLU . . . . . . . . . . . . . 44.9 mt-10 -102.92 -3.24 26.44 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-O 121.026 0.441 . . . . 0.0 110.253 178.4 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 107' ' ' ILE . . . . . 0.606 HG21 ' HZ ' ' A' ' 137' ' ' PHE . 62.0 mt -94.13 112.57 27.15 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.645 0 CA-C-N 115.998 -0.547 . . . . 0.0 110.5 -177.741 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 108' ' ' LEU . . . . . . . . . . . . . 64.5 mt -96.09 146.15 30.81 Favored Pre-proline 0 C--N 1.318 -0.769 0 CA-C-N 115.887 -0.597 . . . . 0.0 110.004 179.856 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 109' ' ' PRO . . . . . . . . . . . . . 42.0 Cg_exo -57.91 -28.39 82.56 Favored 'Trans proline' 0 N--CA 1.464 -0.245 0 C-N-CA 122.317 2.011 . . . . 0.0 111.33 175.437 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 110' ' ' ALA . . . . . . . . . . . . . . . -65.6 -34.73 78.92 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-N 115.724 -0.671 . . . . 0.0 110.983 177.083 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 111' ' ' ASP . . . . . 0.455 ' O ' HG13 ' A' ' 115' ' ' ILE . 70.6 m-20 -61.6 -46.24 90.68 Favored 'General case' 0 CA--C 1.516 -0.354 0 CA-C-O 121.027 0.441 . . . . 0.0 109.814 178.864 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 112' ' ' ILE . . . . . 0.542 ' O ' HG12 ' A' ' 116' ' ' ILE . 46.0 mt -69.73 -45.16 78.3 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.585 0 CA-C-N 115.892 -0.595 . . . . 0.0 110.293 179.67 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 113' ' ' GLN . . . . . . . . . . . . . 54.9 tp60 -57.81 -43.45 85.71 Favored 'General case' 0 C--N 1.332 -0.18 0 CA-C-N 116.374 -0.376 . . . . 0.0 111.143 179.721 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 114' ' ' SER . . . . . 0.504 ' O ' ' HG2' ' A' ' 118' ' ' GLU . 13.5 p -66.33 -37.56 85.64 Favored 'General case' 0 C--N 1.327 -0.399 0 C-N-CA 120.903 -0.319 . . . . 0.0 110.814 -179.906 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 115' ' ' ILE . . . . . 0.455 HG13 ' O ' ' A' ' 111' ' ' ASP . 69.0 mt -63.47 -41.92 94.39 Favored 'Isoleucine or valine' 0 N--CA 1.465 0.288 0 CA-C-O 120.731 0.301 . . . . 0.0 110.548 176.184 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 116' ' ' ILE . . . . . 0.542 HG12 ' O ' ' A' ' 112' ' ' ILE . 50.0 mm -65.01 -26.33 39.76 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.323 0 CA-C-O 121.307 0.575 . . . . 0.0 110.439 178.005 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 117' ' ' ASN . . . . . . . . . . . . . 8.8 t30 -86.63 -37.17 18.31 Favored 'General case' 0 C--N 1.325 -0.499 0 CA-C-N 115.759 -0.655 . . . . 0.0 111.435 -179.916 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 118' ' ' GLU . . . . . 0.504 ' HG2' ' O ' ' A' ' 114' ' ' SER . 33.9 mm-40 -79.78 -29.21 40.31 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-N 116.514 -0.312 . . . . 0.0 111.388 -176.212 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 119' ' ' THR . . . . . 0.492 ' HB ' HD21 ' A' ' 126' ' ' LEU . 62.0 m -76.03 111.31 11.3 Favored 'General case' 0 C--N 1.323 -0.573 0 CA-C-O 121.415 0.626 . . . . 0.0 109.752 176.83 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 120' ' ' LYS . . . . . . . . . . . . . 45.4 mtmt -96.11 31.59 2.13 Favored 'General case' 0 C--N 1.322 -0.599 0 CA-C-N 115.499 -0.773 . . . . 0.0 110.766 -174.157 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 121' ' ' LEU . . . . . 0.428 HD13 HG23 ' A' ' 119' ' ' THR . 11.2 mp -90.09 -174.93 4.39 Favored 'General case' 0 C--N 1.321 -0.641 0 CA-C-N 115.296 -0.865 . . . . 0.0 110.235 178.11 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 122' ' ' ALA . . . . . . . . . . . . . . . -62.33 152.62 33.31 Favored 'General case' 0 C--N 1.326 -0.439 0 CA-C-N 115.955 -0.566 . . . . 0.0 111.581 -177.301 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 123' ' ' LYS . . . . . 0.78 ' HE3' ' HA ' ' A' ' 123' ' ' LYS . 1.0 OUTLIER -56.88 -39.65 74.75 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 115.508 -0.769 . . . . 0.0 110.791 -177.784 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 124' ' ' ASN . . . . . . . . . . . . . 17.7 m120 -55.85 -47.33 77.47 Favored 'General case' 0 C--N 1.331 -0.217 0 CA-C-N 116.056 -0.52 . . . . 0.0 111.156 179.594 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 125' ' ' THR . . . . . 0.56 ' O ' HG13 ' A' ' 129' ' ' ILE . 19.0 m -59.41 -44.94 92.75 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.054 -0.521 . . . . 0.0 110.715 -178.955 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 126' ' ' LEU . . . . . 0.492 HD21 ' HB ' ' A' ' 119' ' ' THR . 97.5 mt -61.53 -41.68 97.7 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 115.932 -0.576 . . . . 0.0 111.033 179.553 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 127' ' ' LYS . . . . . 0.458 ' HG3' ' O ' ' A' ' 123' ' ' LYS . 51.5 mtpt -66.35 -37.53 85.53 Favored 'General case' 0 C--N 1.326 -0.437 0 CA-C-N 115.872 -0.604 . . . . 0.0 110.359 179.626 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 128' ' ' ALA . . . . . . . . . . . . . . . -67.3 -36.14 80.91 Favored 'General case' 0 C--N 1.326 -0.428 0 CA-C-N 116.055 -0.52 . . . . 0.0 111.149 179.442 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 129' ' ' ILE . . . . . 0.56 HG13 ' O ' ' A' ' 125' ' ' THR . 80.2 mt -58.86 -51.96 66.04 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.277 0 CA-C-O 120.851 0.358 . . . . 0.0 110.432 177.355 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 130' ' ' ARG . . . . . 0.408 HH11 ' HD3' ' A' ' 130' ' ' ARG . 39.8 ttt-85 -62.94 -44.07 97.07 Favored 'General case' 0 C--N 1.331 -0.203 0 CA-C-N 116.045 -0.525 . . . . 0.0 110.602 178.606 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 131' ' ' ASN . . . . . . . . . . . . . 47.5 t30 -57.5 -47.0 83.1 Favored 'General case' 0 N--CA 1.465 0.278 0 CA-C-N 116.111 -0.495 . . . . 0.0 111.277 -179.297 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 132' ' ' THR . . . . . . . . . . . . . 34.6 m -61.31 -49.17 78.11 Favored 'General case' 0 C--N 1.326 -0.413 0 CA-C-N 116.34 -0.391 . . . . 0.0 110.816 -179.748 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 133' ' ' ALA . . . . . . . . . . . . . . . -62.75 -41.72 99.34 Favored 'General case' 0 C--N 1.331 -0.211 0 CA-C-N 116.274 -0.421 . . . . 0.0 111.126 -179.173 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 134' ' ' SER . . . . . . . . . . . . . 32.7 t -60.04 -42.41 94.39 Favored 'General case' 0 C--N 1.327 -0.402 0 CA-C-N 116.182 -0.463 . . . . 0.0 110.993 -178.189 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 135' ' ' GLN . . . . . . . . . . . . . 49.8 mt-30 -65.13 -35.68 81.89 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-N 116.382 -0.372 . . . . 0.0 110.709 179.953 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 136' ' ' ILE . . . . . . . . . . . . . 74.4 mt -65.32 -44.37 94.8 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.272 0 CA-C-N 116.338 -0.392 . . . . 0.0 110.44 177.143 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 137' ' ' PHE . . . . . 0.606 ' HZ ' HG21 ' A' ' 107' ' ' ILE . 50.1 m-85 -62.02 -39.47 92.38 Favored 'General case' 0 N--CA 1.461 0.119 0 CA-C-N 116.3 -0.409 . . . . 0.0 110.675 177.243 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 138' ' ' ARG . . . . . 0.599 ' O ' ' HG2' ' A' ' 142' ' ' GLU . 73.9 mtp180 -58.64 -44.8 90.16 Favored 'General case' 0 C--N 1.33 -0.242 0 CA-C-N 116.395 -0.366 . . . . 0.0 110.768 177.645 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 139' ' ' LEU . . . . . . . . . . . . . 53.9 tp -59.13 -36.93 76.05 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-O 121.061 0.457 . . . . 0.0 110.686 179.232 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 140' ' ' ALA . . . . . . . . . . . . . . . -67.97 -41.0 83.06 Favored 'General case' 0 C--N 1.326 -0.417 0 CA-C-N 116.096 -0.502 . . . . 0.0 110.515 176.792 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 141' ' ' ILE . . . . . 0.57 ' HA ' ' O ' ' A' ' 146' ' ' ILE . 72.2 mt -61.12 -44.33 98.09 Favored 'Isoleucine or valine' 0 C--O 1.234 0.239 0 CA-C-N 116.254 -0.43 . . . . 0.0 110.482 176.482 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 142' ' ' GLU . . . . . 0.599 ' HG2' ' O ' ' A' ' 138' ' ' ARG . 24.8 mm-40 -54.57 -43.99 72.54 Favored 'General case' 0 C--N 1.33 -0.241 0 CA-C-N 115.993 -0.549 . . . . 0.0 110.862 178.458 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 143' ' ' ASN . . . . . . . . . . . . . 42.5 m-80 -90.0 14.05 13.22 Favored 'General case' 0 C--N 1.325 -0.496 0 CA-C-N 115.695 -0.684 . . . . 0.0 111.558 -176.718 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 144' ' ' ARG . . . . . . . . . . . . . 92.6 mtt180 61.98 32.14 17.82 Favored 'General case' 0 N--CA 1.467 0.419 0 N-CA-C 112.144 0.424 . . . . 0.0 112.144 174.367 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 145' ' ' ALA . . . . . . . . . . . . . . . -89.8 -29.95 18.3 Favored 'General case' 0 C--N 1.324 -0.513 0 CA-C-O 121.219 0.533 . . . . 0.0 110.416 177.047 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 146' ' ' ILE . . . . . 0.57 ' O ' ' HA ' ' A' ' 141' ' ' ILE . 16.4 tt -147.32 155.94 10.58 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.69 0 N-CA-C 108.457 -0.942 . . . . 0.0 108.457 177.941 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 147' ' ' ASP . . . . . . . . . . . . . 16.9 t70 -122.34 18.72 10.61 Favored 'General case' 0 C--N 1.323 -0.57 0 CA-C-O 121.122 0.486 . . . . 0.0 111.569 -176.446 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 148' ' ' PHE . . . . . 0.428 ' H ' HG12 ' A' ' 146' ' ' ILE . 49.7 p90 -149.29 154.77 39.51 Favored 'General case' 0 C--N 1.321 -0.635 0 N-CA-C 110.147 -0.316 . . . . 0.0 110.147 176.797 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 149' ' ' ASN . . . . . . . . . . . . . 57.3 t-20 -118.72 96.84 50.42 Favored Pre-proline 0 C--N 1.324 -0.51 0 CA-C-N 116.271 -0.422 . . . . 0.0 110.427 -176.696 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 150' ' ' PRO . . . . . . . . . . . . . 31.9 Cg_exo -59.33 -33.63 97.72 Favored 'Trans proline' 0 C--N 1.342 0.188 0 C-N-CA 122.897 2.398 . . . . 0.0 111.939 179.312 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 151' ' ' ALA . . . . . 0.402 ' HA ' HG23 ' A' ' 154' ' ' VAL . . . -69.37 -32.06 70.86 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.12 -0.491 . . . . 0.0 110.68 -179.555 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 152' ' ' ASP . . . . . . . . . . . . . 30.6 t70 -70.84 -22.72 62.28 Favored 'General case' 0 C--N 1.326 -0.421 0 CA-C-O 121.226 0.536 . . . . 0.0 109.91 178.624 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 153' ' ' TYR . . . . . . . . . . . . . 75.5 t80 -82.85 -16.08 49.05 Favored 'General case' 0 C--N 1.324 -0.512 0 CA-C-N 115.518 -0.765 . . . . 0.0 110.213 -179.04 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 154' ' ' VAL . . . . . 0.402 HG23 ' HA ' ' A' ' 151' ' ' ALA . 24.2 t -68.98 132.44 33.04 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.304 0 CA-C-N 116.25 -0.432 . . . . 0.0 110.298 176.145 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 155' ' ' ARG . . . . . . . . . . . . . 17.3 tpp180 -109.41 119.49 39.62 Favored 'General case' 0 C--N 1.318 -0.79 0 N-CA-C 109.816 -0.438 . . . . 0.0 109.816 173.897 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 156' ' ' ILE . . . . . . . . . . . . . 33.1 mm -66.02 124.48 87.87 Favored Pre-proline 0 C--N 1.327 -0.396 0 CA-C-N 115.658 -0.701 . . . . 0.0 109.731 174.121 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 157' ' ' PRO . . . . . . . . . . . . . 14.7 Cg_exo -69.67 144.7 55.38 Favored 'Trans proline' 0 N--CA 1.455 -0.748 0 C-N-CA 121.92 1.747 . . . . 0.0 110.91 173.41 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 158' ' ' LYS . . . . . . . . . . . . . 75.5 mttt 76.29 -43.5 0.47 Allowed 'General case' 0 N--CA 1.467 0.41 0 C-N-CA 123.72 0.808 . . . . 0.0 111.398 176.821 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 159' ' ' ILE . . . . . . . . . . . . . 4.3 mp 69.97 -56.26 0.28 Allowed 'Isoleucine or valine' 0 N--CA 1.47 0.549 0 C-N-CA 123.463 0.705 . . . . 0.0 112.326 174.117 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 160' ' ' ALA . . . . . . . . . . . . . . . -77.09 164.66 25.5 Favored 'General case' 0 C--N 1.326 -0.43 0 CA-C-O 121.32 0.581 . . . . 0.0 111.979 -174.114 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 161' ' ' LEU . . . . . . . . . . . . . 1.2 pp -118.41 15.25 13.85 Favored 'General case' 0 C--N 1.327 -0.398 0 CA-C-N 115.468 -0.787 . . . . 0.0 111.23 -178.925 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 162' ' ' GLU . . . . . . . . . . . . . 34.5 tt0 -85.04 106.02 16.22 Favored 'General case' 0 C--N 1.327 -0.393 0 CA-C-O 120.988 0.423 . . . . 0.0 110.069 179.408 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 163' ' ' HIS . . . . . . . . . . . . . 57.0 t-80 -107.92 109.87 21.48 Favored 'General case' 0 C--N 1.322 -0.604 0 CA-C-O 121.078 0.466 . . . . 0.0 110.914 -179.041 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 164' ' ' HIS . . . . . . . . . . . . . 31.5 t-80 -125.77 -67.3 0.89 Allowed 'General case' 0 C--N 1.321 -0.635 0 N-CA-C 108.591 -0.892 . . . . 0.0 108.591 170.943 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 165' ' ' HIS . . . . . . . . . . . . . 5.1 t60 69.34 144.66 0.05 Allowed 'General case' 0 CA--C 1.531 0.249 0 O-C-N 124.269 0.981 . . . . 0.0 110.896 174.516 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 166' ' ' HIS . . . . . . . . . . . . . 53.4 t-80 -96.7 70.3 2.54 Favored 'General case' 0 C--N 1.322 -0.6 0 C-N-CA 120.224 -0.59 . . . . 0.0 110.833 -179.023 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 167' ' ' HIS . . . . . . . . . . . . . 11.5 m170 -144.33 77.99 1.56 Allowed 'General case' 0 C--N 1.324 -0.521 0 CA-C-N 115.772 -0.649 . . . . 0.0 109.31 170.395 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 168' ' ' HIS . . . . . . . . . . . . . 0.5 OUTLIER . . . . . 0 C--O 1.244 0.814 0 CA-C-N 114.823 -1.08 . . . . 0.0 108.908 -178.883 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 61' ' ' ARG . . . . . . . . . . . . . 48.1 mtt180 . . . . . 0 N--CA 1.481 1.1 0 N-CA-C 109.772 -0.455 . . . . 0.0 109.772 . . . . . . . . . 0 0 . 1 . 010 nuclear build full ' A' A ' 62' ' ' ASP . . . . . . . . . . . . . 0.7 OUTLIER -150.32 155.03 38.88 Favored 'General case' 0 C--N 1.322 -0.62 0 CA-C-O 121.502 0.668 . . . . 0.0 111.481 -178.518 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 63' ' ' SER . . . . . . . . . . . . . 29.1 t -118.69 161.21 20.47 Favored 'General case' 0 C--N 1.322 -0.603 0 CA-C-N 115.063 -0.971 . . . . 0.0 109.703 -177.658 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 64' ' ' PHE . . . . . 0.533 ' HB2' HD11 ' A' ' 107' ' ' ILE . 73.4 t80 -60.11 -30.04 69.0 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-O 120.76 0.314 . . . . 0.0 110.427 179.194 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 65' ' ' GLY . . . . . 0.461 ' HA2' ' CD1' ' A' ' 100' ' ' TYR . . . -61.11 -41.04 99.34 Favored Glycine 0 N--CA 1.449 -0.472 0 C-N-CA 121.08 -0.581 . . . . 0.0 112.217 176.675 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 66' ' ' ASP . . . . . 0.509 ' O ' ' HG2' ' A' ' 70' ' ' LYS . 33.9 t70 -66.69 -42.58 86.23 Favored 'General case' 0 C--N 1.325 -0.463 0 N-CA-C 109.767 -0.457 . . . . 0.0 109.767 178.185 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 67' ' ' TRP . . . . . . . . . . . . . 93.8 m95 -67.72 -27.82 67.13 Favored 'General case' 0 C--N 1.331 -0.23 0 CA-C-N 115.827 -0.624 . . . . 0.0 111.54 -179.961 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 68' ' ' ALA . . . . . 0.49 ' O ' ' HG ' ' A' ' 72' ' ' LEU . . . -62.22 -49.55 75.3 Favored 'General case' 0 C--N 1.328 -0.355 0 N-CA-C 109.779 -0.452 . . . . 0.0 109.779 174.291 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 69' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER -61.83 -37.64 85.19 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.087 -0.506 . . . . 0.0 110.65 175.262 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 70' ' ' LYS . . . . . 0.509 ' HG2' ' O ' ' A' ' 66' ' ' ASP . 27.0 mmmt -57.58 -52.09 66.83 Favored 'General case' 0 N--CA 1.464 0.254 0 CA-C-N 116.356 -0.384 . . . . 0.0 110.47 176.364 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 71' ' ' PHE . . . . . . . . . . . . . 92.0 t80 -62.12 -40.3 95.44 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 115.998 -0.546 . . . . 0.0 110.829 -179.669 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 72' ' ' LEU . . . . . 0.49 ' HG ' ' O ' ' A' ' 68' ' ' ALA . 79.5 mt -61.74 -51.65 67.48 Favored 'General case' 0 C--N 1.326 -0.456 0 CA-C-N 116.223 -0.444 . . . . 0.0 111.097 179.496 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 73' ' ' LYS . . . . . 0.454 ' HA ' ' HB3' ' A' ' 76' ' ' GLU . 55.0 tttp -71.44 -24.06 61.95 Favored 'General case' 0 C--N 1.326 -0.441 0 C-N-CA 120.216 -0.594 . . . . 0.0 110.59 -179.165 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 74' ' ' SER . . . . . . . . . . . . . 33.5 t -60.26 -45.47 93.19 Favored 'General case' 0 C--N 1.328 -0.358 0 N-CA-C 109.795 -0.446 . . . . 0.0 109.795 173.745 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 75' ' ' LYS . . . . . . . . . . . . . 27.5 mmtm -76.11 -30.35 58.2 Favored 'General case' 0 C--N 1.327 -0.399 0 CA-C-N 116.384 -0.371 . . . . 0.0 110.855 177.605 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 76' ' ' GLU . . . . . 0.454 ' HB3' ' HA ' ' A' ' 73' ' ' LYS . 2.7 tm-20 -58.08 -53.43 58.38 Favored 'General case' 0 C--N 1.327 -0.379 0 CA-C-N 116.092 -0.504 . . . . 0.0 109.722 173.969 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 77' ' ' ALA . . . . . . . . . . . . . . . -71.33 -27.04 63.09 Favored 'General case' 0 C--N 1.325 -0.473 0 CA-C-N 115.721 -0.672 . . . . 0.0 111.229 179.322 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 78' ' ' ASP . . . . . . . . . . . . . 17.4 t70 -64.08 -49.09 73.62 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.114 -0.494 . . . . 0.0 110.528 178.117 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 79' ' ' GLY . . . . . . . . . . . . . . . 131.32 55.15 0.09 OUTLIER Glycine 0 N--CA 1.448 -0.555 0 C-N-CA 120.633 -0.794 . . . . 0.0 112.975 177.084 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 80' ' ' VAL . . . . . 0.631 HG23 ' HG ' ' A' ' 85' ' ' LEU . 22.8 m -112.16 168.91 4.69 Favored 'Isoleucine or valine' 0 C--O 1.237 0.431 0 O-C-N 122.462 -0.434 . . . . 0.0 110.732 175.328 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 81' ' ' SER . . . . . . . . . . . . . 74.9 p -83.08 169.31 16.03 Favored 'General case' 0 C--N 1.322 -0.612 0 CA-C-N 115.929 -0.578 . . . . 0.0 110.944 -178.721 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 82' ' ' VAL . . . . . . . . . . . . . 94.3 t -64.33 -37.83 80.98 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.431 0 N-CA-C 109.379 -0.601 . . . . 0.0 109.379 173.817 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 83' ' ' SER . . . . . . . . . . . . . 13.6 t -60.38 -47.65 85.13 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 115.758 -0.655 . . . . 0.0 110.536 178.657 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 84' ' ' GLN . . . . . 0.412 ' HG3' ' CE2' ' A' ' 88' ' ' TYR . 6.7 tp-100 -63.71 -45.1 91.51 Favored 'General case' 0 C--N 1.332 -0.157 0 CA-C-N 116.369 -0.378 . . . . 0.0 110.396 179.704 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 85' ' ' LEU . . . . . 0.631 ' HG ' HG23 ' A' ' 80' ' ' VAL . 19.1 mt -62.46 -36.07 81.28 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.225 -0.443 . . . . 0.0 111.266 177.418 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 86' ' ' ASN . . . . . . . . . . . . . 53.7 t30 -72.77 -29.95 63.72 Favored 'General case' 0 C--N 1.322 -0.621 0 CA-C-N 115.837 -0.62 . . . . 0.0 109.856 -177.9 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 87' ' ' SER . . . . . 0.413 ' O ' ' HD1' ' A' ' 91' ' ' TYR . 42.4 t -64.27 -49.94 69.87 Favored 'General case' 0 N--CA 1.452 -0.363 0 CA-C-N 115.655 -0.702 . . . . 0.0 109.682 172.877 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 88' ' ' TYR . . . . . 0.412 ' CE2' ' HG3' ' A' ' 84' ' ' GLN . 25.7 m-85 -59.86 -38.72 82.95 Favored 'General case' 0 C--N 1.331 -0.234 0 CA-C-N 116.208 -0.451 . . . . 0.0 111.265 179.733 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 89' ' ' LYS . . . . . 0.467 ' HG3' ' O ' ' A' ' 85' ' ' LEU . 64.6 mttp -57.92 -44.58 86.94 Favored 'General case' 0 C--N 1.333 -0.115 0 CA-C-O 120.801 0.334 . . . . 0.0 110.89 177.625 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 90' ' ' ASN . . . . . . . . . . . . . 20.7 t-20 -64.49 -42.9 95.57 Favored 'General case' 0 C--N 1.325 -0.487 0 CA-C-N 116.038 -0.528 . . . . 0.0 111.048 -177.295 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 91' ' ' TYR . . . . . 0.413 ' HD1' ' O ' ' A' ' 87' ' ' SER . 11.8 m-85 -66.54 -46.65 75.41 Favored 'General case' 0 C--N 1.324 -0.524 0 N-CA-C 111.719 0.266 . . . . 0.0 111.719 -177.926 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 92' ' ' CYS . . . . . 0.499 ' HA ' HD12 ' A' ' 96' ' ' LEU . 24.5 p -75.98 -25.68 56.04 Favored 'General case' 0 C--N 1.327 -0.391 0 N-CA-C 111.883 0.327 . . . . 0.0 111.883 -175.122 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 93' ' ' ARG . . . . . 0.409 ' HB2' ' O ' ' A' ' 89' ' ' LYS . 51.3 mtt85 -98.12 -31.87 11.89 Favored 'General case' 0 C--N 1.325 -0.494 0 N-CA-C 112.912 0.708 . . . . 0.0 112.912 -176.116 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 94' ' ' ASN . . . . . . . . . . . . . 16.7 m120 -95.31 -45.26 7.22 Favored 'General case' 0 C--N 1.325 -0.469 0 C-N-CA 120.581 -0.448 . . . . 0.0 111.608 -179.285 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 95' ' ' HIS . . . . . . . . . . . . . 80.3 m80 -84.96 -44.46 13.09 Favored 'General case' 0 C--N 1.327 -0.39 0 CA-C-O 120.881 0.372 . . . . 0.0 110.501 -177.611 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 96' ' ' LEU . . . . . 0.499 HD12 ' HA ' ' A' ' 92' ' ' CYS . 79.8 mt -91.72 26.8 2.24 Favored 'General case' 0 C--N 1.324 -0.534 0 CA-C-N 116.107 -0.497 . . . . 0.0 110.061 179.854 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 97' ' ' SER . . . . . 0.585 ' OG ' ' HD3' ' A' ' 98' ' ' PRO . 1.4 p -54.43 -48.04 95.97 Favored Pre-proline 0 CA--C 1.542 0.657 0 N-CA-C 113.276 0.843 . . . . 0.0 113.276 -176.841 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 98' ' ' PRO . . . . . 0.585 ' HD3' ' OG ' ' A' ' 97' ' ' SER . 13.1 Cg_exo -69.18 -13.96 37.07 Favored 'Trans proline' 0 C--N 1.356 0.934 0 C-N-CA 121.873 1.715 . . . . 0.0 112.233 -178.837 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 99' ' ' LEU . . . . . 0.482 HD12 HD22 ' A' ' 96' ' ' LEU . 61.2 mt -95.02 -30.84 13.89 Favored 'General case' 0 C--N 1.324 -0.516 0 CA-C-N 116.353 -0.385 . . . . 0.0 110.418 -178.519 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 100' ' ' TYR . . . . . 0.461 ' CD1' ' HA2' ' A' ' 65' ' ' GLY . 84.4 t80 -56.5 -32.77 65.35 Favored 'General case' 0 C--N 1.331 -0.203 0 CA-C-N 115.855 -0.612 . . . . 0.0 111.716 -176.458 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 101' ' ' MET . . . . . . . . . . . . . 25.6 ttt -98.92 1.19 45.41 Favored 'General case' 0 C--N 1.323 -0.575 0 CA-C-O 120.871 0.367 . . . . 0.0 111.406 -176.051 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 102' ' ' LYS . . . . . 0.477 ' HG3' ' O ' ' A' ' 98' ' ' PRO . 77.8 mttt -90.42 145.65 24.76 Favored 'General case' 0 C--N 1.322 -0.595 0 CA-C-O 121.482 0.658 . . . . 0.0 111.813 -178.561 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 103' ' ' SER . . . . . 0.426 ' O ' HG13 ' A' ' 107' ' ' ILE . 44.8 t -66.88 145.02 55.91 Favored 'General case' 0 C--N 1.323 -0.576 0 CA-C-N 115.236 -0.893 . . . . 0.0 109.183 173.0 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 104' ' ' LEU . . . . . . . . . . . . . 41.9 tp -56.85 -51.19 69.98 Favored 'General case' 0 C--N 1.328 -0.353 0 N-CA-C 112.536 0.569 . . . . 0.0 112.536 -170.043 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 105' ' ' SER . . . . . . . . . . . . . 4.8 m -74.29 -11.35 60.24 Favored 'General case' 0 C--N 1.327 -0.382 0 CA-C-O 121.001 0.429 . . . . 0.0 111.388 -175.966 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 106' ' ' GLU . . . . . . . . . . . . . 2.1 mp0 -96.84 5.64 50.17 Favored 'General case' 0 C--N 1.326 -0.416 0 CA-C-N 116.071 -0.513 . . . . 0.0 111.434 -174.688 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 107' ' ' ILE . . . . . 0.533 HD11 ' HB2' ' A' ' 64' ' ' PHE . 70.2 mt -89.57 137.6 21.02 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.455 0 CA-C-O 120.992 0.425 . . . . 0.0 111.0 -179.695 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 108' ' ' LEU . . . . . 0.44 ' N ' HD22 ' A' ' 108' ' ' LEU . 2.1 mm? -108.66 148.32 37.51 Favored Pre-proline 0 C--N 1.325 -0.482 0 CA-C-N 115.777 -0.647 . . . . 0.0 110.294 -179.863 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 109' ' ' PRO . . . . . . . . . . . . . 27.5 Cg_endo -63.59 -22.52 70.44 Favored 'Trans proline' 0 C--N 1.343 0.239 0 C-N-CA 122.182 1.921 . . . . 0.0 111.031 174.296 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 110' ' ' ALA . . . . . . . . . . . . . . . -63.76 -41.81 97.92 Favored 'General case' 0 N--CA 1.454 -0.255 0 CA-C-N 115.464 -0.789 . . . . 0.0 111.16 -179.641 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 111' ' ' ASP . . . . . 0.483 ' O ' HG13 ' A' ' 115' ' ' ILE . 20.2 m-20 -58.33 -44.43 88.68 Favored 'General case' 0 N--CA 1.465 0.288 0 CA-C-O 121.189 0.519 . . . . 0.0 110.897 178.837 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 112' ' ' ILE . . . . . 0.581 HG21 HH22 ' A' ' 130' ' ' ARG . 12.7 mt -72.09 -33.89 48.49 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.59 0 CA-C-N 115.863 -0.608 . . . . 0.0 110.652 -176.373 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 113' ' ' GLN . . . . . . . . . . . . . 25.1 tp60 -64.92 -40.55 95.23 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 115.996 -0.547 . . . . 0.0 110.626 -179.619 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 114' ' ' SER . . . . . . . . . . . . . 6.8 p -72.52 -36.13 68.26 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 116.46 -0.336 . . . . 0.0 110.935 179.616 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 115' ' ' ILE . . . . . 0.483 HG13 ' O ' ' A' ' 111' ' ' ASP . 77.5 mt -56.4 -46.78 82.1 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.158 0 CA-C-O 120.896 0.379 . . . . 0.0 110.292 175.729 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 116' ' ' ILE . . . . . . . . . . . . . 49.1 mm -67.22 -35.59 74.47 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.316 0 CA-C-N 116.094 -0.503 . . . . 0.0 110.686 178.661 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 117' ' ' ASN . . . . . . . . . . . . . 50.8 t30 -66.05 -40.93 91.34 Favored 'General case' 0 C--N 1.327 -0.398 0 CA-C-N 116.158 -0.473 . . . . 0.0 111.171 -179.735 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 118' ' ' GLU . . . . . . . . . . . . . 43.0 mt-10 -84.91 -19.3 32.47 Favored 'General case' 0 C--N 1.326 -0.444 0 CA-C-N 116.169 -0.468 . . . . 0.0 111.787 -176.605 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 119' ' ' THR . . . . . . . . . . . . . 69.6 m -84.04 112.94 20.65 Favored 'General case' 0 C--N 1.326 -0.444 0 CA-C-O 121.209 0.528 . . . . 0.0 109.763 175.042 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 120' ' ' LYS . . . . . 0.405 ' HB3' ' HE2' ' A' ' 120' ' ' LYS . 11.4 ptpt -110.34 86.29 2.28 Favored 'General case' 0 C--N 1.32 -0.696 0 CA-C-O 121.817 0.818 . . . . 0.0 110.887 -177.614 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 121' ' ' LEU . . . . . . . . . . . . . 96.0 mt -133.16 -175.04 3.66 Favored 'General case' 0 C--N 1.322 -0.622 0 CA-C-N 114.65 -1.159 . . . . 0.0 109.122 179.29 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 122' ' ' ALA . . . . . . . . . . . . . . . -58.52 145.58 38.55 Favored 'General case' 0 C--N 1.326 -0.419 0 O-C-N 123.123 0.264 . . . . 0.0 110.644 178.009 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 123' ' ' LYS . . . . . . . . . . . . . 21.4 ptmt -60.75 -33.93 73.67 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.662 -0.244 . . . . 0.0 111.537 -175.563 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 124' ' ' ASN . . . . . . . . . . . . . 1.9 p-10 -68.66 -27.15 65.74 Favored 'General case' 0 N--CA 1.463 0.208 0 CA-C-O 121.127 0.489 . . . . 0.0 110.036 178.925 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 125' ' ' THR . . . . . 0.402 ' O ' HG13 ' A' ' 129' ' ' ILE . 20.7 m -78.22 -34.63 49.19 Favored 'General case' 0 N--CA 1.452 -0.356 0 CA-C-N 115.932 -0.576 . . . . 0.0 109.828 178.877 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 126' ' ' LEU . . . . . . . . . . . . . 91.8 mt -67.42 -38.14 84.15 Favored 'General case' 0 C--N 1.327 -0.407 0 CA-C-N 115.809 -0.632 . . . . 0.0 109.879 175.723 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 127' ' ' LYS . . . . . 0.572 ' HG2' HG21 ' A' ' 156' ' ' ILE . 50.2 mtpt -70.4 -26.61 63.77 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.009 -0.541 . . . . 0.0 110.706 176.184 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 128' ' ' ALA . . . . . . . . . . . . . . . -67.09 -41.19 86.73 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-O 120.845 0.355 . . . . 0.0 110.132 174.97 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 129' ' ' ILE . . . . . 0.402 HG13 ' O ' ' A' ' 125' ' ' THR . 62.6 mt -65.29 -43.33 95.15 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.289 0 CA-C-N 116.017 -0.538 . . . . 0.0 109.791 175.628 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 130' ' ' ARG . . . . . 0.672 ' HA ' ' CZ ' ' A' ' 130' ' ' ARG . 0.5 OUTLIER -58.39 -49.92 75.53 Favored 'General case' 0 C--N 1.331 -0.229 0 CA-C-N 115.562 -0.745 . . . . 0.0 110.435 176.721 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 131' ' ' ASN . . . . . . . . . . . . . 5.4 t30 -55.96 -55.86 27.6 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 115.677 -0.692 . . . . 0.0 111.233 178.041 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 132' ' ' THR . . . . . 0.498 ' O ' HG13 ' A' ' 136' ' ' ILE . 37.3 m -56.12 -53.56 55.62 Favored 'General case' 0 C--N 1.327 -0.373 0 CA-C-N 116.055 -0.52 . . . . 0.0 111.488 -175.16 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 133' ' ' ALA . . . . . . . . . . . . . . . -63.2 -37.57 87.74 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.52 -0.309 . . . . 0.0 111.133 -177.858 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 134' ' ' SER . . . . . 0.469 ' O ' ' HG3' ' A' ' 138' ' ' ARG . 8.3 t -66.26 -44.3 84.02 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.433 -0.349 . . . . 0.0 110.512 -177.486 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 135' ' ' GLN . . . . . . . . . . . . . 44.5 mt-30 -62.93 -33.53 75.53 Favored 'General case' 0 C--O 1.233 0.199 0 CA-C-O 120.669 0.271 . . . . 0.0 110.914 -179.078 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 136' ' ' ILE . . . . . 0.498 HG13 ' O ' ' A' ' 132' ' ' THR . 66.3 mt -63.61 -48.44 86.75 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.218 0 CA-C-N 116.347 -0.388 . . . . 0.0 110.696 176.95 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 137' ' ' PHE . . . . . 0.419 ' O ' HG13 ' A' ' 141' ' ' ILE . 56.4 m-85 -66.25 -37.53 85.71 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-N 116.635 -0.257 . . . . 0.0 110.879 178.579 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 138' ' ' ARG . . . . . 0.469 ' HG3' ' O ' ' A' ' 134' ' ' SER . 41.4 mtp-105 -60.03 -40.3 88.85 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-N 116.449 -0.342 . . . . 0.0 110.454 176.871 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 139' ' ' LEU . . . . . . . . . . . . . 62.1 tp -62.73 -38.56 90.97 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 115.947 -0.569 . . . . 0.0 110.225 177.35 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 140' ' ' ALA . . . . . . . . . . . . . . . -63.94 -41.55 97.58 Favored 'General case' 0 C--N 1.326 -0.427 0 CA-C-N 115.942 -0.572 . . . . 0.0 110.522 176.408 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 141' ' ' ILE . . . . . 0.419 HG13 ' O ' ' A' ' 137' ' ' PHE . 58.9 mt -63.62 -39.04 83.88 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.267 0 CA-C-N 116.565 -0.289 . . . . 0.0 111.021 174.76 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 142' ' ' GLU . . . . . 0.449 ' HG3' ' O ' ' A' ' 138' ' ' ARG . 48.8 mt-10 -60.87 -39.29 88.65 Favored 'General case' 0 N--CA 1.462 0.157 0 CA-C-O 120.858 0.361 . . . . 0.0 110.626 177.169 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 143' ' ' ASN . . . . . . . . . . . . . 4.3 m-20 -84.87 0.94 49.25 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.204 -0.453 . . . . 0.0 110.189 177.074 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 144' ' ' ARG . . . . . . . . . . . . . 99.5 mtt180 55.15 44.7 27.41 Favored 'General case' 0 C--O 1.232 0.139 0 CA-C-N 115.341 -0.845 . . . . 0.0 111.713 179.222 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 145' ' ' ALA . . . . . . . . . . . . . . . -88.21 -55.59 3.68 Favored 'General case' 0 C--N 1.327 -0.4 0 CA-C-N 115.44 -0.8 . . . . 0.0 109.632 173.897 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 146' ' ' ILE . . . . . 0.446 HG12 ' H ' ' A' ' 148' ' ' PHE . 18.3 tt -104.85 147.49 10.68 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.44 0 N-CA-C 109.359 -0.608 . . . . 0.0 109.359 175.966 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 147' ' ' ASP . . . . . . . . . . . . . 27.2 t70 -87.7 -6.3 58.28 Favored 'General case' 0 C--N 1.324 -0.52 0 CA-C-N 116.4 -0.364 . . . . 0.0 111.891 -172.593 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 148' ' ' PHE . . . . . 0.446 ' H ' HG12 ' A' ' 146' ' ' ILE . 33.0 p90 -155.33 168.7 26.23 Favored 'General case' 0 C--N 1.325 -0.458 0 CA-C-O 120.885 0.374 . . . . 0.0 111.023 -174.003 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 149' ' ' ASN . . . . . . . . . . . . . 29.6 t30 -115.15 102.16 54.63 Favored Pre-proline 0 C--N 1.324 -0.527 0 CA-C-N 115.857 -0.611 . . . . 0.0 110.163 178.303 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 150' ' ' PRO . . . . . . . . . . . . . 40.7 Cg_endo -68.04 -17.96 46.0 Favored 'Trans proline' 0 C--N 1.343 0.254 0 C-N-CA 122.787 2.324 . . . . 0.0 112.48 -178.367 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 151' ' ' ALA . . . . . 0.462 ' HB1' HH21 ' A' ' 130' ' ' ARG . . . -71.54 -20.35 62.04 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 116.269 -0.423 . . . . 0.0 110.942 -179.453 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 152' ' ' ASP . . . . . . . . . . . . . 36.7 t70 -72.92 -15.39 61.58 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 115.821 -0.627 . . . . 0.0 110.822 -178.301 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 153' ' ' TYR . . . . . . . . . . . . . 88.4 m-85 -92.21 2.51 56.56 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.061 -0.518 . . . . 0.0 111.255 -177.922 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 154' ' ' VAL . . . . . . . . . . . . . 81.1 t -90.99 121.86 41.8 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.449 0 CA-C-O 120.752 0.31 . . . . 0.0 111.107 -177.505 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 155' ' ' ARG . . . . . . . . . . . . . 12.4 ttm180 -80.97 134.12 35.64 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 116.155 -0.475 . . . . 0.0 110.03 177.865 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 156' ' ' ILE . . . . . 0.572 HG21 ' HG2' ' A' ' 127' ' ' LYS . 46.1 mm -105.95 130.26 23.28 Favored Pre-proline 0 C--N 1.325 -0.484 0 CA-C-N 116.174 -0.466 . . . . 0.0 109.765 176.613 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 157' ' ' PRO . . . . . . . . . . . . . 18.4 Cg_endo -60.33 130.72 35.13 Favored 'Trans proline' 0 C--N 1.344 0.335 0 C-N-CA 122.343 2.029 . . . . 0.0 111.912 179.323 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 158' ' ' LYS . . . . . . . . . . . . . 93.5 mttt -102.46 -12.27 17.96 Favored 'General case' 0 C--N 1.322 -0.605 0 CA-C-N 115.851 -0.613 . . . . 0.0 111.031 -174.858 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 159' ' ' ILE . . . . . 0.424 HD12 ' N ' ' A' ' 159' ' ' ILE . 4.3 mp -110.49 103.04 14.84 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.489 0 CA-C-N 116.19 -0.459 . . . . 0.0 110.051 -178.53 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 160' ' ' ALA . . . . . . . . . . . . . . . -148.66 115.64 6.06 Favored 'General case' 0 C--N 1.324 -0.543 0 CA-C-N 116.551 -0.295 . . . . 0.0 111.031 -179.575 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 161' ' ' LEU . . . . . . . . . . . . . 93.3 mt 63.7 -157.12 0.32 Allowed 'General case' 0 C--O 1.234 0.259 0 CA-C-N 115.724 -0.671 . . . . 0.0 111.149 175.345 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 162' ' ' GLU . . . . . . . . . . . . . 10.1 pt-20 -79.31 149.32 31.8 Favored 'General case' 0 C--N 1.326 -0.446 0 CA-C-O 121.118 0.485 . . . . 0.0 111.063 -179.901 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 163' ' ' HIS . . . . . . . . . . . . . 6.1 p80 -112.09 63.67 0.62 Allowed 'General case' 0 C--N 1.32 -0.687 0 CA-C-O 121.798 0.809 . . . . 0.0 109.54 177.788 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 164' ' ' HIS . . . . . . . . . . . . . 17.6 t-160 -87.44 17.42 4.52 Favored 'General case' 0 C--N 1.326 -0.426 0 CA-C-N 114.919 -1.037 . . . . 0.0 110.658 -174.687 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 165' ' ' HIS . . . . . . . . . . . . . 94.5 m-70 -135.79 133.74 38.21 Favored 'General case' 0 C--N 1.322 -0.622 0 CA-C-N 116.114 -0.494 . . . . 0.0 109.924 177.832 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 166' ' ' HIS . . . . . . . . . . . . . 26.8 p80 -159.15 148.52 18.64 Favored 'General case' 0 C--N 1.326 -0.423 0 N-CA-C 110.16 -0.311 . . . . 0.0 110.16 176.751 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 167' ' ' HIS . . . . . . . . . . . . . 6.4 p80 -82.36 171.78 13.81 Favored 'General case' 0 C--N 1.323 -0.552 0 N-CA-C 110.13 -0.322 . . . . 0.0 110.13 177.72 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 168' ' ' HIS . . . . . . . . . . . . . 4.1 t-160 . . . . . 0 C--O 1.242 0.695 0 CA-C-O 118.573 -0.727 . . . . 0.0 109.09 174.074 . . . . . . . . 0 0 . 1 . 011 nuclear build full ' A' A ' 61' ' ' ARG . . . . . 0.409 HH11 ' HD3' ' A' ' 61' ' ' ARG . 1.3 ptm180 . . . . . 0 N--CA 1.481 1.105 0 CA-C-O 120.918 0.389 . . . . 0.0 111.094 . . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 62' ' ' ASP . . . . . . . . . . . . . 5.4 p-10 -177.92 149.84 0.6 Allowed 'General case' 0 C--O 1.233 0.188 0 CA-C-N 116.259 -0.428 . . . . 0.0 110.914 -177.673 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 63' ' ' SER . . . . . 0.511 ' HA ' ' HA ' ' A' ' 103' ' ' SER . 97.7 p -119.64 158.78 25.71 Favored 'General case' 0 C--N 1.326 -0.436 0 N-CA-C 109.556 -0.535 . . . . 0.0 109.556 169.54 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 64' ' ' PHE . . . . . . . . . . . . . 82.4 t80 -62.02 -28.74 69.79 Favored 'General case' 0 C--N 1.324 -0.542 0 CA-C-O 120.994 0.426 . . . . 0.0 109.987 178.021 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 65' ' ' GLY . . . . . . . . . . . . . . . -63.8 -37.57 94.87 Favored Glycine 0 N--CA 1.449 -0.497 0 CA-C-N 115.941 -0.572 . . . . 0.0 112.144 176.711 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 66' ' ' ASP . . . . . . . . . . . . . 56.1 m-20 -65.31 -43.77 90.02 Favored 'General case' 0 C--O 1.234 0.243 0 CA-C-O 120.958 0.408 . . . . 0.0 109.957 178.308 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 67' ' ' TRP . . . . . . . . . . . . . 99.4 m95 -69.6 -36.74 76.5 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 115.787 -0.642 . . . . 0.0 111.059 178.371 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 68' ' ' ALA . . . . . 0.469 ' O ' ' HG ' ' A' ' 72' ' ' LEU . . . -59.13 -43.4 92.0 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-O 120.868 0.366 . . . . 0.0 110.544 176.998 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 69' ' ' GLU . . . . . 0.466 ' O ' ' HG2' ' A' ' 73' ' ' LYS . 36.6 tt0 -62.4 -44.77 95.66 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.229 -0.442 . . . . 0.0 110.166 175.506 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 70' ' ' LYS . . . . . 0.455 ' HG2' HD21 ' A' ' 139' ' ' LEU . 64.2 tttp -59.42 -39.99 85.27 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 115.886 -0.597 . . . . 0.0 110.66 -179.963 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 71' ' ' PHE . . . . . . . . . . . . . 68.7 t80 -63.62 -44.42 93.98 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.207 -0.451 . . . . 0.0 110.142 176.619 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 72' ' ' LEU . . . . . 0.469 ' HG ' ' O ' ' A' ' 68' ' ' ALA . 82.8 mt -64.62 -36.65 84.92 Favored 'General case' 0 C--N 1.325 -0.486 0 CA-C-N 116.177 -0.465 . . . . 0.0 110.982 -179.913 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 73' ' ' LYS . . . . . 0.466 ' HG2' ' O ' ' A' ' 69' ' ' GLU . 33.3 mmtp -70.6 -40.84 72.97 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-O 120.681 0.277 . . . . 0.0 111.268 -179.912 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 74' ' ' SER . . . . . . . . . . . . . 8.1 p -71.97 -34.56 69.05 Favored 'General case' 0 C--N 1.324 -0.535 0 CA-C-O 120.829 0.347 . . . . 0.0 110.513 179.169 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 75' ' ' LYS . . . . . 0.52 ' HE3' HG11 ' A' ' 80' ' ' VAL . 46.1 tptt -74.02 -30.24 62.34 Favored 'General case' 0 N--CA 1.444 -0.752 0 CA-C-O 120.928 0.394 . . . . 0.0 110.065 177.087 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 76' ' ' GLU . . . . . . . . . . . . . 33.9 tt0 -59.48 -50.24 74.69 Favored 'General case' 0 C--N 1.327 -0.403 0 CA-C-O 121.183 0.516 . . . . 0.0 109.628 171.291 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 77' ' ' ALA . . . . . . . . . . . . . . . -72.69 -10.96 60.41 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-N 115.332 -0.849 . . . . 0.0 111.06 179.131 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 78' ' ' ASP . . . . . 0.504 ' HB3' ' O ' ' A' ' 75' ' ' LYS . 27.9 t70 -73.54 -15.83 61.29 Favored 'General case' 0 C--N 1.326 -0.439 0 CA-C-N 115.844 -0.616 . . . . 0.0 109.983 175.649 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 79' ' ' GLY . . . . . . . . . . . . . . . 91.87 60.42 1.27 Allowed Glycine 0 N--CA 1.446 -0.655 0 CA-C-N 115.762 -0.654 . . . . 0.0 112.06 177.354 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 80' ' ' VAL . . . . . 0.52 HG11 ' HE3' ' A' ' 75' ' ' LYS . 34.9 m -115.79 152.42 17.47 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.433 0 CA-C-O 120.87 0.367 . . . . 0.0 110.74 178.76 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 81' ' ' SER . . . . . . . . . . . . . 31.2 t -64.45 153.01 40.09 Favored 'General case' 0 C--N 1.322 -0.627 0 CA-C-N 115.732 -0.667 . . . . 0.0 109.829 175.668 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 82' ' ' VAL . . . . . . . . . . . . . 59.2 t -62.56 -43.53 98.51 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.336 0 CA-C-O 120.874 0.369 . . . . 0.0 110.575 -179.203 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 83' ' ' SER . . . . . . . . . . . . . 18.0 t -64.48 -30.71 71.74 Favored 'General case' 0 C--N 1.326 -0.428 0 CA-C-N 116.135 -0.484 . . . . 0.0 110.421 177.509 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 84' ' ' GLN . . . . . . . . . . . . . 47.9 tp60 -71.86 -38.79 70.01 Favored 'General case' 0 C--N 1.332 -0.187 0 CA-C-N 116.076 -0.511 . . . . 0.0 109.738 176.961 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 85' ' ' LEU . . . . . 0.405 ' HA ' ' HD2' ' A' ' 88' ' ' TYR . 40.1 tp -66.56 -38.76 87.77 Favored 'General case' 0 C--N 1.327 -0.389 0 CA-C-N 115.878 -0.601 . . . . 0.0 110.217 176.226 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 86' ' ' ASN . . . . . . . . . . . . . 86.0 m-20 -64.47 -26.87 68.63 Favored 'General case' 0 C--O 1.233 0.201 0 CA-C-N 116.129 -0.487 . . . . 0.0 110.716 176.382 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 87' ' ' SER . . . . . . . . . . . . . 13.0 t -65.71 -48.54 71.65 Favored 'General case' 0 C--N 1.324 -0.501 0 N-CA-C 109.711 -0.477 . . . . 0.0 109.711 175.771 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 88' ' ' TYR . . . . . 0.405 ' HD2' ' HA ' ' A' ' 85' ' ' LEU . 77.7 m-85 -62.45 -35.5 79.49 Favored 'General case' 0 N--CA 1.464 0.25 0 CA-C-O 121.084 0.468 . . . . 0.0 110.38 175.638 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 89' ' ' LYS . . . . . . . . . . . . . 39.1 ttmt -61.2 -37.17 82.01 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-N 115.709 -0.678 . . . . 0.0 110.154 178.809 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 90' ' ' ASN . . . . . 0.484 ' O ' ' HB3' ' A' ' 94' ' ' ASN . 26.6 t-20 -65.49 -39.2 91.63 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 115.79 -0.641 . . . . 0.0 110.414 177.66 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 91' ' ' TYR . . . . . . . . . . . . . 56.5 m-85 -63.91 -59.75 4.13 Favored 'General case' 0 C--N 1.327 -0.409 0 CA-C-N 116.363 -0.38 . . . . 0.0 110.879 176.96 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 92' ' ' CYS . . . . . 0.508 ' HA ' HD12 ' A' ' 96' ' ' LEU . 58.3 m -63.55 -46.71 84.71 Favored 'General case' 0 C--N 1.326 -0.456 0 N-CA-C 112.594 0.59 . . . . 0.0 112.594 -173.485 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 93' ' ' ARG . . . . . . . . . . . . . 40.8 ttm180 -86.13 -39.98 16.15 Favored 'General case' 0 C--N 1.327 -0.405 0 N-CA-C 112.355 0.502 . . . . 0.0 112.355 -172.71 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 94' ' ' ASN . . . . . 0.484 ' HB3' ' O ' ' A' ' 90' ' ' ASN . 49.8 t30 -92.78 -52.81 4.44 Favored 'General case' 0 C--N 1.328 -0.368 0 C-N-CA 120.726 -0.39 . . . . 0.0 111.842 -173.876 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 95' ' ' HIS . . . . . . . . . . . . . 8.8 m80 -77.71 -36.17 51.27 Favored 'General case' 0 C--N 1.326 -0.427 0 C-N-CA 120.789 -0.364 . . . . 0.0 111.57 -176.204 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 96' ' ' LEU . . . . . 0.508 HD12 ' HA ' ' A' ' 92' ' ' CYS . 84.3 mt -98.16 27.05 4.83 Favored 'General case' 0 C--N 1.321 -0.65 0 CA-C-N 116.441 -0.345 . . . . 0.0 110.37 178.678 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 97' ' ' SER . . . . . 0.512 ' N ' ' HD2' ' A' ' 98' ' ' PRO . 1.8 p -53.01 -46.72 97.47 Favored Pre-proline 0 CA--C 1.543 0.686 0 N-CA-C 113.444 0.905 . . . . 0.0 113.444 -175.884 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 98' ' ' PRO . . . . . 0.512 ' HD2' ' N ' ' A' ' 97' ' ' SER . 18.3 Cg_endo -60.43 -34.24 93.32 Favored 'Trans proline' 0 C--N 1.359 1.091 0 C-N-CA 121.771 1.647 . . . . 0.0 112.106 178.301 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 99' ' ' LEU . . . . . 0.539 HD22 HG23 ' A' ' 107' ' ' ILE . 41.1 mt -83.81 -28.78 27.85 Favored 'General case' 0 C--N 1.325 -0.475 0 CA-C-O 121.071 0.462 . . . . 0.0 110.366 -177.668 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 100' ' ' TYR . . . . . . . . . . . . . 44.1 t80 -59.38 -25.79 64.55 Favored 'General case' 0 C--N 1.325 -0.497 0 CA-C-N 115.218 -0.901 . . . . 0.0 111.603 -176.802 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 101' ' ' MET . . . . . . . . . . . . . 22.5 ptp -104.17 5.18 34.76 Favored 'General case' 0 C--N 1.327 -0.385 0 CA-C-N 116.347 -0.388 . . . . 0.0 111.24 -178.867 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 102' ' ' LYS . . . . . 0.539 ' HB3' ' HB3' ' A' ' 106' ' ' GLU . 64.0 mttm -105.43 166.96 10.06 Favored 'General case' 0 C--N 1.324 -0.501 0 CA-C-N 116.55 -0.295 . . . . 0.0 110.521 -179.561 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 103' ' ' SER . . . . . 0.511 ' HA ' ' HA ' ' A' ' 63' ' ' SER . 50.9 p -94.97 170.8 9.17 Favored 'General case' 0 C--N 1.32 -0.688 0 N-CA-C 109.613 -0.514 . . . . 0.0 109.613 173.806 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 104' ' ' LEU . . . . . . . . . . . . . 96.5 mt -58.69 -31.04 67.86 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-O 120.747 0.308 . . . . 0.0 111.028 179.222 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 105' ' ' SER . . . . . . . . . . . . . 14.0 m -86.91 -20.99 26.57 Favored 'General case' 0 C--N 1.327 -0.391 0 CA-C-N 116.344 -0.389 . . . . 0.0 111.112 -179.109 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 106' ' ' GLU . . . . . 0.539 ' HB3' ' HB3' ' A' ' 102' ' ' LYS . 0.6 OUTLIER -83.04 -25.23 32.31 Favored 'General case' 0 C--N 1.326 -0.433 0 CA-C-O 121.219 0.533 . . . . 0.0 110.443 -176.901 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' A' A ' 107' ' ' ILE . . . . . 0.539 HG23 HD22 ' A' ' 99' ' ' LEU . 78.9 mt -70.84 127.11 32.36 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.571 0 CA-C-N 115.929 -0.578 . . . . 0.0 111.329 -179.004 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 108' ' ' LEU . . . . . 0.422 ' HA ' ' HD3' ' A' ' 109' ' ' PRO . 93.5 mt -100.44 137.89 20.05 Favored Pre-proline 0 C--N 1.326 -0.452 0 CA-C-N 115.691 -0.686 . . . . 0.0 110.457 176.669 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 109' ' ' PRO . . . . . 0.422 ' HD3' ' HA ' ' A' ' 108' ' ' LEU . 44.2 Cg_exo -56.62 -44.04 49.32 Favored 'Trans proline' 0 CA--C 1.53 0.315 0 C-N-CA 122.709 2.273 . . . . 0.0 112.528 178.97 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 110' ' ' ALA . . . . . . . . . . . . . . . -65.78 -27.99 68.69 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-O 120.818 0.342 . . . . 0.0 111.469 -178.502 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 111' ' ' ASP . . . . . 0.539 ' O ' HG13 ' A' ' 115' ' ' ILE . 10.3 t70 -68.68 -39.82 80.37 Favored 'General case' 0 C--N 1.325 -0.486 0 CA-C-O 121.383 0.611 . . . . 0.0 109.703 179.996 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 112' ' ' ILE . . . . . 0.521 ' HB ' HG21 ' A' ' 154' ' ' VAL . 40.5 mt -67.62 -38.25 80.14 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.39 0 CA-C-N 115.583 -0.735 . . . . 0.0 109.829 175.178 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 113' ' ' GLN . . . . . 0.434 ' HA ' HG13 ' A' ' 154' ' ' VAL . 25.2 tp60 -62.88 -41.23 99.33 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-N 115.466 -0.788 . . . . 0.0 110.794 -179.012 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 114' ' ' SER . . . . . 0.415 ' HA ' ' HB3' ' A' ' 117' ' ' ASN . 41.3 p -70.1 -30.66 67.93 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.761 -0.2 . . . . 0.0 111.024 -179.516 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 115' ' ' ILE . . . . . 0.539 HG13 ' O ' ' A' ' 111' ' ' ASP . 83.6 mt -56.55 -55.32 20.03 Favored 'Isoleucine or valine' 0 N--CA 1.463 0.193 0 CA-C-O 120.951 0.405 . . . . 0.0 110.045 174.442 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 116' ' ' ILE . . . . . 0.422 HG23 ' HB3' ' A' ' 126' ' ' LEU . 45.2 mm -64.71 -30.04 49.12 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.378 0 CA-C-N 115.815 -0.63 . . . . 0.0 110.432 179.569 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 117' ' ' ASN . . . . . 0.415 ' HB3' ' HA ' ' A' ' 114' ' ' SER . 8.1 t30 -66.37 -43.25 86.49 Favored 'General case' 0 C--N 1.324 -0.505 0 CA-C-N 115.564 -0.744 . . . . 0.0 111.524 -178.587 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 118' ' ' GLU . . . . . . . . . . . . . 39.3 mt-10 -91.61 -30.46 16.35 Favored 'General case' 0 C--N 1.327 -0.39 0 N-CA-C 112.41 0.522 . . . . 0.0 112.41 -175.897 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 119' ' ' THR . . . . . . . . . . . . . 63.4 m -64.99 111.9 3.07 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-O 120.96 0.409 . . . . 0.0 110.356 -178.68 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 120' ' ' LYS . . . . . . . . . . . . . 91.2 mttt -92.93 79.58 4.63 Favored 'General case' 0 C--N 1.326 -0.42 0 CA-C-O 121.309 0.576 . . . . 0.0 110.734 -176.896 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 121' ' ' LEU . . . . . . . . . . . . . 76.5 mt -126.97 -175.66 3.48 Favored 'General case' 0 C--N 1.321 -0.658 0 CA-C-N 115.5 -0.773 . . . . 0.0 109.612 177.559 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 122' ' ' ALA . . . . . . . . . . . . . . . -65.53 152.28 44.42 Favored 'General case' 0 C--N 1.325 -0.495 0 CA-C-N 116.497 -0.319 . . . . 0.0 110.328 178.812 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 123' ' ' LYS . . . . . . . . . . . . . 0.4 OUTLIER -63.56 -35.66 81.22 Favored 'General case' 0 C--N 1.325 -0.491 0 CA-C-N 116.273 -0.421 . . . . 0.0 110.238 -176.043 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 124' ' ' ASN . . . . . 0.783 ' HA ' ' HE3' ' A' ' 127' ' ' LYS . 11.6 t30 -69.61 -35.69 75.5 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 116.176 -0.465 . . . . 0.0 110.246 177.979 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 125' ' ' THR . . . . . 0.545 ' O ' HG13 ' A' ' 129' ' ' ILE . 8.6 m -65.43 -44.25 87.92 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.226 -0.443 . . . . 0.0 110.274 177.015 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 126' ' ' LEU . . . . . 0.422 ' HB3' HG23 ' A' ' 116' ' ' ILE . 98.6 mt -61.55 -43.27 99.16 Favored 'General case' 0 C--N 1.33 -0.246 0 CA-C-N 115.911 -0.586 . . . . 0.0 110.57 178.665 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 127' ' ' LYS . . . . . 0.783 ' HE3' ' HA ' ' A' ' 124' ' ' ASN . 44.9 mtmt -60.87 -40.06 91.53 Favored 'General case' 0 C--N 1.331 -0.219 0 CA-C-N 116.118 -0.492 . . . . 0.0 110.519 175.824 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 128' ' ' ALA . . . . . . . . . . . . . . . -64.47 -34.38 78.06 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 116.086 -0.506 . . . . 0.0 110.995 179.48 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 129' ' ' ILE . . . . . 0.545 HG13 ' O ' ' A' ' 125' ' ' THR . 71.3 mt -63.26 -53.42 46.04 Favored 'Isoleucine or valine' 0 C--O 1.234 0.244 0 CA-C-N 116.565 -0.289 . . . . 0.0 110.347 177.196 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 130' ' ' ARG . . . . . . . . . . . . . 40.4 ttp180 -62.85 -40.69 98.23 Favored 'General case' 0 CA--C 1.521 -0.154 0 CA-C-O 120.793 0.33 . . . . 0.0 110.126 178.455 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 131' ' ' ASN . . . . . 0.632 ' O ' ' HG2' ' A' ' 135' ' ' GLN . 7.5 t30 -54.98 -55.91 25.55 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-N 115.777 -0.647 . . . . 0.0 110.832 178.538 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 132' ' ' THR . . . . . 0.465 ' O ' HG13 ' A' ' 136' ' ' ILE . 32.0 m -57.04 -45.6 83.04 Favored 'General case' 0 C--N 1.326 -0.433 0 CA-C-N 116.295 -0.412 . . . . 0.0 110.79 -178.705 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 133' ' ' ALA . . . . . . . . . . . . . . . -63.34 -48.67 77.03 Favored 'General case' 0 C--N 1.332 -0.193 0 CA-C-N 116.325 -0.398 . . . . 0.0 111.56 179.796 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 134' ' ' SER . . . . . 0.585 ' O ' ' HG3' ' A' ' 138' ' ' ARG . 26.9 p -66.53 -32.0 73.08 Favored 'General case' 0 C--N 1.327 -0.39 0 CA-C-N 116.633 -0.258 . . . . 0.0 111.27 -177.108 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 135' ' ' GLN . . . . . 0.632 ' HG2' ' O ' ' A' ' 131' ' ' ASN . 11.0 mm100 -65.53 -38.24 89.08 Favored 'General case' 0 C--N 1.331 -0.205 0 C-N-CA 120.967 -0.293 . . . . 0.0 110.36 176.777 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 136' ' ' ILE . . . . . 0.465 HG13 ' O ' ' A' ' 132' ' ' THR . 76.3 mt -64.0 -39.9 87.11 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.262 0 CA-C-N 116.285 -0.416 . . . . 0.0 109.986 176.699 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 137' ' ' PHE . . . . . 0.523 ' O ' HG13 ' A' ' 141' ' ' ILE . 44.2 m-85 -62.86 -42.89 99.92 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.183 -0.462 . . . . 0.0 110.638 175.435 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 138' ' ' ARG . . . . . 0.585 ' HG3' ' O ' ' A' ' 134' ' ' SER . 42.4 mtt180 -60.84 -38.56 85.91 Favored 'General case' 0 N--CA 1.465 0.283 0 CA-C-O 120.804 0.335 . . . . 0.0 110.537 178.559 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 139' ' ' LEU . . . . . 0.455 HD21 ' HG2' ' A' ' 70' ' ' LYS . 65.5 tp -56.45 -38.65 71.92 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 115.821 -0.627 . . . . 0.0 110.519 177.071 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 140' ' ' ALA . . . . . . . . . . . . . . . -74.87 -33.27 62.07 Favored 'General case' 0 C--N 1.325 -0.47 0 CA-C-N 115.872 -0.604 . . . . 0.0 110.706 177.43 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 141' ' ' ILE . . . . . 0.65 ' HA ' ' O ' ' A' ' 146' ' ' ILE . 73.6 mt -64.35 -43.59 97.12 Favored 'Isoleucine or valine' 0 C--O 1.233 0.228 0 CA-C-N 116.08 -0.509 . . . . 0.0 111.01 177.983 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 142' ' ' GLU . . . . . 0.48 ' HG3' ' O ' ' A' ' 138' ' ' ARG . 48.4 mt-10 -60.69 -39.33 88.08 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.113 -0.494 . . . . 0.0 110.657 178.976 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 143' ' ' ASN . . . . . . . . . . . . . 43.7 m-80 -83.97 3.09 35.77 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 115.782 -0.645 . . . . 0.0 110.622 179.555 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 144' ' ' ARG . . . . . . . . . . . . . 99.5 mtt180 60.87 28.66 18.42 Favored 'General case' 0 C--O 1.234 0.267 0 CA-C-N 115.423 -0.808 . . . . 0.0 111.762 174.014 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 145' ' ' ALA . . . . . . . . . . . . . . . -78.25 -37.77 44.43 Favored 'General case' 0 C--N 1.326 -0.428 0 CA-C-N 115.672 -0.694 . . . . 0.0 109.224 174.276 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 146' ' ' ILE . . . . . 0.65 ' O ' ' HA ' ' A' ' 141' ' ' ILE . 13.8 tt -144.73 140.26 23.47 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.626 0 CA-C-N 115.011 -0.995 . . . . 0.0 108.847 175.961 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 147' ' ' ASP . . . . . . . . . . . . . 31.6 t70 -117.1 46.12 1.74 Allowed 'General case' 0 C--N 1.318 -0.791 0 N-CA-C 108.75 -0.833 . . . . 0.0 108.75 178.53 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 148' ' ' PHE . . . . . . . . . . . . . 70.5 t80 -151.42 123.9 8.39 Favored 'General case' 0 C--N 1.322 -0.603 0 CA-C-N 114.851 -1.068 . . . . 0.0 109.321 -177.105 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 149' ' ' ASN . . . . . . . . . . . . . 49.0 t-20 -110.74 98.12 36.26 Favored Pre-proline 0 C--N 1.321 -0.634 0 N-CA-C 110.119 -0.326 . . . . 0.0 110.119 -179.354 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 150' ' ' PRO . . . . . . . . . . . . . 26.6 Cg_exo -62.37 -33.2 80.64 Favored 'Trans proline' 0 C--O 1.232 0.181 0 C-N-CA 122.689 2.259 . . . . 0.0 111.98 -179.335 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 151' ' ' ALA . . . . . . . . . . . . . . . -73.46 -18.11 61.16 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 115.988 -0.551 . . . . 0.0 111.386 -176.51 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 152' ' ' ASP . . . . . . . . . . . . . 34.6 t70 -72.49 -24.3 61.15 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-O 121.288 0.566 . . . . 0.0 110.234 179.216 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 153' ' ' TYR . . . . . . . . . . . . . 62.5 m-85 -89.91 -4.41 57.54 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-N 115.954 -0.567 . . . . 0.0 110.138 179.916 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 154' ' ' VAL . . . . . 0.521 HG21 ' HB ' ' A' ' 112' ' ' ILE . 60.3 t -89.67 139.11 18.01 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.544 0 CA-C-N 115.531 -0.759 . . . . 0.0 109.495 176.437 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 155' ' ' ARG . . . . . . . . . . . . . 15.9 ptt180 -124.58 155.55 38.9 Favored 'General case' 0 C--N 1.321 -0.648 0 C-N-CA 120.554 -0.458 . . . . 0.0 110.963 179.855 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 156' ' ' ILE . . . . . 0.424 ' HA ' ' HD3' ' A' ' 157' ' ' PRO . 2.4 mp -96.43 116.29 66.07 Favored Pre-proline 0 C--N 1.324 -0.51 0 CA-C-N 115.843 -0.617 . . . . 0.0 109.986 179.734 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 157' ' ' PRO . . . . . 0.424 ' HD3' ' HA ' ' A' ' 156' ' ' ILE . 14.2 Cg_exo -69.32 131.27 21.48 Favored 'Trans proline' 0 N--CA 1.456 -0.685 0 C-N-CA 122.591 2.194 . . . . 0.0 111.181 177.191 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 158' ' ' LYS . . . . . . . . . . . . . 64.5 mttp -80.36 -6.19 57.6 Favored 'General case' 0 C--N 1.325 -0.474 0 CA-C-N 116.513 -0.312 . . . . 0.0 110.334 179.681 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 159' ' ' ILE . . . . . . . . . . . . . 47.3 mm 72.46 -56.46 0.28 Allowed 'Isoleucine or valine' 0 N--CA 1.465 0.302 0 CA-C-N 115.556 -0.747 . . . . 0.0 111.295 -179.79 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 160' ' ' ALA . . . . . . . . . . . . . . . -76.73 84.41 3.35 Favored 'General case' 0 C--N 1.323 -0.582 0 CA-C-O 121.502 0.667 . . . . 0.0 110.761 179.083 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 161' ' ' LEU . . . . . . . . . . . . . 92.7 mt -105.99 -7.74 17.94 Favored 'General case' 0 C--N 1.312 -1.056 0 CA-C-N 114.825 -1.08 . . . . 0.0 109.349 175.854 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 162' ' ' GLU . . . . . . . . . . . . . 41.1 mt-10 66.41 173.38 0.24 Allowed 'General case' 0 C--O 1.236 0.379 0 CA-C-N 114.55 -1.205 . . . . 0.0 111.998 178.188 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 163' ' ' HIS . . . . . . . . . . . . . 32.2 m170 -108.19 128.17 54.48 Favored 'General case' 0 C--N 1.321 -0.634 0 CA-C-N 115.793 -0.64 . . . . 0.0 110.018 178.788 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 164' ' ' HIS . . . . . . . . . . . . . 30.1 m80 -94.7 118.28 31.48 Favored 'General case' 0 C--N 1.322 -0.615 0 CA-C-N 115.954 -0.566 . . . . 0.0 109.959 -176.712 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 165' ' ' HIS . . . . . . . . . . . . . 48.1 m80 -113.66 -54.79 2.58 Favored 'General case' 0 C--N 1.323 -0.58 0 CA-C-O 121.04 0.448 . . . . 0.0 110.257 -176.948 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 166' ' ' HIS . . . . . . . . . . . . . 32.6 m80 -100.92 -157.81 0.63 Allowed 'General case' 0 C--N 1.324 -0.518 0 CA-C-N 115.632 -0.713 . . . . 0.0 109.369 179.143 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 167' ' ' HIS . . . . . . . . . . . . . 33.3 m80 -74.55 78.6 1.96 Allowed 'General case' 0 C--N 1.327 -0.392 0 N-CA-C 109.23 -0.655 . . . . 0.0 109.23 175.31 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 168' ' ' HIS . . . . . . . . . . . . . 58.9 t-80 . . . . . 0 C--O 1.251 1.17 0 CA-C-O 118.29 -0.862 . . . . 0.0 109.202 -177.961 . . . . . . . . 0 0 . 1 . 012 nuclear build full ' A' A ' 61' ' ' ARG . . . . . . . . . . . . . 59.5 mtp180 . . . . . 0 N--CA 1.48 1.025 0 CA-C-O 121.217 0.532 . . . . 0.0 110.801 . . . . . . . . . 0 0 . 1 . 012 nuclear build full ' A' A ' 62' ' ' ASP . . . . . . . . . . . . . 5.2 p-10 -136.59 111.51 8.87 Favored 'General case' 0 C--N 1.321 -0.663 0 N-CA-C 108.593 -0.892 . . . . 0.0 108.593 171.041 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 63' ' ' SER . . . . . 0.596 ' HB2' ' HB2' ' A' ' 66' ' ' ASP . 5.5 m -119.45 149.49 41.78 Favored 'General case' 0 C--N 1.318 -0.803 0 N-CA-C 109.784 -0.451 . . . . 0.0 109.784 -179.448 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 64' ' ' PHE . . . . . 0.491 ' HB2' HD11 ' A' ' 107' ' ' ILE . 80.0 t80 -64.23 -50.37 68.28 Favored 'General case' 0 C--N 1.328 -0.365 0 N-CA-C 109.989 -0.374 . . . . 0.0 109.989 178.588 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 65' ' ' GLY . . . . . . . . . . . . . . . -62.87 -27.67 70.58 Favored Glycine 0 C--N 1.33 0.247 0 C-N-CA 120.816 -0.707 . . . . 0.0 112.193 177.378 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 66' ' ' ASP . . . . . 0.596 ' HB2' ' HB2' ' A' ' 63' ' ' SER . 8.1 t70 -62.68 -53.28 56.88 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-O 121.107 0.479 . . . . 0.0 110.34 177.692 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 67' ' ' TRP . . . . . . . . . . . . . 90.8 m95 -75.22 -27.26 59.47 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 115.788 -0.642 . . . . 0.0 111.256 -179.922 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 68' ' ' ALA . . . . . 0.557 ' O ' ' HG ' ' A' ' 72' ' ' LEU . . . -60.34 -48.54 81.33 Favored 'General case' 0 C--N 1.326 -0.419 0 N-CA-C 110.025 -0.361 . . . . 0.0 110.025 174.995 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 69' ' ' GLU . . . . . . . . . . . . . 17.8 tp10 -56.68 -44.06 81.07 Favored 'General case' 0 C--O 1.233 0.236 0 CA-C-N 115.885 -0.598 . . . . 0.0 110.527 175.358 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 70' ' ' LYS . . . . . . . . . . . . . 59.2 mttp -61.27 -45.1 95.91 Favored 'General case' 0 C--N 1.326 -0.416 0 CA-C-N 116.07 -0.514 . . . . 0.0 110.832 177.597 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 71' ' ' PHE . . . . . . . . . . . . . 69.8 t80 -66.04 -42.79 89.12 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.352 -0.385 . . . . 0.0 111.058 -178.974 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 72' ' ' LEU . . . . . 0.557 ' HG ' ' O ' ' A' ' 68' ' ' ALA . 88.6 mt -63.74 -49.94 71.05 Favored 'General case' 0 C--N 1.326 -0.417 0 CA-C-O 120.857 0.361 . . . . 0.0 110.667 179.805 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 73' ' ' LYS . . . . . . . . . . . . . 5.7 ttpm? -69.32 -32.32 71.36 Favored 'General case' 0 C--N 1.323 -0.548 0 CA-C-N 116.173 -0.467 . . . . 0.0 111.406 -175.653 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 74' ' ' SER . . . . . . . . . . . . . 37.9 p -71.04 -32.25 68.94 Favored 'General case' 0 C--N 1.328 -0.327 0 C-N-CA 120.628 -0.429 . . . . 0.0 110.216 175.955 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 75' ' ' LYS . . . . . 0.402 ' O ' HG22 ' A' ' 80' ' ' VAL . 39.5 mmtt -70.59 -35.92 73.27 Favored 'General case' 0 C--O 1.233 0.203 0 CA-C-O 120.801 0.334 . . . . 0.0 110.687 174.082 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 76' ' ' GLU . . . . . . . . . . . . . 33.9 tt0 -56.22 -44.8 79.9 Favored 'General case' 0 C--N 1.327 -0.403 0 CA-C-N 116.011 -0.54 . . . . 0.0 110.175 176.083 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 77' ' ' ALA . . . . . . . . . . . . . . . -80.96 -24.1 38.32 Favored 'General case' 0 C--N 1.326 -0.423 0 CA-C-N 115.818 -0.628 . . . . 0.0 111.276 177.417 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 78' ' ' ASP . . . . . . . . . . . . . 15.6 t70 -57.35 -54.6 45.03 Favored 'General case' 0 N--CA 1.466 0.343 0 CA-C-N 116.108 -0.496 . . . . 0.0 110.735 179.192 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 79' ' ' GLY . . . . . . . . . . . . . . . 146.52 56.37 0.02 OUTLIER Glycine 0 N--CA 1.443 -0.884 0 C-N-CA 120.335 -0.936 . . . . 0.0 112.656 178.2 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 80' ' ' VAL . . . . . 0.619 ' HB ' ' HB2' ' A' ' 84' ' ' GLN . 32.9 m -121.2 148.88 24.27 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.642 0 CA-C-O 120.763 0.316 . . . . 0.0 110.223 176.67 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 81' ' ' SER . . . . . . . . . . . . . 13.1 p -81.94 172.78 12.88 Favored 'General case' 0 C--N 1.319 -0.733 0 CA-C-N 116.146 -0.479 . . . . 0.0 110.076 176.789 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 82' ' ' VAL . . . . . . . . . . . . . 7.9 p -58.7 -40.08 78.38 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.47 0 CA-C-N 116.49 -0.323 . . . . 0.0 111.463 -176.178 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 83' ' ' SER . . . . . . . . . . . . . 13.7 t -62.86 -33.43 75.25 Favored 'General case' 0 C--N 1.331 -0.206 0 CA-C-O 120.623 0.249 . . . . 0.0 110.734 -178.631 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 84' ' ' GLN . . . . . 0.619 ' HB2' ' HB ' ' A' ' 80' ' ' VAL . 87.1 mm-40 -68.35 -57.49 5.83 Favored 'General case' 0 C--N 1.332 -0.191 0 N-CA-C 109.896 -0.409 . . . . 0.0 109.896 177.464 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 85' ' ' LEU . . . . . 0.49 HD21 ' O ' ' A' ' 72' ' ' LEU . 0.2 OUTLIER -58.93 -39.87 82.86 Favored 'General case' 0 C--N 1.325 -0.462 0 CA-C-N 116.051 -0.522 . . . . 0.0 110.507 -176.618 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' A' A ' 86' ' ' ASN . . . . . . . . . . . . . 62.7 t30 -63.83 -35.67 81.38 Favored 'General case' 0 C--N 1.326 -0.453 0 CA-C-N 115.865 -0.607 . . . . 0.0 110.832 -179.486 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 87' ' ' SER . . . . . . . . . . . . . 75.9 p -78.55 -36.85 44.08 Favored 'General case' 0 CA--C 1.531 0.239 0 C-N-CA 121.033 -0.267 . . . . 0.0 111.143 178.448 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 88' ' ' TYR . . . . . . . . . . . . . 29.8 m-85 -56.6 -47.69 79.05 Favored 'General case' 0 N--CA 1.463 0.182 0 CA-C-O 121.381 0.61 . . . . 0.0 109.728 173.791 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 89' ' ' LYS . . . . . 0.434 ' HB2' ' HE2' ' A' ' 89' ' ' LYS . 21.9 ttmm -64.64 -41.81 95.9 Favored 'General case' 0 C--N 1.327 -0.392 0 CA-C-N 115.173 -0.921 . . . . 0.0 110.554 178.859 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 90' ' ' ASN . . . . . . . . . . . . . 20.3 t30 -53.41 -50.02 66.04 Favored 'General case' 0 C--O 1.237 0.427 0 CA-C-O 120.945 0.402 . . . . 0.0 111.094 177.831 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 91' ' ' TYR . . . . . 0.423 ' O ' ' HB2' ' A' ' 95' ' ' HIS . 34.0 m-85 -60.39 -48.97 79.46 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.335 -0.393 . . . . 0.0 111.112 179.599 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 92' ' ' CYS . . . . . 0.554 ' HA ' ' HB2' ' A' ' 96' ' ' LEU . 51.2 t -71.14 -24.99 62.37 Favored 'General case' 0 C--N 1.324 -0.532 0 CA-C-O 120.878 0.37 . . . . 0.0 111.609 -176.299 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 93' ' ' ARG . . . . . 0.413 ' O ' ' HB3' ' A' ' 97' ' ' SER . 37.5 ttt180 -77.31 -52.24 9.52 Favored 'General case' 0 C--N 1.324 -0.512 0 CA-C-N 116.371 -0.377 . . . . 0.0 111.844 -174.951 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 94' ' ' ASN . . . . . . . . . . . . . 52.9 t30 -103.65 -36.45 7.9 Favored 'General case' 0 C--N 1.33 -0.269 0 C-N-CA 120.937 -0.305 . . . . 0.0 111.812 -175.211 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 95' ' ' HIS . . . . . 0.423 ' HB2' ' O ' ' A' ' 91' ' ' TYR . 42.6 m80 -85.71 -21.14 28.44 Favored 'General case' 0 C--N 1.322 -0.605 0 C-N-CA 120.688 -0.405 . . . . 0.0 111.344 -175.544 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 96' ' ' LEU . . . . . 0.554 ' HB2' ' HA ' ' A' ' 92' ' ' CYS . 89.7 mt -117.66 24.52 11.02 Favored 'General case' 0 C--N 1.324 -0.511 0 CA-C-O 121.124 0.487 . . . . 0.0 110.173 177.123 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 97' ' ' SER . . . . . 0.587 ' OG ' ' HD3' ' A' ' 98' ' ' PRO . 8.1 p -61.16 -43.12 89.37 Favored Pre-proline 0 CA--C 1.541 0.63 0 N-CA-C 113.272 0.841 . . . . 0.0 113.272 -177.548 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 98' ' ' PRO . . . . . 0.587 ' HD3' ' OG ' ' A' ' 97' ' ' SER . 17.5 Cg_exo -66.9 -15.06 46.02 Favored 'Trans proline' 0 C--N 1.361 1.208 0 C-N-CA 121.711 1.607 . . . . 0.0 112.028 -179.924 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 99' ' ' LEU . . . . . 0.405 HD12 HD22 ' A' ' 96' ' ' LEU . 49.9 mt -98.33 -33.69 10.97 Favored 'General case' 0 C--N 1.324 -0.501 0 CA-C-N 115.942 -0.572 . . . . 0.0 110.575 -178.835 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 100' ' ' TYR . . . . . . . . . . . . . 45.0 t80 -53.94 -43.44 69.81 Favored 'General case' 0 N--CA 1.465 0.279 0 CA-C-N 115.931 -0.577 . . . . 0.0 111.956 -175.434 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 101' ' ' MET . . . . . . . . . . . . . 0.7 OUTLIER -80.18 -16.13 55.51 Favored 'General case' 0 C--N 1.328 -0.335 0 N-CA-C 112.175 0.435 . . . . 0.0 112.175 -176.601 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 102' ' ' LYS . . . . . . . . . . . . . 95.4 mttt -88.95 153.64 20.87 Favored 'General case' 0 C--N 1.325 -0.5 0 CA-C-O 121.204 0.526 . . . . 0.0 110.975 -176.731 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 103' ' ' SER . . . . . 0.603 ' HB2' ' CG ' ' A' ' 106' ' ' GLU . 3.1 m -69.69 148.09 49.71 Favored 'General case' 0 C--N 1.324 -0.521 0 CA-C-N 115.651 -0.704 . . . . 0.0 109.174 175.003 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 104' ' ' LEU . . . . . . . . . . . . . 25.1 tp -59.87 -55.37 34.99 Favored 'General case' 0 C--N 1.323 -0.548 0 CA-C-O 120.803 0.335 . . . . 0.0 111.582 -171.466 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 105' ' ' SER . . . . . . . . . . . . . 34.4 t -73.09 -11.87 60.7 Favored 'General case' 0 C--N 1.325 -0.465 0 CA-C-N 116.212 -0.449 . . . . 0.0 111.45 -176.741 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 106' ' ' GLU . . . . . 0.603 ' CG ' ' HB2' ' A' ' 103' ' ' SER . 6.6 mm-40 -88.29 -15.55 35.48 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-O 120.686 0.279 . . . . 0.0 110.657 -178.465 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 107' ' ' ILE . . . . . 0.531 HG13 ' O ' ' A' ' 103' ' ' SER . 81.5 mt -69.78 129.27 34.05 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.376 0 CA-C-N 116.246 -0.433 . . . . 0.0 110.691 -179.49 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 108' ' ' LEU . . . . . . . . . . . . . 65.6 mt -88.3 146.01 37.04 Favored Pre-proline 0 C--N 1.322 -0.618 0 CA-C-N 115.916 -0.583 . . . . 0.0 109.871 178.267 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 109' ' ' PRO . . . . . . . . . . . . . 52.6 Cg_exo -55.38 -31.05 75.79 Favored 'Trans proline' 0 N--CA 1.463 -0.318 0 C-N-CA 122.184 1.923 . . . . 0.0 111.123 173.387 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 110' ' ' ALA . . . . . . . . . . . . . . . -60.98 -37.93 84.21 Favored 'General case' 0 N--CA 1.453 -0.287 0 CA-C-N 115.342 -0.844 . . . . 0.0 111.434 178.319 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 111' ' ' ASP . . . . . 0.432 ' O ' HG13 ' A' ' 115' ' ' ILE . 5.9 m-20 -58.46 -56.58 20.24 Favored 'General case' 0 N--CA 1.466 0.329 0 CA-C-O 120.9 0.381 . . . . 0.0 110.999 -179.247 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 112' ' ' ILE . . . . . . . . . . . . . 18.6 mt -65.43 -43.35 94.66 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.514 0 CA-C-N 115.578 -0.737 . . . . 0.0 110.684 -176.332 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 113' ' ' GLN . . . . . 0.473 ' HA ' HG13 ' A' ' 154' ' ' VAL . 24.7 tp60 -61.96 -40.95 97.32 Favored 'General case' 0 C--N 1.332 -0.195 0 CA-C-N 116.227 -0.442 . . . . 0.0 110.524 -179.927 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 114' ' ' SER . . . . . 0.429 ' O ' ' HG2' ' A' ' 118' ' ' GLU . 48.3 t -59.42 -46.22 89.33 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.088 -0.505 . . . . 0.0 110.492 178.194 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 115' ' ' ILE . . . . . 0.432 HG13 ' O ' ' A' ' 111' ' ' ASP . 79.2 mt -58.87 -57.63 10.37 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.224 0 CA-C-N 116.162 -0.472 . . . . 0.0 110.683 179.812 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 116' ' ' ILE . . . . . . . . . . . . . 47.3 mm -57.86 -38.48 66.22 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.371 0 CA-C-N 116.196 -0.456 . . . . 0.0 111.55 -177.51 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 117' ' ' ASN . . . . . . . . . . . . . 7.8 t30 -65.93 -38.32 88.35 Favored 'General case' 0 C--N 1.327 -0.384 0 CA-C-N 116.457 -0.338 . . . . 0.0 111.707 -175.452 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 118' ' ' GLU . . . . . 0.429 ' HG2' ' O ' ' A' ' 114' ' ' SER . 11.0 pt-20 -96.43 -12.41 24.28 Favored 'General case' 0 C--N 1.33 -0.279 0 N-CA-C 112.239 0.459 . . . . 0.0 112.239 -176.255 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 119' ' ' THR . . . . . . . . . . . . . 90.3 m -68.95 113.7 6.59 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-O 121.259 0.552 . . . . 0.0 110.103 177.98 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 120' ' ' LYS . . . . . . . . . . . . . 47.9 mttp -93.8 81.28 4.22 Favored 'General case' 0 C--N 1.322 -0.618 0 CA-C-N 115.726 -0.67 . . . . 0.0 110.429 -174.924 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 121' ' ' LEU . . . . . . . . . . . . . 85.2 mt -133.86 -175.48 3.85 Favored 'General case' 0 C--N 1.325 -0.499 0 CA-C-N 115.308 -0.86 . . . . 0.0 109.695 179.825 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 122' ' ' ALA . . . . . . . . . . . . . . . -71.78 158.3 36.36 Favored 'General case' 0 C--N 1.325 -0.489 0 CA-C-O 120.83 0.348 . . . . 0.0 111.097 -179.045 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 123' ' ' LYS . . . . . . . . . . . . . 54.9 mtpt -60.04 -40.2 88.54 Favored 'General case' 0 C--N 1.33 -0.244 0 CA-C-N 115.858 -0.61 . . . . 0.0 111.3 -176.08 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 124' ' ' ASN . . . . . . . . . . . . . 20.4 p-10 -73.36 -30.52 63.36 Favored 'General case' 0 C--N 1.326 -0.442 0 CA-C-N 116.077 -0.51 . . . . 0.0 110.726 -179.76 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 125' ' ' THR . . . . . 0.403 ' O ' HG13 ' A' ' 129' ' ' ILE . 8.0 m -70.5 -41.17 73.02 Favored 'General case' 0 C--N 1.323 -0.578 0 CA-C-N 116.326 -0.397 . . . . 0.0 110.623 178.982 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 126' ' ' LEU . . . . . . . . . . . . . 91.1 mt -61.74 -44.02 97.71 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 116.105 -0.498 . . . . 0.0 110.675 178.348 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 127' ' ' LYS . . . . . 0.629 ' HG2' HG13 ' A' ' 156' ' ' ILE . 87.8 mttt -64.45 -39.0 92.99 Favored 'General case' 0 C--N 1.331 -0.213 0 CA-C-N 116.126 -0.488 . . . . 0.0 111.005 178.985 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 128' ' ' ALA . . . . . . . . . . . . . . . -58.32 -44.41 88.62 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.276 -0.42 . . . . 0.0 110.895 -179.874 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 129' ' ' ILE . . . . . 0.403 HG13 ' O ' ' A' ' 125' ' ' THR . 65.2 mt -61.97 -47.81 91.45 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.37 0 CA-C-N 115.86 -0.609 . . . . 0.0 110.446 179.024 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 130' ' ' ARG . . . . . 0.415 HH11 ' HD2' ' A' ' 130' ' ' ARG . 10.4 ttp180 -64.95 -43.82 91.46 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 115.864 -0.607 . . . . 0.0 110.952 -178.188 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 131' ' ' ASN . . . . . . . . . . . . . 9.9 t30 -62.12 -44.56 96.38 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.421 -0.354 . . . . 0.0 111.084 -179.317 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 132' ' ' THR . . . . . 0.485 ' O ' HG13 ' A' ' 136' ' ' ILE . 35.8 m -58.17 -48.22 80.98 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.268 -0.424 . . . . 0.0 110.292 178.844 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 133' ' ' ALA . . . . . . . . . . . . . . . -65.1 -38.83 91.98 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.131 -0.486 . . . . 0.0 110.991 178.905 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 134' ' ' SER . . . . . 0.443 ' HA ' ' HB3' ' A' ' 151' ' ' ALA . 18.5 t -61.76 -41.92 98.31 Favored 'General case' 0 C--N 1.327 -0.393 0 CA-C-N 116.048 -0.524 . . . . 0.0 110.622 -179.199 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 135' ' ' GLN . . . . . . . . . . . . . 49.7 mt-30 -66.8 -31.0 71.35 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 116.544 -0.298 . . . . 0.0 111.322 178.101 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 136' ' ' ILE . . . . . 0.485 HG13 ' O ' ' A' ' 132' ' ' THR . 76.1 mt -65.95 -50.93 66.44 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.225 0 CA-C-O 120.807 0.337 . . . . 0.0 110.202 176.761 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 137' ' ' PHE . . . . . 0.491 ' O ' HG13 ' A' ' 141' ' ' ILE . 66.0 m-85 -62.7 -37.46 86.57 Favored 'General case' 0 C--N 1.331 -0.213 0 CA-C-N 116.279 -0.418 . . . . 0.0 110.539 176.431 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 138' ' ' ARG . . . . . . . . . . . . . 26.5 ttp85 -60.1 -44.28 94.94 Favored 'General case' 0 N--CA 1.45 -0.469 0 CA-C-N 116.11 -0.496 . . . . 0.0 110.549 178.88 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 139' ' ' LEU . . . . . . . . . . . . . 65.9 tp -60.29 -34.92 74.44 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 115.678 -0.692 . . . . 0.0 110.562 177.87 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 140' ' ' ALA . . . . . 0.481 ' HB1' ' HB3' ' A' ' 145' ' ' ALA . . . -72.62 -34.65 67.48 Favored 'General case' 0 C--N 1.323 -0.579 0 CA-C-N 115.975 -0.557 . . . . 0.0 110.868 178.512 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 141' ' ' ILE . . . . . 0.562 ' HA ' ' O ' ' A' ' 146' ' ' ILE . 81.7 mt -60.31 -49.96 82.18 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.235 0 CA-C-N 116.708 -0.224 . . . . 0.0 111.281 176.982 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 142' ' ' GLU . . . . . . . . . . . . . 14.9 pt-20 -70.08 -18.78 63.28 Favored 'General case' 0 N--CA 1.464 0.252 0 CA-C-O 120.943 0.402 . . . . 0.0 111.298 -179.216 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 143' ' ' ASN . . . . . . . . . . . . . 20.8 m-80 -97.74 6.22 48.18 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.37 -0.377 . . . . 0.0 110.515 175.32 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 144' ' ' ARG . . . . . . . . . . . . . 44.7 mtt180 60.1 32.45 20.97 Favored 'General case' 0 N--CA 1.464 0.26 0 CA-C-N 115.65 -0.705 . . . . 0.0 112.037 173.966 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 145' ' ' ALA . . . . . 0.481 ' HB3' ' HB1' ' A' ' 140' ' ' ALA . . . -88.4 -32.09 18.51 Favored 'General case' 0 C--N 1.324 -0.524 0 CA-C-O 121.073 0.463 . . . . 0.0 109.754 175.009 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 146' ' ' ILE . . . . . 0.562 ' O ' ' HA ' ' A' ' 141' ' ' ILE . 16.5 tt -143.11 144.5 23.81 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.444 0 CA-C-N 115.32 -0.854 . . . . 0.0 108.882 176.293 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 147' ' ' ASP . . . . . . . . . . . . . 34.6 t70 -96.89 -0.45 47.67 Favored 'General case' 0 C--N 1.323 -0.551 0 CA-C-O 120.953 0.406 . . . . 0.0 111.887 -172.823 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 148' ' ' PHE . . . . . 0.453 ' H ' HG12 ' A' ' 146' ' ' ILE . 46.7 p90 -144.43 163.28 34.27 Favored 'General case' 0 C--N 1.324 -0.52 0 O-C-N 122.026 -0.421 . . . . 0.0 111.07 -175.949 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 149' ' ' ASN . . . . . 0.505 ' HB2' HD11 ' A' ' 141' ' ' ILE . 47.1 t-20 -120.67 89.84 45.36 Favored Pre-proline 0 C--N 1.328 -0.365 0 CA-C-N 116.24 -0.436 . . . . 0.0 110.394 -177.492 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 150' ' ' PRO . . . . . . . . . . . . . 35.9 Cg_endo -66.15 -22.08 54.69 Favored 'Trans proline' 0 C--N 1.343 0.246 0 C-N-CA 122.59 2.193 . . . . 0.0 112.173 -178.223 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 151' ' ' ALA . . . . . 0.443 ' HB3' ' HA ' ' A' ' 134' ' ' SER . . . -70.75 -30.66 67.22 Favored 'General case' 0 C--N 1.327 -0.399 0 CA-C-N 116.269 -0.423 . . . . 0.0 110.553 179.694 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 152' ' ' ASP . . . . . . . . . . . . . 9.3 t70 -77.81 -15.29 59.19 Favored 'General case' 0 C--N 1.329 -0.306 0 N-CA-C 109.195 -0.669 . . . . 0.0 109.195 178.561 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 153' ' ' TYR . . . . . . . . . . . . . 73.3 t80 -83.18 -16.44 46.58 Favored 'General case' 0 C--N 1.327 -0.411 0 CA-C-N 115.656 -0.702 . . . . 0.0 109.453 177.396 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 154' ' ' VAL . . . . . 0.473 HG13 ' HA ' ' A' ' 113' ' ' GLN . 63.2 t -71.83 136.26 26.13 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.422 0 CA-C-N 115.724 -0.671 . . . . 0.0 110.006 177.474 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 155' ' ' ARG . . . . . 0.424 HH11 ' HD2' ' A' ' 155' ' ' ARG . 40.4 mtt180 -98.43 141.43 31.31 Favored 'General case' 0 C--N 1.322 -0.627 0 CA-C-N 115.838 -0.619 . . . . 0.0 111.167 -177.535 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 156' ' ' ILE . . . . . 0.629 HG13 ' HG2' ' A' ' 127' ' ' LYS . 46.8 mm -98.22 107.27 40.51 Favored Pre-proline 0 C--N 1.321 -0.672 0 N-CA-C 108.593 -0.891 . . . . 0.0 108.593 170.922 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 157' ' ' PRO . . . . . . . . . . . . . 58.8 Cg_endo -75.19 129.39 12.13 Favored 'Trans proline' 0 N--CA 1.451 -0.976 0 C-N-CA 121.281 1.321 . . . . 0.0 113.288 -173.754 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 158' ' ' LYS . . . . . . . . . . . . . 12.4 ptmm? -127.36 19.97 6.82 Favored 'General case' 0 C--N 1.319 -0.73 0 N-CA-C 107.179 -1.415 . . . . 0.0 107.179 171.054 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 159' ' ' ILE . . . . . . . . . . . . . 0.2 OUTLIER -105.62 -22.94 4.64 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.588 0 CA-C-N 112.959 -1.928 . . . . 0.0 110.18 -175.057 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 160' ' ' ALA . . . . . . . . . . . . . . . -78.5 -173.29 3.28 Favored 'General case' 0 C--N 1.326 -0.449 0 CA-C-N 115.549 -0.751 . . . . 0.0 111.475 -175.326 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 161' ' ' LEU . . . . . . . . . . . . . 92.0 mt -56.99 122.43 12.28 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 115.756 -0.657 . . . . 0.0 110.468 176.724 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 162' ' ' GLU . . . . . . . . . . . . . 46.2 mt-10 -81.42 169.87 16.66 Favored 'General case' 0 C--N 1.325 -0.499 0 CA-C-O 121.271 0.558 . . . . 0.0 111.043 -179.93 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 163' ' ' HIS . . . . . . . . . . . . . 26.4 p80 -70.92 168.17 17.5 Favored 'General case' 0 C--N 1.326 -0.428 0 CA-C-N 115.425 -0.807 . . . . 0.0 111.833 -176.131 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 164' ' ' HIS . . . . . 0.57 ' O ' ' HB2' ' A' ' 165' ' ' HIS . 6.3 p80 -55.91 136.32 51.69 Favored 'General case' 0 C--O 1.235 0.317 0 CA-C-N 115.789 -0.641 . . . . 0.0 109.469 170.897 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 165' ' ' HIS . . . . . 0.57 ' HB2' ' O ' ' A' ' 164' ' ' HIS . 20.3 m170 79.62 138.73 0.07 Allowed 'General case' 0 N--CA 1.47 0.567 0 O-C-N 124.223 0.952 . . . . 0.0 110.055 -172.537 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 166' ' ' HIS . . . . . . . . . . . . . 35.8 t-80 72.24 93.02 0.08 Allowed 'General case' 0 C--N 1.329 -0.314 0 O-C-N 124.1 0.875 . . . . 0.0 110.109 -172.403 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 167' ' ' HIS . . . . . . . . . . . . . 78.1 m-70 -89.99 120.55 31.3 Favored 'General case' 0 C--N 1.323 -0.556 0 CA-C-N 115.692 -0.685 . . . . 0.0 110.113 179.649 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 168' ' ' HIS . . . . . . . . . . . . . 17.0 t-80 . . . . . 0 C--O 1.246 0.92 0 CA-C-O 118.477 -0.773 . . . . 0.0 109.614 -176.303 . . . . . . . . 0 0 . 1 . 013 nuclear build full ' A' A ' 61' ' ' ARG . . . . . . . . . . . . . 36.8 ttm180 . . . . . 0 N--CA 1.478 0.939 0 N-CA-C 109.83 -0.433 . . . . 0.0 109.83 . . . . . . . . . 0 0 . 1 . 013 nuclear build full ' A' A ' 62' ' ' ASP . . . . . . . . . . . . . 8.3 m-20 -112.62 -175.92 2.79 Favored 'General case' 0 C--N 1.324 -0.517 0 CA-C-N 116.062 -0.517 . . . . 0.0 110.803 -177.643 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 63' ' ' SER . . . . . 0.599 ' HA ' ' HA ' ' A' ' 103' ' ' SER . 18.7 m -93.89 158.4 15.66 Favored 'General case' 0 C--O 1.242 0.693 0 CA-C-N 115.824 -0.625 . . . . 0.0 111.177 -177.461 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 64' ' ' PHE . . . . . 0.433 ' HB2' HD11 ' A' ' 107' ' ' ILE . 79.5 t80 -60.01 -37.18 78.97 Favored 'General case' 0 C--N 1.325 -0.484 0 CA-C-N 115.206 -0.906 . . . . 0.0 110.32 179.479 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 65' ' ' GLY . . . . . . . . . . . . . . . -58.19 -40.83 94.33 Favored Glycine 0 N--CA 1.451 -0.305 0 C-N-CA 121.145 -0.55 . . . . 0.0 112.692 177.606 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 66' ' ' ASP . . . . . . . . . . . . . 7.3 m-20 -59.9 -53.2 60.62 Favored 'General case' 0 C--O 1.236 0.357 0 CA-C-O 121.375 0.607 . . . . 0.0 110.756 179.04 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 67' ' ' TRP . . . . . 0.424 ' CE3' ' HD3' ' A' ' 70' ' ' LYS . 87.4 m95 -76.91 -23.25 52.52 Favored 'General case' 0 C--N 1.325 -0.494 0 CA-C-N 115.614 -0.721 . . . . 0.0 111.955 -175.804 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 68' ' ' ALA . . . . . 0.597 ' O ' ' HG ' ' A' ' 72' ' ' LEU . . . -63.51 -48.59 76.95 Favored 'General case' 0 C--N 1.325 -0.473 0 CA-C-O 120.837 0.351 . . . . 0.0 110.573 175.969 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 69' ' ' GLU . . . . . 0.515 ' HA ' HD12 ' A' ' 72' ' ' LEU . 26.4 mt-10 -74.2 -22.12 59.52 Favored 'General case' 0 C--N 1.327 -0.375 0 CA-C-N 116.469 -0.332 . . . . 0.0 110.939 -179.965 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 70' ' ' LYS . . . . . 0.424 ' HD3' ' CE3' ' A' ' 67' ' ' TRP . 60.9 tttp -68.19 -41.81 80.87 Favored 'General case' 0 C--N 1.326 -0.43 0 N-CA-C 109.568 -0.53 . . . . 0.0 109.568 172.637 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 71' ' ' PHE . . . . . . . . . . . . . 61.9 t80 -61.61 -44.09 97.65 Favored 'General case' 0 N--CA 1.454 -0.251 0 CA-C-N 116.038 -0.528 . . . . 0.0 109.935 174.2 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 72' ' ' LEU . . . . . 0.597 ' HG ' ' O ' ' A' ' 68' ' ' ALA . 87.3 mt -56.87 -43.96 81.74 Favored 'General case' 0 C--N 1.327 -0.38 0 CA-C-N 116.162 -0.472 . . . . 0.0 110.361 176.802 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 73' ' ' LYS . . . . . . . . . . . . . 24.8 ttmm -64.49 -37.08 86.29 Favored 'General case' 0 C--N 1.326 -0.422 0 CA-C-N 115.763 -0.653 . . . . 0.0 111.207 -179.358 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 74' ' ' SER . . . . . . . . . . . . . 96.8 p -68.89 -34.13 74.92 Favored 'General case' 0 C--O 1.226 -0.181 0 C-N-CA 120.588 -0.445 . . . . 0.0 110.458 179.288 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 75' ' ' LYS . . . . . 0.659 ' HE2' ' HA ' ' A' ' 75' ' ' LYS . 11.3 mmpt? -70.04 -39.47 75.72 Favored 'General case' 0 C--O 1.233 0.189 0 CA-C-O 121.117 0.484 . . . . 0.0 109.989 175.589 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 76' ' ' GLU . . . . . . . . . . . . . 33.2 tt0 -57.17 -46.05 83.13 Favored 'General case' 0 C--N 1.324 -0.517 0 CA-C-N 115.222 -0.899 . . . . 0.0 110.867 177.394 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 77' ' ' ALA . . . . . . . . . . . . . . . -80.31 -20.07 45.15 Favored 'General case' 0 C--N 1.323 -0.567 0 CA-C-N 115.762 -0.654 . . . . 0.0 111.518 179.638 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 78' ' ' ASP . . . . . . . . . . . . . 20.6 t70 -68.22 -53.22 26.3 Favored 'General case' 0 C--N 1.327 -0.384 0 CA-C-O 121.003 0.43 . . . . 0.0 110.604 -179.894 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 79' ' ' GLY . . . . . . . . . . . . . . . 137.51 65.77 0.05 OUTLIER Glycine 0 N--CA 1.447 -0.595 0 C-N-CA 120.518 -0.848 . . . . 0.0 112.42 179.539 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 80' ' ' VAL . . . . . . . . . . . . . 35.0 m -121.69 150.19 24.94 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.558 0 CA-C-O 120.737 0.303 . . . . 0.0 110.407 177.253 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 81' ' ' SER . . . . . . . . . . . . . 45.9 t -76.09 168.57 19.8 Favored 'General case' 0 C--N 1.324 -0.501 0 CA-C-N 116.398 -0.365 . . . . 0.0 110.252 179.02 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 82' ' ' VAL . . . . . . . . . . . . . 67.4 t -56.87 -51.07 72.54 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.215 0 CA-C-N 116.381 -0.372 . . . . 0.0 110.782 -178.657 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 83' ' ' SER . . . . . . . . . . . . . 14.9 m -59.73 -28.07 67.03 Favored 'General case' 0 C--N 1.327 -0.381 0 CA-C-N 116.361 -0.381 . . . . 0.0 111.358 -178.912 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 84' ' ' GLN . . . . . . . . . . . . . 6.5 tp-100 -80.48 -48.18 13.19 Favored 'General case' 0 C--N 1.327 -0.38 0 CA-C-O 120.824 0.345 . . . . 0.0 110.458 -179.328 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 85' ' ' LEU . . . . . . . . . . . . . 51.2 tp -64.55 -42.36 95.75 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-O 121.105 0.479 . . . . 0.0 110.229 178.738 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 86' ' ' ASN . . . . . . . . . . . . . 50.2 t30 -63.42 -33.9 76.56 Favored 'General case' 0 C--N 1.325 -0.457 0 CA-C-N 115.626 -0.715 . . . . 0.0 110.062 177.627 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 87' ' ' SER . . . . . . . . . . . . . 9.1 t -63.31 -45.19 92.46 Favored 'General case' 0 C--N 1.329 -0.283 0 N-CA-C 109.634 -0.506 . . . . 0.0 109.634 175.7 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 88' ' ' TYR . . . . . . . . . . . . . 18.5 m-85 -58.88 -43.61 90.96 Favored 'General case' 0 C--O 1.234 0.289 0 CA-C-N 116.465 -0.334 . . . . 0.0 110.531 176.708 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 89' ' ' LYS . . . . . 0.591 ' HG2' HD13 ' A' ' 72' ' ' LEU . 67.5 mttm -60.59 -42.35 96.57 Favored 'General case' 0 C--N 1.332 -0.163 0 CA-C-N 116.138 -0.483 . . . . 0.0 110.398 176.983 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 90' ' ' ASN . . . . . . . . . . . . . 26.3 t30 -56.95 -44.84 82.98 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.002 -0.545 . . . . 0.0 111.17 178.144 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 91' ' ' TYR . . . . . . . . . . . . . 63.3 m-85 -63.52 -49.2 74.47 Favored 'General case' 0 C--N 1.325 -0.458 0 C-N-CA 120.891 -0.323 . . . . 0.0 111.094 179.384 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 92' ' ' CYS . . . . . 0.471 ' HA ' HD12 ' A' ' 96' ' ' LEU . 58.6 m -65.88 -42.54 90.21 Favored 'General case' 0 C--N 1.326 -0.443 0 CA-C-O 121.064 0.459 . . . . 0.0 111.574 -177.308 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 93' ' ' ARG . . . . . . . . . . . . . 10.0 ttt180 -82.35 -51.06 8.24 Favored 'General case' 0 C--N 1.323 -0.553 0 N-CA-C 112.434 0.531 . . . . 0.0 112.434 -174.353 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 94' ' ' ASN . . . . . . . . . . . . . 31.9 t30 -89.53 -40.5 12.6 Favored 'General case' 0 C--N 1.325 -0.475 0 N-CA-C 112.121 0.415 . . . . 0.0 112.121 -172.04 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 95' ' ' HIS . . . . . . . . . . . . . 82.4 m-70 -85.46 -34.38 21.66 Favored 'General case' 0 C--N 1.322 -0.629 0 O-C-N 122.056 -0.402 . . . . 0.0 111.435 -176.755 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 96' ' ' LEU . . . . . 0.472 HD22 HD22 ' A' ' 99' ' ' LEU . 86.9 mt -106.46 27.07 9.13 Favored 'General case' 0 C--N 1.323 -0.574 0 CA-C-N 116.374 -0.376 . . . . 0.0 111.164 -176.647 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 97' ' ' SER . . . . . 0.444 ' N ' ' HD2' ' A' ' 98' ' ' PRO . 15.3 m -46.92 -53.05 29.04 Favored Pre-proline 0 CA--C 1.541 0.608 0 N-CA-C 112.715 0.635 . . . . 0.0 112.715 -178.985 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 98' ' ' PRO . . . . . 0.444 ' HD2' ' N ' ' A' ' 97' ' ' SER . 38.0 Cg_endo -66.44 -20.82 54.24 Favored 'Trans proline' 0 C--N 1.356 0.954 0 C-N-CA 121.936 1.757 . . . . 0.0 113.285 -178.185 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 99' ' ' LEU . . . . . 0.571 HD21 HG12 ' A' ' 112' ' ' ILE . 11.2 mp -88.89 -27.79 20.76 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-O 120.903 0.383 . . . . 0.0 110.476 -179.559 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 100' ' ' TYR . . . . . . . . . . . . . 5.9 t80 -57.76 -31.75 66.8 Favored 'General case' 0 C--N 1.325 -0.472 0 CA-C-N 115.541 -0.754 . . . . 0.0 111.394 -174.962 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 101' ' ' MET . . . . . . . . . . . . . 66.3 mtt -102.17 14.05 33.01 Favored 'General case' 0 C--N 1.327 -0.394 0 CA-C-N 116.217 -0.447 . . . . 0.0 111.334 -178.447 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 102' ' ' LYS . . . . . . . . . . . . . 96.5 mttt -103.26 151.11 23.05 Favored 'General case' 0 C--N 1.326 -0.422 0 N-CA-C 110.136 -0.32 . . . . 0.0 110.136 176.825 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 103' ' ' SER . . . . . 0.599 ' HA ' ' HA ' ' A' ' 63' ' ' SER . 46.6 t -75.85 161.41 29.02 Favored 'General case' 0 C--N 1.322 -0.588 0 N-CA-C 109.084 -0.71 . . . . 0.0 109.084 171.296 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 104' ' ' LEU . . . . . 0.42 ' HB3' HD12 ' A' ' 146' ' ' ILE . 90.3 mt -58.91 -28.93 66.66 Favored 'General case' 0 C--N 1.323 -0.56 0 CA-C-O 121.041 0.448 . . . . 0.0 110.613 179.208 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 105' ' ' SER . . . . . . . . . . . . . 26.4 t -87.97 -7.57 56.91 Favored 'General case' 0 CA--C 1.534 0.357 0 CA-C-N 115.98 -0.555 . . . . 0.0 111.472 -179.269 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 106' ' ' GLU . . . . . 0.528 ' HG3' ' HB3' ' A' ' 103' ' ' SER . 45.2 mt-10 -96.67 -6.38 36.68 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-O 120.792 0.33 . . . . 0.0 111.049 -177.553 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 107' ' ' ILE . . . . . 0.433 HD11 ' HB2' ' A' ' 64' ' ' PHE . 72.4 mt -93.89 122.23 45.2 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.594 0 CA-C-O 120.972 0.415 . . . . 0.0 110.778 -176.963 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 108' ' ' LEU . . . . . 0.428 ' HB2' ' HB2' ' A' ' 111' ' ' ASP . 86.4 mt -96.72 143.79 26.72 Favored Pre-proline 0 C--N 1.326 -0.445 0 CA-C-N 115.944 -0.571 . . . . 0.0 110.641 -178.88 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 109' ' ' PRO . . . . . 0.603 ' HB3' ' HB2' ' A' ' 153' ' ' TYR . 50.2 Cg_exo -55.31 -45.33 40.95 Favored 'Trans proline' 0 CA--C 1.531 0.374 0 C-N-CA 122.81 2.34 . . . . 0.0 112.378 176.823 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 110' ' ' ALA . . . . . . . . . . . . . . . -69.34 -25.11 64.04 Favored 'General case' 0 C--N 1.332 -0.186 0 CA-C-N 116.497 -0.32 . . . . 0.0 111.134 -179.46 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 111' ' ' ASP . . . . . 0.428 ' HB2' ' HB2' ' A' ' 108' ' ' LEU . 38.2 t70 -65.99 -45.14 82.7 Favored 'General case' 0 C--N 1.326 -0.437 0 CA-C-O 121.131 0.491 . . . . 0.0 109.785 179.309 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 112' ' ' ILE . . . . . 0.571 HG12 HD21 ' A' ' 99' ' ' LEU . 19.2 mt -69.14 -39.95 79.98 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.295 0 CA-C-N 115.752 -0.658 . . . . 0.0 110.071 176.557 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 113' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -58.18 -43.22 87.4 Favored 'General case' 0 C--N 1.331 -0.215 0 CA-C-N 115.892 -0.595 . . . . 0.0 109.89 178.877 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 114' ' ' SER . . . . . . . . . . . . . 40.8 t -56.12 -50.25 71.63 Favored 'General case' 0 C--N 1.331 -0.231 0 CA-C-N 116.039 -0.528 . . . . 0.0 110.226 177.052 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 115' ' ' ILE . . . . . . . . . . . . . 67.1 mt -58.15 -44.44 87.59 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.193 0 CA-C-N 116.372 -0.376 . . . . 0.0 111.002 179.309 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 116' ' ' ILE . . . . . 0.411 HG12 ' O ' ' A' ' 112' ' ' ILE . 47.3 mm -62.81 -41.35 92.17 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.326 0 CA-C-O 120.821 0.343 . . . . 0.0 111.1 -179.93 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 117' ' ' ASN . . . . . . . . . . . . . 8.4 t30 -69.98 -33.67 72.37 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-N 116.391 -0.368 . . . . 0.0 111.165 -179.251 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 118' ' ' GLU . . . . . . . . . . . . . 28.3 mm-40 -80.1 -21.94 42.74 Favored 'General case' 0 C--N 1.327 -0.396 0 CA-C-N 116.251 -0.431 . . . . 0.0 110.846 179.48 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 119' ' ' THR . . . . . . . . . . . . . 61.7 m -78.38 111.04 13.98 Favored 'General case' 0 N--CA 1.448 -0.526 0 N-CA-C 108.937 -0.764 . . . . 0.0 108.937 173.897 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 120' ' ' LYS . . . . . 0.456 ' C ' HD12 ' A' ' 121' ' ' LEU . 96.2 mttt -111.61 78.22 1.1 Allowed 'General case' 0 C--N 1.32 -0.693 0 CA-C-O 121.992 0.901 . . . . 0.0 110.993 -173.001 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 121' ' ' LEU . . . . . 0.458 HD22 HG21 ' A' ' 125' ' ' THR . 8.0 mp -131.61 -174.44 3.41 Favored 'General case' 0 C--N 1.326 -0.426 0 CA-C-N 114.093 -1.412 . . . . 0.0 108.825 178.462 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 122' ' ' ALA . . . . . . . . . . . . . . . -59.88 148.54 34.49 Favored 'General case' 0 C--N 1.326 -0.431 0 CA-C-O 120.611 0.243 . . . . 0.0 110.568 177.296 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 123' ' ' LYS . . . . . . . . . . . . . 56.0 mtmt -60.79 -29.46 69.46 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-N 116.332 -0.395 . . . . 0.0 111.241 -176.719 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 124' ' ' ASN . . . . . . . . . . . . . 0.2 OUTLIER -59.93 -37.97 81.02 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.193 -0.458 . . . . 0.0 109.882 176.959 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 125' ' ' THR . . . . . 0.458 HG21 HD22 ' A' ' 121' ' ' LEU . 17.7 m -71.82 -39.63 69.67 Favored 'General case' 0 C--N 1.327 -0.394 0 CA-C-N 115.921 -0.582 . . . . 0.0 110.361 179.512 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 126' ' ' LEU . . . . . . . . . . . . . 93.3 mt -61.72 -40.91 96.73 Favored 'General case' 0 C--N 1.327 -0.383 0 CA-C-N 116.051 -0.522 . . . . 0.0 110.345 177.802 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 127' ' ' LYS . . . . . . . . . . . . . 90.6 mttt -66.18 -31.83 72.9 Favored 'General case' 0 C--N 1.327 -0.377 0 CA-C-N 116.025 -0.534 . . . . 0.0 111.399 177.961 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 128' ' ' ALA . . . . . . . . . . . . . . . -62.25 -43.96 97.64 Favored 'General case' 0 C--N 1.325 -0.457 0 CA-C-O 120.766 0.317 . . . . 0.0 110.602 178.923 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 129' ' ' ILE . . . . . . . . . . . . . 35.4 mt -67.16 -43.67 88.37 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.313 0 CA-C-N 116.145 -0.479 . . . . 0.0 109.736 177.264 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 130' ' ' ARG . . . . . 0.588 ' HB2' HD11 ' A' ' 156' ' ' ILE . 16.4 tpt85 -55.8 -51.74 66.39 Favored 'General case' 0 C--N 1.331 -0.219 0 CA-C-N 115.35 -0.841 . . . . 0.0 111.005 178.159 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 131' ' ' ASN . . . . . . . . . . . . . 14.4 m-80 -58.59 -54.41 47.42 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.202 -0.454 . . . . 0.0 111.109 179.986 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 132' ' ' THR . . . . . 0.419 ' O ' HG13 ' A' ' 136' ' ' ILE . 33.6 m -52.9 -50.7 63.38 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-N 116.136 -0.483 . . . . 0.0 111.255 -178.519 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 133' ' ' ALA . . . . . . . . . . . . . . . -61.45 -48.46 81.06 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.301 -0.409 . . . . 0.0 111.39 -178.266 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 134' ' ' SER . . . . . 0.498 ' O ' ' HG2' ' A' ' 138' ' ' ARG . 52.9 p -62.44 -36.35 82.15 Favored 'General case' 0 C--N 1.331 -0.214 0 CA-C-N 116.569 -0.287 . . . . 0.0 111.157 -177.918 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 135' ' ' GLN . . . . . 0.436 ' HA ' ' HG2' ' A' ' 138' ' ' ARG . 85.2 mm-40 -66.37 -36.26 82.43 Favored 'General case' 0 C--N 1.333 -0.138 0 CA-C-N 116.576 -0.284 . . . . 0.0 111.266 -178.723 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 136' ' ' ILE . . . . . 0.419 HG13 ' O ' ' A' ' 132' ' ' THR . 79.5 mt -66.75 -45.68 87.42 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.505 0 CA-C-O 120.786 0.327 . . . . 0.0 110.73 179.624 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 137' ' ' PHE . . . . . 0.477 ' O ' HG13 ' A' ' 141' ' ' ILE . 58.5 m-85 -67.47 -45.21 76.6 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.373 -0.376 . . . . 0.0 111.566 -178.962 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 138' ' ' ARG . . . . . 0.498 ' HG2' ' O ' ' A' ' 134' ' ' SER . 13.3 ptm180 -65.17 -33.02 75.02 Favored 'General case' 0 N--CA 1.463 0.19 0 C-N-CA 120.796 -0.362 . . . . 0.0 110.77 -179.327 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 139' ' ' LEU . . . . . . . . . . . . . 54.6 tp -63.93 -41.19 97.71 Favored 'General case' 0 C--N 1.33 -0.239 0 CA-C-O 121.014 0.435 . . . . 0.0 109.901 176.608 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 140' ' ' ALA . . . . . . . . . . . . . . . -64.62 -37.67 88.37 Favored 'General case' 0 C--N 1.326 -0.42 0 CA-C-N 116.033 -0.531 . . . . 0.0 110.499 176.629 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 141' ' ' ILE . . . . . 0.477 HG13 ' O ' ' A' ' 137' ' ' PHE . 78.4 mt -63.7 -42.86 97.43 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.299 0 CA-C-N 116.22 -0.445 . . . . 0.0 110.469 177.138 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 142' ' ' GLU . . . . . 0.459 ' HG3' ' O ' ' A' ' 138' ' ' ARG . 43.5 mt-10 -69.07 -8.9 49.44 Favored 'General case' 0 N--CA 1.463 0.219 0 CA-C-N 116.248 -0.433 . . . . 0.0 111.558 179.758 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 143' ' ' ASN . . . . . . . . . . . . . 43.2 m-80 -114.38 14.52 17.95 Favored 'General case' 0 C--N 1.327 -0.378 0 CA-C-N 116.656 -0.247 . . . . 0.0 111.425 177.617 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 144' ' ' ARG . . . . . . . . . . . . . 99.4 mtt180 62.12 26.24 15.76 Favored 'General case' 0 N--CA 1.471 0.59 0 O-C-N 123.434 0.459 . . . . 0.0 112.063 176.738 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 145' ' ' ALA . . . . . . . . . . . . . . . -90.48 -23.52 20.94 Favored 'General case' 0 C--N 1.324 -0.537 0 CA-C-O 120.823 0.344 . . . . 0.0 110.924 -179.35 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 146' ' ' ILE . . . . . 0.466 ' O ' ' HA ' ' A' ' 141' ' ' ILE . 13.3 tt -159.95 157.62 2.83 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.596 0 N-CA-C 109.231 -0.655 . . . . 0.0 109.231 178.131 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 147' ' ' ASP . . . . . . . . . . . . . 31.2 t70 -126.62 27.54 6.08 Favored 'General case' 0 C--N 1.322 -0.598 0 CA-C-O 121.849 0.833 . . . . 0.0 110.188 -179.436 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 148' ' ' PHE . . . . . 0.437 ' H ' HG12 ' A' ' 146' ' ' ILE . 78.2 t80 -141.26 132.73 26.85 Favored 'General case' 0 C--N 1.319 -0.732 0 CA-C-N 115.579 -0.737 . . . . 0.0 109.589 -179.906 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 149' ' ' ASN . . . . . . . . . . . . . 48.6 t-20 -114.93 92.6 31.14 Favored Pre-proline 0 C--N 1.322 -0.607 0 CA-C-N 116.488 -0.324 . . . . 0.0 110.322 -179.657 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 150' ' ' PRO . . . . . . . . . . . . . 23.7 Cg_exo -64.71 -27.9 60.21 Favored 'Trans proline' 0 C--N 1.344 0.297 0 C-N-CA 122.803 2.335 . . . . 0.0 112.243 -178.714 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 151' ' ' ALA . . . . . 0.424 ' HA ' HG23 ' A' ' 154' ' ' VAL . . . -73.5 -21.32 60.44 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.087 -0.506 . . . . 0.0 111.219 -177.063 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 152' ' ' ASP . . . . . . . . . . . . . 3.9 t70 -76.58 -17.08 59.4 Favored 'General case' 0 C--N 1.326 -0.455 0 CA-C-O 121.357 0.599 . . . . 0.0 109.865 -179.877 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 153' ' ' TYR . . . . . 0.603 ' HB2' ' HB3' ' A' ' 109' ' ' PRO . 47.3 m-85 -93.45 2.45 56.47 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-N 115.737 -0.665 . . . . 0.0 110.799 179.133 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 154' ' ' VAL . . . . . 0.424 HG23 ' HA ' ' A' ' 151' ' ' ALA . 98.6 t -83.31 115.92 26.53 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.485 0 CA-C-N 116.299 -0.41 . . . . 0.0 110.639 -178.92 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 155' ' ' ARG . . . . . . . . . . . . . 39.8 ttm-85 -77.88 132.94 38.18 Favored 'General case' 0 C--N 1.322 -0.626 0 CA-C-N 115.802 -0.635 . . . . 0.0 110.526 179.406 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 156' ' ' ILE . . . . . 0.588 HD11 ' HB2' ' A' ' 130' ' ' ARG . 45.1 mm -96.85 120.7 61.2 Favored Pre-proline 0 C--N 1.322 -0.59 0 N-CA-C 109.458 -0.571 . . . . 0.0 109.458 174.729 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 157' ' ' PRO . . . . . 0.437 ' HD3' ' HA ' ' A' ' 156' ' ' ILE . 35.7 Cg_exo -59.82 132.51 45.57 Favored 'Trans proline' 0 N--CA 1.463 -0.313 0 C-N-CA 122.655 2.237 . . . . 0.0 112.588 -178.034 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 158' ' ' LYS . . . . . . . . . . . . . 63.1 mttm -92.13 18.79 7.59 Favored 'General case' 0 C--N 1.325 -0.478 0 CA-C-O 121.605 0.717 . . . . 0.0 109.084 175.855 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 159' ' ' ILE . . . . . . . . . . . . . 63.9 mt -79.98 107.68 12.64 Favored 'Isoleucine or valine' 0 N--CA 1.446 -0.644 0 CA-C-N 114.881 -1.054 . . . . 0.0 110.57 -173.955 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 160' ' ' ALA . . . . . . . . . . . . . . . -98.01 146.35 25.61 Favored 'General case' 0 C--N 1.314 -0.941 0 CA-C-N 115.789 -0.641 . . . . 0.0 109.572 174.619 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 161' ' ' LEU . . . . . . . . . . . . . 90.1 mt -85.07 13.22 6.4 Favored 'General case' 0 C--N 1.322 -0.614 0 CA-C-N 116.344 -0.389 . . . . 0.0 110.647 -177.815 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 162' ' ' GLU . . . . . 0.47 ' HG3' ' H ' ' A' ' 163' ' ' HIS . 7.8 tp10 64.92 -176.03 0.17 Allowed 'General case' 0 C--O 1.235 0.328 0 O-C-N 123.816 0.698 . . . . 0.0 110.057 178.411 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 163' ' ' HIS . . . . . 0.47 ' H ' ' HG3' ' A' ' 162' ' ' GLU . 74.5 m80 -80.19 54.62 2.0 Allowed 'General case' 0 C--N 1.323 -0.574 0 CA-C-O 120.904 0.383 . . . . 0.0 110.046 178.518 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 164' ' ' HIS . . . . . . . . . . . . . 29.7 t60 -82.52 -51.92 7.34 Favored 'General case' 0 C--N 1.325 -0.475 0 N-CA-C 109.419 -0.585 . . . . 0.0 109.419 179.346 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 165' ' ' HIS . . . . . . . . . . . . . 1.7 t-80 -129.35 127.03 40.22 Favored 'General case' 0 C--N 1.325 -0.472 0 N-CA-C 109.357 -0.608 . . . . 0.0 109.357 173.916 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 166' ' ' HIS . . . . . 0.469 ' CD2' ' HB3' ' A' ' 168' ' ' HIS . 82.0 t60 -85.38 98.84 10.79 Favored 'General case' 0 C--N 1.321 -0.651 0 CA-C-O 121.09 0.472 . . . . 0.0 111.706 -172.577 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 167' ' ' HIS . . . . . . . . . . . . . 72.4 t60 -77.85 110.08 12.42 Favored 'General case' 0 C--N 1.322 -0.596 0 N-CA-C 109.233 -0.654 . . . . 0.0 109.233 171.666 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 168' ' ' HIS . . . . . 0.469 ' HB3' ' CD2' ' A' ' 166' ' ' HIS . 7.4 p80 . . . . . 0 C--O 1.244 0.775 0 CA-C-O 118.081 -0.962 . . . . 0.0 110.075 -177.665 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 61' ' ' ARG . . . . . . . . . . . . . 13.4 ttm180 . . . . . 0 N--CA 1.481 1.098 0 N-CA-C 110.083 -0.34 . . . . 0.0 110.083 . . . . . . . . . 0 0 . 1 . 014 nuclear build full ' A' A ' 62' ' ' ASP . . . . . . . . . . . . . 5.8 m-20 -134.63 26.0 3.71 Favored 'General case' 0 CA--C 1.516 -0.328 0 N-CA-C 109.264 -0.643 . . . . 0.0 109.264 175.297 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 63' ' ' SER . . . . . 0.563 ' HA ' ' HA ' ' A' ' 103' ' ' SER . 87.5 p -79.69 163.22 24.7 Favored 'General case' 0 C--N 1.321 -0.655 0 CA-C-N 115.974 -0.557 . . . . 0.0 110.428 -176.055 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 64' ' ' PHE . . . . . 0.585 ' HB2' HD11 ' A' ' 107' ' ' ILE . 64.9 t80 -60.84 -31.82 71.24 Favored 'General case' 0 C--N 1.323 -0.573 0 N-CA-C 109.229 -0.656 . . . . 0.0 109.229 175.647 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 65' ' ' GLY . . . . . . . . . . . . . . . -61.03 -32.67 81.13 Favored Glycine 0 N--CA 1.451 -0.363 0 CA-C-N 115.969 -0.56 . . . . 0.0 112.505 176.934 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 66' ' ' ASP . . . . . . . . . . . . . 24.9 m-20 -68.9 -55.3 11.48 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-O 121.208 0.527 . . . . 0.0 110.18 177.195 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 67' ' ' TRP . . . . . . . . . . . . . 99.4 m95 -68.18 -32.32 72.48 Favored 'General case' 0 C--N 1.326 -0.431 0 CA-C-N 115.705 -0.68 . . . . 0.0 111.869 -176.813 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 68' ' ' ALA . . . . . 0.61 ' O ' ' HG ' ' A' ' 72' ' ' LEU . . . -64.21 -47.43 79.77 Favored 'General case' 0 C--N 1.326 -0.432 0 N-CA-C 110.17 -0.308 . . . . 0.0 110.17 176.706 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 69' ' ' GLU . . . . . . . . . . . . . 7.5 tp10 -63.3 -40.08 96.35 Favored 'General case' 0 C--N 1.329 -0.297 0 N-CA-C 109.497 -0.557 . . . . 0.0 109.497 177.838 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 70' ' ' LYS . . . . . . . . . . . . . 10.7 tppt? -56.12 -49.6 73.43 Favored 'General case' 0 C--N 1.331 -0.223 0 CA-C-N 115.622 -0.717 . . . . 0.0 110.36 174.519 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 71' ' ' PHE . . . . . . . . . . . . . 80.3 t80 -64.71 -46.68 81.29 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 116.123 -0.49 . . . . 0.0 111.477 -179.08 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 72' ' ' LEU . . . . . 0.61 ' HG ' ' O ' ' A' ' 68' ' ' ALA . 85.7 mt -61.02 -43.63 98.61 Favored 'General case' 0 C--N 1.327 -0.396 0 CA-C-O 121.01 0.433 . . . . 0.0 110.422 179.776 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 73' ' ' LYS . . . . . . . . . . . . . 58.3 tttm -67.43 -26.53 66.46 Favored 'General case' 0 C--N 1.326 -0.42 0 CA-C-O 121.192 0.52 . . . . 0.0 110.155 179.015 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 74' ' ' SER . . . . . . . . . . . . . 60.7 m -68.39 -37.8 80.73 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 116.122 -0.49 . . . . 0.0 110.01 174.716 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 75' ' ' LYS . . . . . . . . . . . . . 71.4 mmtt -69.67 -34.03 73.4 Favored 'General case' 0 C--O 1.233 0.19 0 CA-C-N 116.346 -0.388 . . . . 0.0 110.892 177.575 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 76' ' ' GLU . . . . . . . . . . . . . 6.8 tp10 -54.27 -49.55 69.31 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-O 121.095 0.474 . . . . 0.0 109.847 173.591 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 77' ' ' ALA . . . . . . . . . . . . . . . -80.26 -16.66 54.21 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 115.961 -0.563 . . . . 0.0 111.325 179.781 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 78' ' ' ASP . . . . . . . . . . . . . 19.9 t70 -69.57 -34.38 74.08 Favored 'General case' 0 N--CA 1.464 0.24 0 CA-C-O 121.016 0.436 . . . . 0.0 110.196 -179.15 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 79' ' ' GLY . . . . . . . . . . . . . . . 108.09 37.16 2.2 Favored Glycine 0 N--CA 1.449 -0.5 0 C-N-CA 120.497 -0.859 . . . . 0.0 113.375 174.159 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 80' ' ' VAL . . . . . 0.508 ' HB ' ' HB2' ' A' ' 84' ' ' GLN . 17.7 m -88.51 155.73 3.15 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.503 0 CA-C-N 116.973 0.387 . . . . 0.0 110.431 175.511 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 81' ' ' SER . . . . . . . . . . . . . 19.5 m -66.44 159.12 27.76 Favored 'General case' 0 C--N 1.325 -0.49 0 N-CA-C 109.943 -0.391 . . . . 0.0 109.943 177.402 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 82' ' ' VAL . . . . . . . . . . . . . 61.2 t -56.75 -36.71 50.12 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.27 0 CA-C-O 120.905 0.383 . . . . 0.0 110.538 -178.966 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 83' ' ' SER . . . . . . . . . . . . . 14.4 m -57.27 -42.09 80.94 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 115.962 -0.563 . . . . 0.0 110.969 177.352 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 84' ' ' GLN . . . . . 0.508 ' HB2' ' HB ' ' A' ' 80' ' ' VAL . 75.9 mm-40 -64.88 -56.61 12.36 Favored 'General case' 0 CA--C 1.518 -0.269 0 CA-C-N 116.718 -0.219 . . . . 0.0 110.44 -179.951 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 85' ' ' LEU . . . . . . . . . . . . . 53.7 tp -57.82 -39.13 76.9 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.131 -0.486 . . . . 0.0 110.866 -177.657 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 86' ' ' ASN . . . . . . . . . . . . . 24.4 t-20 -61.14 -47.65 85.26 Favored 'General case' 0 C--N 1.327 -0.37 0 CA-C-N 115.864 -0.607 . . . . 0.0 110.074 177.215 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 87' ' ' SER . . . . . . . . . . . . . 49.7 m -64.78 -42.01 95.41 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-N 116.384 -0.371 . . . . 0.0 111.101 179.051 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 88' ' ' TYR . . . . . . . . . . . . . 29.4 m-85 -57.53 -48.68 78.62 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-O 120.976 0.417 . . . . 0.0 110.835 178.683 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 89' ' ' LYS . . . . . . . . . . . . . 22.0 ttmm -72.36 -32.35 66.39 Favored 'General case' 0 C--N 1.326 -0.415 0 CA-C-N 116.131 -0.486 . . . . 0.0 110.82 179.599 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 90' ' ' ASN . . . . . . . . . . . . . 62.0 t30 -66.46 -46.4 76.51 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-O 121.124 0.488 . . . . 0.0 110.447 178.739 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 91' ' ' TYR . . . . . 0.412 ' HD2' HG12 ' A' ' 129' ' ' ILE . 5.1 m-85 -62.42 -37.99 87.96 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.043 -0.526 . . . . 0.0 110.442 177.813 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 92' ' ' CYS . . . . . 0.558 ' HA ' ' HB2' ' A' ' 96' ' ' LEU . 53.2 t -67.59 -36.73 81.45 Favored 'General case' 0 C--N 1.327 -0.412 0 CA-C-N 115.929 -0.578 . . . . 0.0 110.723 177.966 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 93' ' ' ARG . . . . . 0.5 ' O ' ' HB3' ' A' ' 97' ' ' SER . 39.3 ttt180 -71.51 -44.97 63.69 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-O 121.029 0.442 . . . . 0.0 110.815 179.758 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 94' ' ' ASN . . . . . . . . . . . . . 95.1 m-20 -81.19 -61.2 2.02 Favored 'General case' 0 C--N 1.325 -0.499 0 N-CA-C 112.219 0.452 . . . . 0.0 112.219 -175.414 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 95' ' ' HIS . . . . . . . . . . . . . 95.0 m-70 -85.52 -40.34 16.44 Favored 'General case' 0 C--N 1.327 -0.385 0 CA-C-O 120.704 0.288 . . . . 0.0 111.697 -170.272 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 96' ' ' LEU . . . . . 0.558 ' HB2' ' HA ' ' A' ' 92' ' ' CYS . 74.9 mt -91.87 16.99 9.78 Favored 'General case' 0 C--N 1.325 -0.48 0 CA-C-N 116.622 -0.263 . . . . 0.0 111.279 -174.074 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 97' ' ' SER . . . . . 0.586 ' OG ' ' HD3' ' A' ' 98' ' ' PRO . 3.5 p -61.16 -45.7 95.79 Favored Pre-proline 0 CA--C 1.544 0.741 0 N-CA-C 113.123 0.786 . . . . 0.0 113.123 -177.661 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 98' ' ' PRO . . . . . 0.586 ' HD3' ' OG ' ' A' ' 97' ' ' SER . 21.9 Cg_exo -63.6 -33.66 66.56 Favored 'Trans proline' 0 C--N 1.361 1.211 0 C-N-CA 121.657 1.572 . . . . 0.0 111.622 179.133 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 99' ' ' LEU . . . . . 0.451 ' O ' ' HB3' ' A' ' 64' ' ' PHE . 40.4 mt -74.27 -40.22 62.47 Favored 'General case' 0 C--N 1.323 -0.572 0 CA-C-N 115.523 -0.762 . . . . 0.0 109.759 179.849 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 100' ' ' TYR . . . . . . . . . . . . . 36.0 t80 -51.71 -40.89 60.97 Favored 'General case' 0 C--N 1.33 -0.248 0 CA-C-N 115.235 -0.893 . . . . 0.0 111.394 -178.3 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 101' ' ' MET . . . . . . . . . . . . . 24.8 mmt -91.34 11.56 23.3 Favored 'General case' 0 C--N 1.326 -0.425 0 CA-C-N 116.325 -0.398 . . . . 0.0 112.047 -177.13 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 102' ' ' LYS . . . . . . . . . . . . . 66.0 mttt -105.8 150.33 25.65 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-O 120.862 0.363 . . . . 0.0 110.916 176.807 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 103' ' ' SER . . . . . 0.563 ' HA ' ' HA ' ' A' ' 63' ' ' SER . 24.1 t -72.93 150.33 42.64 Favored 'General case' 0 C--N 1.324 -0.526 0 N-CA-C 109.224 -0.658 . . . . 0.0 109.224 171.816 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 104' ' ' LEU . . . . . . . . . . . . . 26.2 tp -56.69 -29.48 62.42 Favored 'General case' 0 C--N 1.324 -0.543 0 CA-C-O 120.933 0.397 . . . . 0.0 112.045 -175.399 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 105' ' ' SER . . . . . . . . . . . . . 40.3 t -83.65 -22.34 32.18 Favored 'General case' 0 C--N 1.326 -0.415 0 N-CA-C 112.211 0.448 . . . . 0.0 112.211 -175.545 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 106' ' ' GLU . . . . . . . . . . . . . 12.1 pt-20 -97.94 6.08 48.13 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-O 120.817 0.341 . . . . 0.0 111.22 -174.298 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 107' ' ' ILE . . . . . 0.594 HG21 ' HZ ' ' A' ' 137' ' ' PHE . 63.4 mt -83.5 121.5 36.34 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.575 0 CA-C-N 116.296 -0.411 . . . . 0.0 110.1 178.93 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 108' ' ' LEU . . . . . . . . . . . . . 84.8 mt -103.44 151.16 38.6 Favored Pre-proline 0 C--N 1.32 -0.698 0 CA-C-N 116.062 -0.517 . . . . 0.0 110.073 179.991 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 109' ' ' PRO . . . . . . . . . . . . . 31.3 Cg_exo -59.88 -27.9 85.97 Favored 'Trans proline' 0 C--N 1.343 0.266 0 C-N-CA 122.27 1.98 . . . . 0.0 111.042 174.47 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 110' ' ' ALA . . . . . . . . . . . . . . . -61.66 -41.14 97.12 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 115.244 -0.889 . . . . 0.0 111.003 178.576 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 111' ' ' ASP . . . . . . . . . . . . . 33.3 m-20 -52.9 -58.41 7.03 Favored 'General case' 0 C--O 1.236 0.351 0 CA-C-O 121.423 0.63 . . . . 0.0 110.547 178.842 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 112' ' ' ILE . . . . . 0.449 HG12 HD11 ' A' ' 99' ' ' LEU . 21.4 mt -66.23 -40.59 87.32 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.557 0 CA-C-N 114.871 -1.059 . . . . 0.0 111.141 -174.651 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 113' ' ' GLN . . . . . . . . . . . . . 17.3 tm0? -65.01 -39.43 93.43 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.404 -0.362 . . . . 0.0 110.401 -178.29 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 114' ' ' SER . . . . . . . . . . . . . 50.0 m -60.57 -38.29 84.08 Favored 'General case' 0 C--O 1.233 0.226 0 CA-C-O 121.041 0.448 . . . . 0.0 110.485 178.039 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 115' ' ' ILE . . . . . . . . . . . . . 78.3 mt -60.12 -46.14 94.84 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.239 0 CA-C-N 115.938 -0.573 . . . . 0.0 110.432 176.592 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 116' ' ' ILE . . . . . . . . . . . . . 51.2 mm -60.33 -37.06 72.72 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.277 0 CA-C-N 115.992 -0.549 . . . . 0.0 111.043 -179.984 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 117' ' ' ASN . . . . . . . . . . . . . 93.6 m-20 -60.79 -44.49 96.75 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.492 -0.322 . . . . 0.0 111.169 179.124 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 118' ' ' GLU . . . . . . . . . . . . . 48.9 mt-10 -80.95 -18.25 47.68 Favored 'General case' 0 C--N 1.327 -0.377 0 CA-C-N 116.292 -0.413 . . . . 0.0 111.506 -176.982 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 119' ' ' THR . . . . . 0.403 ' CG2' HD13 ' A' ' 121' ' ' LEU . 29.2 m -90.86 111.8 23.37 Favored 'General case' 0 C--N 1.324 -0.539 0 CA-C-O 121.054 0.454 . . . . 0.0 110.48 -178.807 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 120' ' ' LYS . . . . . 0.448 ' C ' HD12 ' A' ' 121' ' ' LEU . 48.7 mtpt -106.82 86.9 2.4 Favored 'General case' 0 C--N 1.327 -0.4 0 CA-C-O 120.991 0.424 . . . . 0.0 110.828 -178.491 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 121' ' ' LEU . . . . . 0.448 HD12 ' C ' ' A' ' 120' ' ' LYS . 7.8 mp -132.75 -174.87 3.59 Favored 'General case' 0 C--N 1.323 -0.554 0 CA-C-N 115.547 -0.751 . . . . 0.0 109.622 177.62 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 122' ' ' ALA . . . . . . . . . . . . . . . -65.37 152.69 43.25 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-O 120.629 0.252 . . . . 0.0 111.247 178.927 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 123' ' ' LYS . . . . . 0.468 ' HB2' ' NZ ' ' A' ' 123' ' ' LYS . 9.5 mtmp? -55.85 -43.17 76.79 Favored 'General case' 0 C--N 1.331 -0.235 0 CA-C-N 115.998 -0.546 . . . . 0.0 110.735 -178.428 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 124' ' ' ASN . . . . . . . . . . . . . 3.2 m-20 -61.19 -37.81 84.28 Favored 'General case' 0 C--N 1.327 -0.408 0 CA-C-N 115.362 -0.836 . . . . 0.0 110.774 -178.124 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 125' ' ' THR . . . . . 0.44 ' O ' HG13 ' A' ' 129' ' ' ILE . 10.8 m -69.96 -41.58 74.32 Favored 'General case' 0 C--N 1.325 -0.457 0 CA-C-N 116.201 -0.454 . . . . 0.0 110.532 178.64 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 126' ' ' LEU . . . . . . . . . . . . . 92.5 mt -61.96 -43.68 98.34 Favored 'General case' 0 C--O 1.235 0.292 0 CA-C-N 116.08 -0.509 . . . . 0.0 110.741 179.184 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 127' ' ' LYS . . . . . . . . . . . . . 52.3 mtpt -68.93 -30.99 69.56 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.27 -0.423 . . . . 0.0 110.756 179.133 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 128' ' ' ALA . . . . . . . . . . . . . . . -64.11 -45.74 87.29 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.321 -0.4 . . . . 0.0 110.57 176.94 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 129' ' ' ILE . . . . . 0.44 HG13 ' O ' ' A' ' 125' ' ' THR . 70.1 mt -59.25 -50.25 80.48 Favored 'Isoleucine or valine' 0 C--O 1.235 0.319 0 CA-C-N 116.103 -0.499 . . . . 0.0 110.414 177.865 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 130' ' ' ARG . . . . . . . . . . . . . 45.7 ttt-85 -61.88 -40.97 97.23 Favored 'General case' 0 C--N 1.327 -0.384 0 CA-C-N 115.758 -0.656 . . . . 0.0 111.039 179.427 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 131' ' ' ASN . . . . . . . . . . . . . 4.4 t-20 -62.8 -44.81 95.18 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-O 120.648 0.261 . . . . 0.0 110.45 -179.314 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 132' ' ' THR . . . . . 0.481 ' O ' HG13 ' A' ' 136' ' ' ILE . 39.2 m -55.1 -52.7 62.43 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 115.774 -0.648 . . . . 0.0 110.482 178.695 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 133' ' ' ALA . . . . . . . . . . . . . . . -65.45 -38.98 91.47 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.219 -0.446 . . . . 0.0 110.803 179.098 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 134' ' ' SER . . . . . . . . . . . . . 26.9 t -60.28 -43.23 96.4 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 115.964 -0.562 . . . . 0.0 110.84 -179.45 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 135' ' ' GLN . . . . . . . . . . . . . 45.9 mt-30 -67.55 -30.66 70.35 Favored 'General case' 0 C--N 1.33 -0.28 0 C-N-CA 121.133 -0.227 . . . . 0.0 110.791 179.178 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 136' ' ' ILE . . . . . 0.481 HG13 ' O ' ' A' ' 132' ' ' THR . 86.8 mt -65.13 -45.21 94.8 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.333 0 CA-C-N 116.346 -0.388 . . . . 0.0 110.203 175.959 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 137' ' ' PHE . . . . . 0.594 ' HZ ' HG21 ' A' ' 107' ' ' ILE . 60.0 m-85 -65.35 -44.98 85.98 Favored 'General case' 0 C--N 1.331 -0.208 0 CA-C-N 116.292 -0.413 . . . . 0.0 110.353 175.603 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 138' ' ' ARG . . . . . 0.46 ' O ' ' HG3' ' A' ' 142' ' ' GLU . 29.0 mtp180 -55.39 -41.19 72.31 Favored 'General case' 0 C--O 1.223 -0.31 0 CA-C-N 116.029 -0.532 . . . . 0.0 111.092 177.053 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 139' ' ' LEU . . . . . . . . . . . . . 29.4 tp -59.36 -43.09 92.87 Favored 'General case' 0 C--N 1.321 -0.645 0 CA-C-N 115.999 -0.546 . . . . 0.0 110.525 179.829 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 140' ' ' ALA . . . . . . . . . . . . . . . -68.0 -31.47 71.19 Favored 'General case' 0 C--N 1.331 -0.217 0 CA-C-N 116.348 -0.387 . . . . 0.0 110.255 176.443 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 141' ' ' ILE . . . . . 0.659 ' HA ' ' O ' ' A' ' 146' ' ' ILE . 79.7 mt -66.54 -45.93 87.59 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.236 0 CA-C-N 116.275 -0.42 . . . . 0.0 110.465 175.585 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 142' ' ' GLU . . . . . 0.46 ' HG3' ' O ' ' A' ' 138' ' ' ARG . 43.3 mt-10 -67.73 -21.65 65.28 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-O 121.021 0.439 . . . . 0.0 110.774 -179.843 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 143' ' ' ASN . . . . . . . . . . . . . 4.3 m-20 -94.83 1.42 55.37 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.138 -0.483 . . . . 0.0 110.643 175.991 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 144' ' ' ARG . . . . . 0.414 HH11 ' HD2' ' A' ' 144' ' ' ARG . 29.3 mtp85 59.58 36.91 22.82 Favored 'General case' 0 N--CA 1.465 0.304 0 CA-C-N 115.721 -0.672 . . . . 0.0 112.444 178.37 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 145' ' ' ALA . . . . . . . . . . . . . . . -90.4 -24.68 20.71 Favored 'General case' 0 C--N 1.323 -0.556 0 CA-C-O 121.547 0.689 . . . . 0.0 109.455 173.413 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 146' ' ' ILE . . . . . 0.659 ' O ' ' HA ' ' A' ' 141' ' ' ILE . 11.4 tt -156.84 157.96 3.48 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.569 0 N-CA-C 108.007 -1.108 . . . . 0.0 108.007 177.567 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 147' ' ' ASP . . . . . . . . . . . . . 7.3 p-10 -123.83 21.81 9.04 Favored 'General case' 0 C--N 1.322 -0.604 0 CA-C-O 121.1 0.476 . . . . 0.0 110.862 179.628 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 148' ' ' PHE . . . . . 0.477 ' H ' HG12 ' A' ' 146' ' ' ILE . 73.7 m-85 -121.6 151.06 40.81 Favored 'General case' 0 C--N 1.326 -0.433 0 CA-C-N 115.877 -0.601 . . . . 0.0 109.986 178.537 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 149' ' ' ASN . . . . . . . . . . . . . 53.7 t-20 -124.6 87.77 54.17 Favored Pre-proline 0 C--N 1.321 -0.658 0 N-CA-C 109.682 -0.488 . . . . 0.0 109.682 173.552 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 150' ' ' PRO . . . . . . . . . . . . . 77.6 Cg_exo -52.18 -34.64 59.72 Favored 'Trans proline' 0 C--N 1.344 0.329 0 C-N-CA 122.958 2.439 . . . . 0.0 112.925 177.408 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 151' ' ' ALA . . . . . . . . . . . . . . . -71.39 -26.06 62.62 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.321 -0.399 . . . . 0.0 110.982 -177.31 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 152' ' ' ASP . . . . . . . . . . . . . 39.0 t70 -74.98 -18.25 60.4 Favored 'General case' 0 C--N 1.325 -0.476 0 CA-C-O 120.815 0.341 . . . . 0.0 110.601 -179.59 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 153' ' ' TYR . . . . . . . . . . . . . 96.3 m-85 -83.81 -11.48 56.99 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.284 -0.416 . . . . 0.0 110.863 179.057 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 154' ' ' VAL . . . . . . . . . . . . . 57.4 t -64.63 123.83 18.25 Favored 'Isoleucine or valine' 0 C--O 1.235 0.336 0 CA-C-O 120.876 0.37 . . . . 0.0 111.364 -177.507 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 155' ' ' ARG . . . . . . . . . . . . . 88.7 mtt180 -73.04 117.72 15.11 Favored 'General case' 0 C--N 1.325 -0.488 0 CA-C-N 115.828 -0.624 . . . . 0.0 110.404 174.603 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 156' ' ' ILE . . . . . . . . . . . . . 37.2 mm -92.47 119.6 67.95 Favored Pre-proline 0 C--N 1.318 -0.778 0 N-CA-C 109.317 -0.623 . . . . 0.0 109.317 173.453 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 157' ' ' PRO . . . . . . . . . . . . . 42.1 Cg_endo -68.21 129.61 19.67 Favored 'Trans proline' 0 N--CA 1.457 -0.637 0 C-N-CA 122.107 1.871 . . . . 0.0 112.237 -178.851 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 158' ' ' LYS . . . . . . . . . . . . . 62.9 mttp -82.08 75.9 8.99 Favored 'General case' 0 C--N 1.321 -0.642 0 N-CA-C 108.573 -0.899 . . . . 0.0 108.573 173.45 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 159' ' ' ILE . . . . . . . . . . . . . 51.1 mm -52.78 102.3 0.04 OUTLIER 'Isoleucine or valine' 0 C--N 1.33 -0.263 0 CA-C-N 114.887 -1.052 . . . . 0.0 111.441 -178.892 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 160' ' ' ALA . . . . . . . . . . . . . . . -117.51 14.69 14.61 Favored 'General case' 0 C--N 1.32 -0.708 0 CA-C-N 115.327 -0.851 . . . . 0.0 109.849 177.509 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 161' ' ' LEU . . . . . . . . . . . . . 86.6 mt -71.24 96.4 1.4 Allowed 'General case' 0 C--N 1.322 -0.629 0 CA-C-N 114.59 -1.186 . . . . 0.0 109.585 177.646 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 162' ' ' GLU . . . . . . . . . . . . . 6.1 tp10 54.72 80.01 0.13 Allowed 'General case' 0 CA--C 1.533 0.313 0 CA-C-N 115.501 -0.772 . . . . 0.0 110.379 -172.241 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 163' ' ' HIS . . . . . . . . . . . . . 37.5 t-80 -131.89 128.45 38.62 Favored 'General case' 0 C--N 1.323 -0.569 0 N-CA-C 108.895 -0.78 . . . . 0.0 108.895 175.558 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 164' ' ' HIS . . . . . . . . . . . . . 34.4 m170 -96.03 -176.35 3.67 Favored 'General case' 0 C--N 1.319 -0.729 0 CA-C-N 116.254 -0.43 . . . . 0.0 111.35 -173.441 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 165' ' ' HIS . . . . . . . . . . . . . 59.4 m170 -64.66 139.48 58.77 Favored 'General case' 0 C--N 1.326 -0.416 0 CA-C-N 115.787 -0.642 . . . . 0.0 110.846 -177.572 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 166' ' ' HIS . . . . . . . . . . . . . 40.6 t-80 -71.24 -53.08 15.6 Favored 'General case' 0 C--N 1.322 -0.613 0 CA-C-N 115.714 -0.676 . . . . 0.0 110.307 178.998 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 167' ' ' HIS . . . . . . . . . . . . . 49.6 t-80 -157.19 145.66 19.55 Favored 'General case' 0 C--N 1.327 -0.38 0 CA-C-N 116.62 -0.264 . . . . 0.0 110.831 179.476 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 168' ' ' HIS . . . . . . . . . . . . . 45.3 t-80 . . . . . 0 C--O 1.25 1.1 0 CA-C-O 118.603 -0.713 . . . . 0.0 109.511 172.787 . . . . . . . . 0 0 . 1 . 015 nuclear build full ' A' A ' 61' ' ' ARG . . . . . . . . . . . . . 18.2 mtm-85 . . . . . 0 N--CA 1.481 1.104 0 CA-C-O 120.489 0.185 . . . . 0.0 110.602 . . . . . . . . . 0 0 . 1 . 015 nuclear build full ' A' A ' 62' ' ' ASP . . . . . . . . . . . . . 26.9 m-20 -94.03 157.84 15.9 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-O 120.626 0.25 . . . . 0.0 110.507 -175.905 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 63' ' ' SER . . . . . . . . . . . . . 36.1 t -84.9 144.37 28.42 Favored 'General case' 0 C--N 1.322 -0.591 0 CA-C-O 120.971 0.415 . . . . 0.0 110.522 178.264 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 64' ' ' PHE . . . . . . . . . . . . . 81.2 t80 -63.74 -30.12 71.26 Favored 'General case' 0 C--N 1.327 -0.411 0 CA-C-N 115.857 -0.61 . . . . 0.0 109.723 177.254 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 65' ' ' GLY . . . . . . . . . . . . . . . -62.93 -36.15 93.03 Favored Glycine 0 N--CA 1.448 -0.559 0 C-N-CA 120.862 -0.685 . . . . 0.0 112.157 178.205 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 66' ' ' ASP . . . . . . . . . . . . . 22.7 t70 -69.6 -43.19 73.27 Favored 'General case' 0 C--N 1.327 -0.398 0 CA-C-O 120.931 0.396 . . . . 0.0 110.371 179.515 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 67' ' ' TRP . . . . . . . . . . . . . 83.8 m95 -72.33 -28.02 62.8 Favored 'General case' 0 C--N 1.325 -0.488 0 CA-C-N 116.153 -0.476 . . . . 0.0 111.392 179.477 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 68' ' ' ALA . . . . . 0.489 ' O ' ' HG ' ' A' ' 72' ' ' LEU . . . -65.82 -44.87 84.28 Favored 'General case' 0 C--N 1.329 -0.302 0 N-CA-C 109.57 -0.53 . . . . 0.0 109.57 173.312 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 69' ' ' GLU . . . . . . . . . . . . . 10.3 tp10 -59.46 -46.39 88.92 Favored 'General case' 0 C--O 1.234 0.244 0 CA-C-N 115.605 -0.725 . . . . 0.0 109.998 175.17 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 70' ' ' LYS . . . . . . . . . . . . . 54.7 mttp -63.35 -34.54 77.94 Favored 'General case' 0 C--N 1.331 -0.228 0 CA-C-N 115.793 -0.639 . . . . 0.0 111.645 178.663 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 71' ' ' PHE . . . . . . . . . . . . . 62.7 t80 -67.17 -43.72 81.53 Favored 'General case' 0 C--N 1.326 -0.421 0 CA-C-O 120.887 0.375 . . . . 0.0 110.578 178.809 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 72' ' ' LEU . . . . . 0.489 ' HG ' ' O ' ' A' ' 68' ' ' ALA . 85.7 mt -62.21 -44.21 97.1 Favored 'General case' 0 C--N 1.324 -0.543 0 CA-C-N 116.111 -0.495 . . . . 0.0 110.397 178.355 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 73' ' ' LYS . . . . . . . . . . . . . 35.6 mttp -72.55 -36.37 68.24 Favored 'General case' 0 C--N 1.327 -0.377 0 CA-C-N 116.001 -0.545 . . . . 0.0 112.233 -178.695 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 74' ' ' SER . . . . . . . . . . . . . 35.1 p -66.27 -34.37 77.84 Favored 'General case' 0 C--N 1.328 -0.336 0 C-N-CA 120.725 -0.39 . . . . 0.0 110.31 178.022 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 75' ' ' LYS . . . . . 0.43 ' HD3' ' HA ' ' A' ' 75' ' ' LYS . 25.8 mmtp -75.07 -32.88 61.6 Favored 'General case' 0 C--N 1.332 -0.187 0 CA-C-O 120.894 0.378 . . . . 0.0 110.903 174.958 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 76' ' ' GLU . . . . . . . . . . . . . 43.1 tt0 -63.46 -38.94 93.06 Favored 'General case' 0 C--N 1.323 -0.56 0 CA-C-O 121.219 0.533 . . . . 0.0 110.098 175.198 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 77' ' ' ALA . . . . . . . . . . . . . . . -76.4 -28.99 56.92 Favored 'General case' 0 C--N 1.325 -0.487 0 CA-C-N 115.841 -0.618 . . . . 0.0 110.741 174.578 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 78' ' ' ASP . . . . . 0.407 ' HB3' ' HA ' ' A' ' 75' ' ' LYS . 16.4 t70 -65.37 -46.3 80.7 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 115.898 -0.592 . . . . 0.0 110.357 178.056 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 79' ' ' GLY . . . . . . . . . . . . . . . 121.77 58.28 0.22 Allowed Glycine 0 N--CA 1.445 -0.714 0 C-N-CA 120.858 -0.687 . . . . 0.0 112.378 177.827 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 80' ' ' VAL . . . . . . . . . . . . . 29.8 m -100.65 141.36 17.59 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.5 0 CA-C-O 120.714 0.292 . . . . 0.0 110.533 177.492 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 81' ' ' SER . . . . . . . . . . . . . 32.0 m -57.56 156.17 8.6 Favored 'General case' 0 C--N 1.326 -0.438 0 CA-C-N 115.815 -0.629 . . . . 0.0 110.932 178.645 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 82' ' ' VAL . . . . . . . . . . . . . 7.1 p -58.2 -44.59 88.13 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.281 0 CA-C-N 116.651 -0.249 . . . . 0.0 111.504 -175.506 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 83' ' ' SER . . . . . . . . . . . . . 22.3 m -66.01 -33.13 75.11 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-O 120.771 0.32 . . . . 0.0 110.258 179.041 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 84' ' ' GLN . . . . . . . . . . . . . 52.6 tp60 -68.47 -39.17 81.5 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 115.798 -0.637 . . . . 0.0 110.26 -179.177 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 85' ' ' LEU . . . . . . . . . . . . . 49.1 tp -68.24 -33.49 74.48 Favored 'General case' 0 C--N 1.325 -0.483 0 CA-C-N 116.12 -0.491 . . . . 0.0 110.2 177.166 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 86' ' ' ASN . . . . . . . . . . . . . 90.5 m-20 -76.76 -30.64 56.61 Favored 'General case' 0 C--N 1.327 -0.4 0 CA-C-N 116.111 -0.495 . . . . 0.0 111.144 -179.791 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 87' ' ' SER . . . . . . . . . . . . . 2.9 p -69.75 -38.89 76.96 Favored 'General case' 0 N--CA 1.453 -0.28 0 C-N-CA 120.535 -0.466 . . . . 0.0 109.959 175.25 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 88' ' ' TYR . . . . . . . . . . . . . 16.3 m-85 -60.5 -43.06 97.43 Favored 'General case' 0 C--O 1.232 0.183 0 N-CA-C 109.491 -0.559 . . . . 0.0 109.491 171.32 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 89' ' ' LYS . . . . . 0.428 ' HD3' HD13 ' A' ' 72' ' ' LEU . 1.5 tppp? -54.81 -43.87 73.3 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 115.01 -0.996 . . . . 0.0 110.004 177.392 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 90' ' ' ASN . . . . . . . . . . . . . 48.1 t30 -63.94 -57.18 10.53 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 115.07 -0.968 . . . . 0.0 111.307 -178.571 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 91' ' ' TYR . . . . . . . . . . . . . 31.3 m-85 -54.48 -45.42 73.19 Favored 'General case' 0 C--O 1.235 0.33 0 CA-C-O 120.614 0.245 . . . . 0.0 111.551 -176.411 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 92' ' ' CYS . . . . . . . . . . . . . 62.1 m -68.13 -42.35 80.32 Favored 'General case' 0 C--N 1.326 -0.416 0 N-CA-C 112.518 0.562 . . . . 0.0 112.518 -175.235 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 93' ' ' ARG . . . . . 0.435 ' O ' ' HB3' ' A' ' 97' ' ' SER . 52.0 ttt180 -94.89 -24.85 16.83 Favored 'General case' 0 C--N 1.326 -0.419 0 C-N-CA 120.158 -0.617 . . . . 0.0 112.133 -172.698 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 94' ' ' ASN . . . . . . . . . . . . . 49.8 t-20 -85.79 -61.64 1.71 Allowed 'General case' 0 C--N 1.324 -0.521 0 C-N-CA 120.816 -0.354 . . . . 0.0 110.709 -178.159 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 95' ' ' HIS . . . . . . . . . . . . . 14.3 m80 -86.94 -40.73 14.54 Favored 'General case' 0 C--N 1.326 -0.415 0 N-CA-C 112.387 0.514 . . . . 0.0 112.387 -176.558 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 96' ' ' LEU . . . . . 0.513 HD22 HD12 ' A' ' 99' ' ' LEU . 89.7 mt -88.31 20.91 3.05 Favored 'General case' 0 C--N 1.327 -0.393 0 CA-C-O 120.828 0.346 . . . . 0.0 111.141 -177.037 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 97' ' ' SER . . . . . 0.527 ' N ' ' HD2' ' A' ' 98' ' ' PRO . 1.6 p -58.51 -45.55 99.66 Favored Pre-proline 0 CA--C 1.543 0.681 0 N-CA-C 112.925 0.713 . . . . 0.0 112.925 -177.901 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 98' ' ' PRO . . . . . 0.527 ' HD2' ' N ' ' A' ' 97' ' ' SER . 18.1 Cg_endo -61.28 -34.44 87.9 Favored 'Trans proline' 0 C--N 1.361 1.186 0 C-N-CA 121.623 1.549 . . . . 0.0 112.215 178.091 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 99' ' ' LEU . . . . . 0.513 HD12 HD22 ' A' ' 96' ' ' LEU . 80.6 mt -74.1 -33.37 63.6 Favored 'General case' 0 C--N 1.326 -0.42 0 CA-C-O 120.968 0.413 . . . . 0.0 110.451 -179.288 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 100' ' ' TYR . . . . . . . . . . . . . 38.2 t80 -60.14 -26.29 66.16 Favored 'General case' 0 CA--C 1.532 0.272 0 CA-C-N 115.688 -0.687 . . . . 0.0 110.301 178.551 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 101' ' ' MET . . . . . . . . . . . . . 55.0 mtt -96.54 6.92 47.74 Favored 'General case' 0 C--O 1.236 0.361 0 CA-C-N 115.666 -0.697 . . . . 0.0 111.005 -178.439 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 102' ' ' LYS . . . . . 0.528 ' HE3' HG12 ' A' ' 107' ' ' ILE . 27.3 mtpp -109.15 166.7 10.65 Favored 'General case' 0 C--N 1.324 -0.518 0 CA-C-N 116.172 -0.467 . . . . 0.0 110.984 -179.068 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 103' ' ' SER . . . . . 0.584 ' HB3' ' HG2' ' A' ' 106' ' ' GLU . 20.0 t -94.13 149.12 21.53 Favored 'General case' 0 N--CA 1.449 -0.495 0 N-CA-C 108.743 -0.836 . . . . 0.0 108.743 176.796 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 104' ' ' LEU . . . . . 0.515 HD21 ' HB1' ' A' ' 140' ' ' ALA . 35.9 tp -52.54 -52.3 55.44 Favored 'General case' 0 C--N 1.322 -0.615 0 N-CA-C 112.78 0.659 . . . . 0.0 112.78 -170.147 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 105' ' ' SER . . . . . . . . . . . . . 38.4 m -82.91 -7.36 59.67 Favored 'General case' 0 C--N 1.322 -0.61 0 N-CA-C 112.905 0.706 . . . . 0.0 112.905 -172.828 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 106' ' ' GLU . . . . . 0.584 ' HG2' ' HB3' ' A' ' 103' ' ' SER . 1.1 pp20? -106.48 15.42 25.95 Favored 'General case' 0 C--O 1.233 0.196 0 CA-C-O 121.233 0.54 . . . . 0.0 111.19 -178.899 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 107' ' ' ILE . . . . . 0.528 HG12 ' HE3' ' A' ' 102' ' ' LYS . 80.0 mt -88.14 134.57 27.69 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.56 0 CA-C-N 115.866 -0.606 . . . . 0.0 109.664 173.061 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 108' ' ' LEU . . . . . . . . . . . . . 97.9 mt -105.21 150.21 38.58 Favored Pre-proline 0 C--N 1.327 -0.413 0 CA-C-N 116.465 -0.334 . . . . 0.0 110.479 178.505 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 109' ' ' PRO . . . . . . . . . . . . . 36.5 Cg_exo -60.88 -26.27 82.8 Favored 'Trans proline' 0 C--N 1.343 0.275 0 C-N-CA 122.491 2.127 . . . . 0.0 111.257 175.136 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 110' ' ' ALA . . . . . . . . . . . . . . . -64.77 -38.94 92.69 Favored 'General case' 0 C--N 1.331 -0.227 0 CA-C-N 115.495 -0.775 . . . . 0.0 110.958 178.786 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 111' ' ' ASP . . . . . . . . . . . . . 41.5 m-20 -61.88 -49.66 75.35 Favored 'General case' 0 CA--C 1.52 -0.209 0 CA-C-O 121.074 0.464 . . . . 0.0 109.935 177.759 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 112' ' ' ILE . . . . . 0.44 ' O ' HG12 ' A' ' 116' ' ' ILE . 39.2 mt -62.31 -43.46 98.08 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.249 0 CA-C-N 115.556 -0.747 . . . . 0.0 110.871 -179.193 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 113' ' ' GLN . . . . . . . . . . . . . 7.8 tp-100 -61.34 -38.61 87.56 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.364 -0.38 . . . . 0.0 110.642 178.908 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 114' ' ' SER . . . . . . . . . . . . . 48.2 m -62.72 -41.32 99.1 Favored 'General case' 0 C--N 1.326 -0.42 0 CA-C-N 116.137 -0.483 . . . . 0.0 110.253 177.14 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 115' ' ' ILE . . . . . 0.433 HD11 ' HG2' ' A' ' 98' ' ' PRO . 74.4 mt -62.53 -44.2 99.1 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.214 0 CA-C-N 116.338 -0.392 . . . . 0.0 110.454 176.982 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 116' ' ' ILE . . . . . 0.44 HG12 ' O ' ' A' ' 112' ' ' ILE . 45.4 mm -58.96 -46.88 91.24 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.337 0 CA-C-N 116.034 -0.53 . . . . 0.0 110.915 178.717 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 117' ' ' ASN . . . . . . . . . . . . . 28.7 t-20 -75.07 -23.16 58.0 Favored 'General case' 0 C--N 1.326 -0.442 0 CA-C-N 116.388 -0.369 . . . . 0.0 111.227 -178.189 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 118' ' ' GLU . . . . . . . . . . . . . 7.6 mm-40 -79.7 -20.71 45.9 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-O 120.755 0.312 . . . . 0.0 110.42 175.075 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 119' ' ' THR . . . . . . . . . . . . . 80.9 m -73.48 112.9 10.0 Favored 'General case' 0 N--CA 1.449 -0.488 0 N-CA-C 109.661 -0.496 . . . . 0.0 109.661 175.456 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 120' ' ' LYS . . . . . . . . . . . . . 6.5 ptmt -93.55 26.55 2.98 Favored 'General case' 0 C--N 1.321 -0.639 0 CA-C-N 115.863 -0.608 . . . . 0.0 111.364 -174.846 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 121' ' ' LEU . . . . . . . . . . . . . 3.8 mm? -95.95 -175.82 3.52 Favored 'General case' 0 C--N 1.327 -0.398 0 CA-C-N 115.763 -0.653 . . . . 0.0 110.374 178.879 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 122' ' ' ALA . . . . . 0.406 ' O ' ' HG ' ' A' ' 126' ' ' LEU . . . -87.58 174.03 8.71 Favored 'General case' 0 C--N 1.327 -0.391 0 N-CA-C 112.38 0.511 . . . . 0.0 112.38 -173.521 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 123' ' ' LYS . . . . . . . . . . . . . 14.4 tttm -48.24 -48.22 35.38 Favored 'General case' 0 N--CA 1.467 0.382 0 CA-C-N 115.198 -0.91 . . . . 0.0 113.037 -178.122 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 124' ' ' ASN . . . . . . . . . . . . . 7.1 m-20 -63.52 -40.78 97.94 Favored 'General case' 0 C--N 1.326 -0.418 0 CA-C-O 120.533 0.206 . . . . 0.0 111.354 -176.204 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 125' ' ' THR . . . . . . . . . . . . . 13.3 m -66.77 -39.59 87.92 Favored 'General case' 0 C--N 1.325 -0.46 0 CA-C-O 120.739 0.304 . . . . 0.0 110.739 179.071 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 126' ' ' LEU . . . . . 0.406 ' HG ' ' O ' ' A' ' 122' ' ' ALA . 94.1 mt -59.93 -45.81 91.39 Favored 'General case' 0 N--CA 1.462 0.165 0 CA-C-O 121.197 0.522 . . . . 0.0 110.644 179.239 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 127' ' ' LYS . . . . . . . . . . . . . 58.0 mttm -71.08 -29.68 65.61 Favored 'General case' 0 C--N 1.326 -0.453 0 CA-C-N 115.712 -0.677 . . . . 0.0 111.274 -178.926 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 128' ' ' ALA . . . . . . . . . . . . . . . -62.48 -47.06 85.64 Favored 'General case' 0 C--N 1.326 -0.444 0 CA-C-N 116.223 -0.444 . . . . 0.0 110.322 175.753 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 129' ' ' ILE . . . . . . . . . . . . . 57.9 mt -65.15 -41.07 90.82 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.332 0 CA-C-N 116.112 -0.494 . . . . 0.0 110.021 176.734 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 130' ' ' ARG . . . . . 0.767 HH12 ' HB1' ' A' ' 151' ' ' ALA . 3.8 tpm_? -57.08 -56.21 24.75 Favored 'General case' 0 C--N 1.33 -0.24 0 CA-C-N 115.57 -0.741 . . . . 0.0 111.102 178.796 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 131' ' ' ASN . . . . . 0.498 ' O ' ' HG2' ' A' ' 135' ' ' GLN . 58.1 t30 -59.22 -46.5 88.3 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.359 -0.382 . . . . 0.0 110.822 -178.174 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 132' ' ' THR . . . . . 0.422 ' O ' HG13 ' A' ' 136' ' ' ILE . 61.0 m -56.67 -53.58 56.0 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.314 -0.403 . . . . 0.0 111.224 -179.312 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 133' ' ' ALA . . . . . . . . . . . . . . . -62.48 -34.7 77.35 Favored 'General case' 0 C--N 1.331 -0.217 0 CA-C-O 121.093 0.473 . . . . 0.0 110.965 -179.808 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 134' ' ' SER . . . . . . . . . . . . . 14.0 t -63.27 -46.58 86.16 Favored 'General case' 0 C--N 1.327 -0.374 0 CA-C-N 115.891 -0.595 . . . . 0.0 110.198 179.534 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 135' ' ' GLN . . . . . 0.498 ' HG2' ' O ' ' A' ' 131' ' ' ASN . 82.6 mm-40 -60.2 -39.73 87.59 Favored 'General case' 0 C--N 1.332 -0.175 0 CA-C-N 116.19 -0.459 . . . . 0.0 111.246 -178.952 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 136' ' ' ILE . . . . . 0.422 HG13 ' O ' ' A' ' 132' ' ' THR . 62.8 mt -59.16 -49.73 82.32 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.253 0 CA-C-N 116.343 -0.39 . . . . 0.0 110.733 -179.881 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 137' ' ' PHE . . . . . 0.562 ' O ' HG13 ' A' ' 141' ' ' ILE . 52.8 m-85 -63.29 -41.69 98.99 Favored 'General case' 0 C--N 1.331 -0.217 0 CA-C-N 116.344 -0.389 . . . . 0.0 110.764 177.625 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 138' ' ' ARG . . . . . 0.453 ' O ' ' HG2' ' A' ' 142' ' ' GLU . 72.9 mtp180 -59.79 -42.98 94.58 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.067 -0.515 . . . . 0.0 111.137 179.571 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 139' ' ' LEU . . . . . . . . . . . . . 50.3 tp -60.21 -39.0 85.06 Favored 'General case' 0 C--N 1.325 -0.481 0 CA-C-N 116.091 -0.504 . . . . 0.0 110.685 178.069 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 140' ' ' ALA . . . . . 0.515 ' HB1' HD21 ' A' ' 104' ' ' LEU . . . -67.57 -39.73 84.88 Favored 'General case' 0 C--N 1.326 -0.434 0 CA-C-N 116.193 -0.458 . . . . 0.0 110.668 178.014 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 141' ' ' ILE . . . . . 0.562 HG13 ' O ' ' A' ' 137' ' ' PHE . 66.5 mt -62.96 -39.42 85.06 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.27 0 CA-C-N 116.064 -0.517 . . . . 0.0 110.662 177.007 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 142' ' ' GLU . . . . . 0.453 ' HG2' ' O ' ' A' ' 138' ' ' ARG . 35.8 mm-40 -54.5 -45.07 73.19 Favored 'General case' 0 N--CA 1.463 0.196 0 CA-C-O 121.161 0.505 . . . . 0.0 111.053 177.521 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 143' ' ' ASN . . . . . . . . . . . . . 41.0 m-80 -85.78 6.55 27.5 Favored 'General case' 0 C--N 1.327 -0.409 0 CA-C-N 115.683 -0.69 . . . . 0.0 110.676 -178.34 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 144' ' ' ARG . . . . . 0.4 HH11 ' HD2' ' A' ' 144' ' ' ARG . 41.1 mtp85 58.02 28.09 15.77 Favored 'General case' 0 N--CA 1.465 0.315 0 CA-C-N 115.706 -0.679 . . . . 0.0 112.106 179.54 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 145' ' ' ALA . . . . . . . . . . . . . . . -76.53 -23.01 53.63 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-O 121.739 0.78 . . . . 0.0 109.496 174.663 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 146' ' ' ILE . . . . . 0.549 ' O ' ' HA ' ' A' ' 141' ' ' ILE . 14.6 tt -149.77 144.01 17.77 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.713 0 CA-C-N 114.772 -1.103 . . . . 0.0 108.169 173.578 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 147' ' ' ASP . . . . . . . . . . . . . 30.4 t70 -116.55 27.3 9.28 Favored 'General case' 0 C--N 1.319 -0.755 0 CA-C-O 122.117 0.961 . . . . 0.0 109.158 -179.233 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 148' ' ' PHE . . . . . 0.484 ' H ' HG12 ' A' ' 146' ' ' ILE . 69.8 t80 -137.39 136.97 38.35 Favored 'General case' 0 C--N 1.318 -0.786 0 CA-C-N 114.603 -1.18 . . . . 0.0 109.032 -175.755 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 149' ' ' ASN . . . . . . . . . . . . . 66.5 t30 -120.19 90.06 44.11 Favored Pre-proline 0 C--N 1.322 -0.616 0 C-N-CA 120.89 -0.324 . . . . 0.0 110.74 -177.318 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 150' ' ' PRO . . . . . . . . . . . . . 21.7 Cg_exo -64.45 -22.85 65.32 Favored 'Trans proline' 0 C--N 1.345 0.35 0 C-N-CA 122.559 2.173 . . . . 0.0 111.108 178.542 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 151' ' ' ALA . . . . . 0.767 ' HB1' HH12 ' A' ' 130' ' ' ARG . . . -66.11 -27.45 68.06 Favored 'General case' 0 N--CA 1.45 -0.428 0 CA-C-N 115.062 -0.972 . . . . 0.0 111.514 -177.819 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 152' ' ' ASP . . . . . . . . . . . . . 14.6 t70 -71.69 -25.35 62.07 Favored 'General case' 0 C--N 1.327 -0.401 0 CA-C-O 121.07 0.462 . . . . 0.0 110.498 -177.354 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 153' ' ' TYR . . . . . . . . . . . . . 92.4 m-85 -87.41 0.15 55.93 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 115.893 -0.594 . . . . 0.0 110.977 -178.464 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 154' ' ' VAL . . . . . . . . . . . . . 55.9 t -88.34 107.24 17.38 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.416 0 N-CA-C 109.967 -0.383 . . . . 0.0 109.967 178.822 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 155' ' ' ARG . . . . . . . . . . . . . 10.4 tpt180 -89.49 130.44 35.83 Favored 'General case' 0 C--N 1.323 -0.554 0 CA-C-N 116.0 -0.545 . . . . 0.0 110.892 -177.374 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 156' ' ' ILE . . . . . . . . . . . . . 48.0 mm -96.81 115.61 65.76 Favored Pre-proline 0 C--N 1.323 -0.545 0 CA-C-N 116.116 -0.493 . . . . 0.0 110.052 175.021 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 157' ' ' PRO . . . . . . . . . . . . . 93.9 Cg_endo -83.86 142.7 10.2 Favored 'Trans proline' 0 N--CA 1.458 -0.57 0 C-N-CA 122.708 2.272 . . . . 0.0 112.318 176.933 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 158' ' ' LYS . . . . . 0.539 ' O ' ' HB ' ' A' ' 159' ' ' ILE . 41.2 mttp -86.84 20.96 2.39 Favored 'General case' 0 C--N 1.326 -0.445 0 CA-C-N 116.345 -0.389 . . . . 0.0 110.453 179.394 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 159' ' ' ILE . . . . . 0.539 ' HB ' ' O ' ' A' ' 158' ' ' LYS . 1.9 mp 76.24 -29.72 0.01 OUTLIER 'Isoleucine or valine' 0 CA--C 1.538 0.487 0 CA-C-N 115.924 -0.58 . . . . 0.0 110.819 -177.594 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 160' ' ' ALA . . . . . 0.416 ' H ' ' C ' ' A' ' 158' ' ' LYS . . . -72.9 166.94 22.02 Favored 'General case' 0 C--N 1.327 -0.4 0 CA-C-O 121.033 0.444 . . . . 0.0 111.17 178.511 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 161' ' ' LEU . . . . . . . . . . . . . 95.1 mt -83.73 53.82 2.68 Favored 'General case' 0 C--N 1.326 -0.44 0 CA-C-N 116.211 -0.45 . . . . 0.0 111.328 -178.058 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 162' ' ' GLU . . . . . . . . . . . . . 27.1 mt-10 -54.33 -43.11 70.94 Favored 'General case' 0 N--CA 1.464 0.261 0 CA-C-O 121.699 0.762 . . . . 0.0 110.16 177.642 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 163' ' ' HIS . . . . . . . . . . . . . 5.9 p80 -129.72 97.23 4.45 Favored 'General case' 0 C--N 1.32 -0.716 0 CA-C-N 114.771 -1.104 . . . . 0.0 109.721 179.153 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 164' ' ' HIS . . . . . . . . . . . . . 8.4 p-80 -93.73 79.22 4.23 Favored 'General case' 0 C--N 1.321 -0.667 0 CA-C-O 121.828 0.823 . . . . 0.0 109.631 178.338 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 165' ' ' HIS . . . . . . . . . . . . . 49.2 t-80 -161.35 78.23 0.57 Allowed 'General case' 0 C--N 1.321 -0.646 0 CA-C-N 114.471 -1.24 . . . . 0.0 108.408 -177.494 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 166' ' ' HIS . . . . . . . . . . . . . 47.4 t-80 -91.36 72.93 6.13 Favored 'General case' 0 C--N 1.324 -0.526 0 CA-C-N 116.18 -0.464 . . . . 0.0 111.497 -172.064 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 167' ' ' HIS . . . . . . . . . . . . . 3.1 m-70 -157.1 139.39 14.66 Favored 'General case' 0 C--N 1.324 -0.536 0 CA-C-N 116.074 -0.512 . . . . 0.0 110.699 173.269 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 168' ' ' HIS . . . . . . . . . . . . . 53.3 t60 . . . . . 0 C--O 1.247 0.972 0 CA-C-O 118.284 -0.865 . . . . 0.0 109.601 176.618 . . . . . . . . 0 0 . 1 . 016 nuclear build full ' A' A ' 61' ' ' ARG . . . . . . . . . . . . . 77.7 mtp180 . . . . . 0 N--CA 1.483 1.184 0 CA-C-O 120.985 0.422 . . . . 0.0 110.295 . . . . . . . . . 0 0 . 1 . 016 nuclear build full ' A' A ' 62' ' ' ASP . . . . . . . . . . . . . 2.4 m-20 -96.32 133.41 40.73 Favored 'General case' 0 C--N 1.324 -0.536 0 CA-C-N 116.07 -0.514 . . . . 0.0 111.088 -171.8 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 63' ' ' SER . . . . . . . . . . . . . 19.4 m -81.78 167.39 19.13 Favored 'General case' 0 C--N 1.325 -0.474 0 CA-C-N 115.862 -0.608 . . . . 0.0 110.152 177.018 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 64' ' ' PHE . . . . . . . . . . . . . 77.8 t80 -59.04 -33.01 70.27 Favored 'General case' 0 N--CA 1.464 0.236 0 CA-C-O 120.68 0.276 . . . . 0.0 110.578 -177.491 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 65' ' ' GLY . . . . . . . . . . . . . . . -57.87 -41.21 94.03 Favored Glycine 0 N--CA 1.448 -0.559 0 C-N-CA 120.856 -0.688 . . . . 0.0 112.366 176.495 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 66' ' ' ASP . . . . . 0.59 ' O ' ' HG3' ' A' ' 70' ' ' LYS . 6.8 t0 -72.66 -41.27 65.61 Favored 'General case' 0 C--N 1.327 -0.392 0 N-CA-C 109.618 -0.512 . . . . 0.0 109.618 179.78 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 67' ' ' TRP . . . . . . . . . . . . . 97.6 m95 -59.71 -38.33 81.32 Favored 'General case' 0 N--CA 1.464 0.268 0 CA-C-N 116.344 -0.389 . . . . 0.0 110.751 177.184 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 68' ' ' ALA . . . . . . . . . . . . . . . -61.23 -44.5 97.16 Favored 'General case' 0 C--N 1.326 -0.435 0 CA-C-N 116.293 -0.412 . . . . 0.0 110.081 176.314 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 69' ' ' GLU . . . . . . . . . . . . . 28.7 tt0 -62.26 -41.17 98.21 Favored 'General case' 0 CA--C 1.53 0.175 0 CA-C-N 116.116 -0.493 . . . . 0.0 110.024 176.943 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 70' ' ' LYS . . . . . 0.59 ' HG3' ' O ' ' A' ' 66' ' ' ASP . 51.8 mttm -57.34 -44.31 84.16 Favored 'General case' 0 C--O 1.232 0.158 0 CA-C-N 116.354 -0.385 . . . . 0.0 110.587 177.711 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 71' ' ' PHE . . . . . . . . . . . . . 89.2 t80 -60.4 -52.52 64.89 Favored 'General case' 0 C--N 1.331 -0.22 0 CA-C-N 115.905 -0.589 . . . . 0.0 110.63 -179.709 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 72' ' ' LEU . . . . . 0.468 HD12 HD13 ' A' ' 85' ' ' LEU . 4.2 mm? -59.65 -47.4 85.77 Favored 'General case' 0 C--N 1.331 -0.231 0 CA-C-N 116.292 -0.413 . . . . 0.0 110.755 178.856 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 73' ' ' LYS . . . . . 0.444 ' HB2' ' HE3' ' A' ' 73' ' ' LYS . 36.0 ttmt -56.43 -46.64 80.16 Favored 'General case' 0 C--N 1.325 -0.469 0 CA-C-N 115.556 -0.747 . . . . 0.0 110.547 179.774 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 74' ' ' SER . . . . . . . . . . . . . 42.0 m -68.15 -43.79 77.46 Favored 'General case' 0 C--N 1.327 -0.395 0 CA-C-N 115.778 -0.646 . . . . 0.0 111.186 -179.69 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 75' ' ' LYS . . . . . 0.453 ' O ' HG22 ' A' ' 80' ' ' VAL . 3.6 mmtm -69.18 -32.5 71.85 Favored 'General case' 0 C--N 1.331 -0.215 0 CA-C-N 116.701 -0.227 . . . . 0.0 111.423 -177.64 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 76' ' ' GLU . . . . . . . . . . . . . 39.3 tt0 -58.27 -50.68 72.74 Favored 'General case' 0 C--N 1.327 -0.413 0 CA-C-O 121.009 0.433 . . . . 0.0 109.978 173.975 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 77' ' ' ALA . . . . . . . . . . . . . . . -75.45 -10.06 59.12 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 115.689 -0.687 . . . . 0.0 111.108 179.137 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 78' ' ' ASP . . . . . . . . . . . . . 34.5 t70 -76.13 -11.81 60.0 Favored 'General case' 0 C--N 1.324 -0.502 0 CA-C-N 115.727 -0.67 . . . . 0.0 110.885 -177.925 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 79' ' ' GLY . . . . . . . . . . . . . . . 103.55 33.99 3.99 Favored Glycine 0 N--CA 1.451 -0.366 0 C-N-CA 120.632 -0.794 . . . . 0.0 113.332 174.012 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 80' ' ' VAL . . . . . 0.453 HG22 ' O ' ' A' ' 75' ' ' LYS . 31.4 m -101.09 159.53 3.93 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.411 0 CA-C-N 116.935 0.368 . . . . 0.0 110.549 176.653 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 81' ' ' SER . . . . . . . . . . . . . 7.1 p -81.78 174.95 10.84 Favored 'General case' 0 C--N 1.324 -0.54 0 CA-C-N 116.164 -0.471 . . . . 0.0 110.868 179.195 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 82' ' ' VAL . . . . . . . . . . . . . 61.0 t -68.29 -41.66 83.9 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.397 0 CA-C-N 116.341 -0.391 . . . . 0.0 110.615 -177.707 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 83' ' ' SER . . . . . . . . . . . . . 53.0 p -58.9 -39.19 80.74 Favored 'General case' 0 C--N 1.332 -0.188 0 CA-C-O 121.248 0.547 . . . . 0.0 110.507 177.964 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 84' ' ' GLN . . . . . . . . . . . . . 6.5 tp-100 -66.52 -47.98 71.21 Favored 'General case' 0 C--N 1.325 -0.465 0 CA-C-N 115.65 -0.705 . . . . 0.0 110.146 177.822 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 85' ' ' LEU . . . . . 0.468 HD13 HD12 ' A' ' 72' ' ' LEU . 0.6 OUTLIER -62.47 -43.43 98.84 Favored 'General case' 0 C--N 1.326 -0.432 0 CA-C-N 115.599 -0.728 . . . . 0.0 110.559 -178.364 . . . . . . . . 3 3 . 1 . 016 nuclear build full ' A' A ' 86' ' ' ASN . . . . . . . . . . . . . 11.8 m120 -61.44 -38.85 88.68 Favored 'General case' 0 N--CA 1.465 0.297 0 CA-C-O 120.689 0.28 . . . . 0.0 111.005 179.409 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 87' ' ' SER . . . . . . . . . . . . . 49.6 m -60.2 -44.38 95.16 Favored 'General case' 0 C--N 1.327 -0.378 0 CA-C-N 116.32 -0.4 . . . . 0.0 110.772 -179.707 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 88' ' ' TYR . . . . . 0.441 ' HB2' HD11 ' A' ' 72' ' ' LEU . 25.8 m-85 -62.56 -37.97 88.23 Favored 'General case' 0 C--N 1.331 -0.235 0 CA-C-N 116.452 -0.34 . . . . 0.0 110.495 177.706 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 89' ' ' LYS . . . . . 0.62 ' HA ' ' SG ' ' A' ' 92' ' ' CYS . 56.3 mtpt -66.09 -36.74 83.99 Favored 'General case' 0 C--N 1.331 -0.226 0 CA-C-N 116.201 -0.454 . . . . 0.0 110.589 178.522 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 90' ' ' ASN . . . . . 0.507 ' O ' ' HB2' ' A' ' 94' ' ' ASN . 27.3 t-20 -60.98 -33.34 73.07 Favored 'General case' 0 C--N 1.327 -0.382 0 CA-C-O 121.347 0.594 . . . . 0.0 110.375 176.234 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 91' ' ' TYR . . . . . . . . . . . . . 24.1 m-85 -72.18 -50.58 26.57 Favored 'General case' 0 C--N 1.322 -0.616 0 CA-C-N 116.064 -0.516 . . . . 0.0 110.841 178.783 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 92' ' ' CYS . . . . . 0.62 ' SG ' ' HA ' ' A' ' 89' ' ' LYS . 24.9 p -76.81 -40.82 46.73 Favored 'General case' 0 C--N 1.328 -0.331 0 N-CA-C 112.226 0.454 . . . . 0.0 112.226 -174.593 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 93' ' ' ARG . . . . . . . . . . . . . 35.6 ttt180 -78.17 -52.75 8.23 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-O 120.812 0.339 . . . . 0.0 111.834 -176.68 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 94' ' ' ASN . . . . . 0.507 ' HB2' ' O ' ' A' ' 90' ' ' ASN . 3.9 m-20 -77.88 -50.21 12.7 Favored 'General case' 0 C--N 1.324 -0.508 0 CA-C-O 120.976 0.417 . . . . 0.0 111.161 -173.266 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 95' ' ' HIS . . . . . . . . . . . . . 76.0 m80 -86.9 -54.12 4.52 Favored 'General case' 0 C--N 1.323 -0.564 0 CA-C-N 116.193 -0.458 . . . . 0.0 112.101 -173.827 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 96' ' ' LEU . . . . . 0.559 ' HB2' ' HA ' ' A' ' 92' ' ' CYS . 81.8 mt -87.54 26.81 1.2 Allowed 'General case' 0 C--N 1.326 -0.415 0 N-CA-C 111.789 0.292 . . . . 0.0 111.789 -173.471 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 97' ' ' SER . . . . . 0.534 ' N ' ' HD2' ' A' ' 98' ' ' PRO . 0.0 OUTLIER -56.66 -48.05 97.91 Favored Pre-proline 0 CA--C 1.54 0.595 0 N-CA-C 112.595 0.591 . . . . 0.0 112.595 -179.16 . . . . . . . . 3 3 . 1 . 016 nuclear build full ' A' A ' 98' ' ' PRO . . . . . 0.534 ' HD2' ' N ' ' A' ' 97' ' ' SER . 15.7 Cg_endo -58.62 -36.54 97.12 Favored 'Trans proline' 0 C--N 1.358 1.037 0 C-N-CA 122.032 1.821 . . . . 0.0 112.336 176.409 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 99' ' ' LEU . . . . . 0.434 HD22 HD22 ' A' ' 96' ' ' LEU . 8.1 mp -70.09 -33.65 72.15 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-N 116.304 -0.407 . . . . 0.0 110.503 -179.342 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 100' ' ' TYR . . . . . . . . . . . . . 62.9 t80 -57.42 -29.79 64.44 Favored 'General case' 0 C--N 1.327 -0.391 0 CA-C-N 115.541 -0.754 . . . . 0.0 110.926 179.272 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 101' ' ' MET . . . . . . . . . . . . . 47.4 ttm -86.6 -18.61 30.99 Favored 'General case' 0 C--N 1.325 -0.468 0 CA-C-N 116.008 -0.542 . . . . 0.0 110.88 -177.344 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 102' ' ' LYS . . . . . . . . . . . . . 89.2 mttt -91.02 165.2 13.66 Favored 'General case' 0 C--N 1.325 -0.495 0 CA-C-O 121.453 0.644 . . . . 0.0 111.944 -174.348 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 103' ' ' SER . . . . . 0.472 ' O ' HG13 ' A' ' 107' ' ' ILE . 18.1 t -95.02 172.2 8.29 Favored 'General case' 0 C--N 1.323 -0.582 0 CA-C-N 115.396 -0.82 . . . . 0.0 109.051 169.336 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 104' ' ' LEU . . . . . . . . . . . . . 89.0 mt -59.07 -43.72 91.8 Favored 'General case' 0 C--N 1.325 -0.458 0 N-CA-C 111.993 0.368 . . . . 0.0 111.993 -174.686 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 105' ' ' SER . . . . . . . . . . . . . 24.1 t -85.04 1.97 45.32 Favored 'General case' 0 C--N 1.326 -0.447 0 CA-C-O 121.099 0.476 . . . . 0.0 110.74 -177.315 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 106' ' ' GLU . . . . . . . . . . . . . 19.7 tp10 -102.36 -14.06 17.07 Favored 'General case' 0 C--N 1.322 -0.63 0 CA-C-O 121.268 0.556 . . . . 0.0 110.531 -178.128 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 107' ' ' ILE . . . . . 0.472 HG13 ' O ' ' A' ' 103' ' ' SER . 68.3 mt -83.81 140.38 16.27 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.45 0 CA-C-N 116.09 -0.504 . . . . 0.0 110.953 -178.626 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 108' ' ' LEU . . . . . . . . . . . . . 76.1 mt -110.81 151.22 42.76 Favored Pre-proline 0 C--N 1.324 -0.513 0 CA-C-N 116.023 -0.535 . . . . 0.0 109.71 178.161 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 109' ' ' PRO . . . . . . . . . . . . . 18.9 Cg_endo -61.08 -26.8 83.43 Favored 'Trans proline' 0 N--CA 1.464 -0.212 0 C-N-CA 121.979 1.786 . . . . 0.0 111.166 174.633 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 110' ' ' ALA . . . . . 0.425 ' HA ' ' HB3' ' A' ' 113' ' ' GLN . . . -71.48 -26.34 62.65 Favored 'General case' 0 N--CA 1.453 -0.288 0 CA-C-N 115.351 -0.841 . . . . 0.0 111.683 -178.78 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 111' ' ' ASP . . . . . 0.466 ' O ' HG13 ' A' ' 115' ' ' ILE . 29.7 m-20 -57.74 -57.15 14.02 Favored 'General case' 0 N--CA 1.463 0.223 0 CA-C-O 121.272 0.558 . . . . 0.0 109.648 176.426 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 112' ' ' ILE . . . . . . . . . . . . . 19.5 mt -67.23 -37.49 79.22 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.538 0 CA-C-N 115.449 -0.796 . . . . 0.0 110.337 -179.162 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 113' ' ' GLN . . . . . 0.425 ' HB3' ' HA ' ' A' ' 110' ' ' ALA . 23.4 tp60 -58.27 -50.12 74.71 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 115.864 -0.607 . . . . 0.0 111.446 179.651 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 114' ' ' SER . . . . . . . . . . . . . 31.6 p -64.7 -35.2 80.27 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 116.335 -0.393 . . . . 0.0 110.956 -177.963 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 115' ' ' ILE . . . . . 0.466 HG13 ' O ' ' A' ' 111' ' ' ASP . 92.7 mt -60.44 -53.3 50.69 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.299 0 CA-C-O 120.694 0.283 . . . . 0.0 110.359 175.979 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 116' ' ' ILE . . . . . . . . . . . . . 47.5 mm -60.16 -41.95 88.47 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.289 0 CA-C-N 116.121 -0.49 . . . . 0.0 110.924 -179.435 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 117' ' ' ASN . . . . . . . . . . . . . 27.9 t-20 -65.49 -32.67 74.41 Favored 'General case' 0 C--N 1.326 -0.447 0 CA-C-N 116.066 -0.515 . . . . 0.0 111.926 -176.896 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 118' ' ' GLU . . . . . . . . . . . . . 21.3 mt-10 -103.17 4.18 36.6 Favored 'General case' 0 C--N 1.329 -0.311 0 N-CA-C 112.176 0.436 . . . . 0.0 112.176 -177.663 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 119' ' ' THR . . . . . . . . . . . . . 96.7 m -97.85 112.06 24.12 Favored 'General case' 0 C--N 1.322 -0.596 0 CA-C-O 121.176 0.512 . . . . 0.0 110.239 173.636 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 120' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -93.86 88.62 5.82 Favored 'General case' 0 C--N 1.325 -0.458 0 CA-C-N 115.943 -0.571 . . . . 0.0 110.362 -177.869 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 121' ' ' LEU . . . . . 0.415 HD13 HG21 ' A' ' 125' ' ' THR . 57.6 mt -138.69 -174.7 3.9 Favored 'General case' 0 C--N 1.32 -0.694 0 CA-C-N 115.392 -0.822 . . . . 0.0 110.025 179.541 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 122' ' ' ALA . . . . . . . . . . . . . . . -64.85 147.39 53.36 Favored 'General case' 0 C--N 1.322 -0.612 0 CA-C-N 116.277 -0.42 . . . . 0.0 110.465 178.439 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 123' ' ' LYS . . . . . 0.51 ' HE3' ' O ' ' A' ' 158' ' ' LYS . 52.6 mttp -55.94 -33.96 65.21 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 115.997 -0.547 . . . . 0.0 111.353 -179.345 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 124' ' ' ASN . . . . . . . . . . . . . 65.5 t30 -64.74 -38.49 91.17 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 115.978 -0.555 . . . . 0.0 110.413 -179.987 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 125' ' ' THR . . . . . 0.475 ' O ' HG13 ' A' ' 129' ' ' ILE . 7.3 m -68.25 -37.52 80.85 Favored 'General case' 0 C--N 1.326 -0.417 0 CA-C-N 115.774 -0.648 . . . . 0.0 110.801 -179.444 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 126' ' ' LEU . . . . . . . . . . . . . 88.5 mt -61.84 -41.8 98.26 Favored 'General case' 0 C--O 1.234 0.289 0 CA-C-O 121.144 0.497 . . . . 0.0 110.221 178.595 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 127' ' ' LYS . . . . . 0.403 ' HG3' ' O ' ' A' ' 123' ' ' LYS . 93.5 mttt -63.49 -44.68 93.66 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 115.663 -0.698 . . . . 0.0 110.201 177.142 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 128' ' ' ALA . . . . . . . . . . . . . . . -57.57 -40.45 78.98 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 115.717 -0.674 . . . . 0.0 111.477 -178.404 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 129' ' ' ILE . . . . . 0.475 HG13 ' O ' ' A' ' 125' ' ' THR . 67.3 mt -62.63 -50.19 80.77 Favored 'Isoleucine or valine' 0 C--O 1.235 0.295 0 CA-C-N 116.478 -0.328 . . . . 0.0 110.687 178.809 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 130' ' ' ARG . . . . . . . . . . . . . 13.7 ttt180 -61.63 -45.68 93.02 Favored 'General case' 0 C--O 1.231 0.107 0 CA-C-N 116.467 -0.333 . . . . 0.0 110.782 178.106 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 131' ' ' ASN . . . . . . . . . . . . . 7.1 m-20 -58.29 -49.54 76.77 Favored 'General case' 0 C--N 1.325 -0.457 0 CA-C-N 116.36 -0.382 . . . . 0.0 111.49 -179.061 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 132' ' ' THR . . . . . 0.484 ' O ' HG13 ' A' ' 136' ' ' ILE . 52.9 m -54.76 -50.72 67.76 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 116.227 -0.442 . . . . 0.0 110.594 178.268 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 133' ' ' ALA . . . . . . . . . . . . . . . -61.06 -40.91 95.46 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.209 -0.451 . . . . 0.0 111.103 179.436 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 134' ' ' SER . . . . . 0.455 ' O ' ' HG3' ' A' ' 138' ' ' ARG . 58.7 m -59.29 -45.57 90.9 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.044 -0.526 . . . . 0.0 111.123 -179.884 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 135' ' ' GLN . . . . . . . . . . . . . 12.3 mm100 -66.0 -34.85 79.04 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.399 -0.364 . . . . 0.0 111.071 -177.716 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 136' ' ' ILE . . . . . 0.484 HG13 ' O ' ' A' ' 132' ' ' THR . 64.3 mt -64.68 -43.81 96.61 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.264 0 CA-C-O 120.843 0.354 . . . . 0.0 110.166 177.219 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 137' ' ' PHE . . . . . 0.531 ' O ' HG13 ' A' ' 141' ' ' ILE . 43.5 m-85 -63.9 -39.86 95.16 Favored 'General case' 0 C--N 1.332 -0.18 0 CA-C-N 116.179 -0.464 . . . . 0.0 110.671 176.346 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 138' ' ' ARG . . . . . 0.455 ' HG3' ' O ' ' A' ' 134' ' ' SER . 79.0 mtt180 -64.0 -36.38 83.8 Favored 'General case' 0 C--N 1.332 -0.185 0 CA-C-O 120.738 0.304 . . . . 0.0 110.634 178.605 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 139' ' ' LEU . . . . . . . . . . . . . 54.8 tp -59.22 -41.52 88.84 Favored 'General case' 0 C--N 1.326 -0.423 0 CA-C-N 116.056 -0.52 . . . . 0.0 110.043 176.13 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 140' ' ' ALA . . . . . . . . . . . . . . . -67.0 -36.3 81.86 Favored 'General case' 0 C--N 1.327 -0.385 0 CA-C-N 116.243 -0.435 . . . . 0.0 110.537 176.715 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 141' ' ' ILE . . . . . 0.604 ' HA ' ' O ' ' A' ' 146' ' ' ILE . 77.3 mt -63.51 -45.58 97.4 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.301 0 CA-C-N 116.083 -0.508 . . . . 0.0 110.582 176.776 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 142' ' ' GLU . . . . . . . . . . . . . 46.4 mt-10 -63.16 -27.66 69.52 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.015 -0.539 . . . . 0.0 111.159 179.534 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 143' ' ' ASN . . . . . . . . . . . . . 35.1 m-80 -95.97 11.85 32.48 Favored 'General case' 0 C--N 1.326 -0.421 0 CA-C-N 116.284 -0.416 . . . . 0.0 110.821 179.43 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 144' ' ' ARG . . . . . . . . . . . . . 81.5 mtm180 60.88 25.24 15.19 Favored 'General case' 0 N--CA 1.469 0.498 0 CA-C-N 115.7 -0.682 . . . . 0.0 112.553 174.589 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 145' ' ' ALA . . . . . . . . . . . . . . . -80.41 -42.35 22.92 Favored 'General case' 0 C--N 1.323 -0.553 0 CA-C-O 121.25 0.548 . . . . 0.0 110.309 177.835 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 146' ' ' ILE . . . . . 0.604 ' O ' ' HA ' ' A' ' 141' ' ' ILE . 13.7 tt -147.13 152.19 13.28 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.542 0 CA-C-N 115.677 -0.692 . . . . 0.0 109.336 179.412 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 147' ' ' ASP . . . . . . . . . . . . . 25.9 t70 -125.83 70.06 1.2 Allowed 'General case' 0 C--N 1.321 -0.634 0 N-CA-C 109.314 -0.625 . . . . 0.0 109.314 175.096 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 148' ' ' PHE . . . . . . . . . . . . . 61.5 t80 -169.48 133.8 1.37 Allowed 'General case' 0 C--N 1.324 -0.535 0 CA-C-N 115.618 -0.719 . . . . 0.0 109.647 -177.905 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 149' ' ' ASN . . . . . . . . . . . . . 59.0 t30 -115.7 96.3 46.06 Favored Pre-proline 0 C--N 1.322 -0.591 0 CA-C-N 116.478 -0.328 . . . . 0.0 110.737 179.369 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 150' ' ' PRO . . . . . . . . . . . . . 17.3 Cg_exo -67.4 -21.47 47.03 Favored 'Trans proline' 0 C--N 1.344 0.311 0 C-N-CA 122.852 2.368 . . . . 0.0 112.07 179.682 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 151' ' ' ALA . . . . . 0.407 ' HA ' HG23 ' A' ' 154' ' ' VAL . . . -72.18 -15.8 61.96 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-N 115.972 -0.558 . . . . 0.0 111.246 -178.582 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 152' ' ' ASP . . . . . . . . . . . . . 25.2 t70 -72.01 -19.56 61.84 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-O 121.212 0.53 . . . . 0.0 110.568 179.997 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 153' ' ' TYR . . . . . . . . . . . . . 97.8 m-85 -93.38 1.52 56.87 Favored 'General case' 0 C--N 1.326 -0.435 0 CA-C-N 115.958 -0.565 . . . . 0.0 111.251 -177.573 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 154' ' ' VAL . . . . . 0.407 HG23 ' HA ' ' A' ' 151' ' ' ALA . 48.8 t -77.2 110.82 13.3 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.373 0 CA-C-N 116.374 -0.376 . . . . 0.0 110.334 179.615 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 155' ' ' ARG . . . . . . . . . . . . . 77.0 mtt-85 -77.22 135.39 38.48 Favored 'General case' 0 C--N 1.321 -0.637 0 CA-C-N 116.181 -0.463 . . . . 0.0 110.273 179.279 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 156' ' ' ILE . . . . . . . . . . . . . 49.8 mm -105.06 104.92 49.48 Favored Pre-proline 0 C--N 1.321 -0.646 0 CA-C-N 115.736 -0.665 . . . . 0.0 109.77 -179.113 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 157' ' ' PRO . . . . . . . . . . . . . 58.2 Cg_endo -73.08 131.69 17.08 Favored 'Trans proline' 0 N--CA 1.461 -0.394 0 C-N-CA 122.412 2.075 . . . . 0.0 112.227 -177.937 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 158' ' ' LYS . . . . . 0.51 ' O ' ' HE3' ' A' ' 123' ' ' LYS . 95.7 mttt -92.25 -48.69 6.56 Favored 'General case' 0 C--N 1.322 -0.625 0 CA-C-N 116.043 -0.526 . . . . 0.0 110.068 179.604 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 159' ' ' ILE . . . . . . . . . . . . . 62.8 mt 69.0 98.74 0.05 OUTLIER 'Isoleucine or valine' 0 N--CA 1.463 0.207 0 CA-C-N 115.769 -0.65 . . . . 0.0 111.486 176.622 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 160' ' ' ALA . . . . . . . . . . . . . . . -111.09 26.82 10.3 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-O 121.581 0.705 . . . . 0.0 110.134 178.687 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 161' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -152.05 46.03 0.76 Allowed 'General case' 0 C--N 1.317 -0.84 0 CA-C-N 114.762 -1.108 . . . . 0.0 110.401 -177.094 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 162' ' ' GLU . . . . . . . . . . . . . 3.6 mp0 -52.18 113.55 1.06 Allowed 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 115.771 -0.65 . . . . 0.0 112.429 -174.762 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 163' ' ' HIS . . . . . 0.437 ' O ' ' HB3' ' A' ' 164' ' ' HIS . 39.7 p-80 -131.48 -169.41 2.18 Favored 'General case' 0 C--N 1.325 -0.467 0 CA-C-N 115.248 -0.887 . . . . 0.0 109.136 176.356 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 164' ' ' HIS . . . . . 0.437 ' HB3' ' O ' ' A' ' 163' ' ' HIS . 74.2 t60 69.06 95.07 0.07 Allowed 'General case' 0 N--CA 1.466 0.351 0 N-CA-C 109.742 -0.466 . . . . 0.0 109.742 -176.816 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 165' ' ' HIS . . . . . . . . . . . . . 39.5 t60 62.13 29.84 17.63 Favored 'General case' 0 N--CA 1.466 0.346 0 CA-C-O 121.587 0.708 . . . . 0.0 109.521 -177.177 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 166' ' ' HIS . . . . . . . . . . . . . 26.7 m80 -129.94 116.76 19.09 Favored 'General case' 0 C--N 1.326 -0.45 0 CA-C-N 116.055 -0.52 . . . . 0.0 111.657 -177.319 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 167' ' ' HIS . . . . . . . . . . . . . 10.2 p80 -97.62 107.0 19.4 Favored 'General case' 0 C--N 1.322 -0.592 0 N-CA-C 108.084 -1.08 . . . . 0.0 108.084 168.111 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 168' ' ' HIS . . . . . . . . . . . . . 35.1 t-80 . . . . . 0 C--O 1.248 1.016 0 CA-C-O 118.563 -0.732 . . . . 0.0 110.417 -174.025 . . . . . . . . 0 0 . 1 . 017 nuclear build full ' A' A ' 61' ' ' ARG . . . . . 0.469 ' NE ' ' HA ' ' A' ' 61' ' ' ARG . 4.1 mmp_? . . . . . 0 N--CA 1.479 0.991 0 N-CA-C 110.171 -0.307 . . . . 0.0 110.171 . . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 62' ' ' ASP . . . . . . . . . . . . . 16.3 m-20 -93.82 147.01 23.47 Favored 'General case' 0 C--N 1.32 -0.716 0 CA-C-O 120.964 0.411 . . . . 0.0 111.033 -176.897 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 63' ' ' SER . . . . . . . . . . . . . 21.9 p -118.8 148.18 43.12 Favored 'General case' 0 C--N 1.321 -0.637 0 CA-C-N 115.971 -0.559 . . . . 0.0 110.077 178.356 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 64' ' ' PHE . . . . . 0.408 ' HB3' ' O ' ' A' ' 99' ' ' LEU . 83.0 t80 -61.84 -42.44 99.04 Favored 'General case' 0 C--N 1.326 -0.445 0 CA-C-N 116.448 -0.342 . . . . 0.0 110.746 -177.055 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 65' ' ' GLY . . . . . . . . . . . . . . . -63.46 -30.64 78.21 Favored Glycine 0 C--N 1.329 0.188 0 C-N-CA 120.898 -0.668 . . . . 0.0 113.019 -178.534 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 66' ' ' ASP . . . . . . . . . . . . . 23.7 t70 -71.31 -45.18 63.64 Favored 'General case' 0 C--N 1.326 -0.434 0 CA-C-O 121.067 0.46 . . . . 0.0 110.574 -179.525 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 67' ' ' TRP . . . . . 0.44 ' HA ' ' HE2' ' A' ' 70' ' ' LYS . 83.2 m95 -74.79 -28.89 60.92 Favored 'General case' 0 C--N 1.325 -0.493 0 CA-C-N 116.285 -0.416 . . . . 0.0 110.942 178.559 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 68' ' ' ALA . . . . . . . . . . . . . . . -64.28 -37.15 86.48 Favored 'General case' 0 C--N 1.331 -0.219 0 CA-C-O 121.008 0.432 . . . . 0.0 110.142 173.971 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 69' ' ' GLU . . . . . . . . . . . . . 43.4 tt0 -59.08 -48.64 80.85 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 115.661 -0.699 . . . . 0.0 109.964 175.661 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 70' ' ' LYS . . . . . 0.44 ' HE2' ' HA ' ' A' ' 67' ' ' TRP . 19.2 mtmm -62.45 -31.63 72.38 Favored 'General case' 0 C--N 1.328 -0.326 0 CA-C-N 115.665 -0.698 . . . . 0.0 111.427 177.428 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 71' ' ' PHE . . . . . 0.417 ' CE2' HG23 ' A' ' 132' ' ' THR . 92.1 t80 -68.14 -45.13 74.44 Favored 'General case' 0 C--O 1.235 0.298 0 CA-C-O 120.578 0.228 . . . . 0.0 111.072 178.78 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 72' ' ' LEU . . . . . . . . . . . . . 8.0 mp -60.07 -42.5 94.69 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-O 121.09 0.471 . . . . 0.0 110.637 177.668 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 73' ' ' LYS . . . . . . . . . . . . . 58.2 mtpt -72.6 -24.6 61.1 Favored 'General case' 0 C--N 1.325 -0.457 0 CA-C-N 115.874 -0.603 . . . . 0.0 110.707 179.207 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 74' ' ' SER . . . . . . . . . . . . . 26.7 t -68.44 -51.32 44.97 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 115.89 -0.596 . . . . 0.0 110.277 177.634 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 75' ' ' LYS . . . . . 0.423 ' O ' HG22 ' A' ' 80' ' ' VAL . 5.2 mptp? -68.42 -27.93 66.62 Favored 'General case' 0 C--O 1.234 0.241 0 CA-C-O 120.865 0.364 . . . . 0.0 110.719 178.741 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 76' ' ' GLU . . . . . . . . . . . . . 36.0 tt0 -56.48 -47.84 78.39 Favored 'General case' 0 C--N 1.324 -0.534 0 CA-C-N 115.803 -0.635 . . . . 0.0 109.772 172.07 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 77' ' ' ALA . . . . . . . . . . . . . . . -75.06 -23.72 58.1 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 115.645 -0.707 . . . . 0.0 111.164 177.904 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 78' ' ' ASP . . . . . . . . . . . . . 20.2 t70 -63.58 -31.61 72.83 Favored 'General case' 0 N--CA 1.464 0.237 0 CA-C-O 121.194 0.521 . . . . 0.0 110.581 178.318 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 79' ' ' GLY . . . . . . . . . . . . . . . 105.14 21.06 9.17 Favored Glycine 0 N--CA 1.446 -0.656 0 C-N-CA 120.636 -0.792 . . . . 0.0 112.795 176.229 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 80' ' ' VAL . . . . . 0.423 HG22 ' O ' ' A' ' 75' ' ' LYS . 25.7 m -71.02 153.5 8.3 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.451 0 CA-C-O 120.838 0.352 . . . . 0.0 110.29 178.986 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 81' ' ' SER . . . . . . . . . . . . . 10.7 p -68.77 160.58 30.16 Favored 'General case' 0 C--N 1.323 -0.573 0 CA-C-N 116.131 -0.486 . . . . 0.0 110.67 179.476 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 82' ' ' VAL . . . . . . . . . . . . . 13.3 p -61.51 -34.35 61.13 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.393 0 CA-C-O 120.735 0.302 . . . . 0.0 110.514 179.6 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 83' ' ' SER . . . . . . . . . . . . . 4.0 p -66.79 -42.29 86.23 Favored 'General case' 0 C--O 1.236 0.387 0 CA-C-O 121.087 0.47 . . . . 0.0 110.282 177.497 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 84' ' ' GLN . . . . . . . . . . . . . 6.3 tp-100 -64.65 -43.87 92.25 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 115.809 -0.632 . . . . 0.0 110.019 176.936 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 85' ' ' LEU . . . . . 0.491 ' O ' ' HG3' ' A' ' 89' ' ' LYS . 52.7 tp -62.68 -45.15 94.12 Favored 'General case' 0 C--N 1.326 -0.431 0 CA-C-N 115.921 -0.581 . . . . 0.0 110.496 178.4 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 86' ' ' ASN . . . . . . . . . . . . . 78.1 m-20 -57.15 -35.49 69.59 Favored 'General case' 0 N--CA 1.464 0.233 0 CA-C-N 116.459 -0.337 . . . . 0.0 110.808 177.325 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 87' ' ' SER . . . . . . . . . . . . . 48.2 m -60.54 -45.36 94.17 Favored 'General case' 0 C--N 1.327 -0.393 0 CA-C-N 116.318 -0.401 . . . . 0.0 110.29 177.827 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 88' ' ' TYR . . . . . . . . . . . . . 54.1 m-85 -66.24 -38.85 88.86 Favored 'General case' 0 C--N 1.331 -0.229 0 CA-C-O 120.926 0.393 . . . . 0.0 110.842 179.126 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 89' ' ' LYS . . . . . 0.491 ' HG3' ' O ' ' A' ' 85' ' ' LEU . 51.7 mtpt -64.29 -40.96 97.02 Favored 'General case' 0 C--N 1.324 -0.504 0 CA-C-N 116.15 -0.477 . . . . 0.0 110.223 178.106 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 90' ' ' ASN . . . . . 0.493 ' O ' ' HB2' ' A' ' 94' ' ' ASN . 7.2 m-20 -66.2 -28.89 69.1 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.073 -0.512 . . . . 0.0 110.897 177.617 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 91' ' ' TYR . . . . . . . . . . . . . 19.7 m-85 -71.88 -50.21 31.31 Favored 'General case' 0 C--N 1.323 -0.574 0 N-CA-C 109.905 -0.405 . . . . 0.0 109.905 174.381 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 92' ' ' CYS . . . . . 0.527 ' HA ' ' HB2' ' A' ' 96' ' ' LEU . 40.5 t -67.25 -54.62 19.29 Favored 'General case' 0 C--N 1.325 -0.458 0 CA-C-N 116.093 -0.503 . . . . 0.0 112.324 -176.601 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 93' ' ' ARG . . . . . 0.527 ' O ' ' HB3' ' A' ' 97' ' ' SER . 7.8 mpt_? -71.33 -36.82 71.7 Favored 'General case' 0 C--N 1.328 -0.361 0 N-CA-C 112.542 0.571 . . . . 0.0 112.542 -172.539 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 94' ' ' ASN . . . . . 0.493 ' HB2' ' O ' ' A' ' 90' ' ' ASN . 3.4 m-20 -93.72 -55.94 3.07 Favored 'General case' 0 C--N 1.324 -0.525 0 CA-C-O 120.871 0.367 . . . . 0.0 111.73 -175.412 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 95' ' ' HIS . . . . . . . . . . . . . 79.6 m80 -84.92 -47.18 10.55 Favored 'General case' 0 C--N 1.323 -0.549 0 CA-C-N 116.212 -0.449 . . . . 0.0 111.515 -170.346 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 96' ' ' LEU . . . . . 0.527 ' HB2' ' HA ' ' A' ' 92' ' ' CYS . 88.6 mt -88.62 19.51 3.91 Favored 'General case' 0 C--N 1.324 -0.536 0 CA-C-N 116.388 -0.369 . . . . 0.0 111.035 -178.237 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 97' ' ' SER . . . . . 0.558 ' OG ' ' HD3' ' A' ' 98' ' ' PRO . 12.4 p -60.76 -42.09 85.79 Favored Pre-proline 0 CA--C 1.542 0.664 0 N-CA-C 113.102 0.778 . . . . 0.0 113.102 -177.986 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 98' ' ' PRO . . . . . 0.558 ' HD3' ' OG ' ' A' ' 97' ' ' SER . 17.3 Cg_exo -65.81 -33.57 43.07 Favored 'Trans proline' 0 C--N 1.359 1.079 0 C-N-CA 121.424 1.416 . . . . 0.0 111.737 178.396 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 99' ' ' LEU . . . . . 0.408 ' O ' ' HB3' ' A' ' 64' ' ' PHE . 68.0 mt -79.72 -29.11 40.55 Favored 'General case' 0 C--N 1.327 -0.382 0 CA-C-N 115.742 -0.663 . . . . 0.0 110.679 -177.221 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 100' ' ' TYR . . . . . . . . . . . . . 46.9 t80 -52.79 -40.31 63.09 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 115.775 -0.648 . . . . 0.0 110.916 179.794 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 101' ' ' MET . . . . . . . . . . . . . 21.0 ptp -95.81 14.16 24.23 Favored 'General case' 0 C--N 1.323 -0.567 0 CA-C-N 115.931 -0.577 . . . . 0.0 111.423 -176.51 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 102' ' ' LYS . . . . . 0.505 ' HG3' ' O ' ' A' ' 98' ' ' PRO . 96.7 mttt -104.33 152.88 21.72 Favored 'General case' 0 C--N 1.324 -0.536 0 CA-C-O 121.054 0.454 . . . . 0.0 111.016 178.442 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 103' ' ' SER . . . . . 0.435 ' O ' ' HG2' ' A' ' 106' ' ' GLU . 37.9 t -70.74 146.37 49.88 Favored 'General case' 0 C--N 1.322 -0.615 0 CA-C-N 115.57 -0.741 . . . . 0.0 109.576 176.416 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 104' ' ' LEU . . . . . . . . . . . . . 30.6 tp -60.47 -31.87 70.87 Favored 'General case' 0 C--N 1.323 -0.574 0 CA-C-N 116.21 -0.45 . . . . 0.0 111.038 -176.56 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 105' ' ' SER . . . . . . . . . . . . . 56.3 p -87.89 -17.35 31.59 Favored 'General case' 0 C--N 1.329 -0.319 0 N-CA-C 112.29 0.478 . . . . 0.0 112.29 -176.019 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 106' ' ' GLU . . . . . 0.435 ' HG2' ' O ' ' A' ' 103' ' ' SER . 8.4 pt-20 -89.03 -18.53 27.14 Favored 'General case' 0 N--CA 1.464 0.234 0 C-N-CA 120.755 -0.378 . . . . 0.0 111.289 -174.263 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 107' ' ' ILE . . . . . 0.434 HG13 ' O ' ' A' ' 103' ' ' SER . 66.3 mt -73.0 111.08 6.87 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.467 0 CA-C-O 120.993 0.425 . . . . 0.0 110.961 -176.412 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 108' ' ' LEU . . . . . 0.44 ' HA ' ' HD3' ' A' ' 109' ' ' PRO . 1.7 pp -97.46 145.4 29.61 Favored Pre-proline 0 C--N 1.323 -0.58 0 CA-C-N 115.83 -0.623 . . . . 0.0 110.102 176.951 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 109' ' ' PRO . . . . . 0.442 ' HG3' ' HA ' ' A' ' 150' ' ' PRO . 52.4 Cg_exo -54.96 -33.19 81.83 Favored 'Trans proline' 0 C--N 1.343 0.283 0 C-N-CA 123.438 2.759 . . . . 0.0 113.74 -174.516 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 110' ' ' ALA . . . . . . . . . . . . . . . -59.62 -32.32 70.31 Favored 'General case' 0 C--N 1.331 -0.209 0 CA-C-O 120.697 0.284 . . . . 0.0 111.43 -178.98 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 111' ' ' ASP . . . . . 0.437 ' H ' HD12 ' A' ' 108' ' ' LEU . 38.7 t70 -73.41 -46.82 46.47 Favored 'General case' 0 C--N 1.325 -0.473 0 CA-C-O 121.05 0.453 . . . . 0.0 110.374 -177.159 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 112' ' ' ILE . . . . . . . . . . . . . 27.9 mt -62.01 -39.93 85.49 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.399 0 CA-C-N 115.686 -0.688 . . . . 0.0 110.223 177.992 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 113' ' ' GLN . . . . . 0.42 ' O ' ' HB ' ' A' ' 116' ' ' ILE . 14.6 tm0? -65.54 -35.12 79.92 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 115.889 -0.596 . . . . 0.0 109.857 179.175 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 114' ' ' SER . . . . . 0.471 ' O ' ' HG2' ' A' ' 118' ' ' GLU . 57.5 m -64.74 -38.95 92.74 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.434 -0.348 . . . . 0.0 110.453 177.225 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 115' ' ' ILE . . . . . . . . . . . . . 67.7 mt -62.42 -36.55 75.38 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.337 0 CA-C-O 121.175 0.512 . . . . 0.0 109.951 176.235 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 116' ' ' ILE . . . . . 0.42 ' HB ' ' O ' ' A' ' 113' ' ' GLN . 42.1 mm -61.69 -42.09 92.96 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.338 0 CA-C-N 115.675 -0.693 . . . . 0.0 110.339 175.21 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 117' ' ' ASN . . . . . . . . . . . . . 83.9 m-20 -66.47 -32.02 73.13 Favored 'General case' 0 N--CA 1.466 0.368 0 CA-C-N 116.121 -0.491 . . . . 0.0 110.908 178.627 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 118' ' ' GLU . . . . . 0.471 ' HG2' ' O ' ' A' ' 114' ' ' SER . 65.9 mm-40 -80.63 -17.84 49.98 Favored 'General case' 0 C--N 1.327 -0.383 0 CA-C-N 116.146 -0.479 . . . . 0.0 111.011 -178.306 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 119' ' ' THR . . . . . . . . . . . . . 36.4 m -87.97 113.71 23.88 Favored 'General case' 0 C--N 1.321 -0.638 0 CA-C-N 116.13 -0.486 . . . . 0.0 109.871 178.69 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 120' ' ' LYS . . . . . . . . . . . . . 59.5 pttt -90.53 29.19 1.33 Allowed 'General case' 0 C--N 1.326 -0.424 0 CA-C-N 116.005 -0.543 . . . . 0.0 111.322 -175.294 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 121' ' ' LEU . . . . . 0.541 HD13 HG21 ' A' ' 125' ' ' THR . 95.9 mt -91.92 162.27 14.48 Favored 'General case' 0 C--N 1.32 -0.707 0 CA-C-N 116.167 -0.47 . . . . 0.0 109.999 179.348 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 122' ' ' ALA . . . . . . . . . . . . . . . -64.81 163.22 14.61 Favored 'General case' 0 C--N 1.326 -0.431 0 CA-C-O 120.979 0.419 . . . . 0.0 111.714 -176.967 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 123' ' ' LYS . . . . . 0.501 ' O ' ' HG3' ' A' ' 127' ' ' LYS . 19.7 pttp -55.05 -35.65 64.72 Favored 'General case' 0 C--N 1.331 -0.197 0 CA-C-N 115.624 -0.717 . . . . 0.0 111.897 -177.804 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 124' ' ' ASN . . . . . . . . . . . . . 48.5 t-20 -56.99 -52.14 66.46 Favored 'General case' 0 C--O 1.234 0.249 0 CA-C-O 121.156 0.503 . . . . 0.0 110.16 178.975 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 125' ' ' THR . . . . . 0.541 HG21 HD13 ' A' ' 121' ' ' LEU . 1.3 m -66.77 -37.2 84.12 Favored 'General case' 0 N--CA 1.449 -0.493 0 CA-C-N 115.801 -0.636 . . . . 0.0 110.809 -178.814 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 126' ' ' LEU . . . . . . . . . . . . . 90.9 mt -61.22 -43.52 98.75 Favored 'General case' 0 C--O 1.234 0.28 0 CA-C-N 116.274 -0.421 . . . . 0.0 110.873 178.52 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 127' ' ' LYS . . . . . 0.532 ' HG2' HG21 ' A' ' 156' ' ' ILE . 47.6 mtpt -64.15 -41.53 97.14 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.307 -0.406 . . . . 0.0 110.455 178.21 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 128' ' ' ALA . . . . . . . . . . . . . . . -60.36 -44.09 95.9 Favored 'General case' 0 C--O 1.234 0.246 0 CA-C-N 116.168 -0.469 . . . . 0.0 111.173 179.855 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 129' ' ' ILE . . . . . 0.463 HG13 ' O ' ' A' ' 125' ' ' THR . 77.6 mt -62.54 -45.79 97.96 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.291 0 CA-C-N 116.249 -0.432 . . . . 0.0 110.27 177.728 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 130' ' ' ARG . . . . . 0.543 ' CZ ' ' HA ' ' A' ' 152' ' ' ASP . 0.3 OUTLIER -65.21 -40.59 94.35 Favored 'General case' 0 C--N 1.331 -0.206 0 CA-C-N 116.056 -0.52 . . . . 0.0 110.485 -179.139 . . . . . . . . 3 3 . 1 . 017 nuclear build full ' A' A ' 131' ' ' ASN . . . . . 0.602 ' O ' ' HG2' ' A' ' 135' ' ' GLN . 83.6 m-20 -59.67 -52.31 66.08 Favored 'General case' 0 CA--C 1.518 -0.26 0 CA-C-N 116.291 -0.413 . . . . 0.0 110.298 177.25 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 132' ' ' THR . . . . . 0.49 ' O ' HG13 ' A' ' 136' ' ' ILE . 55.1 m -51.7 -49.41 62.49 Favored 'General case' 0 C--N 1.329 -0.316 0 O-C-N 123.678 0.611 . . . . 0.0 110.785 178.74 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 133' ' ' ALA . . . . . . . . . . . . . . . -63.81 -44.15 94.12 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.19 -0.459 . . . . 0.0 111.508 -179.744 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 134' ' ' SER . . . . . . . . . . . . . 34.6 p -66.71 -29.51 69.52 Favored 'General case' 0 C--N 1.33 -0.254 0 C-N-CA 121.168 -0.213 . . . . 0.0 111.463 -177.141 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 135' ' ' GLN . . . . . 0.602 ' HG2' ' O ' ' A' ' 131' ' ' ASN . 11.1 mm100 -73.03 -32.68 65.25 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-O 120.784 0.326 . . . . 0.0 110.237 178.094 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 136' ' ' ILE . . . . . 0.49 HG13 ' O ' ' A' ' 132' ' ' THR . 75.2 mt -64.33 -48.06 86.97 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.21 0 CA-C-N 116.159 -0.473 . . . . 0.0 110.058 176.265 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 137' ' ' PHE . . . . . 0.513 ' O ' HG13 ' A' ' 141' ' ' ILE . 62.5 m-85 -62.38 -40.73 97.4 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.147 -0.479 . . . . 0.0 110.532 176.241 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 138' ' ' ARG . . . . . 0.419 HH11 ' HD2' ' A' ' 138' ' ' ARG . 9.7 mtp180 -57.02 -43.1 81.53 Favored 'General case' 0 CA--C 1.519 -0.247 0 CA-C-N 116.331 -0.395 . . . . 0.0 111.109 176.56 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 139' ' ' LEU . . . . . . . . . . . . . 41.2 tp -60.63 -35.76 76.97 Favored 'General case' 0 C--N 1.326 -0.451 0 CA-C-N 116.004 -0.544 . . . . 0.0 110.34 178.938 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 140' ' ' ALA . . . . . . . . . . . . . . . -72.74 -38.76 67.3 Favored 'General case' 0 C--N 1.324 -0.535 0 CA-C-N 116.12 -0.491 . . . . 0.0 110.652 176.555 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 141' ' ' ILE . . . . . 0.637 ' HA ' ' O ' ' A' ' 146' ' ' ILE . 76.1 mt -64.49 -47.37 89.55 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.272 0 CA-C-N 116.535 -0.302 . . . . 0.0 111.502 179.282 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 142' ' ' GLU . . . . . . . . . . . . . 13.0 pt-20 -67.15 -24.6 65.91 Favored 'General case' 0 C--N 1.33 -0.242 0 CA-C-O 120.787 0.327 . . . . 0.0 111.493 -176.796 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 143' ' ' ASN . . . . . . . . . . . . . 37.8 m-80 -99.11 9.45 43.47 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-O 120.823 0.344 . . . . 0.0 110.408 177.791 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 144' ' ' ARG . . . . . . . . . . . . . 25.9 mtm180 59.47 50.93 6.99 Favored 'General case' 0 N--CA 1.463 0.196 0 CA-C-N 115.53 -0.759 . . . . 0.0 112.707 174.827 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 145' ' ' ALA . . . . . . . . . . . . . . . -101.99 -35.36 8.99 Favored 'General case' 0 C--N 1.323 -0.549 0 CA-C-O 121.446 0.641 . . . . 0.0 109.624 170.384 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 146' ' ' ILE . . . . . 0.637 ' O ' ' HA ' ' A' ' 141' ' ' ILE . 13.5 tt -144.32 158.34 15.25 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.458 0 N-CA-C 108.663 -0.865 . . . . 0.0 108.663 176.322 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 147' ' ' ASP . . . . . . . . . . . . . 7.8 p-10 -121.57 16.72 11.22 Favored 'General case' 0 C--N 1.324 -0.536 0 CA-C-O 121.002 0.429 . . . . 0.0 110.766 -177.992 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 148' ' ' PHE . . . . . 0.465 ' H ' HG12 ' A' ' 146' ' ' ILE . 67.6 t80 -135.55 137.6 42.18 Favored 'General case' 0 C--N 1.324 -0.531 0 CA-C-N 116.012 -0.54 . . . . 0.0 109.757 -176.609 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 149' ' ' ASN . . . . . . . . . . . . . 43.0 t-20 -115.47 89.69 22.92 Favored Pre-proline 0 C--N 1.324 -0.538 0 CA-C-N 116.558 -0.292 . . . . 0.0 110.557 -179.311 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 150' ' ' PRO . . . . . 0.442 ' HA ' ' HG3' ' A' ' 109' ' ' PRO . 28.1 Cg_exo -61.71 -32.12 86.48 Favored 'Trans proline' 0 C--N 1.345 0.382 0 C-N-CA 122.78 2.32 . . . . 0.0 111.861 -179.208 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 151' ' ' ALA . . . . . . . . . . . . . . . -67.53 -30.57 70.27 Favored 'General case' 0 C--N 1.326 -0.445 0 CA-C-N 115.768 -0.651 . . . . 0.0 110.969 -177.932 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 152' ' ' ASP . . . . . 0.543 ' HA ' ' CZ ' ' A' ' 130' ' ' ARG . 33.6 t70 -77.03 -22.3 53.24 Favored 'General case' 0 C--N 1.326 -0.447 0 CA-C-O 121.419 0.628 . . . . 0.0 110.159 179.912 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 153' ' ' TYR . . . . . . . . . . . . . 29.6 t80 -85.14 -1.47 56.92 Favored 'General case' 0 C--N 1.324 -0.519 0 CA-C-N 115.562 -0.744 . . . . 0.0 109.786 178.997 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 154' ' ' VAL . . . . . . . . . . . . . 86.8 t -70.82 118.61 15.7 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.316 0 CA-C-N 115.959 -0.564 . . . . 0.0 109.499 173.412 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 155' ' ' ARG . . . . . . . . . . . . . 28.5 ttt85 -84.68 111.57 19.69 Favored 'General case' 0 C--N 1.319 -0.724 0 CA-C-N 116.115 -0.493 . . . . 0.0 110.355 -176.98 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 156' ' ' ILE . . . . . 0.532 HG21 ' HG2' ' A' ' 127' ' ' LYS . 47.6 mm -89.53 120.64 69.6 Favored Pre-proline 0 C--N 1.324 -0.505 0 CA-C-N 115.604 -0.726 . . . . 0.0 110.109 -178.727 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 157' ' ' PRO . . . . . 0.434 ' HD3' ' HA ' ' A' ' 156' ' ' ILE . 6.5 Cg_exo -73.39 130.49 15.13 Favored 'Trans proline' 0 N--CA 1.453 -0.861 0 C-N-CA 122.298 1.999 . . . . 0.0 111.123 177.376 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 158' ' ' LYS . . . . . . . . . . . . . 28.2 mtpp -94.63 1.51 55.58 Favored 'General case' 0 C--N 1.321 -0.661 0 CA-C-O 121.662 0.744 . . . . 0.0 109.386 177.64 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 159' ' ' ILE . . . . . . . . . . . . . 45.8 mt -81.71 87.14 1.73 Allowed 'Isoleucine or valine' 0 N--CA 1.45 -0.473 0 CA-C-N 114.995 -1.002 . . . . 0.0 110.128 179.766 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 160' ' ' ALA . . . . . . . . . . . . . . . -123.51 24.69 8.51 Favored 'General case' 0 C--N 1.321 -0.667 0 CA-C-N 115.694 -0.684 . . . . 0.0 109.312 177.121 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 161' ' ' LEU . . . . . . . . . . . . . 83.1 mt -54.73 117.47 3.41 Favored 'General case' 0 C--N 1.319 -0.757 0 CA-C-N 114.441 -1.254 . . . . 0.0 111.786 -176.072 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 162' ' ' GLU . . . . . . . . . . . . . 34.3 tt0 -69.82 -51.5 33.06 Favored 'General case' 0 C--N 1.327 -0.382 0 CA-C-N 115.953 -0.567 . . . . 0.0 109.857 175.09 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 163' ' ' HIS . . . . . . . . . . . . . 32.4 m80 -100.42 134.16 43.79 Favored 'General case' 0 C--N 1.324 -0.502 0 CA-C-N 115.594 -0.73 . . . . 0.0 110.073 178.608 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 164' ' ' HIS . . . . . . . . . . . . . 8.1 t60 -71.81 104.12 3.34 Favored 'General case' 0 C--N 1.322 -0.607 0 CA-C-N 116.04 -0.527 . . . . 0.0 109.887 178.206 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 165' ' ' HIS . . . . . . . . . . . . . 19.5 t-80 -67.01 113.94 5.41 Favored 'General case' 0 C--N 1.323 -0.547 0 N-CA-C 109.111 -0.7 . . . . 0.0 109.111 176.251 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 166' ' ' HIS . . . . . . . . . . . . . 11.0 t60 -41.61 -66.06 0.38 Allowed 'General case' 0 N--CA 1.472 0.671 0 O-C-N 123.943 0.777 . . . . 0.0 111.995 -171.86 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 167' ' ' HIS . . . . . . . . . . . . . 11.0 t60 -115.95 103.81 10.97 Favored 'General case' 0 C--N 1.322 -0.592 0 N-CA-C 109.437 -0.579 . . . . 0.0 109.437 174.156 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 168' ' ' HIS . . . . . . . . . . . . . 18.5 p80 . . . . . 0 C--O 1.246 0.877 0 CA-C-O 118.367 -0.825 . . . . 0.0 110.176 179.541 . . . . . . . . 0 0 . 1 . 018 nuclear build full ' A' A ' 61' ' ' ARG . . . . . . . . . . . . . 49.8 mtm180 . . . . . 0 N--CA 1.481 1.079 0 N-CA-C 110.278 -0.267 . . . . 0.0 110.278 . . . . . . . . . 0 0 . 1 . 018 nuclear build full ' A' A ' 62' ' ' ASP . . . . . . . . . . . . . 15.8 m-20 50.31 76.88 0.13 Allowed 'General case' 0 N--CA 1.465 0.292 0 O-C-N 123.796 0.685 . . . . 0.0 111.666 179.295 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 63' ' ' SER . . . . . 0.56 ' HA ' ' HA ' ' A' ' 103' ' ' SER . 7.6 m -80.39 153.28 28.41 Favored 'General case' 0 C--N 1.323 -0.558 0 CA-C-N 116.062 -0.517 . . . . 0.0 109.844 178.628 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 64' ' ' PHE . . . . . 0.539 ' HB2' HD11 ' A' ' 107' ' ' ILE . 84.1 t80 -64.42 -42.52 95.99 Favored 'General case' 0 C--N 1.326 -0.455 0 N-CA-C 109.834 -0.432 . . . . 0.0 109.834 178.639 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 65' ' ' GLY . . . . . . . . . . . . . . . -62.8 -29.43 73.97 Favored Glycine 0 N--CA 1.45 -0.424 0 C-N-CA 120.784 -0.722 . . . . 0.0 112.083 176.137 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 66' ' ' ASP . . . . . . . . . . . . . 20.1 t70 -68.04 -48.13 66.5 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-O 120.837 0.351 . . . . 0.0 110.083 177.386 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 67' ' ' TRP . . . . . . . . . . . . . 52.8 m95 -70.99 -30.49 66.76 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 115.94 -0.573 . . . . 0.0 111.573 178.497 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 68' ' ' ALA . . . . . 0.511 ' O ' ' HG ' ' A' ' 72' ' ' LEU . . . -60.01 -49.34 78.04 Favored 'General case' 0 C--N 1.328 -0.359 0 N-CA-C 109.812 -0.44 . . . . 0.0 109.812 173.813 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 69' ' ' GLU . . . . . . . . . . . . . 5.6 mm-40 -58.19 -41.72 84.54 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 115.976 -0.556 . . . . 0.0 110.843 175.918 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 70' ' ' LYS . . . . . . . . . . . . . 61.6 tttm -62.45 -47.93 81.89 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.3 -0.409 . . . . 0.0 110.219 179.299 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 71' ' ' PHE . . . . . . . . . . . . . 33.7 t80 -59.56 -49.61 77.12 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 115.96 -0.564 . . . . 0.0 110.742 176.955 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 72' ' ' LEU . . . . . 0.511 ' HG ' ' O ' ' A' ' 68' ' ' ALA . 91.6 mt -61.01 -35.74 77.67 Favored 'General case' 0 C--N 1.327 -0.401 0 CA-C-N 116.281 -0.418 . . . . 0.0 111.154 -178.918 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 73' ' ' LYS . . . . . 0.401 ' HD3' ' HA ' ' A' ' 73' ' ' LYS . 61.8 mmtt -72.45 -41.64 65.89 Favored 'General case' 0 C--N 1.327 -0.376 0 C-N-CA 121.234 -0.186 . . . . 0.0 111.379 178.52 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 74' ' ' SER . . . . . . . . . . . . . 12.3 p -68.17 -29.43 68.31 Favored 'General case' 0 C--N 1.327 -0.396 0 CA-C-O 120.956 0.408 . . . . 0.0 110.399 177.139 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 75' ' ' LYS . . . . . . . . . . . . . 45.5 tptt -78.22 -31.43 49.36 Favored 'General case' 0 N--CA 1.446 -0.666 0 CA-C-O 121.085 0.469 . . . . 0.0 110.028 177.154 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 76' ' ' GLU . . . . . . . . . . . . . 37.1 tt0 -63.78 -40.34 96.44 Favored 'General case' 0 C--N 1.326 -0.431 0 CA-C-N 115.768 -0.651 . . . . 0.0 109.863 175.485 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 77' ' ' ALA . . . . . . . . . . . . . . . -80.02 -18.02 51.28 Favored 'General case' 0 C--N 1.327 -0.412 0 CA-C-N 115.891 -0.595 . . . . 0.0 111.123 176.318 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 78' ' ' ASP . . . . . . . . . . . . . 28.5 t70 -68.45 -21.41 64.65 Favored 'General case' 0 N--CA 1.465 0.3 0 CA-C-N 115.913 -0.585 . . . . 0.0 110.538 178.771 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 79' ' ' GLY . . . . . . . . . . . . . . . 102.51 71.26 0.89 Allowed Glycine 0 N--CA 1.447 -0.622 0 C-N-CA 120.734 -0.746 . . . . 0.0 112.276 177.387 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 80' ' ' VAL . . . . . . . . . . . . . 28.0 m -123.87 148.62 27.93 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.5 0 CA-C-O 121.083 0.468 . . . . 0.0 110.763 179.765 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 81' ' ' SER . . . . . . . . . . . . . 14.6 m -75.9 162.46 28.1 Favored 'General case' 0 C--N 1.322 -0.618 0 CA-C-N 115.649 -0.705 . . . . 0.0 109.941 177.093 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 82' ' ' VAL . . . . . . . . . . . . . 57.0 t -58.12 -45.23 88.58 Favored 'Isoleucine or valine' 0 C--O 1.222 -0.375 0 CA-C-N 116.414 -0.357 . . . . 0.0 111.195 -176.566 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 83' ' ' SER . . . . . . . . . . . . . 17.2 t -65.46 -32.65 74.37 Favored 'General case' 0 C--N 1.326 -0.419 0 CA-C-O 120.874 0.368 . . . . 0.0 111.272 -177.955 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 84' ' ' GLN . . . . . . . . . . . . . 62.7 tp60 -69.85 -42.61 73.33 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-O 121.074 0.464 . . . . 0.0 110.314 179.258 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 85' ' ' LEU . . . . . . . . . . . . . 25.5 tp -75.07 -26.73 59.57 Favored 'General case' 0 C--N 1.321 -0.641 0 CA-C-O 121.282 0.563 . . . . 0.0 109.924 178.556 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 86' ' ' ASN . . . . . . . . . . . . . 26.5 t-20 -64.54 -47.7 77.81 Favored 'General case' 0 C--N 1.325 -0.464 0 CA-C-N 115.314 -0.857 . . . . 0.0 110.454 176.498 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 87' ' ' SER . . . . . . . . . . . . . 11.3 p -65.14 -35.89 82.55 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.295 -0.411 . . . . 0.0 110.623 179.75 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 88' ' ' TYR . . . . . . . . . . . . . 11.5 m-85 -57.99 -43.77 86.78 Favored 'General case' 0 C--O 1.234 0.28 0 CA-C-O 120.858 0.361 . . . . 0.0 110.393 174.265 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 89' ' ' LYS . . . . . . . . . . . . . 63.9 mttp -62.69 -38.57 90.92 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 116.044 -0.525 . . . . 0.0 110.605 176.617 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 90' ' ' ASN . . . . . 0.415 ' O ' ' HB3' ' A' ' 94' ' ' ASN . 95.4 m-20 -62.64 -42.94 99.88 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.201 -0.454 . . . . 0.0 111.242 -178.9 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 91' ' ' TYR . . . . . . . . . . . . . 43.3 m-85 -59.25 -45.67 90.56 Favored 'General case' 0 C--O 1.235 0.334 0 CA-C-O 121.09 0.471 . . . . 0.0 110.14 177.217 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 92' ' ' CYS . . . . . 0.613 ' HA ' ' HB2' ' A' ' 96' ' ' LEU . 57.9 m -71.45 -43.52 66.53 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 115.626 -0.715 . . . . 0.0 112.014 -175.552 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 93' ' ' ARG . . . . . . . . . . . . . 18.8 mtp180 -84.58 -7.77 59.14 Favored 'General case' 0 C--N 1.325 -0.457 0 N-CA-C 112.454 0.538 . . . . 0.0 112.454 -173.576 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 94' ' ' ASN . . . . . 0.415 ' HB3' ' O ' ' A' ' 90' ' ' ASN . 12.3 t-20 -111.1 -61.26 1.72 Allowed 'General case' 0 C--N 1.328 -0.355 0 CA-C-O 120.769 0.319 . . . . 0.0 111.859 179.006 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 95' ' ' HIS . . . . . . . . . . . . . 0.2 OUTLIER -87.67 -34.57 18.39 Favored 'General case' 0 C--N 1.324 -0.531 0 N-CA-C 112.363 0.505 . . . . 0.0 112.363 -175.473 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 96' ' ' LEU . . . . . 0.613 ' HB2' ' HA ' ' A' ' 92' ' ' CYS . 85.4 mt -91.65 12.45 21.05 Favored 'General case' 0 C--N 1.324 -0.507 0 C-N-CA 121.215 -0.194 . . . . 0.0 111.212 -176.809 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 97' ' ' SER . . . . . 0.511 ' N ' ' HD2' ' A' ' 98' ' ' PRO . 18.6 m -50.85 -50.2 75.46 Favored Pre-proline 0 CA--C 1.539 0.541 0 N-CA-C 112.284 0.476 . . . . 0.0 112.284 179.483 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 98' ' ' PRO . . . . . 0.511 ' HD2' ' N ' ' A' ' 97' ' ' SER . 13.8 Cg_endo -58.09 -41.33 68.85 Favored 'Trans proline' 0 C--N 1.358 1.034 0 C-N-CA 121.962 1.775 . . . . 0.0 112.585 177.622 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 99' ' ' LEU . . . . . 0.406 ' O ' ' HB3' ' A' ' 64' ' ' PHE . 11.2 mp -79.8 -29.74 40.37 Favored 'General case' 0 C--N 1.326 -0.416 0 CA-C-N 116.459 -0.337 . . . . 0.0 111.801 -174.972 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 100' ' ' TYR . . . . . . . . . . . . . 46.3 t80 -52.74 -40.73 63.35 Favored 'General case' 0 C--N 1.328 -0.349 0 C-N-CA 122.795 0.438 . . . . 0.0 111.434 -176.738 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 101' ' ' MET . . . . . . . . . . . . . 64.5 mtt -89.94 -0.53 57.62 Favored 'General case' 0 C--N 1.325 -0.469 0 CA-C-N 116.258 -0.428 . . . . 0.0 111.69 -176.755 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 102' ' ' LYS . . . . . 0.458 ' HG3' ' O ' ' A' ' 98' ' ' PRO . 97.3 mttt -91.13 161.89 14.9 Favored 'General case' 0 C--N 1.326 -0.444 0 CA-C-O 121.047 0.451 . . . . 0.0 110.438 179.493 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 103' ' ' SER . . . . . 0.56 ' HA ' ' HA ' ' A' ' 63' ' ' SER . 29.0 t -82.12 154.87 25.33 Favored 'General case' 0 N--CA 1.447 -0.598 0 N-CA-C 108.881 -0.785 . . . . 0.0 108.881 172.423 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 104' ' ' LEU . . . . . . . . . . . . . 23.6 tp -61.62 -25.35 67.3 Favored 'General case' 0 C--N 1.321 -0.671 0 CA-C-O 121.092 0.473 . . . . 0.0 110.4 -179.041 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 105' ' ' SER . . . . . . . . . . . . . 35.5 t -86.27 -14.4 43.87 Favored 'General case' 0 C--N 1.327 -0.377 0 CA-C-N 116.003 -0.544 . . . . 0.0 111.375 178.855 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 106' ' ' GLU . . . . . 0.525 ' HG3' ' HB3' ' A' ' 103' ' ' SER . 49.4 mt-10 -93.03 4.72 53.52 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-O 120.861 0.362 . . . . 0.0 111.113 -177.258 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 107' ' ' ILE . . . . . 0.55 HG21 ' HZ ' ' A' ' 137' ' ' PHE . 74.7 mt -95.81 118.13 41.42 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.756 0 CA-C-O 121.23 0.538 . . . . 0.0 111.035 -177.456 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 108' ' ' LEU . . . . . . . . . . . . . 7.6 mp -97.05 138.88 21.27 Favored Pre-proline 0 C--N 1.323 -0.582 0 CA-C-N 115.364 -0.835 . . . . 0.0 110.038 -179.992 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 109' ' ' PRO . . . . . . . . . . . . . 11.2 Cg_endo -56.7 -35.74 97.82 Favored 'Trans proline' 0 C--O 1.234 0.322 0 C-N-CA 122.63 2.22 . . . . 0.0 112.268 177.404 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 110' ' ' ALA . . . . . . . . . . . . . . . -70.61 -29.67 66.13 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.236 -0.438 . . . . 0.0 111.232 179.788 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 111' ' ' ASP . . . . . . . . . . . . . 33.2 t70 -68.27 -41.52 80.92 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-O 121.073 0.463 . . . . 0.0 110.048 179.997 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 112' ' ' ILE . . . . . . . . . . . . . 18.7 mt -67.1 -43.04 88.99 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.355 0 CA-C-N 115.809 -0.632 . . . . 0.0 109.698 176.385 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 113' ' ' GLN . . . . . 0.596 ' HG2' ' HA ' ' A' ' 154' ' ' VAL . 0.0 OUTLIER -55.16 -41.62 72.1 Favored 'General case' 0 C--O 1.233 0.211 0 CA-C-N 115.627 -0.715 . . . . 0.0 111.023 176.568 . . . . . . . . 3 3 . 1 . 018 nuclear build full ' A' A ' 114' ' ' SER . . . . . . . . . . . . . 14.3 t -59.75 -46.54 88.85 Favored 'General case' 0 N--CA 1.453 -0.319 0 CA-C-N 116.101 -0.5 . . . . 0.0 110.387 178.889 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 115' ' ' ILE . . . . . . . . . . . . . 69.3 mt -55.88 -51.93 54.91 Favored 'Isoleucine or valine' 0 C--O 1.233 0.225 0 CA-C-O 120.919 0.39 . . . . 0.0 110.918 -179.485 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 116' ' ' ILE . . . . . . . . . . . . . 49.8 mm -62.08 -39.38 83.6 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.322 0 CA-C-N 115.902 -0.59 . . . . 0.0 111.225 -178.421 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 117' ' ' ASN . . . . . . . . . . . . . 34.1 t-20 -69.81 -39.27 76.62 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-O 120.929 0.395 . . . . 0.0 110.503 -178.873 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 118' ' ' GLU . . . . . . . . . . . . . 49.5 mt-10 -80.76 -8.7 59.75 Favored 'General case' 0 C--N 1.327 -0.374 0 CA-C-N 116.368 -0.378 . . . . 0.0 111.271 -177.192 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 119' ' ' THR . . . . . . . . . . . . . 89.5 m -89.88 123.47 33.85 Favored 'General case' 0 C--N 1.326 -0.438 0 CA-C-O 120.834 0.349 . . . . 0.0 110.912 176.17 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 120' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -98.9 80.52 2.51 Favored 'General case' 0 C--N 1.326 -0.443 0 CA-C-O 121.041 0.448 . . . . 0.0 110.692 178.358 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 121' ' ' LEU . . . . . . . . . . . . . 65.1 mt -132.54 -175.77 3.87 Favored 'General case' 0 C--N 1.324 -0.543 0 CA-C-N 115.713 -0.676 . . . . 0.0 109.747 178.463 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 122' ' ' ALA . . . . . . . . . . . . . . . -72.6 146.04 46.92 Favored 'General case' 0 C--N 1.325 -0.499 0 CA-C-N 116.434 -0.348 . . . . 0.0 110.33 177.722 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 123' ' ' LYS . . . . . 0.516 ' O ' ' HG3' ' A' ' 127' ' ' LYS . 59.6 pttt -58.54 -29.53 66.41 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-O 120.844 0.354 . . . . 0.0 110.915 -179.71 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 124' ' ' ASN . . . . . . . . . . . . . 14.4 m120 -68.34 -40.47 81.56 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.178 -0.465 . . . . 0.0 110.48 178.642 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 125' ' ' THR . . . . . . . . . . . . . 6.2 m -67.67 -35.76 79.46 Favored 'General case' 0 C--N 1.327 -0.378 0 CA-C-N 116.095 -0.502 . . . . 0.0 110.219 179.273 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 126' ' ' LEU . . . . . . . . . . . . . 90.7 mt -64.72 -37.17 86.7 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 115.885 -0.598 . . . . 0.0 110.493 178.068 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 127' ' ' LYS . . . . . 0.516 ' HG3' ' O ' ' A' ' 123' ' ' LYS . 97.7 mttt -68.58 -28.87 67.33 Favored 'General case' 0 C--N 1.332 -0.192 0 CA-C-N 116.092 -0.503 . . . . 0.0 110.835 178.032 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 128' ' ' ALA . . . . . . . . . . . . . . . -65.79 -43.86 87.45 Favored 'General case' 0 C--N 1.327 -0.378 0 CA-C-O 120.981 0.42 . . . . 0.0 110.492 176.606 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 129' ' ' ILE . . . . . . . . . . . . . 47.9 mt -64.71 -47.08 90.22 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.221 0 CA-C-N 115.909 -0.587 . . . . 0.0 109.773 176.166 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 130' ' ' ARG . . . . . 0.409 HH11 ' HD3' ' A' ' 130' ' ' ARG . 5.5 tpt180 -52.87 -45.05 67.28 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 115.587 -0.733 . . . . 0.0 110.882 174.768 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 131' ' ' ASN . . . . . . . . . . . . . 26.7 t-20 -61.97 -55.95 24.15 Favored 'General case' 0 C--N 1.326 -0.445 0 CA-C-N 116.144 -0.48 . . . . 0.0 111.744 -176.872 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 132' ' ' THR . . . . . 0.408 ' O ' HG13 ' A' ' 136' ' ' ILE . 14.9 t -65.59 -33.03 74.96 Favored 'General case' 0 CA--C 1.531 0.222 0 C-N-CA 120.84 -0.344 . . . . 0.0 110.938 -175.371 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 133' ' ' ALA . . . . . . . . . . . . . . . -69.75 -46.39 65.97 Favored 'General case' 0 C--N 1.331 -0.205 0 CA-C-O 120.919 0.39 . . . . 0.0 110.515 178.358 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 134' ' ' SER . . . . . . . . . . . . . 22.9 t -61.0 -37.67 83.32 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 115.893 -0.594 . . . . 0.0 110.27 -179.977 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 135' ' ' GLN . . . . . . . . . . . . . 2.7 mp0 -59.08 -45.34 91.08 Favored 'General case' 0 C--N 1.331 -0.232 0 CA-C-N 116.401 -0.363 . . . . 0.0 111.042 176.489 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 136' ' ' ILE . . . . . 0.408 HG13 ' O ' ' A' ' 132' ' ' THR . 73.1 mt -65.03 -47.79 86.55 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.296 0 CA-C-O 120.904 0.383 . . . . 0.0 110.691 179.017 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 137' ' ' PHE . . . . . 0.55 ' HZ ' HG21 ' A' ' 107' ' ' ILE . 41.8 m-85 -62.28 -47.06 85.98 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 116.195 -0.457 . . . . 0.0 111.696 -179.645 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 138' ' ' ARG . . . . . 0.419 ' O ' ' HG2' ' A' ' 142' ' ' GLU . 11.3 ptm180 -74.05 -21.03 60.1 Favored 'General case' 0 C--N 1.327 -0.385 0 C-N-CA 120.538 -0.465 . . . . 0.0 110.853 -176.39 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 139' ' ' LEU . . . . . . . . . . . . . 62.6 tp -63.59 -41.8 98.32 Favored 'General case' 0 C--O 1.234 0.266 0 N-CA-C 109.232 -0.655 . . . . 0.0 109.232 173.256 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 140' ' ' ALA . . . . . 0.501 ' HB1' ' HB3' ' A' ' 145' ' ' ALA . . . -65.24 -32.57 74.31 Favored 'General case' 0 C--N 1.326 -0.429 0 CA-C-N 115.495 -0.775 . . . . 0.0 110.152 176.211 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 141' ' ' ILE . . . . . . . . . . . . . 60.4 mt -64.94 -44.16 96.15 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.29 0 CA-C-N 116.233 -0.44 . . . . 0.0 110.191 175.653 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 142' ' ' GLU . . . . . 0.419 ' HG2' ' O ' ' A' ' 138' ' ' ARG . 34.3 mm-40 -63.33 -29.31 70.64 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-O 121.088 0.471 . . . . 0.0 110.716 177.71 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 143' ' ' ASN . . . . . 0.469 HD22 ' N ' ' A' ' 143' ' ' ASN . 0.9 OUTLIER -93.23 0.85 57.2 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.064 -0.517 . . . . 0.0 111.003 -179.031 . . . . . . . . 3 3 . 1 . 018 nuclear build full ' A' A ' 144' ' ' ARG . . . . . . . . . . . . . 35.1 mtp85 57.47 36.0 26.5 Favored 'General case' 0 N--CA 1.464 0.26 0 CA-C-N 115.752 -0.658 . . . . 0.0 112.272 -178.933 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 145' ' ' ALA . . . . . 0.501 ' HB3' ' HB1' ' A' ' 140' ' ' ALA . . . -82.29 -33.73 28.97 Favored 'General case' 0 C--N 1.325 -0.5 0 N-CA-C 109.268 -0.641 . . . . 0.0 109.268 173.357 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 146' ' ' ILE . . . . . . . . . . . . . 9.8 tt -159.22 125.63 0.54 Allowed 'Isoleucine or valine' 0 C--N 1.324 -0.526 0 CA-C-N 114.873 -1.058 . . . . 0.0 109.433 178.998 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 147' ' ' ASP . . . . . . . . . . . . . 20.9 t70 -99.1 68.46 1.68 Allowed 'General case' 0 C--N 1.319 -0.738 0 CA-C-O 121.662 0.744 . . . . 0.0 109.624 178.575 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 148' ' ' PHE . . . . . 0.482 ' O ' ' HD3' ' A' ' 150' ' ' PRO . 55.8 t80 -169.38 126.44 0.92 Allowed 'General case' 0 C--N 1.321 -0.667 0 CA-C-N 115.086 -0.961 . . . . 0.0 109.178 -179.158 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 149' ' ' ASN . . . . . . . . . . . . . 48.8 t-20 -108.52 95.96 17.85 Favored Pre-proline 0 C--N 1.323 -0.57 0 N-CA-C 110.076 -0.342 . . . . 0.0 110.076 179.272 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 150' ' ' PRO . . . . . 0.482 ' HD3' ' O ' ' A' ' 148' ' ' PHE . 21.6 Cg_exo -65.34 -26.37 56.04 Favored 'Trans proline' 0 C--N 1.342 0.229 0 C-N-CA 122.756 2.304 . . . . 0.0 112.03 -179.626 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 151' ' ' ALA . . . . . . . . . . . . . . . -72.6 -20.38 61.31 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 115.941 -0.572 . . . . 0.0 110.806 -178.032 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 152' ' ' ASP . . . . . . . . . . . . . 28.3 t70 -70.76 -24.91 62.69 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-O 121.089 0.471 . . . . 0.0 110.149 178.488 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 153' ' ' TYR . . . . . . . . . . . . . 58.8 m-85 -83.86 -1.47 54.5 Favored 'General case' 0 C--N 1.327 -0.374 0 CA-C-N 115.772 -0.649 . . . . 0.0 110.51 179.585 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 154' ' ' VAL . . . . . 0.596 ' HA ' ' HG2' ' A' ' 113' ' ' GLN . 55.9 t -88.74 111.52 22.72 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.504 0 CA-C-N 115.807 -0.633 . . . . 0.0 110.311 179.65 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 155' ' ' ARG . . . . . . . . . . . . . 83.9 mtm180 -83.99 141.24 31.35 Favored 'General case' 0 C--N 1.319 -0.742 0 CA-C-N 115.41 -0.814 . . . . 0.0 109.944 179.807 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 156' ' ' ILE . . . . . 0.4 ' HA ' ' HD3' ' A' ' 157' ' ' PRO . 50.7 mm -96.97 113.67 63.35 Favored Pre-proline 0 C--N 1.319 -0.741 0 N-CA-C 109.408 -0.59 . . . . 0.0 109.408 178.704 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 157' ' ' PRO . . . . . 0.4 ' HD3' ' HA ' ' A' ' 156' ' ' ILE . 28.4 Cg_exo -61.8 130.02 29.74 Favored 'Trans proline' 0 N--CA 1.46 -0.444 0 C-N-CA 122.53 2.153 . . . . 0.0 112.196 -177.754 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 158' ' ' LYS . . . . . . . . . . . . . 43.5 mtmt -109.35 41.48 1.64 Allowed 'General case' 0 C--N 1.319 -0.75 0 N-CA-C 109.184 -0.673 . . . . 0.0 109.184 178.809 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 159' ' ' ILE . . . . . . . . . . . . . 50.4 mt -78.34 75.46 0.66 Allowed 'Isoleucine or valine' 0 C--N 1.324 -0.532 0 CA-C-N 115.288 -0.869 . . . . 0.0 110.896 -175.841 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 160' ' ' ALA . . . . . . . . . . . . . . . -124.13 14.96 9.12 Favored 'General case' 0 C--N 1.322 -0.6 0 CA-C-O 122.277 1.037 . . . . 0.0 108.855 172.601 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 161' ' ' LEU . . . . . . . . . . . . . 0.9 OUTLIER -128.42 30.97 5.09 Favored 'General case' 0 C--N 1.315 -0.894 0 CA-C-N 113.813 -1.539 . . . . 0.0 109.748 -177.663 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 162' ' ' GLU . . . . . . . . . . . . . 8.2 tp10 79.48 151.44 0.11 Allowed 'General case' 0 C--O 1.233 0.226 0 CA-C-N 114.632 -1.167 . . . . 0.0 110.725 -175.458 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 163' ' ' HIS . . . . . . . . . . . . . 27.3 p-80 -99.7 136.88 38.97 Favored 'General case' 0 C--N 1.325 -0.466 0 CA-C-N 115.79 -0.641 . . . . 0.0 111.145 -173.708 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 164' ' ' HIS . . . . . . . . . . . . . 8.5 p80 -144.06 23.95 1.67 Allowed 'General case' 0 C--N 1.323 -0.568 0 CA-C-N 115.843 -0.617 . . . . 0.0 110.122 174.348 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 165' ' ' HIS . . . . . . . . . . . . . 72.7 t60 -75.93 88.65 2.92 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 115.489 -0.778 . . . . 0.0 109.351 172.292 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 166' ' ' HIS . . . . . . . . . . . . . 28.4 t-80 -117.61 121.4 40.81 Favored 'General case' 0 C--N 1.321 -0.65 0 CA-C-N 115.969 -0.559 . . . . 0.0 110.336 -179.647 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 167' ' ' HIS . . . . . . . . . . . . . 80.2 t60 -86.8 131.38 34.14 Favored 'General case' 0 C--N 1.32 -0.714 0 CA-C-N 115.703 -0.681 . . . . 0.0 110.031 -178.934 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 168' ' ' HIS . . . . . . . . . . . . . 47.3 t-80 . . . . . 0 C--O 1.247 0.968 0 CA-C-O 118.396 -0.812 . . . . 0.0 109.696 179.434 . . . . . . . . 0 0 . 1 . 019 nuclear build full ' A' A ' 61' ' ' ARG . . . . . . . . . . . . . 13.7 ttt85 . . . . . 0 N--CA 1.476 0.87 0 N-CA-C 108.756 -0.831 . . . . 0.0 108.756 . . . . . . . . . 0 0 . 1 . 019 nuclear build full ' A' A ' 62' ' ' ASP . . . . . 0.643 ' HB3' ' HB2' ' A' ' 66' ' ' ASP . 3.3 m-20 74.17 158.7 0.21 Allowed 'General case' 0 N--CA 1.467 0.378 0 CA-C-O 121.352 0.596 . . . . 0.0 111.47 174.947 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 63' ' ' SER . . . . . . . . . . . . . 78.6 p -100.42 179.86 4.32 Favored 'General case' 0 C--N 1.319 -0.72 0 N-CA-C 109.274 -0.639 . . . . 0.0 109.274 176.255 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 64' ' ' PHE . . . . . 0.476 ' HB3' ' O ' ' A' ' 99' ' ' LEU . 74.6 t80 -63.45 -35.93 82.05 Favored 'General case' 0 C--N 1.327 -0.378 0 C-N-CA 120.862 -0.335 . . . . 0.0 110.384 -177.409 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 65' ' ' GLY . . . . . . . . . . . . . . . -60.0 -38.33 94.05 Favored Glycine 0 N--CA 1.452 -0.249 0 C-N-CA 120.964 -0.636 . . . . 0.0 112.411 178.072 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 66' ' ' ASP . . . . . 0.643 ' HB2' ' HB3' ' A' ' 62' ' ' ASP . 16.4 m-20 -65.8 -43.57 88.33 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-O 120.917 0.389 . . . . 0.0 110.417 -179.921 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 67' ' ' TRP . . . . . . . . . . . . . 98.7 m95 -73.02 -34.21 66.21 Favored 'General case' 0 C--N 1.326 -0.43 0 CA-C-N 115.938 -0.573 . . . . 0.0 111.026 179.675 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 68' ' ' ALA . . . . . 0.547 ' O ' ' HG ' ' A' ' 72' ' ' LEU . . . -61.02 -44.22 97.73 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-O 120.903 0.382 . . . . 0.0 110.101 175.564 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 69' ' ' GLU . . . . . . . . . . . . . 31.2 tt0 -59.75 -45.98 90.57 Favored 'General case' 0 C--O 1.232 0.14 0 CA-C-N 115.806 -0.634 . . . . 0.0 110.22 175.127 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 70' ' ' LYS . . . . . . . . . . . . . 51.5 tttp -57.69 -42.95 84.69 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-N 115.541 -0.754 . . . . 0.0 110.442 179.326 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 71' ' ' PHE . . . . . . . . . . . . . 77.9 t80 -62.31 -49.99 73.44 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-N 115.77 -0.65 . . . . 0.0 110.627 176.525 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 72' ' ' LEU . . . . . 0.547 ' HG ' ' O ' ' A' ' 68' ' ' ALA . 93.4 mt -56.57 -41.54 77.08 Favored 'General case' 0 C--N 1.327 -0.379 0 CA-C-N 116.163 -0.472 . . . . 0.0 110.794 -179.915 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 73' ' ' LYS . . . . . 0.438 ' HA ' ' HB3' ' A' ' 76' ' ' GLU . 36.9 tttp -77.49 -28.45 52.21 Favored 'General case' 0 C--N 1.324 -0.514 0 CA-C-N 116.024 -0.535 . . . . 0.0 111.441 -175.963 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 74' ' ' SER . . . . . 0.43 ' O ' ' HB2' ' A' ' 78' ' ' ASP . 95.3 p -65.67 -31.43 72.44 Favored 'General case' 0 C--N 1.33 -0.262 0 C-N-CA 120.493 -0.483 . . . . 0.0 109.988 178.254 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 75' ' ' LYS . . . . . . . . . . . . . 0.8 OUTLIER -79.32 -42.0 26.7 Favored 'General case' 0 C--O 1.234 0.262 0 CA-C-N 116.444 -0.344 . . . . 0.0 110.509 173.606 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 76' ' ' GLU . . . . . 0.438 ' HB3' ' HA ' ' A' ' 73' ' ' LYS . 42.8 tt0 -52.43 -50.16 63.12 Favored 'General case' 0 CA--C 1.532 0.261 0 CA-C-N 116.137 -0.483 . . . . 0.0 110.776 175.307 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 77' ' ' ALA . . . . . . . . . . . . . . . -73.79 -30.13 62.57 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 115.958 -0.565 . . . . 0.0 111.726 -178.94 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 78' ' ' ASP . . . . . 0.43 ' HB2' ' O ' ' A' ' 74' ' ' SER . 16.1 t70 -62.03 -40.53 96.03 Favored 'General case' 0 N--CA 1.464 0.237 0 CA-C-O 120.985 0.421 . . . . 0.0 110.436 179.802 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 79' ' ' GLY . . . . . . . . . . . . . . . 121.01 33.26 0.99 Allowed Glycine 0 N--CA 1.447 -0.582 0 C-N-CA 120.702 -0.761 . . . . 0.0 113.269 176.291 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 80' ' ' VAL . . . . . . . . . . . . . 24.3 m -81.22 147.01 6.58 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.451 0 N-CA-C 109.894 -0.41 . . . . 0.0 109.894 176.471 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 81' ' ' SER . . . . . . . . . . . . . 23.2 t -68.14 155.58 39.31 Favored 'General case' 0 C--N 1.321 -0.649 0 CA-C-O 120.939 0.399 . . . . 0.0 110.952 -178.071 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 82' ' ' VAL . . . . . . . . . . . . . 7.5 p -56.8 -33.93 42.27 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.24 0 CA-C-N 115.769 -0.65 . . . . 0.0 111.457 -177.893 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 83' ' ' SER . . . . . . . . . . . . . 16.0 m -60.65 -39.62 89.0 Favored 'General case' 0 C--O 1.235 0.299 0 CA-C-O 121.061 0.458 . . . . 0.0 110.592 178.347 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 84' ' ' GLN . . . . . . . . . . . . . 5.8 tp-100 -76.01 -39.36 55.93 Favored 'General case' 0 C--N 1.327 -0.392 0 CA-C-N 116.175 -0.466 . . . . 0.0 109.912 -179.909 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 85' ' ' LEU . . . . . 0.445 HD22 ' HA ' ' A' ' 85' ' ' LEU . 0.3 OUTLIER -63.03 -40.23 97.12 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.06 -0.518 . . . . 0.0 109.932 178.548 . . . . . . . . 3 3 . 1 . 019 nuclear build full ' A' A ' 86' ' ' ASN . . . . . 0.572 ' HA ' ' HD2' ' A' ' 89' ' ' LYS . 80.2 m-20 -62.58 -37.51 86.46 Favored 'General case' 0 CA--C 1.516 -0.338 0 CA-C-N 116.018 -0.537 . . . . 0.0 110.918 176.201 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 87' ' ' SER . . . . . . . . . . . . . 9.6 t -60.8 -41.82 96.39 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-O 120.888 0.375 . . . . 0.0 110.07 178.435 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 88' ' ' TYR . . . . . . . . . . . . . 34.0 m-85 -60.43 -34.43 73.96 Favored 'General case' 0 C--N 1.332 -0.171 0 CA-C-N 116.05 -0.523 . . . . 0.0 110.755 176.681 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 89' ' ' LYS . . . . . 0.572 ' HD2' ' HA ' ' A' ' 86' ' ' ASN . 56.3 mttm -63.88 -39.35 93.98 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.377 -0.374 . . . . 0.0 110.504 176.255 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 90' ' ' ASN . . . . . . . . . . . . . 23.9 m120 -60.0 -34.84 73.88 Favored 'General case' 0 C--O 1.233 0.228 0 CA-C-O 121.061 0.458 . . . . 0.0 110.495 177.164 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 91' ' ' TYR . . . . . . . . . . . . . 31.3 m-85 -80.75 -62.9 1.53 Allowed 'General case' 0 C--N 1.325 -0.467 0 CA-C-N 116.251 -0.431 . . . . 0.0 110.841 179.295 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 92' ' ' CYS . . . . . 0.454 ' HA ' ' HB2' ' A' ' 96' ' ' LEU . 70.2 m -68.54 -49.53 58.79 Favored 'General case' 0 C--N 1.324 -0.502 0 N-CA-C 112.595 0.591 . . . . 0.0 112.595 -171.4 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 93' ' ' ARG . . . . . 0.55 ' O ' ' HD3' ' A' ' 93' ' ' ARG . 0.7 OUTLIER -83.21 -38.41 22.3 Favored 'General case' 0 C--N 1.32 -0.708 0 C-N-CA 120.681 -0.408 . . . . 0.0 111.069 -171.639 . . . . . . . . 3 3 . 1 . 019 nuclear build full ' A' A ' 94' ' ' ASN . . . . . . . . . . . . . 6.7 t30 -91.8 -41.49 10.63 Favored 'General case' 0 C--N 1.326 -0.431 0 N-CA-C 112.172 0.434 . . . . 0.0 112.172 -172.72 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 95' ' ' HIS . . . . . . . . . . . . . 45.6 m80 -88.7 -49.43 6.86 Favored 'General case' 0 C--N 1.328 -0.343 0 N-CA-C 112.069 0.396 . . . . 0.0 112.069 178.678 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 96' ' ' LEU . . . . . 0.56 ' HG ' HD12 ' A' ' 99' ' ' LEU . 9.9 mp -84.91 26.69 0.82 Allowed 'General case' 0 C--N 1.324 -0.507 0 CA-C-N 116.318 -0.401 . . . . 0.0 111.214 -175.743 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 97' ' ' SER . . . . . 0.501 ' N ' ' HD2' ' A' ' 98' ' ' PRO . 5.2 m -53.96 -52.05 71.58 Favored Pre-proline 0 CA--C 1.538 0.498 0 CA-C-N 116.174 -0.467 . . . . 0.0 112.167 -178.762 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 98' ' ' PRO . . . . . 0.501 ' HD2' ' N ' ' A' ' 97' ' ' SER . 18.8 Cg_endo -59.6 -38.27 83.15 Favored 'Trans proline' 0 C--N 1.355 0.92 0 C-N-CA 121.814 1.676 . . . . 0.0 112.142 178.162 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 99' ' ' LEU . . . . . 0.56 HD12 ' HG ' ' A' ' 96' ' ' LEU . 65.4 mt -69.26 -25.31 64.21 Favored 'General case' 0 C--N 1.327 -0.391 0 CA-C-N 116.103 -0.499 . . . . 0.0 111.157 -176.094 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 100' ' ' TYR . . . . . . . . . . . . . 0.2 OUTLIER -58.05 -34.13 69.76 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.361 -0.381 . . . . 0.0 111.449 179.784 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 101' ' ' MET . . . . . . . . . . . . . 23.8 ttt -98.08 2.99 49.28 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-O 121.499 0.666 . . . . 0.0 110.472 -178.773 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 102' ' ' LYS . . . . . 0.579 ' HB3' ' OE2' ' A' ' 106' ' ' GLU . 8.5 mtpm? -102.98 167.67 9.69 Favored 'General case' 0 C--N 1.322 -0.6 0 CA-C-N 115.872 -0.604 . . . . 0.0 110.277 -179.133 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 103' ' ' SER . . . . . 0.541 ' O ' HG13 ' A' ' 107' ' ' ILE . 44.3 m -110.14 136.03 50.0 Favored 'General case' 0 C--N 1.319 -0.723 0 N-CA-C 109.248 -0.649 . . . . 0.0 109.248 178.936 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 104' ' ' LEU . . . . . . . . . . . . . 1.6 pp -60.58 -13.43 14.18 Favored 'General case' 0 C--N 1.325 -0.487 0 N-CA-C 112.541 0.571 . . . . 0.0 112.541 -175.167 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 105' ' ' SER . . . . . . . . . . . . . 35.3 t -87.08 -14.61 40.92 Favored 'General case' 0 C--N 1.327 -0.404 0 CA-C-N 116.518 -0.31 . . . . 0.0 110.882 178.296 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 106' ' ' GLU . . . . . 0.579 ' OE2' ' HB3' ' A' ' 102' ' ' LYS . 0.8 OUTLIER -123.02 12.44 9.66 Favored 'General case' 0 CA--C 1.532 0.271 0 CA-C-O 121.162 0.506 . . . . 0.0 111.077 179.283 . . . . . . . . 3 3 . 1 . 019 nuclear build full ' A' A ' 107' ' ' ILE . . . . . 0.541 HG13 ' O ' ' A' ' 103' ' ' SER . 77.4 mt -90.06 121.66 40.55 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.276 0 CA-C-N 116.018 -0.537 . . . . 0.0 109.884 173.607 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 108' ' ' LEU . . . . . . . . . . . . . 7.6 mp -85.48 147.52 47.02 Favored Pre-proline 0 C--N 1.323 -0.576 0 CA-C-N 116.105 -0.498 . . . . 0.0 110.723 -178.997 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 109' ' ' PRO . . . . . 0.455 ' HB3' ' HB2' ' A' ' 153' ' ' TYR . 35.2 Cg_exo -59.32 -31.61 95.33 Favored 'Trans proline' 0 N--CA 1.465 -0.191 0 C-N-CA 122.551 2.167 . . . . 0.0 111.249 174.136 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 110' ' ' ALA . . . . . 0.403 ' HA ' ' HB3' ' A' ' 113' ' ' GLN . . . -75.82 -20.91 57.81 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 115.742 -0.663 . . . . 0.0 111.108 179.129 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 111' ' ' ASP . . . . . . . . . . . . . 23.5 t0 -71.83 -48.49 45.8 Favored 'General case' 0 C--N 1.327 -0.413 0 N-CA-C 109.009 -0.737 . . . . 0.0 109.009 178.222 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 112' ' ' ILE . . . . . . . . . . . . . 46.4 mt -63.76 -38.49 82.44 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.284 0 CA-C-N 115.345 -0.843 . . . . 0.0 109.624 173.895 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 113' ' ' GLN . . . . . 0.403 ' HB3' ' HA ' ' A' ' 110' ' ' ALA . 27.2 tp60 -53.86 -44.49 70.4 Favored 'General case' 0 C--N 1.33 -0.241 0 CA-C-N 115.32 -0.855 . . . . 0.0 110.584 176.743 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 114' ' ' SER . . . . . . . . . . . . . 45.0 m -59.11 -46.61 87.86 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 115.821 -0.627 . . . . 0.0 110.509 178.898 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 115' ' ' ILE . . . . . . . . . . . . . 66.2 mt -56.86 -49.64 78.13 Favored 'Isoleucine or valine' 0 C--O 1.234 0.248 0 CA-C-O 120.967 0.413 . . . . 0.0 110.855 177.921 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 116' ' ' ILE . . . . . 0.448 HG13 HG11 ' A' ' 154' ' ' VAL . 47.6 mm -57.59 -42.44 81.27 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.262 0 CA-C-N 115.892 -0.594 . . . . 0.0 111.245 -179.886 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 117' ' ' ASN . . . . . . . . . . . . . 93.4 m-20 -71.37 -30.93 66.74 Favored 'General case' 0 C--N 1.326 -0.451 0 CA-C-N 116.328 -0.396 . . . . 0.0 111.438 -176.991 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 118' ' ' GLU . . . . . . . . . . . . . 43.0 mt-10 -89.33 -5.26 57.67 Favored 'General case' 0 C--N 1.326 -0.428 0 CA-C-O 120.735 0.303 . . . . 0.0 111.279 -178.362 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 119' ' ' THR . . . . . . . . . . . . . 98.3 m -79.32 112.37 16.48 Favored 'General case' 0 C--N 1.323 -0.587 0 CA-C-O 121.078 0.466 . . . . 0.0 111.009 176.59 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 120' ' ' LYS . . . . . . . . . . . . . 69.6 mmtt -94.37 83.03 4.11 Favored 'General case' 0 C--N 1.325 -0.487 0 CA-C-N 116.31 -0.405 . . . . 0.0 110.121 176.289 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 121' ' ' LEU . . . . . 0.457 HD13 HG21 ' A' ' 125' ' ' THR . 77.8 mt -145.46 -175.35 4.68 Favored 'General case' 0 C--N 1.323 -0.564 0 CA-C-N 115.744 -0.662 . . . . 0.0 109.768 179.938 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 122' ' ' ALA . . . . . . . . . . . . . . . -62.66 149.49 43.43 Favored 'General case' 0 C--N 1.324 -0.525 0 CA-C-N 116.488 -0.324 . . . . 0.0 110.978 178.565 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 123' ' ' LYS . . . . . . . . . . . . . 17.8 ptpt -61.65 -30.96 71.06 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.132 -0.485 . . . . 0.0 111.475 -177.174 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 124' ' ' ASN . . . . . . . . . . . . . 9.6 t30 -66.29 -40.46 90.05 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-O 120.69 0.281 . . . . 0.0 110.436 176.15 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 125' ' ' THR . . . . . 0.589 ' O ' HG13 ' A' ' 129' ' ' ILE . 53.9 m -64.14 -39.13 93.37 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 116.197 -0.456 . . . . 0.0 110.678 179.151 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 126' ' ' LEU . . . . . . . . . . . . . 89.3 mt -56.58 -48.73 76.77 Favored 'General case' 0 C--O 1.234 0.25 0 CA-C-O 121.254 0.55 . . . . 0.0 110.24 177.253 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 127' ' ' LYS . . . . . . . . . . . . . 98.4 mttt -63.76 -40.03 95.72 Favored 'General case' 0 C--N 1.327 -0.37 0 CA-C-N 115.434 -0.803 . . . . 0.0 110.614 177.535 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 128' ' ' ALA . . . . . . . . . . . . . . . -64.65 -34.66 78.81 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.104 -0.498 . . . . 0.0 111.661 -178.872 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 129' ' ' ILE . . . . . 0.589 HG13 ' O ' ' A' ' 125' ' ' THR . 78.0 mt -62.47 -50.45 79.8 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.282 0 CA-C-O 121.052 0.453 . . . . 0.0 109.951 176.254 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 130' ' ' ARG . . . . . 0.505 ' HD2' ' HB ' ' A' ' 154' ' ' VAL . 47.8 ttt180 -60.72 -44.3 96.78 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 115.693 -0.685 . . . . 0.0 110.472 176.072 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 131' ' ' ASN . . . . . . . . . . . . . 56.0 t30 -56.24 -48.45 76.5 Favored 'General case' 0 C--N 1.326 -0.413 0 CA-C-N 115.889 -0.596 . . . . 0.0 110.518 178.295 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 132' ' ' THR . . . . . . . . . . . . . 96.7 m -57.41 -51.4 69.55 Favored 'General case' 0 C--N 1.327 -0.404 0 CA-C-N 115.973 -0.558 . . . . 0.0 110.802 177.414 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 133' ' ' ALA . . . . . . . . . . . . . . . -61.1 -42.9 99.36 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 115.909 -0.587 . . . . 0.0 111.446 -178.634 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 134' ' ' SER . . . . . . . . . . . . . 51.1 p -64.18 -30.16 71.23 Favored 'General case' 0 C--N 1.33 -0.263 0 N-CA-C 111.755 0.28 . . . . 0.0 111.755 -176.73 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 135' ' ' GLN . . . . . . . . . . . . . 41.4 mt-30 -71.35 -38.37 71.63 Favored 'General case' 0 C--N 1.328 -0.329 0 C-N-CA 120.924 -0.31 . . . . 0.0 110.298 176.101 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 136' ' ' ILE . . . . . . . . . . . . . 65.7 mt -61.1 -46.11 97.28 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.251 0 CA-C-N 116.196 -0.456 . . . . 0.0 110.452 177.818 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 137' ' ' PHE . . . . . 0.484 ' O ' HG13 ' A' ' 141' ' ' ILE . 64.4 m-85 -66.03 -38.31 88.09 Favored 'General case' 0 C--N 1.33 -0.245 0 CA-C-N 116.355 -0.384 . . . . 0.0 110.827 177.745 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 138' ' ' ARG . . . . . 0.491 ' O ' ' HG3' ' A' ' 142' ' ' GLU . 19.9 mtp85 -59.19 -45.55 90.78 Favored 'General case' 0 CA--C 1.518 -0.279 0 CA-C-O 120.725 0.298 . . . . 0.0 110.739 175.952 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 139' ' ' LEU . . . . . . . . . . . . . 48.4 tp -55.81 -36.4 67.39 Favored 'General case' 0 C--N 1.327 -0.386 0 CA-C-N 115.753 -0.658 . . . . 0.0 110.42 178.697 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 140' ' ' ALA . . . . . 0.518 ' HB1' ' HB3' ' A' ' 145' ' ' ALA . . . -69.88 -45.14 68.33 Favored 'General case' 0 C--N 1.324 -0.518 0 CA-C-N 115.858 -0.61 . . . . 0.0 110.748 176.032 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 141' ' ' ILE . . . . . 0.575 ' HA ' ' O ' ' A' ' 146' ' ' ILE . 78.5 mt -55.86 -46.94 80.28 Favored 'Isoleucine or valine' 0 C--O 1.234 0.275 0 CA-C-O 120.997 0.427 . . . . 0.0 110.94 177.606 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 142' ' ' GLU . . . . . 0.491 ' HG3' ' O ' ' A' ' 138' ' ' ARG . 91.7 mt-10 -63.24 -27.55 69.43 Favored 'General case' 0 C--N 1.326 -0.416 0 CA-C-N 115.844 -0.616 . . . . 0.0 111.373 -177.564 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 143' ' ' ASN . . . . . . . . . . . . . 29.0 m-80 -99.49 14.64 29.14 Favored 'General case' 0 C--N 1.327 -0.402 0 CA-C-N 116.329 -0.396 . . . . 0.0 111.418 -178.704 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 144' ' ' ARG . . . . . . . . . . . . . 16.7 mmm180 65.68 27.94 11.23 Favored 'General case' 0 N--CA 1.468 0.462 0 N-CA-C 112.424 0.527 . . . . 0.0 112.424 176.409 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 145' ' ' ALA . . . . . 0.518 ' HB3' ' HB1' ' A' ' 140' ' ' ALA . . . -84.76 -39.66 18.17 Favored 'General case' 0 C--N 1.323 -0.568 0 CA-C-O 121.157 0.503 . . . . 0.0 110.51 177.918 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 146' ' ' ILE . . . . . 0.575 ' O ' ' HA ' ' A' ' 141' ' ' ILE . 15.5 tt -145.36 155.41 13.5 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.423 0 CA-C-N 115.688 -0.687 . . . . 0.0 109.217 -179.154 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 147' ' ' ASP . . . . . . . . . . . . . 3.8 m-20 -105.01 -1.56 25.58 Favored 'General case' 0 C--N 1.327 -0.401 0 N-CA-C 112.381 0.512 . . . . 0.0 112.381 -175.448 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 148' ' ' PHE . . . . . 0.461 ' H ' HG12 ' A' ' 146' ' ' ILE . 50.0 p90 -142.13 165.34 27.7 Favored 'General case' 0 C--N 1.322 -0.614 0 CA-C-O 120.76 0.314 . . . . 0.0 110.998 -176.569 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 149' ' ' ASN . . . . . . . . . . . . . 44.9 t-20 -119.11 101.8 49.44 Favored Pre-proline 0 C--N 1.322 -0.616 0 CA-C-N 116.021 -0.536 . . . . 0.0 110.549 -176.306 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 150' ' ' PRO . . . . . . . . . . . . . 35.2 Cg_exo -59.35 -32.69 97.1 Favored 'Trans proline' 0 C--N 1.342 0.197 0 C-N-CA 122.838 2.359 . . . . 0.0 112.724 178.915 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 151' ' ' ALA . . . . . 0.529 ' HA ' HG23 ' A' ' 154' ' ' VAL . . . -74.81 -19.47 60.18 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-O 121.047 0.451 . . . . 0.0 110.968 -178.466 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 152' ' ' ASP . . . . . . . . . . . . . 24.8 t70 -71.74 -19.81 61.98 Favored 'General case' 0 C--N 1.325 -0.46 0 CA-C-N 115.762 -0.653 . . . . 0.0 110.033 178.662 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 153' ' ' TYR . . . . . 0.455 ' HB2' ' HB3' ' A' ' 109' ' ' PRO . 68.6 m-85 -95.77 1.77 53.49 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 115.744 -0.662 . . . . 0.0 111.513 -178.238 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 154' ' ' VAL . . . . . 0.529 HG23 ' HA ' ' A' ' 151' ' ' ALA . 98.0 t -72.32 123.53 27.1 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.514 0 CA-C-O 121.043 0.449 . . . . 0.0 110.514 -178.954 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 155' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -86.12 101.58 13.11 Favored 'General case' 0 C--N 1.32 -0.711 0 N-CA-C 109.251 -0.648 . . . . 0.0 109.251 179.279 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 156' ' ' ILE . . . . . 0.415 HD13 ' HD3' ' A' ' 130' ' ' ARG . 0.9 OUTLIER -71.12 131.31 87.17 Favored Pre-proline 0 C--N 1.325 -0.469 0 N-CA-C 109.275 -0.639 . . . . 0.0 109.275 176.146 . . . . . . . . 3 3 . 1 . 019 nuclear build full ' A' A ' 157' ' ' PRO . . . . . 0.417 ' HB2' HG13 ' A' ' 159' ' ' ILE . 92.4 Cg_endo -82.42 148.71 14.62 Favored 'Trans proline' 0 N--CA 1.456 -0.685 0 C-N-CA 122.522 2.148 . . . . 0.0 112.856 -176.088 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 158' ' ' LYS . . . . . . . . . . . . . 97.7 mttt -101.33 -38.77 7.91 Favored 'General case' 0 C--N 1.324 -0.54 0 N-CA-C 109.212 -0.662 . . . . 0.0 109.212 175.156 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 159' ' ' ILE . . . . . 0.417 HG13 ' HB2' ' A' ' 157' ' ' PRO . 59.1 mt 60.39 88.71 0.05 OUTLIER 'Isoleucine or valine' 0 C--O 1.233 0.194 0 CA-C-N 114.863 -1.062 . . . . 0.0 111.621 176.32 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 160' ' ' ALA . . . . . . . . . . . . . . . -87.72 110.55 20.53 Favored 'General case' 0 C--N 1.32 -0.68 0 CA-C-N 115.782 -0.645 . . . . 0.0 109.633 176.126 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 161' ' ' LEU . . . . . . . . . . . . . 80.6 mt -63.96 114.7 4.27 Favored 'General case' 0 C--N 1.323 -0.583 0 CA-C-N 115.84 -0.618 . . . . 0.0 110.6 -177.909 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 162' ' ' GLU . . . . . . . . . . . . . 5.4 tm-20 -157.63 -46.03 0.07 Allowed 'General case' 0 C--N 1.322 -0.617 0 CA-C-N 115.092 -0.958 . . . . 0.0 109.731 -172.733 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 163' ' ' HIS . . . . . . . . . . . . . 4.8 m-70 -49.17 109.43 0.26 Allowed 'General case' 0 N--CA 1.463 0.202 0 O-C-N 123.984 0.802 . . . . 0.0 111.172 -173.633 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 164' ' ' HIS . . . . . . . . . . . . . 98.5 m-70 -89.34 96.18 10.6 Favored 'General case' 0 C--N 1.324 -0.533 0 CA-C-N 115.612 -0.722 . . . . 0.0 111.179 -173.44 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 165' ' ' HIS . . . . . . . . . . . . . 12.1 t-80 61.12 29.39 18.84 Favored 'General case' 0 CA--C 1.532 0.262 0 CA-C-N 115.416 -0.811 . . . . 0.0 110.971 175.132 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 166' ' ' HIS . . . . . . . . . . . . . 14.6 t-80 -83.11 -1.59 53.23 Favored 'General case' 0 C--N 1.327 -0.37 0 C-N-CA 120.719 -0.393 . . . . 0.0 110.476 -179.894 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 167' ' ' HIS . . . . . . . . . . . . . 24.1 p80 -141.76 169.24 17.96 Favored 'General case' 0 C--N 1.324 -0.527 0 N-CA-C 109.685 -0.487 . . . . 0.0 109.685 175.606 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 168' ' ' HIS . . . . . . . . . . . . . 21.4 p80 . . . . . 0 C--O 1.247 0.929 0 N-CA-C 108.964 -0.754 . . . . 0.0 108.964 172.408 . . . . . . . . 0 0 . 1 . 020 nuclear build full ' A' A ' 61' ' ' ARG . . . . . . . . . . . . . 45.7 mtm180 . . . . . 0 N--CA 1.477 0.913 0 CA-C-O 120.857 0.36 . . . . 0.0 110.127 . . . . . . . . . 0 0 . 1 . 020 nuclear build full ' A' A ' 62' ' ' ASP . . . . . . . . . . . . . 6.6 m-20 -109.8 149.04 30.4 Favored 'General case' 0 C--N 1.322 -0.628 0 CA-C-N 116.266 -0.425 . . . . 0.0 110.544 -178.351 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 63' ' ' SER . . . . . 0.564 ' HA ' ' HA ' ' A' ' 103' ' ' SER . 39.5 t -90.94 146.73 23.64 Favored 'General case' 0 C--N 1.321 -0.657 0 CA-C-N 116.195 -0.457 . . . . 0.0 110.341 179.458 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 64' ' ' PHE . . . . . 0.48 ' HB2' HD11 ' A' ' 107' ' ' ILE . 78.9 t80 -59.85 -31.82 70.12 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 115.82 -0.627 . . . . 0.0 109.999 178.37 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 65' ' ' GLY . . . . . . . . . . . . . . . -59.24 -31.7 70.14 Favored Glycine 0 N--CA 1.447 -0.582 0 CA-C-N 115.685 -0.689 . . . . 0.0 112.571 178.894 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 66' ' ' ASP . . . . . . . . . . . . . 39.0 t70 -79.66 -48.38 13.81 Favored 'General case' 0 C--N 1.329 -0.308 0 C-N-CA 120.911 -0.316 . . . . 0.0 110.491 -179.959 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 67' ' ' TRP . . . . . . . . . . . . . 83.8 m95 -62.16 -36.59 82.31 Favored 'General case' 0 N--CA 1.465 0.282 0 CA-C-N 116.474 -0.33 . . . . 0.0 111.32 179.582 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 68' ' ' ALA . . . . . 0.595 ' O ' ' HG ' ' A' ' 72' ' ' LEU . . . -63.93 -50.92 66.77 Favored 'General case' 0 C--N 1.325 -0.495 0 CA-C-N 116.273 -0.421 . . . . 0.0 110.535 177.28 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 69' ' ' GLU . . . . . . . . . . . . . 14.9 tp10 -61.88 -35.18 77.58 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.083 -0.508 . . . . 0.0 110.07 178.055 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 70' ' ' LYS . . . . . . . . . . . . . 48.5 tttp -59.17 -44.97 92.16 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 115.932 -0.577 . . . . 0.0 110.325 177.145 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 71' ' ' PHE . . . . . . . . . . . . . 79.5 t80 -69.28 -41.22 77.14 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-O 120.98 0.419 . . . . 0.0 110.441 178.912 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 72' ' ' LEU . . . . . 0.595 ' HG ' ' O ' ' A' ' 68' ' ' ALA . 86.1 mt -63.9 -34.28 77.6 Favored 'General case' 0 C--N 1.325 -0.478 0 CA-C-N 116.14 -0.482 . . . . 0.0 110.526 179.647 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 73' ' ' LYS . . . . . 0.452 ' O ' ' HB3' ' A' ' 76' ' ' GLU . 14.0 ttmm -84.08 -33.33 24.43 Favored 'General case' 0 C--N 1.324 -0.543 0 CA-C-N 116.138 -0.483 . . . . 0.0 111.238 -176.505 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 74' ' ' SER . . . . . . . . . . . . . 15.4 p -71.47 -30.58 66.16 Favored 'General case' 0 C--N 1.324 -0.501 0 N-CA-C 110.051 -0.352 . . . . 0.0 110.051 175.982 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 75' ' ' LYS . . . . . 0.506 ' O ' ' HB3' ' A' ' 78' ' ' ASP . 22.0 tptp -76.62 -32.05 57.8 Favored 'General case' 0 N--CA 1.447 -0.612 0 CA-C-O 121.302 0.572 . . . . 0.0 109.475 174.589 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 76' ' ' GLU . . . . . 0.452 ' HB3' ' O ' ' A' ' 73' ' ' LYS . 30.3 tt0 -58.88 -47.87 83.43 Favored 'General case' 0 C--N 1.327 -0.407 0 CA-C-N 115.377 -0.829 . . . . 0.0 110.072 172.921 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 77' ' ' ALA . . . . . . . . . . . . . . . -76.08 -16.24 59.96 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 115.808 -0.633 . . . . 0.0 111.018 178.584 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 78' ' ' ASP . . . . . 0.506 ' HB3' ' O ' ' A' ' 75' ' ' LYS . 3.8 t70 -65.57 -53.78 37.09 Favored 'General case' 0 C--N 1.331 -0.218 0 CA-C-N 116.014 -0.539 . . . . 0.0 110.519 177.101 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 79' ' ' GLY . . . . . . . . . . . . . . . 142.34 63.97 0.03 OUTLIER Glycine 0 N--CA 1.446 -0.69 0 C-N-CA 120.506 -0.854 . . . . 0.0 112.26 178.495 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 80' ' ' VAL . . . . . . . . . . . . . 36.0 m -115.5 158.43 15.86 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.644 0 CA-C-O 120.759 0.314 . . . . 0.0 110.808 179.634 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 81' ' ' SER . . . . . . . . . . . . . 47.5 t -78.72 151.48 32.11 Favored 'General case' 0 C--N 1.321 -0.665 0 N-CA-C 109.487 -0.56 . . . . 0.0 109.487 174.777 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 82' ' ' VAL . . . . . . . . . . . . . 8.3 p -56.68 -34.4 42.57 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.329 0 CA-C-O 120.834 0.35 . . . . 0.0 110.667 177.631 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 83' ' ' SER . . . . . . . . . . . . . 3.4 m -62.98 -42.42 99.83 Favored 'General case' 0 C--O 1.235 0.291 0 CA-C-O 121.425 0.631 . . . . 0.0 110.181 178.199 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 84' ' ' GLN . . . . . 0.431 ' HG3' ' CE2' ' A' ' 88' ' ' TYR . 23.4 tp60 -74.78 -33.78 62.32 Favored 'General case' 0 C--N 1.325 -0.486 0 CA-C-N 115.497 -0.774 . . . . 0.0 110.389 -179.519 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 85' ' ' LEU . . . . . . . . . . . . . 36.7 tp -68.99 -42.97 75.79 Favored 'General case' 0 C--N 1.323 -0.562 0 CA-C-N 116.084 -0.507 . . . . 0.0 110.607 178.966 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 86' ' ' ASN . . . . . . . . . . . . . 86.3 m-20 -60.36 -44.83 95.21 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.32 -0.4 . . . . 0.0 111.075 178.78 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 87' ' ' SER . . . . . . . . . . . . . 2.0 p -63.58 -38.31 90.65 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 116.649 -0.25 . . . . 0.0 111.201 -179.489 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 88' ' ' TYR . . . . . 0.451 ' HB3' HD22 ' A' ' 72' ' ' LEU . 10.7 m-85 -60.48 -47.95 83.9 Favored 'General case' 0 N--CA 1.465 0.282 0 CA-C-O 121.037 0.446 . . . . 0.0 110.515 175.082 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 89' ' ' LYS . . . . . 0.525 ' HG2' HD13 ' A' ' 72' ' ' LEU . 68.4 mttm -63.38 -37.66 88.12 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 115.787 -0.642 . . . . 0.0 110.767 179.64 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 90' ' ' ASN . . . . . 0.516 ' O ' ' HB3' ' A' ' 94' ' ' ASN . 7.4 m-80 -62.48 -47.65 83.05 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.302 -0.408 . . . . 0.0 111.008 177.354 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 91' ' ' TYR . . . . . . . . . . . . . 14.0 m-85 -57.23 -45.36 83.95 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-O 120.991 0.424 . . . . 0.0 110.507 175.693 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 92' ' ' CYS . . . . . 0.56 ' SG ' ' HB1' ' A' ' 68' ' ' ALA . 47.8 t -66.54 -54.08 27.63 Favored 'General case' 0 C--N 1.321 -0.668 0 CA-C-N 115.507 -0.769 . . . . 0.0 112.407 -175.561 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 93' ' ' ARG . . . . . . . . . . . . . 31.7 ttm-85 -82.45 -35.02 27.91 Favored 'General case' 0 C--N 1.326 -0.451 0 N-CA-C 111.965 0.357 . . . . 0.0 111.965 -171.751 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 94' ' ' ASN . . . . . 0.516 ' HB3' ' O ' ' A' ' 90' ' ' ASN . 22.0 t-20 -83.97 -51.6 7.01 Favored 'General case' 0 C--N 1.326 -0.43 0 CA-C-O 120.651 0.262 . . . . 0.0 111.582 -176.583 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 95' ' ' HIS . . . . . . . . . . . . . 64.7 m80 -85.49 -42.91 14.03 Favored 'General case' 0 C--N 1.327 -0.371 0 CA-C-O 120.701 0.286 . . . . 0.0 111.452 -174.207 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 96' ' ' LEU . . . . . 0.454 HD21 ' HB2' ' A' ' 133' ' ' ALA . 10.1 mp -91.56 26.73 2.21 Favored 'General case' 0 C--N 1.326 -0.435 0 CA-C-O 120.864 0.364 . . . . 0.0 110.464 -179.794 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 97' ' ' SER . . . . . 0.526 ' OG ' ' HD3' ' A' ' 98' ' ' PRO . 0.5 OUTLIER -55.44 -47.12 99.35 Favored Pre-proline 0 CA--C 1.539 0.526 0 N-CA-C 113.02 0.748 . . . . 0.0 113.02 -178.481 . . . . . . . . 3 3 . 1 . 020 nuclear build full ' A' A ' 98' ' ' PRO . . . . . 0.526 ' HD3' ' OG ' ' A' ' 97' ' ' SER . 38.8 Cg_exo -58.08 -34.91 98.99 Favored 'Trans proline' 0 C--N 1.358 1.066 0 C-N-CA 121.663 1.575 . . . . 0.0 111.967 178.095 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 99' ' ' LEU . . . . . 0.455 HD22 HG23 ' A' ' 107' ' ' ILE . 33.2 mt -79.02 -36.82 40.5 Favored 'General case' 0 C--N 1.327 -0.391 0 CA-C-N 115.874 -0.603 . . . . 0.0 110.282 -177.275 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 100' ' ' TYR . . . . . . . . . . . . . 25.8 t80 -60.47 -24.82 65.56 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 115.509 -0.769 . . . . 0.0 111.072 -177.112 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 101' ' ' MET . . . . . . . . . . . . . 65.4 mtt -97.72 -2.58 40.94 Favored 'General case' 0 C--N 1.327 -0.375 0 CA-C-N 116.21 -0.45 . . . . 0.0 111.784 -177.153 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 102' ' ' LYS . . . . . . . . . . . . . 87.7 mttt -102.53 167.35 9.99 Favored 'General case' 0 C--O 1.237 0.402 0 CA-C-O 121.026 0.441 . . . . 0.0 111.012 -179.312 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 103' ' ' SER . . . . . 0.564 ' HA ' ' HA ' ' A' ' 63' ' ' SER . 5.2 m -83.13 156.77 23.1 Favored 'General case' 0 C--N 1.323 -0.569 0 CA-C-N 115.82 -0.627 . . . . 0.0 109.69 174.702 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 104' ' ' LEU . . . . . . . . . . . . . 52.1 tp -55.83 -45.11 78.44 Favored 'General case' 0 C--N 1.325 -0.457 0 CA-C-N 116.501 -0.318 . . . . 0.0 111.525 -176.828 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 105' ' ' SER . . . . . . . . . . . . . 14.8 m -87.12 0.38 55.36 Favored 'General case' 0 C--N 1.325 -0.493 0 CA-C-N 116.453 -0.34 . . . . 0.0 111.896 -174.572 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 106' ' ' GLU . . . . . . . . . . . . . 44.3 mt-10 -104.02 -2.46 25.98 Favored 'General case' 0 C--N 1.327 -0.377 0 O-C-N 122.247 -0.283 . . . . 0.0 111.624 -178.372 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 107' ' ' ILE . . . . . 0.48 HD11 ' HB2' ' A' ' 64' ' ' PHE . 66.9 mt -81.15 126.82 39.87 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.556 0 CA-C-O 121.133 0.492 . . . . 0.0 111.303 -178.116 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 108' ' ' LEU . . . . . . . . . . . . . 62.9 mt -97.61 147.28 32.78 Favored Pre-proline 0 C--N 1.323 -0.583 0 CA-C-N 115.724 -0.671 . . . . 0.0 110.444 -179.488 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 109' ' ' PRO . . . . . . . . . . . . . 19.1 Cg_endo -60.18 -30.33 91.06 Favored 'Trans proline' 0 N--CA 1.464 -0.241 0 C-N-CA 122.351 2.034 . . . . 0.0 111.352 174.977 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 110' ' ' ALA . . . . . . . . . . . . . . . -65.17 -29.85 70.71 Favored 'General case' 0 N--CA 1.454 -0.257 0 CA-C-N 115.868 -0.605 . . . . 0.0 111.043 178.662 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 111' ' ' ASP . . . . . 0.414 ' O ' HG13 ' A' ' 115' ' ' ILE . 79.2 m-20 -64.91 -51.26 62.85 Favored 'General case' 0 CA--C 1.519 -0.244 0 CA-C-O 121.141 0.496 . . . . 0.0 110.025 179.226 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 112' ' ' ILE . . . . . 0.485 ' O ' HG12 ' A' ' 116' ' ' ILE . 30.6 mt -65.16 -40.61 89.36 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.491 0 CA-C-N 115.67 -0.696 . . . . 0.0 110.15 179.741 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 113' ' ' GLN . . . . . . . . . . . . . 6.7 tp-100 -59.01 -42.54 90.35 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.018 -0.537 . . . . 0.0 110.514 175.663 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 114' ' ' SER . . . . . . . . . . . . . 7.4 t -60.25 -45.58 92.78 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-N 116.257 -0.429 . . . . 0.0 109.862 178.304 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 115' ' ' ILE . . . . . 0.414 HG13 ' O ' ' A' ' 111' ' ' ASP . 75.8 mt -56.69 -47.23 82.76 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.221 0 CA-C-N 116.434 -0.348 . . . . 0.0 110.822 178.401 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 116' ' ' ILE . . . . . 0.485 HG12 ' O ' ' A' ' 112' ' ' ILE . 50.3 mm -61.09 -40.99 87.61 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.36 0 CA-C-O 121.108 0.48 . . . . 0.0 110.876 179.165 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 117' ' ' ASN . . . . . . . . . . . . . 46.8 t-20 -71.6 -42.03 68.21 Favored 'General case' 0 C--N 1.324 -0.515 0 CA-C-N 115.797 -0.638 . . . . 0.0 111.067 -177.032 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 118' ' ' GLU . . . . . . . . . . . . . 46.9 mt-10 -80.65 -16.76 53.21 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.253 -0.43 . . . . 0.0 112.035 -174.467 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 119' ' ' THR . . . . . . . . . . . . . 94.8 m -82.0 112.86 19.46 Favored 'General case' 0 C--N 1.325 -0.481 0 CA-C-O 121.331 0.586 . . . . 0.0 110.96 179.985 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 120' ' ' LYS . . . . . . . . . . . . . 24.1 mtmt -93.47 63.24 3.47 Favored 'General case' 0 C--N 1.323 -0.548 0 CA-C-N 115.441 -0.799 . . . . 0.0 110.544 -177.959 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 121' ' ' LEU . . . . . . . . . . . . . 88.8 mt -126.92 -175.75 3.51 Favored 'General case' 0 C--N 1.322 -0.62 0 CA-C-N 115.16 -0.927 . . . . 0.0 109.939 178.305 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 122' ' ' ALA . . . . . . . . . . . . . . . -64.01 157.12 25.97 Favored 'General case' 0 C--N 1.327 -0.37 0 CA-C-O 120.964 0.411 . . . . 0.0 111.808 -176.729 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 123' ' ' LYS . . . . . . . . . . . . . 48.3 mmtm -62.01 -38.39 88.47 Favored 'General case' 0 C--N 1.331 -0.237 0 CA-C-N 115.979 -0.555 . . . . 0.0 111.12 -177.926 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 124' ' ' ASN . . . . . . . . . . . . . 28.9 p30 -65.45 -27.31 68.42 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.321 -0.399 . . . . 0.0 111.064 179.453 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 125' ' ' THR . . . . . 0.495 ' O ' HG13 ' A' ' 129' ' ' ILE . 10.2 m -76.18 -39.2 55.38 Favored 'General case' 0 C--N 1.325 -0.47 0 CA-C-N 116.257 -0.429 . . . . 0.0 110.061 179.125 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 126' ' ' LEU . . . . . 0.433 ' HB3' HG23 ' A' ' 116' ' ' ILE . 84.5 mt -62.42 -44.83 95.5 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.008 -0.542 . . . . 0.0 110.141 177.289 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 127' ' ' LYS . . . . . . . . . . . . . 98.6 mttt -59.7 -43.53 94.04 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 115.774 -0.648 . . . . 0.0 110.18 177.384 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 128' ' ' ALA . . . . . . . . . . . . . . . -60.71 -39.12 87.36 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 115.7 -0.682 . . . . 0.0 111.308 -178.861 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 129' ' ' ILE . . . . . 0.495 HG13 ' O ' ' A' ' 125' ' ' THR . 87.6 mt -58.36 -51.65 68.73 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.245 0 CA-C-N 116.462 -0.336 . . . . 0.0 110.654 178.394 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 130' ' ' ARG . . . . . 0.705 HH21 ' HA ' ' A' ' 152' ' ' ASP . 33.4 ttt-85 -65.15 -45.97 82.8 Favored 'General case' 0 C--N 1.331 -0.206 0 C-N-CA 120.885 -0.326 . . . . 0.0 110.92 179.079 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 131' ' ' ASN . . . . . . . . . . . . . 94.2 m-20 -53.15 -53.06 56.06 Favored 'General case' 0 N--CA 1.466 0.343 0 O-C-N 123.184 0.302 . . . . 0.0 110.833 179.654 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 132' ' ' THR . . . . . 0.533 ' O ' HG12 ' A' ' 136' ' ' ILE . 29.7 m -55.7 -45.23 77.9 Favored 'General case' 0 C--N 1.327 -0.401 0 CA-C-N 116.303 -0.408 . . . . 0.0 110.824 -179.997 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 133' ' ' ALA . . . . . 0.454 ' HB2' HD21 ' A' ' 96' ' ' LEU . . . -64.3 -42.84 96.17 Favored 'General case' 0 C--N 1.331 -0.207 0 CA-C-N 116.21 -0.45 . . . . 0.0 111.388 -179.356 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 134' ' ' SER . . . . . 0.45 ' O ' ' HG3' ' A' ' 138' ' ' ARG . 70.5 p -64.4 -32.69 74.41 Favored 'General case' 0 C--N 1.33 -0.246 0 C-N-CA 121.033 -0.267 . . . . 0.0 110.959 -178.704 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 135' ' ' GLN . . . . . . . . . . . . . 1.2 mp0 -62.88 -41.18 99.3 Favored 'General case' 0 C--N 1.331 -0.206 0 CA-C-O 120.779 0.323 . . . . 0.0 110.245 175.169 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 136' ' ' ILE . . . . . 0.561 HD12 ' HA ' ' A' ' 68' ' ' ALA . 23.1 mm -61.63 -50.77 78.93 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.25 0 CA-C-N 116.014 -0.539 . . . . 0.0 110.402 178.737 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 137' ' ' PHE . . . . . 0.492 ' O ' HG13 ' A' ' 141' ' ' ILE . 62.2 m-85 -62.14 -38.15 87.88 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 115.843 -0.617 . . . . 0.0 111.405 -179.529 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 138' ' ' ARG . . . . . 0.587 ' O ' ' HG2' ' A' ' 142' ' ' GLU . 68.2 mtp180 -64.7 -37.54 87.94 Favored 'General case' 0 C--N 1.329 -0.314 0 C-N-CA 120.823 -0.351 . . . . 0.0 110.877 179.356 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 139' ' ' LEU . . . . . . . . . . . . . 63.4 tp -57.54 -41.77 81.59 Favored 'General case' 0 C--N 1.327 -0.387 0 CA-C-O 121.107 0.479 . . . . 0.0 109.975 176.301 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 140' ' ' ALA . . . . . . . . . . . . . . . -66.6 -38.74 87.63 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 115.716 -0.675 . . . . 0.0 110.711 177.355 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 141' ' ' ILE . . . . . 0.546 ' HA ' ' O ' ' A' ' 146' ' ' ILE . 75.7 mt -64.07 -43.74 97.58 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.268 0 CA-C-N 116.3 -0.409 . . . . 0.0 110.73 177.168 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 142' ' ' GLU . . . . . 0.587 ' HG2' ' O ' ' A' ' 138' ' ' ARG . 39.7 mm-40 -62.77 -30.43 71.44 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.274 -0.421 . . . . 0.0 110.955 179.434 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 143' ' ' ASN . . . . . . . . . . . . . 5.3 m-20 -91.23 1.9 56.76 Favored 'General case' 0 N--CA 1.464 0.229 0 CA-C-N 116.269 -0.423 . . . . 0.0 110.919 179.987 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 144' ' ' ARG . . . . . . . . . . . . . 24.5 mtp85 57.68 40.92 26.1 Favored 'General case' 0 C--O 1.233 0.233 0 CA-C-N 115.633 -0.712 . . . . 0.0 112.054 -177.892 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 145' ' ' ALA . . . . . . . . . . . . . . . -88.41 -28.78 20.7 Favored 'General case' 0 C--N 1.324 -0.508 0 N-CA-C 109.338 -0.616 . . . . 0.0 109.338 172.435 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 146' ' ' ILE . . . . . 0.546 ' O ' ' HA ' ' A' ' 141' ' ' ILE . 13.4 tt -155.07 146.49 13.18 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.479 0 CA-C-N 115.237 -0.892 . . . . 0.0 108.941 177.493 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 147' ' ' ASP . . . . . . . . . . . . . 7.6 m-20 -110.48 24.02 13.51 Favored 'General case' 0 C--N 1.323 -0.548 0 CA-C-O 121.283 0.563 . . . . 0.0 110.192 179.53 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 148' ' ' PHE . . . . . 0.48 ' H ' HG12 ' A' ' 146' ' ' ILE . 1.2 m-85 -129.97 143.95 51.07 Favored 'General case' 0 C--N 1.323 -0.572 0 CA-C-N 115.631 -0.713 . . . . 0.0 110.336 -178.712 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 149' ' ' ASN . . . . . . . . . . . . . 48.0 t-20 -126.36 91.14 48.39 Favored Pre-proline 0 C--N 1.321 -0.664 0 CA-C-N 116.131 -0.486 . . . . 0.0 110.003 178.494 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 150' ' ' PRO . . . . . . . . . . . . . 35.8 Cg_exo -62.19 -26.52 77.78 Favored 'Trans proline' 0 C--N 1.343 0.258 0 C-N-CA 122.798 2.332 . . . . 0.0 112.082 -179.582 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 151' ' ' ALA . . . . . . . . . . . . . . . -70.21 -27.6 64.62 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 116.124 -0.489 . . . . 0.0 111.179 -177.635 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 152' ' ' ASP . . . . . 0.705 ' HA ' HH21 ' A' ' 130' ' ' ARG . 19.3 t70 -75.58 -17.65 59.98 Favored 'General case' 0 C--N 1.323 -0.552 0 CA-C-O 120.887 0.375 . . . . 0.0 110.514 -179.53 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 153' ' ' TYR . . . . . . . . . . . . . 43.7 m-85 -83.35 -10.84 58.23 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.243 -0.435 . . . . 0.0 110.653 178.819 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 154' ' ' VAL . . . . . . . . . . . . . 41.9 t -72.7 117.77 16.79 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.396 0 CA-C-N 116.101 -0.5 . . . . 0.0 110.945 -178.987 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 155' ' ' ARG . . . . . . . . . . . . . 3.8 mmp_? -89.91 131.68 35.7 Favored 'General case' 0 C--N 1.319 -0.719 0 CA-C-N 116.133 -0.485 . . . . 0.0 110.326 174.016 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 156' ' ' ILE . . . . . 0.427 ' HA ' ' HD2' ' A' ' 157' ' ' PRO . 1.9 mp -91.96 117.08 67.54 Favored Pre-proline 0 C--N 1.31 -1.109 0 N-CA-C 107.988 -1.116 . . . . 0.0 107.988 173.481 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 157' ' ' PRO . . . . . 0.427 ' HD2' ' HA ' ' A' ' 156' ' ' ILE . 5.7 Cg_endo -48.57 130.55 22.24 Favored 'Trans proline' 0 C--N 1.345 0.368 0 C-N-CA 123.22 2.613 . . . . 0.0 112.488 -173.657 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 158' ' ' LYS . . . . . . . . . . . . . 57.2 mtmt -89.33 40.31 0.98 Allowed 'General case' 0 C--N 1.324 -0.522 0 CA-C-N 115.601 -0.727 . . . . 0.0 110.33 -176.006 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 159' ' ' ILE . . . . . . . . . . . . . 22.4 mt -80.52 68.58 0.49 Allowed 'Isoleucine or valine' 0 C--N 1.326 -0.428 0 CA-C-N 115.75 -0.659 . . . . 0.0 109.553 178.43 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 160' ' ' ALA . . . . . . . . . . . . . . . -114.7 105.48 13.1 Favored 'General case' 0 C--N 1.321 -0.652 0 CA-C-N 115.573 -0.739 . . . . 0.0 109.855 178.734 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 161' ' ' LEU . . . . . . . . . . . . . 71.8 mt -95.13 3.99 54.14 Favored 'General case' 0 C--N 1.32 -0.694 0 CA-C-N 115.927 -0.579 . . . . 0.0 110.211 -178.156 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 162' ' ' GLU . . . . . . . . . . . . . 50.7 mt-10 -66.02 136.01 55.45 Favored 'General case' 0 C--N 1.325 -0.465 0 CA-C-N 115.391 -0.822 . . . . 0.0 110.529 178.161 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 163' ' ' HIS . . . . . . . . . . . . . 68.1 m80 -85.76 54.65 3.2 Favored 'General case' 0 C--N 1.323 -0.586 0 N-CA-C 109.519 -0.549 . . . . 0.0 109.519 179.659 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 164' ' ' HIS . . . . . . . . . . . . . 9.9 t-160 -103.31 11.2 37.02 Favored 'General case' 0 C--N 1.326 -0.431 0 CA-C-N 115.678 -0.692 . . . . 0.0 110.013 -175.822 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 165' ' ' HIS . . . . . . . . . . . . . 48.6 m-70 -119.15 149.91 40.93 Favored 'General case' 0 C--N 1.323 -0.558 0 CA-C-N 115.776 -0.647 . . . . 0.0 109.528 177.491 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 166' ' ' HIS . . . . . . . . . . . . . 21.9 p80 -123.35 89.51 3.11 Favored 'General case' 0 C--N 1.326 -0.43 0 CA-C-O 121.619 0.724 . . . . 0.0 111.137 176.726 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 167' ' ' HIS . . . . . . . . . . . . . 45.2 p-80 -155.9 145.21 20.8 Favored 'General case' 0 C--N 1.323 -0.581 0 CA-C-N 115.773 -0.649 . . . . 0.0 109.803 176.311 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 168' ' ' HIS . . . . . . . . . . . . . 68.9 m-70 . . . . . 0 C--O 1.248 0.999 0 CA-C-O 118.677 -0.678 . . . . 0.0 109.576 179.962 . . . . . . . . 0 0 . 1 . 001 nuclear nobuild core ' A' A ' 63' ' ' SER . . . . . 0.608 ' HA ' ' HA ' ' A' ' 103' ' ' SER . 29.4 p . . . . . 0 N--CA 1.449 -0.492 0 CA-C-O 120.908 0.385 . . . . 0.0 110.518 . . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 64' ' ' PHE . . . . . 0.504 ' HB2' HD11 ' A' ' 107' ' ' ILE . 83.2 t80 -62.32 -35.62 79.62 Favored 'General case' 0 C--N 1.327 -0.372 0 N-CA-C 109.852 -0.425 . . . . 0.0 109.852 179.174 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 65' ' ' GLY . . . . . . . . . . . . . . . -60.92 -37.57 94.0 Favored Glycine 0 N--CA 1.449 -0.483 0 CA-C-N 115.904 -0.589 . . . . 0.0 112.329 176.964 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 66' ' ' ASP . . . . . . . . . . . . . 9.4 t70 -59.84 -54.39 46.77 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-O 120.894 0.378 . . . . 0.0 110.603 178.063 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 67' ' ' TRP . . . . . . . . . . . . . 87.5 m95 -72.44 -31.38 65.42 Favored 'General case' 0 C--N 1.325 -0.464 0 CA-C-N 115.941 -0.572 . . . . 0.0 111.94 -176.953 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 68' ' ' ALA . . . . . 0.512 ' O ' HD13 ' A' ' 72' ' ' LEU . . . -64.03 -44.87 91.24 Favored 'General case' 0 C--N 1.327 -0.408 0 CA-C-O 120.872 0.368 . . . . 0.0 110.325 176.336 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 69' ' ' GLU . . . . . . . . . . . . . 15.7 tm-20 -62.47 -38.68 90.77 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 115.981 -0.554 . . . . 0.0 110.05 178.916 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 70' ' ' LYS . . . . . . . . . . . . . 90.0 mttt -68.07 -38.49 82.46 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.244 -0.434 . . . . 0.0 111.055 177.399 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 71' ' ' PHE . . . . . . . . . . . . . 87.8 t80 -64.04 -44.15 93.36 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-O 120.958 0.408 . . . . 0.0 110.355 176.786 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 72' ' ' LEU . . . . . 0.518 ' HG ' ' HG2' ' A' ' 89' ' ' LYS . 3.9 mp -56.6 -51.55 68.24 Favored 'General case' 0 C--N 1.327 -0.387 0 CA-C-N 115.735 -0.666 . . . . 0.0 110.421 175.866 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 73' ' ' LYS . . . . . . . . . . . . . 39.9 ttmt -63.01 -37.8 88.63 Favored 'General case' 0 C--N 1.326 -0.423 0 CA-C-N 115.968 -0.56 . . . . 0.0 110.635 179.229 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 74' ' ' SER . . . . . . . . . . . . . 31.4 t -57.68 -51.87 67.75 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.144 -0.48 . . . . 0.0 110.949 177.819 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 75' ' ' LYS . . . . . 0.547 ' HA ' ' HB2' ' A' ' 78' ' ' ASP . 25.9 mmtm -69.84 -30.21 67.65 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-O 120.862 0.363 . . . . 0.0 111.119 -178.044 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 76' ' ' GLU . . . . . . . . . . . . . 35.5 tt0 -64.68 -38.55 91.37 Favored 'General case' 0 C--N 1.323 -0.561 0 CA-C-N 116.105 -0.498 . . . . 0.0 110.195 175.332 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 77' ' ' ALA . . . . . . . . . . . . . . . -80.15 -23.72 40.91 Favored 'General case' 0 C--N 1.325 -0.461 0 CA-C-N 115.83 -0.623 . . . . 0.0 111.158 176.058 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 78' ' ' ASP . . . . . 0.547 ' HB2' ' HA ' ' A' ' 75' ' ' LYS . 11.2 m-20 -67.6 -33.38 74.87 Favored 'General case' 0 CA--C 1.517 -0.294 0 CA-C-N 116.443 -0.344 . . . . 0.0 110.795 177.43 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 79' ' ' GLY . . . . . . . . . . . . . . . 105.7 41.2 1.89 Allowed Glycine 0 N--CA 1.446 -0.669 0 C-N-CA 120.557 -0.83 . . . . 0.0 112.934 176.208 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 80' ' ' VAL . . . . . . . . . . . . . 30.0 m -87.26 158.25 3.15 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.567 0 N-CA-C 109.674 -0.491 . . . . 0.0 109.674 174.549 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 81' ' ' SER . . . . . . . . . . . . . 61.1 m -61.43 146.16 49.33 Favored 'General case' 0 C--N 1.323 -0.561 0 CA-C-N 116.581 -0.282 . . . . 0.0 110.546 177.636 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 82' ' ' VAL . . . . . . . . . . . . . 60.3 t -57.05 -43.17 80.7 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.378 0 CA-C-N 116.384 -0.371 . . . . 0.0 111.03 -178.345 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 83' ' ' SER . . . . . . . . . . . . . 27.9 m -59.65 -39.11 83.3 Favored 'General case' 0 C--N 1.326 -0.441 0 CA-C-N 116.374 -0.375 . . . . 0.0 110.545 176.889 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 84' ' ' GLN . . . . . . . . . . . . . 6.7 tp-100 -69.15 -44.24 72.69 Favored 'General case' 0 C--N 1.326 -0.423 0 CA-C-N 115.964 -0.562 . . . . 0.0 110.091 179.154 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 85' ' ' LEU . . . . . 0.527 ' O ' ' HG3' ' A' ' 89' ' ' LYS . 2.4 tm? -62.64 -43.76 97.98 Favored 'General case' 0 C--N 1.326 -0.438 0 CA-C-N 115.849 -0.614 . . . . 0.0 109.933 178.953 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 86' ' ' ASN . . . . . . . . . . . . . 77.4 m-20 -64.18 -26.94 68.74 Favored 'General case' 0 C--N 1.332 -0.182 0 CA-C-N 116.116 -0.493 . . . . 0.0 111.259 177.564 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 87' ' ' SER . . . . . . . . . . . . . 60.5 m -64.92 -47.27 78.3 Favored 'General case' 0 C--N 1.33 -0.263 0 N-CA-C 109.896 -0.409 . . . . 0.0 109.896 176.403 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 88' ' ' TYR . . . . . . . . . . . . . 44.2 m-85 -58.7 -45.92 88.46 Favored 'General case' 0 C--O 1.232 0.168 0 CA-C-N 116.252 -0.431 . . . . 0.0 110.215 177.298 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 89' ' ' LYS . . . . . 0.527 ' HG3' ' O ' ' A' ' 85' ' ' LEU . 46.5 mtpt -58.71 -44.05 90.27 Favored 'General case' 0 C--N 1.332 -0.19 0 CA-C-N 115.747 -0.661 . . . . 0.0 110.549 179.85 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 90' ' ' ASN . . . . . . . . . . . . . 8.8 t30 -63.66 -39.41 94.26 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 116.196 -0.456 . . . . 0.0 110.832 -179.532 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 91' ' ' TYR . . . . . . . . . . . . . 18.4 m-85 -60.59 -48.65 80.83 Favored 'General case' 0 C--N 1.331 -0.215 0 CA-C-N 116.615 -0.266 . . . . 0.0 111.054 179.895 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 92' ' ' CYS . . . . . 0.619 ' HA ' ' HB2' ' A' ' 96' ' ' LEU . 24.2 p -76.42 -27.47 56.28 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-O 120.711 0.291 . . . . 0.0 111.748 -176.465 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 93' ' ' ARG . . . . . . . . . . . . . 56.0 ttp180 -81.84 -42.9 18.98 Favored 'General case' 0 C--N 1.327 -0.406 0 CA-C-O 120.772 0.32 . . . . 0.0 111.833 -175.914 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 94' ' ' ASN . . . . . . . . . . . . . 13.5 m120 -95.46 -57.27 2.44 Favored 'General case' 0 C--N 1.325 -0.485 0 CA-C-N 116.305 -0.407 . . . . 0.0 111.909 -173.644 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 95' ' ' HIS . . . . . . . . . . . . . 36.6 m80 -78.59 -48.58 14.88 Favored 'General case' 0 C--N 1.327 -0.4 0 CA-C-O 120.849 0.357 . . . . 0.0 111.249 -174.355 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 96' ' ' LEU . . . . . 0.619 ' HB2' ' HA ' ' A' ' 92' ' ' CYS . 66.3 mt -88.82 21.98 2.85 Favored 'General case' 0 C--N 1.324 -0.536 0 CA-C-N 116.342 -0.39 . . . . 0.0 110.253 -179.504 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 97' ' ' SER . . . . . 0.546 ' N ' ' HD2' ' A' ' 98' ' ' PRO . 4.3 t -55.3 -48.26 96.64 Favored Pre-proline 0 CA--C 1.541 0.607 0 CA-C-N 115.881 -0.599 . . . . 0.0 111.477 -178.822 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 98' ' ' PRO . . . . . 0.546 ' HD2' ' N ' ' A' ' 97' ' ' SER . 17.3 Cg_endo -58.97 -33.0 98.57 Favored 'Trans proline' 0 C--N 1.358 1.054 0 C-N-CA 121.988 1.792 . . . . 0.0 112.264 176.314 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 99' ' ' LEU . . . . . 0.545 HD13 HD11 ' A' ' 115' ' ' ILE . 2.5 mp -78.51 -33.57 47.96 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 116.512 -0.313 . . . . 0.0 111.015 -179.129 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 100' ' ' TYR . . . . . . . . . . . . . 19.1 t80 -59.27 -28.07 66.4 Favored 'General case' 0 C--N 1.327 -0.374 0 CA-C-N 115.972 -0.558 . . . . 0.0 111.295 -176.325 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 101' ' ' MET . . . . . . . . . . . . . 27.0 ptt? -95.23 -0.68 52.82 Favored 'General case' 0 C--N 1.327 -0.374 0 CA-C-N 116.161 -0.472 . . . . 0.0 111.379 -179.329 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 102' ' ' LYS . . . . . 0.543 ' HG3' ' O ' ' A' ' 98' ' ' PRO . 91.5 mttt -101.69 162.6 12.78 Favored 'General case' 0 C--N 1.326 -0.45 0 CA-C-O 121.004 0.431 . . . . 0.0 110.562 -178.838 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 103' ' ' SER . . . . . 0.608 ' HA ' ' HA ' ' A' ' 63' ' ' SER . 39.4 t -91.27 158.72 16.41 Favored 'General case' 0 C--N 1.319 -0.722 0 N-CA-C 108.969 -0.752 . . . . 0.0 108.969 172.68 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 104' ' ' LEU . . . . . . . . . . . . . 93.5 mt -56.83 -35.26 68.6 Favored 'General case' 0 C--N 1.325 -0.465 0 CA-C-O 120.824 0.345 . . . . 0.0 111.269 -177.877 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 105' ' ' SER . . . . . . . . . . . . . 25.5 p -77.41 -16.58 58.76 Favored 'General case' 0 C--N 1.324 -0.513 0 CA-C-O 120.968 0.413 . . . . 0.0 111.144 -178.994 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 106' ' ' GLU . . . . . 0.552 ' OE1' ' HB3' ' A' ' 103' ' ' SER . 1.0 OUTLIER -97.08 2.73 51.64 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.119 -0.491 . . . . 0.0 110.875 -178.945 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' A' A ' 107' ' ' ILE . . . . . 0.504 HD11 ' HB2' ' A' ' 64' ' ' PHE . 86.2 mt -96.28 128.92 47.05 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.538 0 CA-C-O 121.101 0.477 . . . . 0.0 110.658 179.749 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 108' ' ' LEU . . . . . 0.708 ' HB2' ' HB2' ' A' ' 111' ' ' ASP . 2.5 mm? -103.48 144.44 28.65 Favored Pre-proline 0 C--N 1.32 -0.682 0 CA-C-N 115.574 -0.739 . . . . 0.0 110.157 -177.937 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 109' ' ' PRO . . . . . . . . . . . . . 32.0 Cg_exo -59.35 -40.73 65.19 Favored 'Trans proline' 0 C--O 1.233 0.26 0 C-N-CA 122.429 2.086 . . . . 0.0 112.035 177.365 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 110' ' ' ALA . . . . . . . . . . . . . . . -75.92 -19.83 58.48 Favored 'General case' 0 C--N 1.332 -0.188 0 CA-C-N 116.295 -0.412 . . . . 0.0 110.794 179.247 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 111' ' ' ASP . . . . . 0.708 ' HB2' ' HB2' ' A' ' 108' ' ' LEU . 33.8 t70 -71.06 -40.83 71.42 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-O 121.299 0.571 . . . . 0.0 109.753 178.769 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 112' ' ' ILE . . . . . 0.52 HG12 HD21 ' A' ' 99' ' ' LEU . 47.9 mt -66.12 -39.34 84.14 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.41 0 CA-C-N 115.71 -0.677 . . . . 0.0 109.759 174.859 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 113' ' ' GLN . . . . . . . . . . . . . 29.6 tp60 -60.83 -31.11 70.54 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 115.388 -0.824 . . . . 0.0 110.095 176.611 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 114' ' ' SER . . . . . . . . . . . . . 22.9 t -67.82 -40.64 83.78 Favored 'General case' 0 C--N 1.33 -0.246 0 CA-C-N 115.866 -0.606 . . . . 0.0 110.29 178.35 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 115' ' ' ILE . . . . . 0.545 HD11 HD13 ' A' ' 99' ' ' LEU . 74.8 mt -59.5 -39.12 78.47 Favored 'Isoleucine or valine' 0 C--O 1.233 0.231 0 CA-C-O 121.012 0.434 . . . . 0.0 110.565 177.105 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 116' ' ' ILE . . . . . . . . . . . . . 47.6 mm -66.44 -31.81 55.24 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.455 0 CA-C-N 115.866 -0.606 . . . . 0.0 110.594 178.143 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 117' ' ' ASN . . . . . . . . . . . . . 8.2 t30 -70.09 -38.08 75.57 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-O 121.069 0.462 . . . . 0.0 110.7 178.269 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 118' ' ' GLU . . . . . . . . . . . . . 39.4 mm-40 -80.14 -30.27 38.97 Favored 'General case' 0 C--N 1.325 -0.494 0 CA-C-N 116.092 -0.503 . . . . 0.0 111.219 -177.677 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 119' ' ' THR . . . . . . . . . . . . . 51.4 m -79.67 110.87 15.42 Favored 'General case' 0 C--N 1.322 -0.591 0 CA-C-O 121.271 0.558 . . . . 0.0 109.851 176.117 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 120' ' ' LYS . . . . . . . . . . . . . 47.4 mttp -111.28 76.83 1.0 Allowed 'General case' 0 C--N 1.317 -0.806 0 CA-C-O 121.46 0.648 . . . . 0.0 110.268 -177.182 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 121' ' ' LEU . . . . . . . . . . . . . 97.9 mt -129.3 -174.88 3.4 Favored 'General case' 0 C--N 1.323 -0.576 0 CA-C-N 114.996 -1.002 . . . . 0.0 109.86 -178.666 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 122' ' ' ALA . . . . . . . . . . . . . . . -62.35 158.2 18.04 Favored 'General case' 0 C--N 1.327 -0.388 0 CA-C-O 120.997 0.427 . . . . 0.0 111.925 -179.001 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 123' ' ' LYS . . . . . . . . . . . . . 93.7 mttt -54.29 -49.6 69.27 Favored 'General case' 0 N--CA 1.464 0.252 0 CA-C-N 115.62 -0.718 . . . . 0.0 111.418 -177.823 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 124' ' ' ASN . . . . . . . . . . . . . 27.8 t-20 -55.13 -40.8 70.96 Favored 'General case' 0 C--N 1.331 -0.234 0 CA-C-N 115.607 -0.724 . . . . 0.0 111.265 -179.038 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 125' ' ' THR . . . . . 0.494 ' O ' HG13 ' A' ' 129' ' ' ILE . 6.5 m -69.13 -44.26 72.71 Favored 'General case' 0 C--N 1.327 -0.393 0 CA-C-N 116.075 -0.512 . . . . 0.0 110.717 -178.447 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 126' ' ' LEU . . . . . . . . . . . . . 87.2 mt -60.26 -45.42 93.36 Favored 'General case' 0 C--O 1.234 0.278 0 CA-C-N 116.26 -0.427 . . . . 0.0 110.907 -179.184 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 127' ' ' LYS . . . . . 0.785 ' HG2' HG13 ' A' ' 156' ' ' ILE . 96.5 mttt -68.28 -36.81 79.95 Favored 'General case' 0 C--N 1.326 -0.44 0 CA-C-N 116.062 -0.517 . . . . 0.0 110.707 179.725 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 128' ' ' ALA . . . . . . . . . . . . . . . -60.34 -41.32 93.35 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.419 -0.355 . . . . 0.0 110.912 179.196 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 129' ' ' ILE . . . . . 0.494 HG13 ' O ' ' A' ' 125' ' ' THR . 80.2 mt -59.87 -49.88 82.21 Favored 'Isoleucine or valine' 0 C--O 1.235 0.301 0 CA-C-N 116.15 -0.477 . . . . 0.0 110.239 177.485 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 130' ' ' ARG . . . . . 0.584 ' NH1' ' HA ' ' A' ' 152' ' ' ASP . 23.3 ttp85 -63.67 -46.11 87.06 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 115.845 -0.616 . . . . 0.0 110.606 -179.216 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 131' ' ' ASN . . . . . . . . . . . . . 92.5 m-20 -58.57 -40.17 82.35 Favored 'General case' 0 N--CA 1.464 0.242 0 CA-C-N 116.302 -0.408 . . . . 0.0 111.086 179.818 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 132' ' ' THR . . . . . 0.424 ' O ' HG13 ' A' ' 136' ' ' ILE . 53.8 m -61.8 -46.61 88.79 Favored 'General case' 0 C--N 1.33 -0.248 0 CA-C-O 120.813 0.34 . . . . 0.0 110.42 177.214 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 133' ' ' ALA . . . . . . . . . . . . . . . -61.15 -44.4 97.38 Favored 'General case' 0 C--N 1.331 -0.233 0 CA-C-N 116.012 -0.54 . . . . 0.0 110.64 178.938 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 134' ' ' SER . . . . . 0.473 ' O ' ' HG3' ' A' ' 138' ' ' ARG . 74.3 m -54.45 -45.9 73.2 Favored 'General case' 0 C--N 1.331 -0.227 0 CA-C-N 116.236 -0.438 . . . . 0.0 111.197 178.665 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 135' ' ' GLN . . . . . . . . . . . . . 75.2 mt-30 -64.9 -38.55 91.35 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-O 120.603 0.24 . . . . 0.0 110.969 -178.855 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 136' ' ' ILE . . . . . 0.424 HG13 ' O ' ' A' ' 132' ' ' THR . 72.4 mt -63.91 -47.01 92.51 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.269 0 CA-C-N 116.485 -0.325 . . . . 0.0 110.704 177.813 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 137' ' ' PHE . . . . . 0.541 ' O ' HG13 ' A' ' 141' ' ' ILE . 46.6 m-85 -63.03 -36.83 84.87 Favored 'General case' 0 C--N 1.331 -0.214 0 CA-C-N 116.303 -0.408 . . . . 0.0 111.004 178.2 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 138' ' ' ARG . . . . . 0.497 ' O ' ' HG3' ' A' ' 142' ' ' GLU . 91.4 mtt180 -61.5 -41.89 97.96 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.742 -0.208 . . . . 0.0 110.819 178.472 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 139' ' ' LEU . . . . . . . . . . . . . 58.2 tp -59.4 -43.02 93.03 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-O 121.147 0.498 . . . . 0.0 110.125 175.213 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 140' ' ' ALA . . . . . . . . . . . . . . . -62.22 -43.64 98.37 Favored 'General case' 0 C--N 1.324 -0.505 0 CA-C-N 115.885 -0.598 . . . . 0.0 110.527 177.201 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 141' ' ' ILE . . . . . 0.541 HG13 ' O ' ' A' ' 137' ' ' PHE . 75.0 mt -61.61 -34.0 59.88 Favored 'Isoleucine or valine' 0 CA--C 1.531 0.238 0 CA-C-N 116.466 -0.334 . . . . 0.0 111.26 176.225 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 142' ' ' GLU . . . . . 0.497 ' HG3' ' O ' ' A' ' 138' ' ' ARG . 43.6 mt-10 -60.37 -41.31 93.48 Favored 'General case' 0 C--N 1.332 -0.17 0 CA-C-O 120.874 0.369 . . . . 0.0 110.692 177.907 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 143' ' ' ASN . . . . . 0.452 HD22 ' N ' ' A' ' 143' ' ' ASN . 0.9 OUTLIER -88.75 -1.58 58.15 Favored 'General case' 0 C--N 1.327 -0.403 0 CA-C-O 121.015 0.436 . . . . 0.0 110.189 176.754 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' A' A ' 144' ' ' ARG . . . . . . . . . . . . . 69.2 mtt180 65.02 27.78 12.54 Favored 'General case' 0 N--CA 1.462 0.155 0 CA-C-N 115.228 -0.897 . . . . 0.0 111.668 177.515 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 145' ' ' ALA . . . . . . . . . . . . . . . -66.62 -43.89 83.51 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 115.685 -0.689 . . . . 0.0 109.508 174.859 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 146' ' ' ILE . . . . . . . . . . . . . 20.5 tt -120.75 151.73 23.72 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.477 0 N-CA-C 108.586 -0.894 . . . . 0.0 108.586 172.632 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 147' ' ' ASP . . . . . . . . . . . . . 39.0 t70 -96.66 -5.86 37.92 Favored 'General case' 0 C--N 1.322 -0.617 0 N-CA-C 112.326 0.491 . . . . 0.0 112.326 -169.723 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 148' ' ' PHE . . . . . . . . . . . . . 47.6 p90 -154.63 171.19 19.89 Favored 'General case' 0 C--N 1.323 -0.558 0 O-C-N 122.18 -0.325 . . . . 0.0 110.783 -173.934 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 149' ' ' ASN . . . . . 0.415 ' HA ' ' HD2' ' A' ' 150' ' ' PRO . 42.9 t-20 -118.51 95.39 48.73 Favored Pre-proline 0 C--N 1.327 -0.393 0 CA-C-N 116.292 -0.413 . . . . 0.0 110.299 -179.011 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 150' ' ' PRO . . . . . 0.415 ' HD2' ' HA ' ' A' ' 149' ' ' ASN . 39.2 Cg_endo -66.61 -22.33 51.02 Favored 'Trans proline' 0 C--N 1.341 0.178 0 C-N-CA 122.817 2.345 . . . . 0.0 112.166 -178.433 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 151' ' ' ALA . . . . . . . . . . . . . . . -70.52 -28.91 65.31 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.227 -0.442 . . . . 0.0 110.564 -179.51 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 152' ' ' ASP . . . . . 0.584 ' HA ' ' NH1' ' A' ' 130' ' ' ARG . 85.6 m-20 -80.01 -10.84 59.8 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-O 121.2 0.524 . . . . 0.0 110.621 179.226 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 153' ' ' TYR . . . . . . . . . . . . . 60.3 t80 -88.9 -16.98 30.55 Favored 'General case' 0 C--N 1.321 -0.661 0 CA-C-N 115.572 -0.74 . . . . 0.0 109.216 174.566 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 154' ' ' VAL . . . . . . . . . . . . . 90.5 t -73.61 130.8 35.67 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.291 0 CA-C-N 115.656 -0.702 . . . . 0.0 109.997 177.535 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 155' ' ' ARG . . . . . . . . . . . . . 71.4 ttt180 -110.7 142.49 42.55 Favored 'General case' 0 C--N 1.318 -0.766 0 N-CA-C 109.523 -0.547 . . . . 0.0 109.523 178.81 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 156' ' ' ILE . . . . . 0.785 HG13 ' HG2' ' A' ' 127' ' ' LYS . 42.3 mm -87.86 116.0 64.81 Favored Pre-proline 0 C--N 1.32 -0.694 0 N-CA-C 109.476 -0.564 . . . . 0.0 109.476 -179.664 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 157' ' ' PRO . . . . . 0.435 ' HD3' ' HA ' ' A' ' 156' ' ' ILE . 24.0 Cg_exo . . . . . 0 N--CA 1.463 -0.269 0 C-N-CA 122.48 2.12 . . . . 0.0 112.144 -176.561 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 63' ' ' SER . . . . . . . . . . . . . 22.9 t . . . . . 0 N--CA 1.447 -0.609 0 N-CA-C 109.001 -0.741 . . . . 0.0 109.001 . . . . . . . . . 0 0 . 1 . 002 nuclear nobuild core ' A' A ' 64' ' ' PHE . . . . . 0.433 ' HB2' HD11 ' A' ' 107' ' ' ILE . 73.8 t80 -66.18 -32.53 74.03 Favored 'General case' 0 C--N 1.328 -0.332 0 N-CA-C 109.149 -0.686 . . . . 0.0 109.149 177.386 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 65' ' ' GLY . . . . . . . . . . . . . . . -59.76 -40.21 96.32 Favored Glycine 0 N--CA 1.448 -0.508 0 CA-C-N 115.775 -0.648 . . . . 0.0 111.666 175.427 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 66' ' ' ASP . . . . . 0.424 ' O ' ' HB2' ' A' ' 70' ' ' LYS . 9.1 m-20 -61.96 -45.06 95.3 Favored 'General case' 0 CA--C 1.519 -0.239 0 CA-C-O 120.83 0.347 . . . . 0.0 110.628 178.682 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 67' ' ' TRP . . . . . 0.517 ' HA ' ' HB2' ' A' ' 70' ' ' LYS . 90.2 m95 -78.13 -31.92 50.14 Favored 'General case' 0 C--N 1.327 -0.383 0 CA-C-N 116.275 -0.42 . . . . 0.0 111.861 -176.856 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 68' ' ' ALA . . . . . 0.557 ' HB1' ' HB3' ' A' ' 92' ' ' CYS . . . -63.08 -44.2 96.42 Favored 'General case' 0 C--N 1.325 -0.474 0 N-CA-C 109.687 -0.486 . . . . 0.0 109.687 174.955 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 69' ' ' GLU . . . . . . . . . . . . . 3.7 tp10 -68.56 -38.12 80.49 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 115.639 -0.71 . . . . 0.0 109.885 174.9 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 70' ' ' LYS . . . . . 0.517 ' HB2' ' HA ' ' A' ' 67' ' ' TRP . 1.7 tppt? -57.51 -45.52 84.85 Favored 'General case' 0 C--N 1.331 -0.201 0 CA-C-N 115.86 -0.609 . . . . 0.0 110.343 179.303 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 71' ' ' PHE . . . . . . . . . . . . . 70.1 t80 -62.5 -44.45 96.34 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 115.834 -0.621 . . . . 0.0 110.593 179.651 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 72' ' ' LEU . . . . . 0.529 HD21 ' HA ' ' A' ' 89' ' ' LYS . 8.5 mp -60.33 -48.86 79.92 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.076 -0.511 . . . . 0.0 110.56 177.226 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 73' ' ' LYS . . . . . . . . . . . . . 59.1 mtpt -59.77 -38.52 82.05 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 116.284 -0.416 . . . . 0.0 110.943 178.335 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 74' ' ' SER . . . . . 0.428 ' O ' ' HB2' ' A' ' 78' ' ' ASP . 58.5 m -61.61 -45.03 95.83 Favored 'General case' 0 C--N 1.327 -0.371 0 CA-C-N 116.431 -0.349 . . . . 0.0 110.947 179.36 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 75' ' ' LYS . . . . . . . . . . . . . 72.3 mmtt -71.29 -42.93 68.09 Favored 'General case' 0 C--N 1.327 -0.377 0 CA-C-O 120.757 0.313 . . . . 0.0 111.071 178.774 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 76' ' ' GLU . . . . . . . . . . . . . 9.4 tp10 -57.48 -46.08 84.1 Favored 'General case' 0 C--N 1.327 -0.383 0 CA-C-N 115.825 -0.625 . . . . 0.0 110.513 179.205 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 77' ' ' ALA . . . . . . . . . . . . . . . -79.25 -21.97 45.4 Favored 'General case' 0 C--N 1.327 -0.405 0 CA-C-N 116.022 -0.535 . . . . 0.0 111.497 -178.582 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 78' ' ' ASP . . . . . 0.428 ' HB2' ' O ' ' A' ' 74' ' ' SER . 24.3 t70 -68.8 -54.5 15.49 Favored 'General case' 0 C--N 1.327 -0.378 0 CA-C-O 121.051 0.453 . . . . 0.0 110.28 179.907 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 79' ' ' GLY . . . . . . . . . . . . . . . 137.61 65.22 0.05 OUTLIER Glycine 0 N--CA 1.445 -0.76 0 CA-C-N 115.688 -0.687 . . . . 0.0 112.194 179.482 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 80' ' ' VAL . . . . . . . . . . . . . 35.0 m -119.0 160.01 19.17 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.523 0 N-CA-C 109.882 -0.414 . . . . 0.0 109.882 176.03 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 81' ' ' SER . . . . . . . . . . . . . 8.7 t -72.35 159.56 33.81 Favored 'General case' 0 C--N 1.322 -0.591 0 N-CA-C 110.08 -0.341 . . . . 0.0 110.08 179.693 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 82' ' ' VAL . . . . . . . . . . . . . 48.2 t -59.91 -46.07 94.37 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.322 0 CA-C-O 120.785 0.326 . . . . 0.0 110.699 -177.793 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 83' ' ' SER . . . . . . . . . . . . . 52.7 p -57.09 -40.83 77.72 Favored 'General case' 0 C--N 1.326 -0.414 0 CA-C-N 115.961 -0.563 . . . . 0.0 110.591 178.252 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 84' ' ' GLN . . . . . . . . . . . . . 6.6 tp-100 -65.5 -45.72 82.51 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 115.644 -0.707 . . . . 0.0 110.336 -179.382 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 85' ' ' LEU . . . . . 0.441 HD21 ' O ' ' A' ' 72' ' ' LEU . 1.3 tm? -64.28 -42.36 96.47 Favored 'General case' 0 C--N 1.325 -0.458 0 CA-C-N 116.059 -0.519 . . . . 0.0 109.618 178.767 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 86' ' ' ASN . . . . . . . . . . . . . 5.8 m-20 -66.82 -21.83 66.02 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.259 -0.428 . . . . 0.0 111.426 178.407 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 87' ' ' SER . . . . . . . . . . . . . 50.5 m -67.08 -48.54 67.91 Favored 'General case' 0 C--N 1.326 -0.445 0 N-CA-C 109.466 -0.568 . . . . 0.0 109.466 174.222 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 88' ' ' TYR . . . . . 0.418 ' HA ' ' CD2' ' A' ' 91' ' ' TYR . 47.8 m-85 -66.06 -35.78 81.46 Favored 'General case' 0 C--N 1.334 -0.107 0 CA-C-O 121.324 0.583 . . . . 0.0 109.832 176.689 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 89' ' ' LYS . . . . . 0.529 ' HA ' HD21 ' A' ' 72' ' ' LEU . 34.5 ttmt -60.14 -43.68 95.51 Favored 'General case' 0 C--N 1.325 -0.492 0 CA-C-N 115.208 -0.906 . . . . 0.0 110.389 177.862 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 90' ' ' ASN . . . . . 0.438 ' O ' ' HB2' ' A' ' 94' ' ' ASN . 36.1 t30 -63.46 -33.39 75.46 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 115.929 -0.578 . . . . 0.0 110.749 177.829 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 91' ' ' TYR . . . . . 0.418 ' CD2' ' HA ' ' A' ' 88' ' ' TYR . 23.2 m-85 -69.88 -59.76 2.72 Favored 'General case' 0 C--N 1.324 -0.52 0 CA-C-N 116.462 -0.335 . . . . 0.0 110.36 177.395 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 92' ' ' CYS . . . . . 0.557 ' HB3' ' HB1' ' A' ' 68' ' ' ALA . 82.0 m -66.53 -47.68 72.14 Favored 'General case' 0 C--N 1.326 -0.423 0 N-CA-C 112.778 0.658 . . . . 0.0 112.778 -173.086 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 93' ' ' ARG . . . . . 0.417 HH11 ' HD3' ' A' ' 93' ' ' ARG . 10.4 mmm180 -77.17 -49.12 15.89 Favored 'General case' 0 C--N 1.326 -0.449 0 N-CA-C 111.966 0.358 . . . . 0.0 111.966 -173.669 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 94' ' ' ASN . . . . . 0.438 ' HB2' ' O ' ' A' ' 90' ' ' ASN . 2.6 m-20 -84.8 -50.73 7.32 Favored 'General case' 0 C--N 1.325 -0.496 0 CA-C-N 116.167 -0.47 . . . . 0.0 111.819 -172.209 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 95' ' ' HIS . . . . . . . . . . . . . 78.5 m80 -86.24 -40.93 15.05 Favored 'General case' 0 C--N 1.325 -0.497 0 N-CA-C 112.017 0.377 . . . . 0.0 112.017 -172.391 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 96' ' ' LEU . . . . . 0.518 HD12 ' HA ' ' A' ' 92' ' ' CYS . 96.0 mt -89.17 22.26 2.89 Favored 'General case' 0 C--N 1.323 -0.586 0 CA-C-O 120.956 0.407 . . . . 0.0 110.699 -179.765 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 97' ' ' SER . . . . . 0.488 ' OG ' ' HD3' ' A' ' 98' ' ' PRO . 3.1 p -57.36 -41.49 91.11 Favored Pre-proline 0 CA--C 1.545 0.771 0 N-CA-C 113.188 0.81 . . . . 0.0 113.188 -179.183 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 98' ' ' PRO . . . . . 0.488 ' HD3' ' OG ' ' A' ' 97' ' ' SER . 31.5 Cg_exo -58.46 -35.74 98.32 Favored 'Trans proline' 0 C--N 1.363 1.33 0 C-N-CA 121.631 1.554 . . . . 0.0 112.109 176.965 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 99' ' ' LEU . . . . . . . . . . . . . 49.2 mt -84.63 -30.07 25.22 Favored 'General case' 0 C--N 1.326 -0.45 0 CA-C-N 116.263 -0.426 . . . . 0.0 110.657 -176.85 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 100' ' ' TYR . . . . . . . . . . . . . 17.4 t80 -57.82 -26.69 62.34 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 115.811 -0.631 . . . . 0.0 111.297 -176.495 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 101' ' ' MET . . . . . . . . . . . . . 26.8 ptt? -97.81 1.92 48.81 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.215 -0.448 . . . . 0.0 111.44 -178.115 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 102' ' ' LYS . . . . . . . . . . . . . 95.5 mttt -109.23 149.29 29.62 Favored 'General case' 0 C--N 1.326 -0.435 0 CA-C-O 120.732 0.301 . . . . 0.0 110.527 -178.285 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 103' ' ' SER . . . . . 0.422 ' O ' HG13 ' A' ' 107' ' ' ILE . 62.5 m -70.04 146.95 50.62 Favored 'General case' 0 C--N 1.323 -0.579 0 CA-C-N 116.226 -0.443 . . . . 0.0 110.238 178.867 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 104' ' ' LEU . . . . . . . . . . . . . 26.5 tp -55.28 -33.6 63.36 Favored 'General case' 0 C--N 1.326 -0.419 0 CA-C-N 115.816 -0.629 . . . . 0.0 111.861 -177.272 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 105' ' ' SER . . . . . . . . . . . . . 2.9 p -81.74 -16.59 50.63 Favored 'General case' 0 C--N 1.323 -0.571 0 N-CA-C 112.769 0.655 . . . . 0.0 112.769 -173.756 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 106' ' ' GLU . . . . . . . . . . . . . 20.3 pt-20 -108.21 9.32 28.11 Favored 'General case' 0 C--N 1.329 -0.325 0 C-N-CA 120.798 -0.361 . . . . 0.0 111.884 -172.388 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 107' ' ' ILE . . . . . 0.433 HD11 ' HB2' ' A' ' 64' ' ' PHE . 69.1 mt -88.03 102.68 12.86 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.5 0 CA-C-O 121.152 0.501 . . . . 0.0 110.707 -179.873 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 108' ' ' LEU . . . . . 0.626 ' H ' HD23 ' A' ' 108' ' ' LEU . 2.5 pt? -75.4 143.25 75.9 Favored Pre-proline 0 C--N 1.324 -0.519 0 CA-C-N 115.86 -0.609 . . . . 0.0 110.391 177.104 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 109' ' ' PRO . . . . . 0.456 ' HG3' ' HB3' ' A' ' 150' ' ' PRO . 32.5 Cg_exo -57.13 -31.41 90.33 Favored 'Trans proline' 0 C--N 1.347 0.479 0 C-N-CA 123.053 2.502 . . . . 0.0 112.347 -177.714 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 110' ' ' ALA . . . . . . . . . . . . . . . -61.55 -35.42 77.73 Favored 'General case' 0 C--N 1.327 -0.375 0 CA-C-N 115.677 -0.692 . . . . 0.0 111.375 -178.859 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 111' ' ' ASP . . . . . . . . . . . . . 26.0 t70 -72.06 -37.89 69.56 Favored 'General case' 0 C--O 1.234 0.289 0 CA-C-O 121.031 0.443 . . . . 0.0 110.338 -176.357 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 112' ' ' ILE . . . . . 0.442 ' HB ' HG21 ' A' ' 154' ' ' VAL . 34.9 mt -66.36 -38.39 81.71 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.363 0 CA-C-N 115.928 -0.578 . . . . 0.0 109.444 175.678 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 113' ' ' GLN . . . . . . . . . . . . . 27.3 tp60 -62.19 -37.46 85.36 Favored 'General case' 0 C--N 1.331 -0.216 0 CA-C-N 115.472 -0.786 . . . . 0.0 110.032 177.002 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 114' ' ' SER . . . . . . . . . . . . . 33.8 m -59.72 -40.67 88.8 Favored 'General case' 0 C--N 1.334 -0.09 0 CA-C-N 116.155 -0.475 . . . . 0.0 110.786 177.031 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 115' ' ' ILE . . . . . . . . . . . . . 69.4 mt -61.75 -47.89 91.19 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.303 0 CA-C-N 116.252 -0.431 . . . . 0.0 110.478 178.934 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 116' ' ' ILE . . . . . . . . . . . . . 38.9 mm -70.68 -18.18 20.89 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.31 0 CA-C-O 121.279 0.562 . . . . 0.0 110.653 -179.365 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 117' ' ' ASN . . . . . . . . . . . . . 1.9 m-20 -77.43 -51.29 11.03 Favored 'General case' 0 C--N 1.326 -0.421 0 CA-C-N 116.006 -0.543 . . . . 0.0 111.253 178.646 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 118' ' ' GLU . . . . . . . . . . . . . 25.3 mt-10 -82.93 -30.23 28.54 Favored 'General case' 0 C--O 1.236 0.346 0 N-CA-C 111.957 0.355 . . . . 0.0 111.957 -175.657 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 119' ' ' THR . . . . . . . . . . . . . 62.0 m -70.26 111.55 5.95 Favored 'General case' 0 C--N 1.325 -0.459 0 N-CA-C 109.474 -0.565 . . . . 0.0 109.474 177.031 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 120' ' ' LYS . . . . . . . . . . . . . 35.2 mtmm -111.91 78.29 1.11 Allowed 'General case' 0 C--N 1.323 -0.585 0 CA-C-O 121.658 0.742 . . . . 0.0 111.027 -176.68 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 121' ' ' LEU . . . . . 0.412 ' H ' HD21 ' A' ' 126' ' ' LEU . 4.6 mm? -108.79 -174.84 2.61 Favored 'General case' 0 C--N 1.318 -0.796 0 CA-C-N 114.357 -1.292 . . . . 0.0 108.402 172.949 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 122' ' ' ALA . . . . . . . . . . . . . . . -56.04 134.03 52.24 Favored 'General case' 0 C--N 1.324 -0.523 0 N-CA-C 109.643 -0.503 . . . . 0.0 109.643 172.164 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 123' ' ' LYS . . . . . 0.53 ' O ' ' HG3' ' A' ' 127' ' ' LYS . 35.1 mtmm -54.07 -35.53 62.16 Favored 'General case' 0 C--N 1.327 -0.403 0 CA-C-N 116.482 -0.326 . . . . 0.0 111.392 -178.644 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 124' ' ' ASN . . . . . . . . . . . . . 36.7 t30 -57.32 -43.39 83.27 Favored 'General case' 0 C--N 1.327 -0.407 0 CA-C-O 121.115 0.484 . . . . 0.0 110.455 175.961 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 125' ' ' THR . . . . . 0.47 ' O ' HG13 ' A' ' 129' ' ' ILE . 33.4 m -73.32 -34.75 65.85 Favored 'General case' 0 C--N 1.326 -0.432 0 CA-C-N 115.852 -0.613 . . . . 0.0 110.764 179.58 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 126' ' ' LEU . . . . . 0.412 HD21 ' H ' ' A' ' 121' ' ' LEU . 92.2 mt -60.96 -42.17 97.74 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-O 120.981 0.42 . . . . 0.0 110.348 177.061 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 127' ' ' LYS . . . . . 0.53 ' HG3' ' O ' ' A' ' 123' ' ' LYS . 44.7 mtpt -60.12 -45.9 91.45 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 115.703 -0.68 . . . . 0.0 109.996 175.16 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 128' ' ' ALA . . . . . . . . . . . . . . . -58.04 -45.86 86.27 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 115.719 -0.673 . . . . 0.0 111.355 -179.421 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 129' ' ' ILE . . . . . 0.47 HG13 ' O ' ' A' ' 125' ' ' THR . 71.9 mt -59.02 -48.32 87.05 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.228 0 CA-C-O 121.122 0.487 . . . . 0.0 110.439 178.155 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 130' ' ' ARG . . . . . 0.428 ' HD3' ' O ' ' A' ' 151' ' ' ALA . 1.5 tmm_? -62.81 -49.56 74.47 Favored 'General case' 0 C--N 1.326 -0.431 0 CA-C-N 115.672 -0.694 . . . . 0.0 110.333 -178.851 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 131' ' ' ASN . . . . . . . . . . . . . 95.9 m-20 -62.55 -39.25 93.03 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-N 116.165 -0.47 . . . . 0.0 111.195 -176.945 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 132' ' ' THR . . . . . 0.496 ' O ' HG13 ' A' ' 136' ' ' ILE . 56.5 m -59.5 -42.16 91.53 Favored 'General case' 0 C--N 1.327 -0.407 0 CA-C-O 120.796 0.331 . . . . 0.0 110.188 176.941 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 133' ' ' ALA . . . . . . . . . . . . . . . -65.37 -44.09 88.69 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 116.162 -0.472 . . . . 0.0 111.207 179.613 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 134' ' ' SER . . . . . 0.457 ' HA ' ' HB3' ' A' ' 151' ' ' ALA . 10.9 p -64.88 -30.31 71.3 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-O 120.651 0.262 . . . . 0.0 111.123 179.916 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 135' ' ' GLN . . . . . 0.541 ' HA ' ' HG2' ' A' ' 138' ' ' ARG . 2.1 mp0 -71.79 -34.96 69.84 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.423 -0.353 . . . . 0.0 110.515 175.813 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 136' ' ' ILE . . . . . 0.496 HG13 ' O ' ' A' ' 132' ' ' THR . 77.8 mt -63.11 -47.36 92.87 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.459 0 CA-C-N 116.128 -0.487 . . . . 0.0 110.492 175.737 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 137' ' ' PHE . . . . . 0.429 ' O ' HG13 ' A' ' 141' ' ' ILE . 48.7 m-85 -64.81 -38.36 90.72 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 116.18 -0.464 . . . . 0.0 111.712 -179.911 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 138' ' ' ARG . . . . . 0.541 ' HG2' ' HA ' ' A' ' 135' ' ' GLN . 9.4 ptm180 -73.73 -25.87 60.4 Favored 'General case' 0 C--N 1.329 -0.307 0 C-N-CA 120.622 -0.431 . . . . 0.0 110.377 -179.393 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 139' ' ' LEU . . . . . . . . . . . . . 55.9 tp -67.51 -32.56 73.45 Favored 'General case' 0 C--N 1.332 -0.153 0 CA-C-O 121.58 0.705 . . . . 0.0 109.391 173.712 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 140' ' ' ALA . . . . . 0.415 ' HB1' ' HB3' ' A' ' 145' ' ' ALA . . . -72.55 -38.33 68.01 Favored 'General case' 0 C--N 1.322 -0.61 0 CA-C-N 115.46 -0.791 . . . . 0.0 110.452 175.408 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 141' ' ' ILE . . . . . 0.429 HG13 ' O ' ' A' ' 137' ' ' PHE . 75.5 mt -56.93 -47.69 82.78 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.286 0 CA-C-N 116.118 -0.492 . . . . 0.0 111.455 177.335 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 142' ' ' GLU . . . . . . . . . . . . . 11.3 pt-20 -70.44 -6.71 37.79 Favored 'General case' 0 CA--C 1.533 0.302 0 CA-C-O 120.924 0.393 . . . . 0.0 111.671 -177.401 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 143' ' ' ASN . . . . . . . . . . . . . 45.4 m-80 -110.99 9.46 22.18 Favored 'General case' 0 C--N 1.326 -0.456 0 CA-C-O 120.857 0.36 . . . . 0.0 110.399 174.678 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 144' ' ' ARG . . . . . . . . . . . . . 41.1 mtm105 62.18 23.23 13.7 Favored 'General case' 0 N--CA 1.463 0.21 0 CA-C-N 115.346 -0.843 . . . . 0.0 111.427 177.429 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 145' ' ' ALA . . . . . 0.415 ' HB3' ' HB1' ' A' ' 140' ' ' ALA . . . -77.94 -35.48 50.35 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-O 120.981 0.419 . . . . 0.0 110.285 179.407 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 146' ' ' ILE . . . . . 0.449 HG12 ' H ' ' A' ' 148' ' ' PHE . 15.6 tt -144.0 152.0 16.08 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.509 0 CA-C-N 115.783 -0.644 . . . . 0.0 109.313 178.093 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 147' ' ' ASP . . . . . . . . . . . . . 33.4 t70 -113.03 14.93 19.71 Favored 'General case' 0 C--N 1.323 -0.573 0 CA-C-O 121.549 0.69 . . . . 0.0 110.495 -176.416 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 148' ' ' PHE . . . . . 0.449 ' H ' HG12 ' A' ' 146' ' ' ILE . 61.2 t80 -145.13 144.3 30.84 Favored 'General case' 0 C--N 1.321 -0.669 0 CA-C-N 115.643 -0.708 . . . . 0.0 109.576 -174.972 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 149' ' ' ASN . . . . . . . . . . . . . 48.0 t-20 -119.18 88.71 37.94 Favored Pre-proline 0 C--N 1.325 -0.467 0 CA-C-O 120.963 0.411 . . . . 0.0 110.413 179.14 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 150' ' ' PRO . . . . . 0.456 ' HB3' ' HG3' ' A' ' 109' ' ' PRO . 35.8 Cg_exo -59.95 -29.25 88.94 Favored 'Trans proline' 0 C--N 1.342 0.195 0 C-N-CA 122.612 2.208 . . . . 0.0 112.154 -178.549 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 151' ' ' ALA . . . . . 0.457 ' HB3' ' HA ' ' A' ' 134' ' ' SER . . . -70.33 -27.78 64.63 Favored 'General case' 0 N--CA 1.449 -0.483 0 CA-C-N 115.69 -0.687 . . . . 0.0 112.164 -173.218 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 152' ' ' ASP . . . . . . . . . . . . . 0.0 OUTLIER -79.03 -14.37 59.22 Favored 'General case' 0 C--N 1.331 -0.232 0 C-N-CA 119.531 -0.868 . . . . 0.0 109.889 -176.953 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 153' ' ' TYR . . . . . . . . . . . . . 86.3 m-85 -88.46 -1.0 57.81 Favored 'General case' 0 C--N 1.331 -0.227 0 CA-C-N 116.036 -0.529 . . . . 0.0 110.522 176.768 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 154' ' ' VAL . . . . . 0.442 HG21 ' HB ' ' A' ' 112' ' ' ILE . 73.5 t -85.87 126.36 40.56 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.436 0 CA-C-N 115.861 -0.608 . . . . 0.0 109.793 175.788 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 155' ' ' ARG . . . . . . . . . . . . . 38.7 ttt180 -103.63 140.59 37.36 Favored 'General case' 0 C--N 1.323 -0.585 0 CA-C-N 116.222 -0.445 . . . . 0.0 111.127 -173.421 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 156' ' ' ILE . . . . . 0.408 HG12 ' HG2' ' A' ' 127' ' ' LYS . 1.9 mp -88.32 140.7 30.4 Favored Pre-proline 0 C--N 1.328 -0.346 0 CA-C-N 115.656 -0.702 . . . . 0.0 110.135 177.904 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 157' ' ' PRO . . . . . . . . . . . . . 52.0 Cg_exo . . . . . 0 N--CA 1.459 -0.541 0 C-N-CA 122.083 1.855 . . . . 0.0 111.818 173.221 . . . . . . . . 0 0 . 1 . 003 nuclear nobuild core ' A' A ' 63' ' ' SER . . . . . 0.437 ' HA ' ' HA ' ' A' ' 103' ' ' SER . 32.3 m . . . . . 0 N--CA 1.45 -0.43 0 N-CA-C 110.035 -0.357 . . . . 0.0 110.035 . . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 64' ' ' PHE . . . . . 0.411 ' HB3' ' O ' ' A' ' 99' ' ' LEU . 88.6 t80 -60.72 -44.71 96.29 Favored 'General case' 0 C--N 1.326 -0.438 0 CA-C-N 116.366 -0.379 . . . . 0.0 110.812 -177.888 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 65' ' ' GLY . . . . . . . . . . . . . . . -68.47 -23.83 75.15 Favored Glycine 0 N--CA 1.451 -0.365 0 C-N-CA 120.765 -0.731 . . . . 0.0 112.374 179.622 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 66' ' ' ASP . . . . . . . . . . . . . 29.9 t70 -74.64 -47.65 30.82 Favored 'General case' 0 C--N 1.322 -0.598 0 N-CA-C 109.512 -0.551 . . . . 0.0 109.512 177.221 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 67' ' ' TRP . . . . . 0.498 ' HA ' ' HG3' ' A' ' 70' ' ' LYS . 64.3 m95 -65.29 -31.37 72.47 Favored 'General case' 0 C--N 1.33 -0.243 0 CA-C-N 115.91 -0.586 . . . . 0.0 110.906 175.361 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 68' ' ' ALA . . . . . 0.552 ' O ' ' HG ' ' A' ' 72' ' ' LEU . . . -61.93 -41.69 98.25 Favored 'General case' 0 C--N 1.327 -0.403 0 CA-C-N 116.171 -0.468 . . . . 0.0 110.239 174.935 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 69' ' ' GLU . . . . . . . . . . . . . 76.8 tt0 -63.74 -41.44 98.03 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.106 -0.497 . . . . 0.0 109.884 177.2 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 70' ' ' LYS . . . . . 0.498 ' HG3' ' HA ' ' A' ' 67' ' ' TRP . 14.1 mmmt -55.72 -47.29 77.12 Favored 'General case' 0 C--N 1.333 -0.122 0 CA-C-N 115.696 -0.684 . . . . 0.0 109.695 174.919 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 71' ' ' PHE . . . . . . . . . . . . . 91.9 t80 -63.97 -44.54 92.44 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 115.378 -0.828 . . . . 0.0 111.219 179.421 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 72' ' ' LEU . . . . . 0.552 ' HG ' ' O ' ' A' ' 68' ' ' ALA . 96.4 mt -60.36 -49.11 78.88 Favored 'General case' 0 C--N 1.327 -0.405 0 CA-C-O 120.735 0.303 . . . . 0.0 111.05 -178.914 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 73' ' ' LYS . . . . . . . . . . . . . 55.7 tptt -65.26 -37.56 87.6 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-O 121.032 0.444 . . . . 0.0 110.331 179.607 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 74' ' ' SER . . . . . . . . . . . . . 27.3 t -66.11 -41.7 90.23 Favored 'General case' 0 C--N 1.326 -0.436 0 CA-C-N 116.07 -0.514 . . . . 0.0 110.277 177.994 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 75' ' ' LYS . . . . . 0.444 ' HA ' ' HD2' ' A' ' 75' ' ' LYS . 38.7 tptt -72.13 -30.8 65.41 Favored 'General case' 0 N--CA 1.447 -0.622 0 CA-C-O 121.011 0.434 . . . . 0.0 110.687 -177.927 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 76' ' ' GLU . . . . . . . . . . . . . 37.2 tt0 -58.82 -50.14 75.07 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.202 -0.454 . . . . 0.0 109.811 171.591 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 77' ' ' ALA . . . . . . . . . . . . . . . -69.3 -27.34 65.31 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 115.935 -0.575 . . . . 0.0 110.748 178.348 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 78' ' ' ASP . . . . . 0.407 ' HB3' ' O ' ' A' ' 75' ' ' LYS . 24.1 t70 -59.27 -31.15 68.84 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 115.752 -0.658 . . . . 0.0 110.009 175.823 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 79' ' ' GLY . . . . . . . . . . . . . . . 105.17 53.22 0.8 Allowed Glycine 0 N--CA 1.451 -0.319 0 C-N-CA 120.715 -0.755 . . . . 0.0 113.238 172.466 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 80' ' ' VAL . . . . . . . . . . . . . 30.2 m -99.73 161.38 3.26 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.519 0 CA-C-O 120.685 0.279 . . . . 0.0 111.001 178.644 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 81' ' ' SER . . . . . . . . . . . . . 5.5 m -66.09 154.61 39.13 Favored 'General case' 0 C--N 1.325 -0.496 0 CA-C-N 115.767 -0.651 . . . . 0.0 110.379 178.164 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 82' ' ' VAL . . . . . . . . . . . . . 8.7 p -59.78 -40.21 81.93 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.297 0 CA-C-O 120.542 0.21 . . . . 0.0 111.199 -178.433 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 83' ' ' SER . . . . . . . . . . . . . 69.2 m -74.09 -22.29 59.56 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-O 120.662 0.267 . . . . 0.0 110.725 178.59 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 84' ' ' GLN . . . . . . . . . . . . . 50.8 tt0 -71.96 -44.33 63.74 Favored 'General case' 0 N--CA 1.455 -0.189 0 N-CA-C 109.336 -0.616 . . . . 0.0 109.336 178.228 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 85' ' ' LEU . . . . . 0.447 ' HA ' HD22 ' A' ' 85' ' ' LEU . 0.3 OUTLIER -63.4 -36.14 82.75 Favored 'General case' 0 C--N 1.327 -0.409 0 N-CA-C 109.12 -0.696 . . . . 0.0 109.12 175.869 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' A' A ' 86' ' ' ASN . . . . . . . . . . . . . 8.1 m-80 -66.74 -37.52 84.82 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 115.612 -0.722 . . . . 0.0 111.707 178.392 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 87' ' ' SER . . . . . . . . . . . . . 66.6 p -67.1 -29.74 69.57 Favored 'General case' 0 C--N 1.332 -0.189 0 C-N-CA 120.667 -0.413 . . . . 0.0 110.694 178.846 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 88' ' ' TYR . . . . . . . . . . . . . 26.1 m-85 -66.68 -35.63 80.61 Favored 'General case' 0 N--CA 1.454 -0.227 0 N-CA-C 109.755 -0.461 . . . . 0.0 109.755 174.827 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 89' ' ' LYS . . . . . . . . . . . . . 62.9 mttm -63.89 -38.68 91.99 Favored 'General case' 0 CA--C 1.529 0.167 0 CA-C-N 116.063 -0.517 . . . . 0.0 110.113 173.873 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 90' ' ' ASN . . . . . 0.562 ' O ' ' HB3' ' A' ' 94' ' ' ASN . 6.8 m120 -57.88 -35.68 71.33 Favored 'General case' 0 N--CA 1.467 0.389 0 CA-C-N 116.055 -0.521 . . . . 0.0 111.012 177.441 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 91' ' ' TYR . . . . . 0.505 ' CD1' HG12 ' A' ' 129' ' ' ILE . 23.1 m-85 -84.54 -49.14 8.86 Favored 'General case' 0 C--N 1.318 -0.781 0 CA-C-N 116.325 -0.398 . . . . 0.0 111.121 -179.773 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 92' ' ' CYS . . . . . 0.53 ' HA ' ' HB2' ' A' ' 96' ' ' LEU . 50.3 t -70.22 -48.72 55.79 Favored 'General case' 0 C--N 1.323 -0.564 0 N-CA-C 112.236 0.458 . . . . 0.0 112.236 -174.524 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 93' ' ' ARG . . . . . 0.533 ' O ' ' HB3' ' A' ' 97' ' ' SER . 54.7 ttt180 -80.95 -25.13 37.62 Favored 'General case' 0 C--N 1.325 -0.464 0 CA-C-O 120.741 0.305 . . . . 0.0 111.63 -172.669 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 94' ' ' ASN . . . . . 0.562 ' HB3' ' O ' ' A' ' 90' ' ' ASN . 24.0 t-20 -100.18 -61.36 1.38 Allowed 'General case' 0 C--N 1.325 -0.467 0 C-N-CA 120.66 -0.416 . . . . 0.0 111.397 -178.514 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 95' ' ' HIS . . . . . . . . . . . . . 60.5 m80 -85.82 -14.46 45.0 Favored 'General case' 0 C--N 1.326 -0.453 0 N-CA-C 112.494 0.553 . . . . 0.0 112.494 -170.987 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 96' ' ' LEU . . . . . 0.53 ' HB2' ' HA ' ' A' ' 92' ' ' CYS . 93.5 mt -119.61 17.2 12.84 Favored 'General case' 0 C--N 1.321 -0.661 0 CA-C-O 120.796 0.332 . . . . 0.0 110.449 -179.606 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 97' ' ' SER . . . . . 0.536 ' N ' ' HD2' ' A' ' 98' ' ' PRO . 22.2 p -61.88 -42.19 81.13 Favored Pre-proline 0 CA--C 1.543 0.675 0 N-CA-C 113.073 0.768 . . . . 0.0 113.073 -176.251 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 98' ' ' PRO . . . . . 0.536 ' HD2' ' N ' ' A' ' 97' ' ' SER . 36.3 Cg_endo -65.42 -26.09 55.62 Favored 'Trans proline' 0 C--N 1.36 1.137 0 C-N-CA 121.431 1.421 . . . . 0.0 112.037 178.378 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 99' ' ' LEU . . . . . 0.414 HD22 HG23 ' A' ' 107' ' ' ILE . 80.9 mt -89.93 -21.67 22.36 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 115.978 -0.555 . . . . 0.0 110.673 -178.45 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 100' ' ' TYR . . . . . . . . . . . . . 28.1 t80 -55.06 -43.15 73.59 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 115.858 -0.61 . . . . 0.0 110.825 -179.07 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 101' ' ' MET . . . . . . . . . . . . . 23.1 ptt? -94.63 14.12 22.06 Favored 'General case' 0 C--N 1.319 -0.723 0 CA-C-N 115.807 -0.633 . . . . 0.0 111.52 -175.727 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 102' ' ' LYS . . . . . . . . . . . . . 64.6 mttm -108.77 165.99 11.14 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-O 120.962 0.41 . . . . 0.0 110.997 178.092 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 103' ' ' SER . . . . . 0.494 ' O ' ' HG2' ' A' ' 106' ' ' GLU . 3.1 m -79.91 143.06 34.58 Favored 'General case' 0 C--N 1.323 -0.559 0 N-CA-C 108.821 -0.807 . . . . 0.0 108.821 172.138 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 104' ' ' LEU . . . . . . . . . . . . . 1.9 pt? -68.14 -18.92 64.76 Favored 'General case' 0 C--N 1.322 -0.618 0 C-N-CA 120.898 -0.321 . . . . 0.0 111.748 -174.103 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 105' ' ' SER . . . . . . . . . . . . . 16.7 p -87.79 -22.17 24.67 Favored 'General case' 0 C--N 1.327 -0.411 0 N-CA-C 111.813 0.301 . . . . 0.0 111.813 -179.171 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 106' ' ' GLU . . . . . 0.494 ' HG2' ' O ' ' A' ' 103' ' ' SER . 11.5 pt-20 -89.66 -7.63 54.24 Favored 'General case' 0 C--N 1.331 -0.199 0 CA-C-O 120.963 0.411 . . . . 0.0 110.583 -177.633 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 107' ' ' ILE . . . . . 0.474 HG13 ' O ' ' A' ' 103' ' ' SER . 73.4 mt -70.41 135.16 28.73 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.48 0 CA-C-N 115.885 -0.598 . . . . 0.0 110.566 179.826 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 108' ' ' LEU . . . . . 0.451 ' HB2' ' HB2' ' A' ' 111' ' ' ASP . 54.3 mt -97.43 129.52 31.61 Favored Pre-proline 0 C--N 1.325 -0.49 0 CA-C-N 116.175 -0.466 . . . . 0.0 110.776 -176.434 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 109' ' ' PRO . . . . . . . . . . . . . 50.6 Cg_exo -56.95 -38.24 96.45 Favored 'Trans proline' 0 CA--C 1.529 0.274 0 C-N-CA 122.752 2.301 . . . . 0.0 112.032 177.213 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 110' ' ' ALA . . . . . . . . . . . . . . . -70.83 -32.37 69.4 Favored 'General case' 0 C--N 1.332 -0.192 0 CA-C-N 116.204 -0.453 . . . . 0.0 110.776 178.751 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 111' ' ' ASP . . . . . 0.451 ' HB2' ' HB2' ' A' ' 108' ' ' LEU . 36.6 t70 -64.93 -45.72 84.62 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.079 -0.51 . . . . 0.0 109.925 179.038 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 112' ' ' ILE . . . . . . . . . . . . . 36.4 mt -64.25 -39.37 85.29 Favored 'Isoleucine or valine' 0 C--O 1.234 0.277 0 CA-C-N 115.589 -0.732 . . . . 0.0 110.511 176.823 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 113' ' ' GLN . . . . . . . . . . . . . 6.5 tp-100 -58.3 -44.73 88.66 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 115.774 -0.648 . . . . 0.0 110.791 178.232 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 114' ' ' SER . . . . . . . . . . . . . 53.5 m -62.57 -36.0 81.29 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.667 -0.242 . . . . 0.0 110.911 178.097 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 115' ' ' ILE . . . . . 0.419 HG13 ' O ' ' A' ' 111' ' ' ASP . 72.4 mt -64.86 -48.63 83.53 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.193 0 CA-C-O 120.686 0.279 . . . . 0.0 110.384 177.707 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 116' ' ' ILE . . . . . . . . . . . . . 40.8 mm -61.45 -43.42 96.76 Favored 'Isoleucine or valine' 0 N--CA 1.463 0.209 0 CA-C-N 116.265 -0.425 . . . . 0.0 110.53 177.833 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 117' ' ' ASN . . . . . . . . . . . . . 3.0 t-20 -60.17 -37.0 78.84 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 115.689 -0.687 . . . . 0.0 111.203 179.964 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 118' ' ' GLU . . . . . . . . . . . . . 48.4 mt-10 -93.8 0.76 56.44 Favored 'General case' 0 C--N 1.326 -0.417 0 CA-C-N 116.382 -0.372 . . . . 0.0 111.713 -178.513 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 119' ' ' THR . . . . . . . . . . . . . 94.2 m -88.04 110.02 20.29 Favored 'General case' 0 N--CA 1.447 -0.6 0 N-CA-C 108.067 -1.086 . . . . 0.0 108.067 168.876 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 120' ' ' LYS . . . . . . . . . . . . . 66.4 mttm -107.69 64.98 0.63 Allowed 'General case' 0 C--N 1.322 -0.601 0 CA-C-O 121.919 0.866 . . . . 0.0 110.471 -172.401 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 121' ' ' LEU . . . . . . . . . . . . . 87.5 mt -119.5 -174.19 2.68 Favored 'General case' 0 C--N 1.321 -0.634 0 CA-C-N 114.567 -1.197 . . . . 0.0 109.639 -179.526 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 122' ' ' ALA . . . . . . . . . . . . . . . -61.2 149.3 38.04 Favored 'General case' 0 C--N 1.325 -0.476 0 CA-C-N 116.337 -0.392 . . . . 0.0 111.364 -179.832 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 123' ' ' LYS . . . . . . . . . . . . . 55.5 pttt -56.14 -33.01 64.77 Favored 'General case' 0 C--N 1.327 -0.378 0 CA-C-N 115.802 -0.635 . . . . 0.0 111.217 178.473 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 124' ' ' ASN . . . . . . . . . . . . . 95.0 m-20 -62.18 -39.96 94.44 Favored 'General case' 0 C--N 1.331 -0.219 0 CA-C-N 116.069 -0.514 . . . . 0.0 110.472 177.944 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 125' ' ' THR . . . . . 0.555 ' O ' HG13 ' A' ' 129' ' ' ILE . 8.6 m -68.29 -41.41 81.01 Favored 'General case' 0 C--N 1.326 -0.424 0 CA-C-N 116.031 -0.532 . . . . 0.0 110.489 -179.895 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 126' ' ' LEU . . . . . . . . . . . . . 92.6 mt -59.99 -45.54 92.38 Favored 'General case' 0 C--O 1.235 0.324 0 CA-C-N 116.071 -0.513 . . . . 0.0 110.755 179.691 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 127' ' ' LYS . . . . . . . . . . . . . 98.8 mttt -67.29 -34.83 78.22 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.018 -0.537 . . . . 0.0 110.766 178.844 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 128' ' ' ALA . . . . . . . . . . . . . . . -65.82 -43.65 87.95 Favored 'General case' 0 C--N 1.327 -0.391 0 CA-C-N 116.162 -0.472 . . . . 0.0 111.059 -179.273 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 129' ' ' ILE . . . . . 0.555 HG13 ' O ' ' A' ' 125' ' ' THR . 59.1 mt -61.2 -41.82 90.98 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.185 0 CA-C-O 121.154 0.502 . . . . 0.0 109.795 176.998 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 130' ' ' ARG . . . . . 0.608 HH21 HG11 ' A' ' 154' ' ' VAL . 3.2 tpp180 -64.5 -48.1 76.45 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 115.843 -0.617 . . . . 0.0 110.723 179.032 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 131' ' ' ASN . . . . . . . . . . . . . 0.9 OUTLIER -57.83 -52.67 64.51 Favored 'General case' 0 C--N 1.328 -0.345 0 O-C-N 123.341 0.4 . . . . 0.0 110.899 -179.887 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 132' ' ' THR . . . . . 0.479 ' O ' HG13 ' A' ' 136' ' ' ILE . 33.3 m -54.55 -54.06 46.29 Favored 'General case' 0 C--N 1.327 -0.384 0 CA-C-N 116.098 -0.501 . . . . 0.0 110.94 -179.451 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 133' ' ' ALA . . . . . . . . . . . . . . . -62.9 -39.32 94.14 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 116.284 -0.416 . . . . 0.0 111.932 -176.929 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 134' ' ' SER . . . . . . . . . . . . . 79.4 p -65.46 -32.53 74.19 Favored 'General case' 0 C--O 1.233 0.188 0 CA-C-O 120.55 0.214 . . . . 0.0 111.259 -176.514 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 135' ' ' GLN . . . . . 0.484 ' O ' ' HG2' ' A' ' 138' ' ' ARG . 36.1 mt-30 -79.73 -26.11 40.9 Favored 'General case' 0 N--CA 1.453 -0.306 0 C-N-CA 120.946 -0.302 . . . . 0.0 110.808 -179.919 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 136' ' ' ILE . . . . . 0.479 HG13 ' O ' ' A' ' 132' ' ' THR . 73.5 mt -65.34 -46.59 89.94 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.323 0 N-CA-C 109.823 -0.436 . . . . 0.0 109.823 173.791 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 137' ' ' PHE . . . . . 0.424 ' O ' HG13 ' A' ' 141' ' ' ILE . 53.3 m-85 -64.87 -40.5 95.23 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 116.078 -0.51 . . . . 0.0 111.102 177.33 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 138' ' ' ARG . . . . . 0.484 ' HG2' ' O ' ' A' ' 135' ' ' GLN . 0.2 OUTLIER -67.5 -26.07 66.17 Favored 'General case' 0 CA--C 1.53 0.203 0 CA-C-O 120.805 0.336 . . . . 0.0 110.391 -177.751 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' A' A ' 139' ' ' LEU . . . . . 0.413 ' HA ' ' HG2' ' A' ' 142' ' ' GLU . 62.2 tp -67.65 -34.3 76.67 Favored 'General case' 0 C--N 1.332 -0.195 0 CA-C-O 121.28 0.562 . . . . 0.0 109.561 176.706 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 140' ' ' ALA . . . . . . . . . . . . . . . -74.61 -33.78 62.68 Favored 'General case' 0 C--N 1.325 -0.459 0 CA-C-N 115.907 -0.588 . . . . 0.0 110.081 175.697 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 141' ' ' ILE . . . . . 0.634 ' HA ' ' O ' ' A' ' 146' ' ' ILE . 75.9 mt -62.3 -47.94 90.73 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.28 0 CA-C-N 115.947 -0.569 . . . . 0.0 111.069 176.795 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 142' ' ' GLU . . . . . 0.413 ' HG2' ' HA ' ' A' ' 139' ' ' LEU . 5.3 pt-20 -69.56 -16.55 63.44 Favored 'General case' 0 C--N 1.331 -0.229 0 CA-C-O 120.917 0.389 . . . . 0.0 110.975 -179.52 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 143' ' ' ASN . . . . . . . . . . . . . 18.3 m-80 -98.41 2.9 48.31 Favored 'General case' 0 C--N 1.326 -0.435 0 CA-C-N 116.399 -0.364 . . . . 0.0 110.485 175.68 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 144' ' ' ARG . . . . . 0.434 HH11 ' HD2' ' A' ' 144' ' ' ARG . 25.6 mtm180 63.43 20.55 12.31 Favored 'General case' 0 N--CA 1.464 0.271 0 CA-C-N 115.649 -0.705 . . . . 0.0 112.146 175.663 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 145' ' ' ALA . . . . . . . . . . . . . . . -75.12 -37.58 61.38 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-O 121.367 0.604 . . . . 0.0 109.418 176.421 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 146' ' ' ILE . . . . . 0.634 ' O ' ' HA ' ' A' ' 141' ' ' ILE . 13.7 tt -146.85 137.9 18.17 Favored 'Isoleucine or valine' 0 N--CA 1.449 -0.513 0 CA-C-N 115.254 -0.885 . . . . 0.0 108.823 175.192 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 147' ' ' ASP . . . . . . . . . . . . . 7.9 p-10 -106.04 19.71 20.1 Favored 'General case' 0 C--N 1.321 -0.639 0 CA-C-O 121.19 0.519 . . . . 0.0 110.188 -178.947 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 148' ' ' PHE . . . . . 0.497 ' H ' HG12 ' A' ' 146' ' ' ILE . 70.6 t80 -132.12 123.35 26.96 Favored 'General case' 0 C--N 1.32 -0.689 0 CA-C-N 115.353 -0.84 . . . . 0.0 109.846 -175.058 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 149' ' ' ASN . . . . . 0.528 ' HB2' HD11 ' A' ' 141' ' ' ILE . 31.5 t-20 -107.58 98.12 22.79 Favored Pre-proline 0 C--N 1.325 -0.494 0 N-CA-C 110.058 -0.349 . . . . 0.0 110.058 -179.656 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 150' ' ' PRO . . . . . . . . . . . . . 55.2 Cg_endo -70.44 -13.89 33.41 Favored 'Trans proline' 0 C--N 1.344 0.338 0 C-N-CA 122.765 2.31 . . . . 0.0 112.661 -176.51 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 151' ' ' ALA . . . . . . . . . . . . . . . -71.24 -20.02 62.29 Favored 'General case' 0 C--N 1.326 -0.414 0 CA-C-N 116.206 -0.452 . . . . 0.0 110.987 -179.374 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 152' ' ' ASP . . . . . . . . . . . . . 31.0 t70 -71.99 -21.74 61.53 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-O 121.186 0.517 . . . . 0.0 110.902 -179.82 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 153' ' ' TYR . . . . . . . . . . . . . 99.2 m-85 -92.58 1.73 57.1 Favored 'General case' 0 C--N 1.324 -0.532 0 CA-C-N 115.893 -0.594 . . . . 0.0 110.81 -177.962 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 154' ' ' VAL . . . . . 0.608 HG11 HH21 ' A' ' 130' ' ' ARG . 60.6 t -88.11 106.52 16.56 Favored 'Isoleucine or valine' 0 N--CA 1.448 -0.529 0 N-CA-C 109.529 -0.545 . . . . 0.0 109.529 175.949 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 155' ' ' ARG . . . . . . . . . . . . . 12.0 tpp180 -77.01 121.6 23.75 Favored 'General case' 0 C--N 1.32 -0.675 0 CA-C-N 115.853 -0.612 . . . . 0.0 109.891 -178.982 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 156' ' ' ILE . . . . . . . . . . . . . 48.5 mm -90.0 120.2 69.31 Favored Pre-proline 0 C--N 1.325 -0.499 0 CA-C-N 116.272 -0.422 . . . . 0.0 110.213 179.932 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 157' ' ' PRO . . . . . . . . . . . . . 55.5 Cg_endo . . . . . 0 N--CA 1.461 -0.402 0 C-N-CA 122.349 2.033 . . . . 0.0 111.819 178.372 . . . . . . . . 0 0 . 1 . 004 nuclear nobuild core ' A' A ' 63' ' ' SER . . . . . . . . . . . . . 36.5 t . . . . . 0 N--CA 1.45 -0.438 0 N-CA-C 109.744 -0.465 . . . . 0.0 109.744 . . . . . . . . . 0 0 . 1 . 004 nuclear nobuild core ' A' A ' 64' ' ' PHE . . . . . 0.453 ' HB3' ' O ' ' A' ' 99' ' ' LEU . 87.4 t80 -59.07 -38.61 79.85 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-N 116.207 -0.451 . . . . 0.0 110.357 179.753 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 65' ' ' GLY . . . . . . . . . . . . . . . -65.38 -32.32 83.21 Favored Glycine 0 N--CA 1.45 -0.38 0 C-N-CA 120.91 -0.662 . . . . 0.0 112.745 179.99 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 66' ' ' ASP . . . . . . . . . . . . . 20.3 t70 -68.33 -41.45 80.78 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-O 121.043 0.449 . . . . 0.0 110.154 -179.645 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 67' ' ' TRP . . . . . . . . . . . . . 80.4 m95 -74.84 -31.56 61.69 Favored 'General case' 0 C--N 1.327 -0.399 0 CA-C-N 116.027 -0.533 . . . . 0.0 110.979 178.061 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 68' ' ' ALA . . . . . . . . . . . . . . . -62.07 -41.66 98.39 Favored 'General case' 0 C--N 1.33 -0.243 0 N-CA-C 109.874 -0.417 . . . . 0.0 109.874 174.342 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 69' ' ' GLU . . . . . . . . . . . . . 3.3 tm-20 -54.32 -51.09 65.79 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 115.607 -0.724 . . . . 0.0 110.246 175.034 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 70' ' ' LYS . . . . . . . . . . . . . 48.3 mttp -72.81 -25.44 61.14 Favored 'General case' 0 C--N 1.324 -0.531 0 CA-C-N 115.904 -0.589 . . . . 0.0 111.828 -176.688 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 71' ' ' PHE . . . . . . . . . . . . . 69.5 t80 -70.36 -49.38 49.78 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-O 120.876 0.37 . . . . 0.0 110.29 175.337 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 72' ' ' LEU . . . . . 0.442 HD13 ' HA ' ' A' ' 72' ' ' LEU . 4.0 mm? -65.42 -34.71 78.93 Favored 'General case' 0 C--N 1.326 -0.446 0 CA-C-O 120.882 0.373 . . . . 0.0 110.222 177.065 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 73' ' ' LYS . . . . . . . . . . . . . 3.9 tppp? -64.05 -45.9 86.77 Favored 'General case' 0 C--N 1.325 -0.469 0 CA-C-N 115.84 -0.618 . . . . 0.0 110.513 178.43 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 74' ' ' SER . . . . . 0.435 ' O ' ' HB2' ' A' ' 78' ' ' ASP . 13.1 p -70.33 -27.73 64.6 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 116.333 -0.394 . . . . 0.0 111.037 -179.023 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 75' ' ' LYS . . . . . 0.467 ' HA ' ' HD3' ' A' ' 75' ' ' LYS . 67.9 mmtt -74.83 -34.18 62.28 Favored 'General case' 0 C--O 1.236 0.346 0 CA-C-O 120.929 0.395 . . . . 0.0 110.842 174.462 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 76' ' ' GLU . . . . . . . . . . . . . 7.5 tp10 -63.06 -41.54 99.49 Favored 'General case' 0 C--N 1.324 -0.526 0 CA-C-O 121.369 0.604 . . . . 0.0 109.608 173.842 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 77' ' ' ALA . . . . . . . . . . . . . . . -81.18 -10.09 59.69 Favored 'General case' 0 C--N 1.327 -0.404 0 CA-C-N 115.755 -0.657 . . . . 0.0 110.92 177.033 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 78' ' ' ASP . . . . . 0.435 ' HB2' ' O ' ' A' ' 74' ' ' SER . 17.9 t70 -77.23 -49.48 15.0 Favored 'General case' 0 C--N 1.327 -0.4 0 CA-C-N 115.999 -0.546 . . . . 0.0 110.101 178.824 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 79' ' ' GLY . . . . . . . . . . . . . . . 121.43 25.54 2.17 Favored Glycine 0 N--CA 1.449 -0.489 0 C-N-CA 120.573 -0.822 . . . . 0.0 113.052 177.227 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 80' ' ' VAL . . . . . . . . . . . . . 15.9 m -67.67 157.39 6.24 Favored 'Isoleucine or valine' 0 C--O 1.234 0.262 0 CA-C-N 117.088 0.444 . . . . 0.0 110.559 176.734 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 81' ' ' SER . . . . . . . . . . . . . 28.7 t -58.67 138.39 57.02 Favored 'General case' 0 N--CA 1.451 -0.418 0 CA-C-N 115.985 -0.552 . . . . 0.0 109.755 174.812 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 82' ' ' VAL . . . . . . . . . . . . . 14.0 p -58.39 -34.07 49.49 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.583 0 CA-C-O 120.732 0.301 . . . . 0.0 110.786 -179.44 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 83' ' ' SER . . . . . . . . . . . . . 23.3 t -69.38 -43.16 74.09 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-O 121.17 0.509 . . . . 0.0 109.861 177.715 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 84' ' ' GLN . . . . . . . . . . . . . 24.6 tp60 -64.58 -37.62 88.17 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 115.757 -0.656 . . . . 0.0 110.085 178.008 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 85' ' ' LEU . . . . . . . . . . . . . 41.1 tp -66.02 -43.07 88.73 Favored 'General case' 0 C--N 1.327 -0.403 0 CA-C-N 115.646 -0.706 . . . . 0.0 110.564 177.781 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 86' ' ' ASN . . . . . . . . . . . . . 12.3 m-80 -59.6 -38.66 81.86 Favored 'General case' 0 N--CA 1.463 0.189 0 CA-C-N 116.452 -0.34 . . . . 0.0 110.405 176.469 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 87' ' ' SER . . . . . . . . . . . . . 33.1 t -60.62 -48.22 82.75 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 115.903 -0.589 . . . . 0.0 110.4 177.341 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 88' ' ' TYR . . . . . . . . . . . . . 21.8 m-85 -61.58 -45.16 95.32 Favored 'General case' 0 C--O 1.234 0.28 0 CA-C-O 120.786 0.327 . . . . 0.0 110.745 178.311 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 89' ' ' LYS . . . . . . . . . . . . . 97.4 mttt -61.27 -39.33 90.0 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 116.127 -0.488 . . . . 0.0 111.066 179.328 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 90' ' ' ASN . . . . . . . . . . . . . 8.7 t30 -65.26 -41.95 93.73 Favored 'General case' 0 C--N 1.327 -0.37 0 CA-C-O 120.762 0.315 . . . . 0.0 110.578 -179.399 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 91' ' ' TYR . . . . . . . . . . . . . 21.4 m-30 -64.63 -43.22 94.42 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.392 -0.367 . . . . 0.0 111.221 179.93 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 92' ' ' CYS . . . . . 0.527 ' HA ' HD12 ' A' ' 96' ' ' LEU . 58.4 m -76.37 -42.89 43.05 Favored 'General case' 0 C--N 1.323 -0.564 0 CA-C-N 116.5 -0.318 . . . . 0.0 111.844 -175.846 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 93' ' ' ARG . . . . . . . . . . . . . 63.8 ttt180 -79.25 -36.4 39.98 Favored 'General case' 0 C--N 1.326 -0.426 0 CA-C-O 120.669 0.271 . . . . 0.0 111.478 -174.46 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 94' ' ' ASN . . . . . . . . . . . . . 4.1 m-20 -101.03 -49.96 3.95 Favored 'General case' 0 C--N 1.328 -0.337 0 N-CA-C 111.997 0.369 . . . . 0.0 111.997 -174.509 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 95' ' ' HIS . . . . . . . . . . . . . 0.6 OUTLIER -82.25 -32.53 29.63 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-O 120.943 0.402 . . . . 0.0 111.248 -174.0 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 96' ' ' LEU . . . . . 0.554 HD21 ' NH2' ' A' ' 130' ' ' ARG . 93.3 mt -98.68 22.48 9.92 Favored 'General case' 0 C--N 1.324 -0.524 0 CA-C-N 116.115 -0.493 . . . . 0.0 110.741 179.746 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 97' ' ' SER . . . . . 0.551 ' OG ' ' HD3' ' A' ' 98' ' ' PRO . 2.5 p -53.86 -45.1 99.01 Favored Pre-proline 0 CA--C 1.544 0.742 0 N-CA-C 113.29 0.848 . . . . 0.0 113.29 -177.98 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 98' ' ' PRO . . . . . 0.551 ' HD3' ' OG ' ' A' ' 97' ' ' SER . 33.8 Cg_exo -60.3 -43.77 32.59 Favored 'Trans proline' 0 C--N 1.361 1.224 0 C-N-CA 121.593 1.528 . . . . 0.0 111.938 178.454 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 99' ' ' LEU . . . . . 0.453 ' O ' ' HB3' ' A' ' 64' ' ' PHE . 61.1 mt -76.29 -32.45 58.78 Favored 'General case' 0 C--N 1.326 -0.456 0 CA-C-N 115.818 -0.628 . . . . 0.0 110.592 -176.399 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 100' ' ' TYR . . . . . . . . . . . . . 42.8 t80 -57.84 -33.22 68.4 Favored 'General case' 0 C--N 1.326 -0.433 0 CA-C-N 115.73 -0.668 . . . . 0.0 110.801 -179.652 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 101' ' ' MET . . . . . . . . . . . . . 65.8 mtt -102.32 14.29 32.35 Favored 'General case' 0 C--N 1.324 -0.508 0 CA-C-N 116.206 -0.452 . . . . 0.0 110.889 -178.244 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 102' ' ' LYS . . . . . 0.437 ' HG3' ' O ' ' A' ' 98' ' ' PRO . 64.6 mttt -99.05 163.14 12.7 Favored 'General case' 0 C--N 1.326 -0.444 0 CA-C-O 121.24 0.543 . . . . 0.0 111.162 179.104 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 103' ' ' SER . . . . . . . . . . . . . 20.3 m -80.3 137.06 36.54 Favored 'General case' 0 N--CA 1.446 -0.662 0 CA-C-N 115.307 -0.86 . . . . 0.0 109.134 173.533 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 104' ' ' LEU . . . . . 0.563 ' HG ' HD12 ' A' ' 146' ' ' ILE . 50.3 tp -55.07 -43.82 74.25 Favored 'General case' 0 C--N 1.327 -0.409 0 N-CA-C 112.65 0.611 . . . . 0.0 112.65 -171.293 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 105' ' ' SER . . . . . . . . . . . . . 15.5 m -84.01 -9.72 58.44 Favored 'General case' 0 C--N 1.321 -0.665 0 N-CA-C 112.702 0.631 . . . . 0.0 112.702 -171.171 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 106' ' ' GLU . . . . . . . . . . . . . 0.2 OUTLIER -86.95 -22.12 25.8 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-O 120.871 0.367 . . . . 0.0 110.229 -177.082 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 107' ' ' ILE . . . . . . . . . . . . . 62.9 mt -60.66 126.25 18.2 Favored 'Isoleucine or valine' 0 C--O 1.236 0.35 0 CA-C-N 115.747 -0.66 . . . . 0.0 111.491 -174.939 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 108' ' ' LEU . . . . . 0.482 ' H ' HD23 ' A' ' 108' ' ' LEU . 1.4 pt? -112.25 149.32 40.81 Favored Pre-proline 0 C--N 1.325 -0.488 0 CA-C-N 115.432 -0.804 . . . . 0.0 110.31 -179.541 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 109' ' ' PRO . . . . . . . . . . . . . 50.9 Cg_exo -55.01 -39.77 89.25 Favored 'Trans proline' 0 C--N 1.344 0.324 0 C-N-CA 122.952 2.435 . . . . 0.0 112.906 179.674 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 110' ' ' ALA . . . . . 0.47 ' HB3' HD12 ' A' ' 108' ' ' LEU . . . -58.85 -38.67 79.28 Favored 'General case' 0 N--CA 1.464 0.243 0 N-CA-C 111.779 0.289 . . . . 0.0 111.779 -178.209 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 111' ' ' ASP . . . . . . . . . . . . . 28.2 t70 -66.49 -45.91 78.05 Favored 'General case' 0 C--N 1.327 -0.379 0 CA-C-O 121.246 0.546 . . . . 0.0 110.155 -178.172 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 112' ' ' ILE . . . . . 0.58 HD12 ' HB2' ' A' ' 150' ' ' PRO . 58.4 mt -65.74 -38.6 82.63 Favored 'Isoleucine or valine' 0 C--O 1.239 0.519 0 CA-C-N 115.564 -0.744 . . . . 0.0 110.581 177.486 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 113' ' ' GLN . . . . . . . . . . . . . 27.1 tp60 -61.91 -40.57 95.93 Favored 'General case' 0 C--N 1.327 -0.384 0 CA-C-N 115.266 -0.879 . . . . 0.0 110.348 179.597 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 114' ' ' SER . . . . . . . . . . . . . 19.0 t -60.18 -43.95 95.45 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 116.088 -0.506 . . . . 0.0 110.152 177.687 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 115' ' ' ILE . . . . . . . . . . . . . 69.0 mt -54.88 -39.52 48.93 Favored 'Isoleucine or valine' 0 CA--C 1.53 0.195 0 CA-C-O 120.8 0.333 . . . . 0.0 110.677 178.491 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 116' ' ' ILE . . . . . 0.503 HG12 HH11 ' A' ' 130' ' ' ARG . 23.3 mm -70.02 -40.0 77.99 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.238 0 CA-C-N 116.425 -0.352 . . . . 0.0 111.332 177.905 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 117' ' ' ASN . . . . . . . . . . . . . 6.4 t30 -67.39 -32.82 73.98 Favored 'General case' 0 C--N 1.324 -0.51 0 CA-C-O 120.948 0.404 . . . . 0.0 110.501 -178.772 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 118' ' ' GLU . . . . . . . . . . . . . 36.9 mt-10 -83.7 -30.61 26.63 Favored 'General case' 0 C--N 1.327 -0.391 0 CA-C-N 115.808 -0.633 . . . . 0.0 111.564 -178.848 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 119' ' ' THR . . . . . . . . . . . . . 97.9 m -83.77 121.06 26.79 Favored 'General case' 0 C--N 1.325 -0.467 0 CA-C-O 120.977 0.417 . . . . 0.0 111.399 -177.584 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 120' ' ' LYS . . . . . . . . . . . . . 74.6 mmtt -109.09 86.11 2.22 Favored 'General case' 0 C--N 1.321 -0.666 0 CA-C-O 121.293 0.568 . . . . 0.0 110.868 176.716 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 121' ' ' LEU . . . . . . . . . . . . . 85.8 mt -120.52 -175.2 2.97 Favored 'General case' 0 C--N 1.319 -0.755 0 CA-C-N 115.235 -0.893 . . . . 0.0 108.841 174.727 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 122' ' ' ALA . . . . . . . . . . . . . . . -58.5 139.42 55.69 Favored 'General case' 0 C--N 1.324 -0.529 0 N-CA-C 109.325 -0.62 . . . . 0.0 109.325 173.871 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 123' ' ' LYS . . . . . . . . . . . . . 91.6 mttt -62.33 -33.04 73.93 Favored 'General case' 0 C--N 1.322 -0.618 0 CA-C-O 121.141 0.495 . . . . 0.0 110.832 -174.432 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 124' ' ' ASN . . . . . . . . . . . . . 42.9 m-80 -65.56 -39.07 91.26 Favored 'General case' 0 C--N 1.325 -0.49 0 CA-C-N 115.666 -0.697 . . . . 0.0 110.312 175.09 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 125' ' ' THR . . . . . 0.475 ' O ' HG13 ' A' ' 129' ' ' ILE . 17.3 m -69.75 -37.39 76.42 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 116.001 -0.545 . . . . 0.0 110.691 179.48 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 126' ' ' LEU . . . . . . . . . . . . . 98.2 mt -56.8 -51.45 68.88 Favored 'General case' 0 C--O 1.237 0.442 0 CA-C-N 116.27 -0.423 . . . . 0.0 110.949 179.364 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 127' ' ' LYS . . . . . 0.56 ' HB3' HG21 ' A' ' 156' ' ' ILE . 12.7 ptmm? -71.29 -21.29 62.1 Favored 'General case' 0 C--N 1.327 -0.41 0 CA-C-N 116.269 -0.423 . . . . 0.0 111.254 179.593 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 128' ' ' ALA . . . . . . . . . . . . . . . -69.08 -43.02 75.4 Favored 'General case' 0 C--N 1.331 -0.222 0 CA-C-O 120.859 0.362 . . . . 0.0 110.654 175.353 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 129' ' ' ILE . . . . . 0.475 HG13 ' O ' ' A' ' 125' ' ' THR . 51.9 mt -66.07 -29.45 46.83 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.235 0 CA-C-O 121.177 0.513 . . . . 0.0 110.03 177.779 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 130' ' ' ARG . . . . . 0.866 ' HE ' ' HA ' ' A' ' 130' ' ' ARG . 0.4 OUTLIER -76.09 -43.31 44.06 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.397 -0.365 . . . . 0.0 110.932 175.69 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' A' A ' 131' ' ' ASN . . . . . 0.576 ' O ' ' HG2' ' A' ' 135' ' ' GLN . 27.2 t-20 -55.86 -51.51 67.29 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-O 120.889 0.376 . . . . 0.0 110.259 177.649 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 132' ' ' THR . . . . . . . . . . . . . 28.5 m -54.81 -48.57 72.61 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 115.569 -0.741 . . . . 0.0 110.966 178.454 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 133' ' ' ALA . . . . . . . . . . . . . . . -63.15 -39.27 94.18 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.122 -0.49 . . . . 0.0 111.04 179.654 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 134' ' ' SER . . . . . . . . . . . . . 11.1 t -63.98 -38.56 91.53 Favored 'General case' 0 C--N 1.327 -0.406 0 CA-C-N 116.372 -0.376 . . . . 0.0 110.429 -179.613 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 135' ' ' GLN . . . . . 0.576 ' HG2' ' O ' ' A' ' 131' ' ' ASN . 78.1 mm-40 -61.04 -37.81 83.92 Favored 'General case' 0 C--N 1.331 -0.229 0 CA-C-O 121.016 0.436 . . . . 0.0 110.198 177.474 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 136' ' ' ILE . . . . . . . . . . . . . 69.9 mt -64.57 -46.62 92.02 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.357 0 CA-C-N 115.71 -0.677 . . . . 0.0 110.683 177.998 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 137' ' ' PHE . . . . . 0.473 ' O ' HG13 ' A' ' 141' ' ' ILE . 53.4 m-85 -61.0 -42.27 98.11 Favored 'General case' 0 N--CA 1.462 0.14 0 CA-C-O 120.908 0.385 . . . . 0.0 110.548 176.192 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 138' ' ' ARG . . . . . 0.522 ' O ' ' HG3' ' A' ' 142' ' ' GLU . 25.9 mtp180 -57.88 -47.11 83.73 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 115.895 -0.593 . . . . 0.0 111.207 177.699 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 139' ' ' LEU . . . . . . . . . . . . . 61.7 tp -56.55 -37.34 70.38 Favored 'General case' 0 C--N 1.327 -0.392 0 CA-C-O 121.28 0.562 . . . . 0.0 110.637 178.67 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 140' ' ' ALA . . . . . 0.518 ' HB1' HD21 ' A' ' 104' ' ' LEU . . . -68.92 -43.09 75.85 Favored 'General case' 0 C--N 1.324 -0.511 0 CA-C-N 115.775 -0.648 . . . . 0.0 110.551 176.955 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 141' ' ' ILE . . . . . 0.473 HG13 ' O ' ' A' ' 137' ' ' PHE . 81.7 mt -60.3 -39.11 79.85 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.254 0 CA-C-N 116.109 -0.496 . . . . 0.0 110.911 177.094 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 142' ' ' GLU . . . . . 0.522 ' HG3' ' O ' ' A' ' 138' ' ' ARG . 42.5 mt-10 -61.5 -32.58 72.61 Favored 'General case' 0 C--N 1.33 -0.243 0 CA-C-N 116.419 -0.355 . . . . 0.0 111.16 179.624 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 143' ' ' ASN . . . . . . . . . . . . . 44.9 m-80 -95.34 6.58 48.63 Favored 'General case' 0 C--N 1.326 -0.42 0 CA-C-N 116.365 -0.38 . . . . 0.0 110.477 178.58 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 144' ' ' ARG . . . . . . . . . . . . . 47.7 mtp85 59.81 30.67 20.23 Favored 'General case' 0 N--CA 1.466 0.333 0 CA-C-N 115.525 -0.761 . . . . 0.0 111.426 179.309 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 145' ' ' ALA . . . . . . . . . . . . . . . -85.5 -9.43 57.43 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 115.897 -0.592 . . . . 0.0 110.237 177.703 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 146' ' ' ILE . . . . . 0.563 HD12 ' HG ' ' A' ' 104' ' ' LEU . 14.8 tt -160.08 150.4 6.0 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.454 0 CA-C-N 115.545 -0.752 . . . . 0.0 109.069 174.992 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 147' ' ' ASP . . . . . . . . . . . . . 21.2 t70 -116.76 19.83 14.28 Favored 'General case' 0 C--N 1.326 -0.447 0 CA-C-O 121.864 0.84 . . . . 0.0 109.469 -177.81 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 148' ' ' PHE . . . . . 0.46 ' H ' HG12 ' A' ' 146' ' ' ILE . 61.4 t80 -141.93 134.26 27.92 Favored 'General case' 0 C--N 1.321 -0.653 0 CA-C-N 115.321 -0.854 . . . . 0.0 109.985 -171.532 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 149' ' ' ASN . . . . . . . . . . . . . 54.7 t-20 -117.19 95.96 48.25 Favored Pre-proline 0 C--N 1.324 -0.539 0 N-CA-C 109.64 -0.504 . . . . 0.0 109.64 176.816 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 150' ' ' PRO . . . . . 0.58 ' HB2' HD12 ' A' ' 112' ' ' ILE . 23.3 Cg_exo -63.54 -32.26 70.26 Favored 'Trans proline' 0 CA--C 1.528 0.191 0 C-N-CA 122.604 2.202 . . . . 0.0 112.324 -177.692 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 151' ' ' ALA . . . . . . . . . . . . . . . -71.91 -20.09 61.83 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.114 -0.494 . . . . 0.0 111.163 -177.073 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 152' ' ' ASP . . . . . . . . . . . . . 31.9 t70 -68.85 -25.48 64.67 Favored 'General case' 0 C--N 1.326 -0.422 0 CA-C-N 116.196 -0.457 . . . . 0.0 110.854 -179.63 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 153' ' ' TYR . . . . . . . . . . . . . 78.8 m-85 -93.5 -7.29 44.74 Favored 'General case' 0 C--N 1.327 -0.373 0 CA-C-N 115.981 -0.554 . . . . 0.0 111.203 -176.857 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 154' ' ' VAL . . . . . . . . . . . . . 99.3 t -76.33 117.31 20.79 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.42 0 CA-C-O 121.033 0.444 . . . . 0.0 111.346 -175.284 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 155' ' ' ARG . . . . . . . . . . . . . 32.7 ptt85 -80.43 144.05 32.94 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 115.882 -0.599 . . . . 0.0 110.112 177.912 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 156' ' ' ILE . . . . . 0.624 HD11 ' HG3' ' A' ' 130' ' ' ARG . 24.3 mm -115.55 131.89 23.41 Favored Pre-proline 0 C--N 1.323 -0.546 0 CA-C-N 116.133 -0.485 . . . . 0.0 110.653 -179.024 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 157' ' ' PRO . . . . . . . . . . . . . 55.7 Cg_endo . . . . . 0 N--CA 1.459 -0.5 0 C-N-CA 122.186 1.924 . . . . 0.0 111.278 174.068 . . . . . . . . 0 0 . 1 . 005 nuclear nobuild core ' A' A ' 63' ' ' SER . . . . . . . . . . . . . 93.9 p . . . . . 0 C--O 1.234 0.283 0 CA-C-O 120.733 0.301 . . . . 0.0 110.258 . . . . . . . . . 0 0 . 1 . 005 nuclear nobuild core ' A' A ' 64' ' ' PHE . . . . . 0.474 ' HB2' HD11 ' A' ' 107' ' ' ILE . 64.0 t80 -64.78 -29.91 70.9 Favored 'General case' 0 C--N 1.327 -0.382 0 N-CA-C 109.634 -0.506 . . . . 0.0 109.634 178.587 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 65' ' ' GLY . . . . . . . . . . . . . . . -61.4 -39.37 97.18 Favored Glycine 0 C--N 1.332 0.342 0 CA-C-N 115.885 -0.598 . . . . 0.0 112.133 176.664 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 66' ' ' ASP . . . . . . . . . . . . . 20.5 m-20 -62.57 -51.68 66.39 Favored 'General case' 0 N--CA 1.463 0.187 0 CA-C-O 121.106 0.479 . . . . 0.0 110.162 178.263 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 67' ' ' TRP . . . . . . . . . . . . . 95.7 m95 -68.78 -29.32 67.66 Favored 'General case' 0 C--N 1.326 -0.451 0 CA-C-N 115.577 -0.738 . . . . 0.0 111.937 -177.777 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 68' ' ' ALA . . . . . 0.629 ' HB1' ' SG ' ' A' ' 92' ' ' CYS . . . -61.23 -48.78 79.9 Favored 'General case' 0 C--N 1.324 -0.517 0 CA-C-O 121.086 0.469 . . . . 0.0 110.282 175.725 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 69' ' ' GLU . . . . . . . . . . . . . 5.1 mm-40 -59.71 -44.14 93.82 Favored 'General case' 0 C--N 1.326 -0.416 0 CA-C-N 115.525 -0.761 . . . . 0.0 111.055 176.218 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 70' ' ' LYS . . . . . . . . . . . . . 57.0 mtpt -66.28 -33.97 76.95 Favored 'General case' 0 C--N 1.327 -0.388 0 CA-C-N 115.936 -0.575 . . . . 0.0 110.825 -179.872 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 71' ' ' PHE . . . . . 0.552 ' CE1' ' HB3' ' A' ' 135' ' ' GLN . 65.9 t80 -66.91 -49.35 65.84 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-O 120.843 0.354 . . . . 0.0 110.657 176.683 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 72' ' ' LEU . . . . . 0.456 ' HG ' ' O ' ' A' ' 68' ' ' ALA . 89.9 mt -59.89 -40.58 89.22 Favored 'General case' 0 C--N 1.324 -0.526 0 CA-C-N 116.238 -0.437 . . . . 0.0 110.681 -179.047 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 73' ' ' LYS . . . . . 0.729 ' HA ' ' HG2' ' A' ' 76' ' ' GLU . 28.1 tttp -78.34 -27.0 46.97 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.412 -0.358 . . . . 0.0 111.549 -175.989 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 74' ' ' SER . . . . . . . . . . . . . 22.1 p -75.89 -26.08 56.67 Favored 'General case' 0 C--N 1.321 -0.64 0 C-N-CA 120.197 -0.601 . . . . 0.0 110.226 176.355 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 75' ' ' LYS . . . . . 0.438 ' HG2' ' O ' ' A' ' 71' ' ' PHE . 28.8 mmmt -77.52 -43.25 32.69 Favored 'General case' 0 C--O 1.234 0.251 0 CA-C-N 116.554 -0.293 . . . . 0.0 110.835 177.368 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 76' ' ' GLU . . . . . 0.729 ' HG2' ' HA ' ' A' ' 73' ' ' LYS . 12.2 pt-20 -62.05 -35.39 78.48 Favored 'General case' 0 N--CA 1.462 0.167 0 CA-C-O 120.84 0.353 . . . . 0.0 110.223 176.709 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 77' ' ' ALA . . . . . . . . . . . . . . . -73.8 -32.7 63.88 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.21 -0.45 . . . . 0.0 110.85 176.987 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 78' ' ' ASP . . . . . . . . . . . . . 19.3 t70 -61.68 -54.77 38.26 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.099 -0.5 . . . . 0.0 110.787 178.47 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 79' ' ' GLY . . . . . . . . . . . . . . . 145.89 50.43 0.03 OUTLIER Glycine 0 N--CA 1.45 -0.427 0 C-N-CA 120.275 -0.964 . . . . 0.0 113.068 177.076 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 80' ' ' VAL . . . . . 0.452 HG21 HD23 ' A' ' 85' ' ' LEU . 31.0 m -106.56 155.48 7.34 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.514 0 O-C-N 122.652 -0.322 . . . . 0.0 110.334 177.055 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 81' ' ' SER . . . . . . . . . . . . . 13.0 m -70.73 150.55 45.8 Favored 'General case' 0 C--N 1.32 -0.682 0 CA-C-N 116.137 -0.483 . . . . 0.0 109.789 175.162 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 82' ' ' VAL . . . . . . . . . . . . . 14.1 p -60.75 -35.61 65.37 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.402 0 CA-C-O 120.597 0.237 . . . . 0.0 110.556 179.274 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 83' ' ' SER . . . . . . . . . . . . . 8.5 m -65.29 -37.49 87.31 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-O 121.081 0.467 . . . . 0.0 110.57 177.419 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 84' ' ' GLN . . . . . . . . . . . . . 6.1 tp-100 -68.42 -40.08 81.35 Favored 'General case' 0 C--N 1.332 -0.179 0 CA-C-N 115.971 -0.559 . . . . 0.0 109.609 177.031 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 85' ' ' LEU . . . . . 0.46 ' HA ' HD22 ' A' ' 85' ' ' LEU . 0.7 OUTLIER -65.12 -36.73 85.2 Favored 'General case' 0 C--N 1.327 -0.385 0 CA-C-N 115.59 -0.732 . . . . 0.0 109.486 177.35 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' A' A ' 86' ' ' ASN . . . . . . . . . . . . . 11.6 m120 -57.64 -39.47 77.06 Favored 'General case' 0 CA--C 1.519 -0.221 0 CA-C-N 116.046 -0.524 . . . . 0.0 110.622 175.261 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 87' ' ' SER . . . . . . . . . . . . . 49.0 m -65.23 -46.3 81.17 Favored 'General case' 0 C--N 1.326 -0.42 0 CA-C-N 116.407 -0.36 . . . . 0.0 110.547 178.588 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 88' ' ' TYR . . . . . . . . . . . . . 49.2 m-85 -57.5 -46.45 83.75 Favored 'General case' 0 N--CA 1.463 0.198 0 CA-C-O 121.01 0.433 . . . . 0.0 110.404 175.495 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 89' ' ' LYS . . . . . . . . . . . . . 38.4 ttmt -66.44 -35.6 80.69 Favored 'General case' 0 C--N 1.324 -0.528 0 CA-C-N 115.652 -0.704 . . . . 0.0 110.734 -178.951 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 90' ' ' ASN . . . . . . . . . . . . . 25.9 t-20 -62.29 -47.86 82.46 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-O 120.943 0.401 . . . . 0.0 110.207 178.553 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 91' ' ' TYR . . . . . . . . . . . . . 31.0 m-85 -62.3 -50.94 69.65 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.085 -0.507 . . . . 0.0 110.185 177.361 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 92' ' ' CYS . . . . . 0.629 ' SG ' ' HB1' ' A' ' 68' ' ' ALA . 42.0 t -63.96 -48.56 76.0 Favored 'General case' 0 C--N 1.323 -0.579 0 N-CA-C 112.368 0.507 . . . . 0.0 112.368 -175.262 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 93' ' ' ARG . . . . . . . . . . . . . 72.5 ttt180 -70.93 -38.5 72.91 Favored 'General case' 0 C--N 1.324 -0.504 0 N-CA-C 111.914 0.338 . . . . 0.0 111.914 -173.293 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 94' ' ' ASN . . . . . . . . . . . . . 73.1 m-20 -102.96 -58.12 1.93 Allowed 'General case' 0 C--N 1.324 -0.527 0 C-N-CA 120.912 -0.315 . . . . 0.0 111.718 -172.437 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 95' ' ' HIS . . . . . . . . . . . . . 78.0 m-70 -74.05 -42.7 59.84 Favored 'General case' 0 C--N 1.326 -0.425 0 CA-C-O 120.73 0.3 . . . . 0.0 111.086 -174.572 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 96' ' ' LEU . . . . . 0.568 ' HB2' ' HA ' ' A' ' 92' ' ' CYS . 96.0 mt -93.16 16.88 11.98 Favored 'General case' 0 C--N 1.325 -0.471 0 CA-C-N 116.475 -0.329 . . . . 0.0 110.63 179.414 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 97' ' ' SER . . . . . 0.575 ' N ' ' HD2' ' A' ' 98' ' ' PRO . 18.6 t -54.37 -47.55 97.28 Favored Pre-proline 0 CA--C 1.537 0.476 0 CA-C-N 115.811 -0.632 . . . . 0.0 111.427 178.665 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 98' ' ' PRO . . . . . 0.586 ' O ' ' HG3' ' A' ' 102' ' ' LYS . 10.3 Cg_endo -53.56 -32.38 63.6 Favored 'Trans proline' 0 C--N 1.36 1.143 0 C-N-CA 122.329 2.019 . . . . 0.0 112.758 175.554 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 99' ' ' LEU . . . . . 0.583 HD21 HG12 ' A' ' 112' ' ' ILE . 10.7 mp -81.22 -39.76 24.87 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-O 120.766 0.317 . . . . 0.0 110.865 178.243 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 100' ' ' TYR . . . . . . . . . . . . . 33.4 t80 -54.03 -33.69 57.98 Favored 'General case' 0 C--N 1.331 -0.225 0 CA-C-N 115.642 -0.708 . . . . 0.0 110.531 179.062 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 101' ' ' MET . . . . . . . . . . . . . 65.0 mtt -91.15 6.41 45.16 Favored 'General case' 0 C--N 1.327 -0.401 0 CA-C-N 115.539 -0.755 . . . . 0.0 111.652 -177.586 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 102' ' ' LYS . . . . . 0.586 ' HG3' ' O ' ' A' ' 98' ' ' PRO . 59.3 mttp -108.92 166.52 10.76 Favored 'General case' 0 C--N 1.326 -0.456 0 CA-C-O 121.555 0.693 . . . . 0.0 111.148 178.942 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 103' ' ' SER . . . . . 0.492 ' O ' HG13 ' A' ' 107' ' ' ILE . 28.6 t -96.93 160.38 14.38 Favored 'General case' 0 C--N 1.32 -0.703 0 CA-C-N 115.199 -0.909 . . . . 0.0 109.312 174.218 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 104' ' ' LEU . . . . . 0.513 ' HB3' HD12 ' A' ' 146' ' ' ILE . 84.9 mt -50.21 -59.57 3.81 Favored 'General case' 0 N--CA 1.468 0.469 0 N-CA-C 113.407 0.891 . . . . 0.0 113.407 -171.087 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 105' ' ' SER . . . . . . . . . . . . . 29.4 t -81.02 -0.47 39.85 Favored 'General case' 0 C--N 1.325 -0.483 0 CA-C-O 121.061 0.457 . . . . 0.0 111.046 -174.115 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 106' ' ' GLU . . . . . . . . . . . . . 3.4 mp0 -99.46 -1.8 37.62 Favored 'General case' 0 C--N 1.325 -0.481 0 CA-C-N 116.131 -0.486 . . . . 0.0 110.702 -175.962 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 107' ' ' ILE . . . . . 0.492 HG13 ' O ' ' A' ' 103' ' ' SER . 76.0 mt -87.13 129.0 39.31 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.455 0 CA-C-N 115.889 -0.596 . . . . 0.0 110.596 179.83 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 108' ' ' LEU . . . . . . . . . . . . . 91.9 mt -97.44 136.63 21.25 Favored Pre-proline 0 C--N 1.321 -0.636 0 CA-C-N 116.093 -0.503 . . . . 0.0 110.206 178.311 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 109' ' ' PRO . . . . . . . . . . . . . 32.5 Cg_exo -59.03 -32.94 98.42 Favored 'Trans proline' 0 CA--C 1.528 0.215 0 C-N-CA 122.738 2.292 . . . . 0.0 111.892 177.06 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 110' ' ' ALA . . . . . . . . . . . . . . . -67.04 -30.72 70.87 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 115.77 -0.65 . . . . 0.0 110.988 178.651 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 111' ' ' ASP . . . . . 0.431 ' O ' HG13 ' A' ' 115' ' ' ILE . 32.5 t70 -65.92 -39.61 90.7 Favored 'General case' 0 C--N 1.331 -0.218 0 N-CA-C 109.448 -0.575 . . . . 0.0 109.448 179.975 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 112' ' ' ILE . . . . . 0.583 HG12 HD21 ' A' ' 99' ' ' LEU . 15.6 mt -68.39 -40.95 83.09 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.308 0 CA-C-N 115.358 -0.837 . . . . 0.0 110.238 177.474 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 113' ' ' GLN . . . . . 0.517 ' HA ' HG23 ' A' ' 154' ' ' VAL . 0.0 OUTLIER -63.14 -40.63 98.13 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 115.911 -0.586 . . . . 0.0 109.988 -179.514 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' A' A ' 114' ' ' SER . . . . . . . . . . . . . 58.2 m -59.59 -41.47 90.36 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 116.358 -0.383 . . . . 0.0 110.862 176.921 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 115' ' ' ILE . . . . . 0.504 HD11 ' HG2' ' A' ' 98' ' ' PRO . 78.1 mt -57.65 -50.38 77.56 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.211 0 CA-C-O 120.81 0.338 . . . . 0.0 110.52 176.547 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 116' ' ' ILE . . . . . 0.404 HG23 ' HB3' ' A' ' 126' ' ' LEU . 49.5 mm -60.56 -43.2 94.0 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.343 0 CA-C-N 115.897 -0.592 . . . . 0.0 111.017 179.784 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 117' ' ' ASN . . . . . . . . . . . . . 55.1 t30 -67.18 -36.55 82.02 Favored 'General case' 0 C--N 1.324 -0.503 0 CA-C-N 115.925 -0.579 . . . . 0.0 111.492 -177.492 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 118' ' ' GLU . . . . . . . . . . . . . 43.2 mt-10 -84.19 -19.89 33.27 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 116.496 -0.32 . . . . 0.0 111.813 -177.43 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 119' ' ' THR . . . . . 0.412 HG23 HD23 ' A' ' 121' ' ' LEU . 96.1 m -70.82 126.29 29.18 Favored 'General case' 0 C--N 1.323 -0.563 0 N-CA-C 109.817 -0.438 . . . . 0.0 109.817 176.202 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 120' ' ' LYS . . . . . . . . . . . . . 21.8 mtpp -102.44 35.75 2.35 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-O 120.862 0.363 . . . . 0.0 111.591 -174.659 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 121' ' ' LEU . . . . . 0.412 HD23 HG23 ' A' ' 119' ' ' THR . 3.9 mm? -100.92 -175.92 3.02 Favored 'General case' 0 C--N 1.323 -0.574 0 CA-C-N 116.215 -0.448 . . . . 0.0 109.919 177.105 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 122' ' ' ALA . . . . . 0.422 ' O ' ' HG ' ' A' ' 126' ' ' LEU . . . -69.65 162.68 27.2 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-O 121.072 0.463 . . . . 0.0 111.67 -177.228 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 123' ' ' LYS . . . . . . . . . . . . . 53.2 mtmt -62.84 -34.2 76.82 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 115.764 -0.653 . . . . 0.0 111.073 -179.043 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 124' ' ' ASN . . . . . 0.743 ' HA ' ' HE3' ' A' ' 127' ' ' LYS . 65.2 t30 -64.4 -39.45 93.88 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-O 121.06 0.457 . . . . 0.0 109.911 176.937 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 125' ' ' THR . . . . . 0.44 ' O ' HG13 ' A' ' 129' ' ' ILE . 3.5 m -65.98 -39.0 89.97 Favored 'General case' 0 C--N 1.327 -0.399 0 CA-C-N 115.665 -0.698 . . . . 0.0 110.29 178.6 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 126' ' ' LEU . . . . . 0.422 ' HG ' ' O ' ' A' ' 122' ' ' ALA . 85.0 mt -62.33 -43.16 99.47 Favored 'General case' 0 C--O 1.234 0.26 0 CA-C-N 115.862 -0.608 . . . . 0.0 110.563 177.151 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 127' ' ' LYS . . . . . 0.743 ' HE3' ' HA ' ' A' ' 124' ' ' ASN . 27.0 mtmt -59.92 -41.35 91.54 Favored 'General case' 0 C--N 1.331 -0.237 0 CA-C-N 116.132 -0.486 . . . . 0.0 110.766 177.328 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 128' ' ' ALA . . . . . . . . . . . . . . . -60.99 -34.78 75.32 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.148 -0.478 . . . . 0.0 111.327 -179.308 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 129' ' ' ILE . . . . . 0.44 HG13 ' O ' ' A' ' 125' ' ' THR . 64.6 mt -65.69 -50.55 70.51 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.304 0 CA-C-N 116.519 -0.31 . . . . 0.0 110.397 178.424 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 130' ' ' ARG . . . . . . . . . . . . . 24.5 ttt180 -60.68 -42.85 97.93 Favored 'General case' 0 N--CA 1.462 0.14 0 CA-C-N 116.455 -0.339 . . . . 0.0 110.336 176.23 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 131' ' ' ASN . . . . . . . . . . . . . 7.7 t30 -55.91 -52.31 64.56 Favored 'General case' 0 C--N 1.327 -0.384 0 CA-C-N 115.816 -0.629 . . . . 0.0 110.519 -179.768 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 132' ' ' THR . . . . . 0.571 ' O ' HG13 ' A' ' 136' ' ' ILE . 37.7 m -57.43 -48.88 77.95 Favored 'General case' 0 C--N 1.326 -0.442 0 CA-C-N 115.714 -0.675 . . . . 0.0 110.814 178.898 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 133' ' ' ALA . . . . . . . . . . . . . . . -63.3 -46.99 84.14 Favored 'General case' 0 C--N 1.331 -0.213 0 CA-C-N 116.109 -0.496 . . . . 0.0 111.601 -177.859 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 134' ' ' SER . . . . . . . . . . . . . 9.5 t -62.98 -38.78 92.53 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-O 120.73 0.3 . . . . 0.0 110.519 -177.596 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 135' ' ' GLN . . . . . 0.552 ' HB3' ' CE1' ' A' ' 71' ' ' PHE . 0.8 OUTLIER -61.73 -39.97 93.44 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.255 -0.43 . . . . 0.0 110.967 176.67 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' A' A ' 136' ' ' ILE . . . . . 0.571 HG13 ' O ' ' A' ' 132' ' ' THR . 66.3 mt -65.7 -48.52 82.11 Favored 'Isoleucine or valine' 0 C--O 1.233 0.213 0 CA-C-N 116.344 -0.389 . . . . 0.0 110.635 178.336 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 137' ' ' PHE . . . . . 0.457 ' O ' HG13 ' A' ' 141' ' ' ILE . 40.6 m-85 -58.19 -43.92 87.81 Favored 'General case' 0 CA--C 1.521 -0.143 0 CA-C-N 116.179 -0.464 . . . . 0.0 110.748 178.321 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 138' ' ' ARG . . . . . 0.595 ' O ' ' HG3' ' A' ' 142' ' ' GLU . 62.3 mtt85 -59.51 -42.3 91.88 Favored 'General case' 0 C--O 1.222 -0.354 0 CA-C-N 116.278 -0.419 . . . . 0.0 111.163 178.673 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 139' ' ' LEU . . . . . . . . . . . . . 57.4 tp -56.95 -41.89 79.1 Favored 'General case' 0 C--N 1.326 -0.456 0 CA-C-O 120.942 0.401 . . . . 0.0 110.398 178.301 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 140' ' ' ALA . . . . . . . . . . . . . . . -66.84 -40.46 87.96 Favored 'General case' 0 C--N 1.327 -0.389 0 CA-C-N 116.144 -0.48 . . . . 0.0 110.475 176.693 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 141' ' ' ILE . . . . . 0.457 HG13 ' O ' ' A' ' 137' ' ' PHE . 80.1 mt -63.3 -40.5 89.28 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.301 0 CA-C-N 116.207 -0.451 . . . . 0.0 110.831 178.428 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 142' ' ' GLU . . . . . 0.595 ' HG3' ' O ' ' A' ' 138' ' ' ARG . 50.2 mt-10 -63.47 -29.99 71.19 Favored 'General case' 0 C--N 1.331 -0.228 0 CA-C-O 120.812 0.339 . . . . 0.0 111.049 179.971 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 143' ' ' ASN . . . . . 0.454 HD22 ' N ' ' A' ' 143' ' ' ASN . 0.9 OUTLIER -92.98 6.18 48.82 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-O 120.95 0.405 . . . . 0.0 110.32 176.927 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' A' A ' 144' ' ' ARG . . . . . 0.409 ' HD3' ' HA ' ' A' ' 144' ' ' ARG . 3.8 mmt180 59.52 28.33 17.7 Favored 'General case' 0 N--CA 1.464 0.26 0 CA-C-N 115.545 -0.752 . . . . 0.0 112.096 179.087 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 145' ' ' ALA . . . . . . . . . . . . . . . -78.51 -31.25 47.56 Favored 'General case' 0 C--N 1.327 -0.395 0 CA-C-O 121.074 0.464 . . . . 0.0 109.965 176.874 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 146' ' ' ILE . . . . . 0.513 HD12 ' HB3' ' A' ' 104' ' ' LEU . 14.8 tt -141.75 142.48 28.37 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.464 0 CA-C-N 115.641 -0.708 . . . . 0.0 109.165 175.503 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 147' ' ' ASP . . . . . . . . . . . . . 33.1 t70 -108.28 25.66 11.37 Favored 'General case' 0 C--N 1.322 -0.626 0 CA-C-O 121.681 0.753 . . . . 0.0 110.394 -175.999 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 148' ' ' PHE . . . . . 0.445 ' H ' HG12 ' A' ' 146' ' ' ILE . 80.7 t80 -148.81 141.96 24.98 Favored 'General case' 0 C--N 1.325 -0.498 0 CA-C-N 115.909 -0.587 . . . . 0.0 110.498 -177.393 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 149' ' ' ASN . . . . . . . . . . . . . 47.3 t-20 -116.73 99.61 52.95 Favored Pre-proline 0 C--N 1.326 -0.427 0 N-CA-C 110.111 -0.329 . . . . 0.0 110.111 177.83 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 150' ' ' PRO . . . . . . . . . . . . . 24.1 Cg_exo -64.54 -21.69 65.68 Favored 'Trans proline' 0 C--N 1.342 0.229 0 C-N-CA 122.892 2.395 . . . . 0.0 112.757 -178.593 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 151' ' ' ALA . . . . . 0.466 ' O ' HG12 ' A' ' 154' ' ' VAL . . . -73.62 -14.35 61.16 Favored 'General case' 0 C--N 1.327 -0.39 0 CA-C-O 120.875 0.369 . . . . 0.0 111.322 -176.719 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 152' ' ' ASP . . . . . . . . . . . . . 24.1 t70 -64.87 -27.89 69.17 Favored 'General case' 0 C--N 1.324 -0.54 0 CA-C-O 121.044 0.45 . . . . 0.0 110.395 178.201 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 153' ' ' TYR . . . . . . . . . . . . . 63.2 m-85 -97.26 0.81 48.78 Favored 'General case' 0 C--N 1.328 -0.343 0 N-CA-C 112.787 0.662 . . . . 0.0 112.787 -175.275 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 154' ' ' VAL . . . . . 0.517 HG23 ' HA ' ' A' ' 113' ' ' GLN . 6.3 p -94.21 106.7 18.39 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.384 0 C-N-CA 119.667 -0.813 . . . . 0.0 110.224 177.146 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 155' ' ' ARG . . . . . . . . . . . . . 18.2 ptt180 -93.04 144.55 25.15 Favored 'General case' 0 C--N 1.322 -0.622 0 CA-C-N 115.666 -0.697 . . . . 0.0 111.015 -177.249 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 156' ' ' ILE . . . . . . . . . . . . . 44.4 mm -89.25 116.82 67.34 Favored Pre-proline 0 C--N 1.323 -0.555 0 CA-C-N 115.655 -0.702 . . . . 0.0 109.803 179.616 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 157' ' ' PRO . . . . . . . . . . . . . 13.0 Cg_exo . . . . . 0 N--CA 1.464 -0.264 0 C-N-CA 122.613 2.209 . . . . 0.0 111.867 -179.613 . . . . . . . . 0 0 . 1 . 006 nuclear nobuild core ' A' A ' 63' ' ' SER . . . . . 0.513 ' HA ' ' HA ' ' A' ' 103' ' ' SER . 10.7 p . . . . . 0 N--CA 1.452 -0.352 0 N-CA-C 110.259 -0.274 . . . . 0.0 110.259 . . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 64' ' ' PHE . . . . . 0.54 ' HB2' HD11 ' A' ' 107' ' ' ILE . 86.6 t80 -60.99 -34.55 74.96 Favored 'General case' 0 C--N 1.33 -0.249 0 N-CA-C 109.933 -0.395 . . . . 0.0 109.933 179.693 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 65' ' ' GLY . . . . . . . . . . . . . . . -58.5 -44.82 95.19 Favored Glycine 0 N--CA 1.447 -0.6 0 CA-C-N 115.901 -0.59 . . . . 0.0 112.256 176.326 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 66' ' ' ASP . . . . . . . . . . . . . 36.9 t70 -65.08 -40.98 95.42 Favored 'General case' 0 C--N 1.327 -0.393 0 CA-C-O 120.819 0.342 . . . . 0.0 110.324 178.273 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 67' ' ' TRP . . . . . 0.418 ' CH2' ' HA ' ' A' ' 140' ' ' ALA . 87.0 m95 -62.36 -42.02 99.07 Favored 'General case' 0 C--N 1.332 -0.18 0 CA-C-N 116.278 -0.419 . . . . 0.0 110.967 177.011 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 68' ' ' ALA . . . . . 0.519 ' O ' ' HG ' ' A' ' 72' ' ' LEU . . . -59.73 -44.69 93.65 Favored 'General case' 0 C--N 1.327 -0.373 0 CA-C-N 116.287 -0.415 . . . . 0.0 110.669 177.8 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 69' ' ' GLU . . . . . . . . . . . . . 80.6 mt-10 -61.57 -42.85 99.44 Favored 'General case' 0 C--N 1.325 -0.461 0 CA-C-N 116.242 -0.436 . . . . 0.0 111.177 178.51 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 70' ' ' LYS . . . . . . . . . . . . . 43.2 mtmt -69.63 -28.64 66.09 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.272 -0.422 . . . . 0.0 110.731 179.639 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 71' ' ' PHE . . . . . . . . . . . . . 87.8 t80 -74.53 -40.12 61.94 Favored 'General case' 0 C--N 1.325 -0.488 0 CA-C-N 116.07 -0.514 . . . . 0.0 110.216 176.371 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 72' ' ' LEU . . . . . 0.519 ' HG ' ' O ' ' A' ' 68' ' ' ALA . 91.1 mt -65.93 -36.48 83.48 Favored 'General case' 0 C--N 1.327 -0.37 0 CA-C-O 120.883 0.373 . . . . 0.0 110.307 176.773 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 73' ' ' LYS . . . . . . . . . . . . . 39.4 ttmt -63.11 -45.8 90.31 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 115.943 -0.571 . . . . 0.0 110.642 178.472 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 74' ' ' SER . . . . . . . . . . . . . 6.4 p -73.75 -39.8 63.97 Favored 'General case' 0 C--N 1.326 -0.456 0 CA-C-N 115.847 -0.615 . . . . 0.0 111.323 -178.023 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 75' ' ' LYS . . . . . 0.492 ' O ' ' HB3' ' A' ' 78' ' ' ASP . 10.8 tptp -69.61 -21.93 63.54 Favored 'General case' 0 N--CA 1.454 -0.268 0 CA-C-O 120.811 0.338 . . . . 0.0 111.074 179.29 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 76' ' ' GLU . . . . . . . . . . . . . 31.1 tt0 -73.15 -43.5 61.44 Favored 'General case' 0 C--N 1.324 -0.532 0 N-CA-C 109.304 -0.628 . . . . 0.0 109.304 174.183 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 77' ' ' ALA . . . . . . . . . . . . . . . -65.65 -27.18 68.19 Favored 'General case' 0 C--N 1.331 -0.213 0 CA-C-N 115.668 -0.696 . . . . 0.0 110.672 175.714 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 78' ' ' ASP . . . . . 0.492 ' HB3' ' O ' ' A' ' 75' ' ' LYS . 18.5 t0 -51.98 -44.1 63.87 Favored 'General case' 0 C--O 1.235 0.295 0 CA-C-N 115.555 -0.748 . . . . 0.0 109.605 173.712 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 79' ' ' GLY . . . . . . . . . . . . . . . 107.31 29.06 4.65 Favored Glycine 0 N--CA 1.448 -0.521 0 CA-C-N 115.44 -0.8 . . . . 0.0 112.141 -179.315 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 80' ' ' VAL . . . . . . . . . . . . . 33.1 m -69.63 150.35 10.34 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.347 0 CA-C-O 120.956 0.407 . . . . 0.0 110.675 179.758 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 81' ' ' SER . . . . . . . . . . . . . 14.0 m -72.92 168.34 19.16 Favored 'General case' 0 C--N 1.324 -0.518 0 CA-C-N 115.849 -0.614 . . . . 0.0 111.016 -179.383 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 82' ' ' VAL . . . . . . . . . . . . . 48.9 t -57.44 -52.37 57.88 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.187 0 CA-C-N 116.259 -0.428 . . . . 0.0 111.425 -176.523 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 83' ' ' SER . . . . . . . . . . . . . 59.8 m -62.42 -27.6 69.21 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-O 120.891 0.377 . . . . 0.0 111.113 -179.095 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 84' ' ' GLN . . . . . . . . . . . . . 51.5 tp60 -69.18 -54.55 14.25 Favored 'General case' 0 C--N 1.327 -0.396 0 CA-C-N 116.152 -0.476 . . . . 0.0 109.812 -179.74 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 85' ' ' LEU . . . . . . . . . . . . . 31.7 tp -69.17 -30.33 68.53 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.22 -0.446 . . . . 0.0 110.216 179.835 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 86' ' ' ASN . . . . . . . . . . . . . 27.2 t-20 -58.03 -44.65 87.45 Favored 'General case' 0 C--O 1.235 0.3 0 CA-C-N 116.094 -0.503 . . . . 0.0 110.195 176.018 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 87' ' ' SER . . . . . . . . . . . . . 8.7 t -66.83 -39.24 87.58 Favored 'General case' 0 N--CA 1.452 -0.327 0 CA-C-N 115.66 -0.7 . . . . 0.0 110.1 178.821 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 88' ' ' TYR . . . . . . . . . . . . . 30.9 m-85 -59.17 -46.32 88.71 Favored 'General case' 0 C--O 1.231 0.101 0 CA-C-N 116.321 -0.399 . . . . 0.0 111.106 177.053 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 89' ' ' LYS . . . . . . . . . . . . . 88.3 mttt -62.82 -44.38 96.3 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.5 -0.318 . . . . 0.0 110.45 179.09 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 90' ' ' ASN . . . . . . . . . . . . . 27.1 t-20 -57.98 -50.35 73.71 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.095 -0.502 . . . . 0.0 110.913 -179.5 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 91' ' ' TYR . . . . . . . . . . . . . 22.3 m-30 -58.68 -52.1 67.11 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.321 -0.4 . . . . 0.0 110.909 -179.492 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 92' ' ' CYS . . . . . 0.478 ' HA ' ' HB2' ' A' ' 96' ' ' LEU . 61.5 m -67.52 -44.9 77.26 Favored 'General case' 0 C--N 1.325 -0.461 0 CA-C-N 116.173 -0.467 . . . . 0.0 112.117 -173.771 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 93' ' ' ARG . . . . . . . . . . . . . 23.9 mmm-85 -81.08 -28.97 35.07 Favored 'General case' 0 C--N 1.329 -0.318 0 N-CA-C 112.194 0.442 . . . . 0.0 112.194 -173.123 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 94' ' ' ASN . . . . . . . . . . . . . 0.9 OUTLIER -105.54 -61.95 1.42 Allowed 'General case' 0 C--N 1.328 -0.366 0 C-N-CA 120.407 -0.517 . . . . 0.0 112.115 -176.409 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 95' ' ' HIS . . . . . . . . . . . . . 38.9 t-80 -75.84 -26.21 56.95 Favored 'General case' 0 C--N 1.326 -0.416 0 CA-C-O 120.826 0.346 . . . . 0.0 111.148 -172.37 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 96' ' ' LEU . . . . . 0.478 ' HB2' ' HA ' ' A' ' 92' ' ' CYS . 86.7 mt -108.37 14.95 24.4 Favored 'General case' 0 C--N 1.324 -0.504 0 CA-C-N 116.334 -0.394 . . . . 0.0 110.69 -179.793 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 97' ' ' SER . . . . . 0.585 ' N ' ' HD2' ' A' ' 98' ' ' PRO . 8.1 t -57.76 -46.03 99.77 Favored Pre-proline 0 CA--C 1.541 0.632 0 CA-C-N 116.342 -0.39 . . . . 0.0 111.897 -179.249 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 98' ' ' PRO . . . . . 0.585 ' HD2' ' N ' ' A' ' 97' ' ' SER . 10.2 Cg_endo -55.13 -28.19 59.65 Favored 'Trans proline' 0 C--N 1.357 0.992 0 C-N-CA 122.306 2.004 . . . . 0.0 112.591 175.604 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 99' ' ' LEU . . . . . 0.503 HD11 HG12 ' A' ' 112' ' ' ILE . 72.8 mt -89.29 -30.48 18.44 Favored 'General case' 0 C--N 1.326 -0.413 0 CA-C-N 116.251 -0.431 . . . . 0.0 110.219 -179.895 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 100' ' ' TYR . . . . . . . . . . . . . 16.4 t80 -57.11 -39.84 75.88 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 115.473 -0.785 . . . . 0.0 110.577 -179.519 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 101' ' ' MET . . . . . . . . . . . . . 24.7 ttt -76.47 -23.23 53.83 Favored 'General case' 0 C--O 1.233 0.222 0 CA-C-N 115.764 -0.653 . . . . 0.0 110.751 179.706 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 102' ' ' LYS . . . . . . . . . . . . . 50.0 mttm -75.72 146.46 40.1 Favored 'General case' 0 C--N 1.323 -0.573 0 CA-C-O 121.298 0.57 . . . . 0.0 111.63 -177.945 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 103' ' ' SER . . . . . 0.513 ' HA ' ' HA ' ' A' ' 63' ' ' SER . 7.4 m -76.4 160.73 29.29 Favored 'General case' 0 N--CA 1.445 -0.698 0 N-CA-C 108.109 -1.071 . . . . 0.0 108.109 169.788 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 104' ' ' LEU . . . . . 0.556 ' HG ' HD12 ' A' ' 146' ' ' ILE . 18.0 tp -56.5 -33.48 66.03 Favored 'General case' 0 C--N 1.323 -0.568 0 N-CA-C 111.914 0.339 . . . . 0.0 111.914 -174.007 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 105' ' ' SER . . . . . . . . . . . . . 12.1 p -87.77 -2.11 58.4 Favored 'General case' 0 CA--C 1.536 0.437 0 N-CA-C 112.416 0.524 . . . . 0.0 112.416 -177.698 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 106' ' ' GLU . . . . . 0.404 ' HG3' ' HB2' ' A' ' 103' ' ' SER . 43.3 mt-10 -94.41 -6.11 44.82 Favored 'General case' 0 C--O 1.234 0.268 0 CA-C-O 120.93 0.395 . . . . 0.0 111.17 -178.519 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 107' ' ' ILE . . . . . 0.54 HD11 ' HB2' ' A' ' 64' ' ' PHE . 74.8 mt -95.19 120.13 44.19 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.685 0 CA-C-N 116.147 -0.479 . . . . 0.0 111.456 -173.341 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 108' ' ' LEU . . . . . . . . . . . . . 85.7 mt -101.47 152.47 38.02 Favored Pre-proline 0 C--N 1.323 -0.549 0 CA-C-N 115.726 -0.67 . . . . 0.0 109.618 176.744 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 109' ' ' PRO . . . . . . . . . . . . . 18.4 Cg_endo -61.77 -24.39 77.38 Favored 'Trans proline' 0 C--O 1.233 0.235 0 C-N-CA 122.235 1.957 . . . . 0.0 111.516 176.446 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 110' ' ' ALA . . . . . . . . . . . . . . . -69.42 -38.44 77.9 Favored 'General case' 0 N--CA 1.452 -0.354 0 CA-C-N 115.612 -0.722 . . . . 0.0 111.011 179.761 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 111' ' ' ASP . . . . . 0.42 ' O ' HG13 ' A' ' 115' ' ' ILE . 54.6 m-20 -57.7 -52.94 63.37 Favored 'General case' 0 N--CA 1.464 0.228 0 CA-C-O 121.129 0.49 . . . . 0.0 110.437 -179.508 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 112' ' ' ILE . . . . . 0.503 HG12 HD11 ' A' ' 99' ' ' LEU . 28.4 mt -62.58 -47.39 93.16 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.51 0 CA-C-N 115.388 -0.824 . . . . 0.0 111.015 -177.745 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 113' ' ' GLN . . . . . . . . . . . . . 12.2 tm0? -64.97 -40.11 94.5 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.166 -0.47 . . . . 0.0 110.653 -176.2 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 114' ' ' SER . . . . . . . . . . . . . 27.9 t -57.11 -49.47 75.8 Favored 'General case' 0 C--O 1.237 0.438 0 CA-C-O 120.842 0.354 . . . . 0.0 110.477 179.034 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 115' ' ' ILE . . . . . 0.42 HG13 ' O ' ' A' ' 111' ' ' ASP . 60.9 mt -59.4 -49.34 83.89 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.179 0 CA-C-N 115.943 -0.571 . . . . 0.0 109.969 179.015 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 116' ' ' ILE . . . . . 0.47 HG21 HD12 ' A' ' 156' ' ' ILE . 33.4 mm -56.16 -44.29 78.59 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.227 0 CA-C-N 116.033 -0.531 . . . . 0.0 111.024 178.462 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 117' ' ' ASN . . . . . . . . . . . . . 10.1 t30 -55.62 -40.73 72.51 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 115.826 -0.624 . . . . 0.0 112.207 -177.494 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 118' ' ' GLU . . . . . . . . . . . . . 10.9 pt-20 -92.29 -9.22 42.79 Favored 'General case' 0 C--N 1.325 -0.462 0 N-CA-C 112.308 0.484 . . . . 0.0 112.308 -178.572 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 119' ' ' THR . . . . . . . . . . . . . 84.4 m -76.25 132.73 40.04 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-O 120.731 0.301 . . . . 0.0 110.844 178.91 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 120' ' ' LYS . . . . . 0.452 ' HE3' ' HB2' ' A' ' 120' ' ' LYS . 39.3 mtmt -106.91 89.55 3.04 Favored 'General case' 0 C--N 1.328 -0.364 0 N-CA-C 110.247 -0.279 . . . . 0.0 110.247 179.619 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 121' ' ' LEU . . . . . . . . . . . . . 86.8 mt -135.44 173.23 11.95 Favored 'General case' 0 C--N 1.322 -0.598 0 CA-C-N 116.565 -0.289 . . . . 0.0 110.265 178.27 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 122' ' ' ALA . . . . . . . . . . . . . . . -68.4 157.19 36.3 Favored 'General case' 0 C--N 1.327 -0.384 0 CA-C-N 116.359 -0.382 . . . . 0.0 110.543 178.906 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 123' ' ' LYS . . . . . . . . . . . . . 59.2 pttt -57.56 -36.41 71.63 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.2 -0.454 . . . . 0.0 110.83 -179.556 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 124' ' ' ASN . . . . . . . . . . . . . 52.9 t30 -64.82 -46.25 82.76 Favored 'General case' 0 C--N 1.332 -0.161 0 CA-C-N 116.235 -0.439 . . . . 0.0 110.405 177.591 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 125' ' ' THR . . . . . 0.476 ' O ' HG13 ' A' ' 129' ' ' ILE . 2.3 m -66.39 -45.31 80.46 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 115.573 -0.739 . . . . 0.0 111.187 -176.246 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 126' ' ' LEU . . . . . 0.638 ' HB3' HD11 ' A' ' 156' ' ' ILE . 83.8 mt -61.84 -48.01 82.48 Favored 'General case' 0 C--O 1.234 0.246 0 CA-C-N 116.286 -0.415 . . . . 0.0 111.248 -179.144 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 127' ' ' LYS . . . . . . . . . . . . . 98.1 mttt -63.56 -35.11 79.4 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.378 -0.374 . . . . 0.0 110.782 177.81 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 128' ' ' ALA . . . . . . . . . . . . . . . -62.18 -43.28 99.18 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-N 116.57 -0.286 . . . . 0.0 110.969 179.517 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 129' ' ' ILE . . . . . 0.476 HG13 ' O ' ' A' ' 125' ' ' THR . 68.4 mt -61.28 -47.52 93.13 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.33 0 CA-C-O 120.878 0.37 . . . . 0.0 110.499 178.491 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 130' ' ' ARG . . . . . 0.451 ' HD2' ' HB ' ' A' ' 154' ' ' VAL . 9.7 ttt180 -65.31 -45.89 82.52 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.258 -0.428 . . . . 0.0 111.213 -179.666 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 131' ' ' ASN . . . . . . . . . . . . . 92.9 m-20 -63.94 -33.39 75.61 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-O 120.65 0.262 . . . . 0.0 111.094 -179.755 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 132' ' ' THR . . . . . . . . . . . . . 98.0 m -65.53 -45.35 83.81 Favored 'General case' 0 C--N 1.325 -0.493 0 CA-C-O 120.887 0.375 . . . . 0.0 110.331 174.823 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 133' ' ' ALA . . . . . . . . . . . . . . . -64.4 -43.88 93.04 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 115.923 -0.58 . . . . 0.0 111.111 -179.386 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 134' ' ' SER . . . . . 0.534 ' O ' ' HG3' ' A' ' 138' ' ' ARG . 23.6 p -64.3 -35.51 81.1 Favored 'General case' 0 C--N 1.331 -0.196 0 CA-C-N 116.667 -0.242 . . . . 0.0 110.797 -179.373 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 135' ' ' GLN . . . . . . . . . . . . . 13.1 mm100 -59.63 -42.06 91.88 Favored 'General case' 0 C--N 1.331 -0.236 0 CA-C-O 120.803 0.335 . . . . 0.0 110.794 175.034 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 136' ' ' ILE . . . . . . . . . . . . . 69.3 mt -65.07 -42.98 95.89 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.365 0 CA-C-N 115.938 -0.573 . . . . 0.0 110.508 178.045 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 137' ' ' PHE . . . . . 0.437 ' O ' HG13 ' A' ' 141' ' ' ILE . 35.3 m-85 -66.92 -37.83 85.06 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.213 -0.449 . . . . 0.0 110.927 178.207 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 138' ' ' ARG . . . . . 0.534 ' HG3' ' O ' ' A' ' 134' ' ' SER . 54.1 mtp180 -59.32 -43.33 92.69 Favored 'General case' 0 CA--C 1.517 -0.324 0 N-CA-C 110.022 -0.362 . . . . 0.0 110.022 174.92 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 139' ' ' LEU . . . . . . . . . . . . . 49.9 tp -58.87 -41.18 86.47 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 115.75 -0.659 . . . . 0.0 110.075 178.205 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 140' ' ' ALA . . . . . 0.466 ' HB1' HD21 ' A' ' 104' ' ' LEU . . . -64.99 -41.63 95.23 Favored 'General case' 0 C--N 1.327 -0.391 0 CA-C-N 116.086 -0.506 . . . . 0.0 110.62 177.16 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 141' ' ' ILE . . . . . 0.437 HG13 ' O ' ' A' ' 137' ' ' PHE . 74.7 mt -61.81 -46.11 97.23 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.374 0 CA-C-N 116.14 -0.482 . . . . 0.0 110.902 176.299 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 142' ' ' GLU . . . . . . . . . . . . . 44.5 mt-10 -60.61 -36.77 79.41 Favored 'General case' 0 N--CA 1.465 0.282 0 CA-C-O 120.79 0.329 . . . . 0.0 111.012 178.548 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 143' ' ' ASN . . . . . . . . . . . . . 40.4 m-80 -88.23 10.44 19.56 Favored 'General case' 0 C--N 1.331 -0.225 0 CA-C-N 116.154 -0.475 . . . . 0.0 110.719 178.934 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 144' ' ' ARG . . . . . . . . . . . . . 61.6 mtt-85 64.23 21.71 12.61 Favored 'General case' 0 N--CA 1.466 0.334 0 CA-C-N 115.621 -0.718 . . . . 0.0 112.389 171.246 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 145' ' ' ALA . . . . . . . . . . . . . . . -85.26 -27.6 25.91 Favored 'General case' 0 C--N 1.323 -0.552 0 CA-C-O 120.806 0.336 . . . . 0.0 111.595 -176.678 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 146' ' ' ILE . . . . . 0.556 HD12 ' HG ' ' A' ' 104' ' ' LEU . 13.8 tt -143.88 149.58 17.72 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.536 0 CA-C-O 120.906 0.384 . . . . 0.0 110.452 -179.79 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 147' ' ' ASP . . . . . . . . . . . . . 0.9 OUTLIER -114.92 25.03 11.24 Favored 'General case' 0 C--N 1.325 -0.46 0 CA-C-O 121.254 0.549 . . . . 0.0 110.249 179.524 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 148' ' ' PHE . . . . . 0.441 ' H ' HG12 ' A' ' 146' ' ' ILE . 60.1 t80 -144.29 134.01 23.67 Favored 'General case' 0 C--N 1.323 -0.582 0 CA-C-N 115.581 -0.736 . . . . 0.0 109.589 -174.434 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 149' ' ' ASN . . . . . . . . . . . . . 53.6 t-20 -115.19 95.66 43.05 Favored Pre-proline 0 C--N 1.324 -0.525 0 N-CA-C 109.987 -0.375 . . . . 0.0 109.987 178.5 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 150' ' ' PRO . . . . . . . . . . . . . 32.9 Cg_exo -58.62 -33.18 98.01 Favored 'Trans proline' 0 C--N 1.342 0.225 0 C-N-CA 122.937 2.425 . . . . 0.0 112.769 -178.575 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 151' ' ' ALA . . . . . 0.507 ' HA ' HG23 ' A' ' 154' ' ' VAL . . . -73.38 -20.73 60.69 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 116.442 -0.345 . . . . 0.0 111.502 -176.327 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 152' ' ' ASP . . . . . . . . . . . . . 29.9 t70 -70.15 -23.72 63.05 Favored 'General case' 0 C--N 1.325 -0.5 0 CA-C-O 121.123 0.487 . . . . 0.0 110.62 178.942 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 153' ' ' TYR . . . . . . . . . . . . . 77.0 m-85 -96.59 -2.88 43.97 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.114 -0.493 . . . . 0.0 110.763 -178.571 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 154' ' ' VAL . . . . . 0.507 HG23 ' HA ' ' A' ' 151' ' ' ALA . 61.0 t -77.64 117.66 23.15 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.391 0 CA-C-N 116.384 -0.371 . . . . 0.0 110.374 179.19 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 155' ' ' ARG . . . . . . . . . . . . . 51.1 mtp85 -92.12 141.9 28.09 Favored 'General case' 0 C--N 1.318 -0.802 0 CA-C-O 120.972 0.415 . . . . 0.0 110.514 176.32 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 156' ' ' ILE . . . . . 0.638 HD11 ' HB3' ' A' ' 126' ' ' LEU . 2.9 tp -106.97 129.31 24.55 Favored Pre-proline 0 C--N 1.318 -0.789 0 CA-C-N 115.456 -0.793 . . . . 0.0 109.609 -176.889 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 157' ' ' PRO . . . . . . . . . . . . . 86.1 Cg_endo . . . . . 0 N--CA 1.454 -0.8 0 C-N-CA 122.631 2.221 . . . . 0.0 113.08 -179.426 . . . . . . . . 0 0 . 1 . 007 nuclear nobuild core ' A' A ' 63' ' ' SER . . . . . 0.6 ' HA ' ' HA ' ' A' ' 103' ' ' SER . 47.0 m . . . . . 0 N--CA 1.444 -0.77 0 CA-C-O 120.753 0.311 . . . . 0.0 110.54 . . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 64' ' ' PHE . . . . . 0.517 ' HB2' HD11 ' A' ' 107' ' ' ILE . 80.6 t80 -58.47 -34.4 70.84 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 115.865 -0.607 . . . . 0.0 111.145 -176.171 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 65' ' ' GLY . . . . . . . . . . . . . . . -61.68 -40.78 99.23 Favored Glycine 0 N--CA 1.453 -0.224 0 C-N-CA 120.898 -0.668 . . . . 0.0 112.636 179.901 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 66' ' ' ASP . . . . . . . . . . . . . 24.7 t70 -61.11 -52.16 66.08 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-O 120.936 0.398 . . . . 0.0 110.163 177.635 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 67' ' ' TRP . . . . . 0.413 ' NE1' HD11 ' A' ' 104' ' ' LEU . 98.7 m95 -65.51 -34.47 78.33 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-N 115.58 -0.737 . . . . 0.0 111.403 -179.204 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 68' ' ' ALA . . . . . 0.592 ' O ' ' HG ' ' A' ' 72' ' ' LEU . . . -61.96 -50.85 70.46 Favored 'General case' 0 C--N 1.327 -0.377 0 CA-C-O 120.665 0.269 . . . . 0.0 110.827 178.598 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 69' ' ' GLU . . . . . . . . . . . . . 33.3 tt0 -69.87 -34.37 73.48 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-O 120.769 0.319 . . . . 0.0 110.213 -179.791 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 70' ' ' LYS . . . . . . . . . . . . . 48.9 tttm -61.72 -42.93 99.6 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-O 121.298 0.57 . . . . 0.0 109.556 176.264 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 71' ' ' PHE . . . . . . . . . . . . . 71.4 t80 -64.31 -45.15 89.17 Favored 'General case' 0 C--N 1.326 -0.423 0 CA-C-N 115.244 -0.889 . . . . 0.0 111.056 176.82 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 72' ' ' LEU . . . . . 0.592 ' HG ' ' O ' ' A' ' 68' ' ' ALA . 89.2 mt -61.44 -42.41 98.72 Favored 'General case' 0 C--N 1.327 -0.396 0 CA-C-O 121.017 0.436 . . . . 0.0 110.38 178.706 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 73' ' ' LYS . . . . . 0.511 ' HD2' ' HA ' ' A' ' 73' ' ' LYS . 18.2 tptt -70.0 -38.22 75.91 Favored 'General case' 0 C--N 1.326 -0.434 0 CA-C-N 115.842 -0.617 . . . . 0.0 111.15 -176.023 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 74' ' ' SER . . . . . . . . . . . . . 8.1 p -70.06 -32.4 70.48 Favored 'General case' 0 C--N 1.327 -0.376 0 C-N-CA 121.077 -0.249 . . . . 0.0 110.877 179.987 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 75' ' ' LYS . . . . . . . . . . . . . 30.8 mmtp -73.09 -37.28 66.81 Favored 'General case' 0 C--O 1.234 0.273 0 CA-C-O 120.775 0.322 . . . . 0.0 110.478 174.634 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 76' ' ' GLU . . . . . . . . . . . . . 42.0 tt0 -61.84 -46.12 90.83 Favored 'General case' 0 C--N 1.327 -0.379 0 CA-C-N 116.053 -0.521 . . . . 0.0 110.251 177.474 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 77' ' ' ALA . . . . . . . . . . . . . . . -70.54 -33.41 71.12 Favored 'General case' 0 C--N 1.325 -0.466 0 CA-C-N 115.816 -0.629 . . . . 0.0 111.072 177.644 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 78' ' ' ASP . . . . . . . . . . . . . 20.1 t70 -57.9 -47.05 83.95 Favored 'General case' 0 CA--C 1.518 -0.286 0 CA-C-N 116.142 -0.481 . . . . 0.0 110.431 177.449 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 79' ' ' GLY . . . . . . . . . . . . . . . 114.98 41.17 0.85 Allowed Glycine 0 N--CA 1.443 -0.835 0 C-N-CA 120.436 -0.887 . . . . 0.0 112.966 176.288 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 80' ' ' VAL . . . . . . . . . . . . . 29.0 m -77.33 157.53 5.29 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.442 0 N-CA-C 110.137 -0.319 . . . . 0.0 110.137 174.649 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 81' ' ' SER . . . . . . . . . . . . . 18.4 m -62.07 150.3 38.7 Favored 'General case' 0 C--N 1.324 -0.534 0 N-CA-C 110.239 -0.282 . . . . 0.0 110.239 177.925 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 82' ' ' VAL . . . . . . . . . . . . . 55.4 t -58.97 -42.82 87.24 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.495 0 CA-C-N 116.356 -0.384 . . . . 0.0 110.453 -177.348 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 83' ' ' SER . . . . . . . . . . . . . 13.4 m -59.44 -39.19 82.76 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 116.311 -0.404 . . . . 0.0 111.131 179.054 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 84' ' ' GLN . . . . . . . . . . . . . 7.7 tp-100 -63.32 -45.03 93.2 Favored 'General case' 0 C--O 1.234 0.274 0 CA-C-O 121.107 0.48 . . . . 0.0 110.298 177.407 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 85' ' ' LEU . . . . . . . . . . . . . 46.8 tp -67.88 -36.18 79.79 Favored 'General case' 0 C--N 1.327 -0.408 0 CA-C-N 115.936 -0.575 . . . . 0.0 110.428 179.455 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 86' ' ' ASN . . . . . . . . . . . . . 11.8 m120 -60.83 -47.2 87.45 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.233 -0.44 . . . . 0.0 110.563 178.215 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 87' ' ' SER . . . . . . . . . . . . . 3.5 p -63.36 -36.32 83.3 Favored 'General case' 0 CA--C 1.531 0.243 0 C-N-CA 121.038 -0.265 . . . . 0.0 111.319 179.396 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 88' ' ' TYR . . . . . . . . . . . . . 6.6 m-85 -59.62 -54.49 45.86 Favored 'General case' 0 C--O 1.233 0.232 0 CA-C-O 121.707 0.765 . . . . 0.0 110.167 174.236 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 89' ' ' LYS . . . . . 0.403 ' HE3' ' HB2' ' A' ' 89' ' ' LYS . 34.6 ttmt -65.59 -32.97 74.84 Favored 'General case' 0 C--N 1.325 -0.467 0 CA-C-N 114.597 -1.183 . . . . 0.0 110.88 -175.741 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 90' ' ' ASN . . . . . . . . . . . . . 27.6 t-20 -64.43 -52.18 59.41 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 116.02 -0.536 . . . . 0.0 111.324 179.708 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 91' ' ' TYR . . . . . . . . . . . . . 22.3 m-85 -61.06 -39.72 90.91 Favored 'General case' 0 C--O 1.234 0.259 0 CA-C-O 121.033 0.444 . . . . 0.0 110.233 179.756 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 92' ' ' CYS . . . . . 0.614 ' HA ' ' HB2' ' A' ' 96' ' ' LEU . 42.7 t -64.63 -49.57 70.56 Favored 'General case' 0 C--N 1.325 -0.474 0 CA-C-N 115.31 -0.859 . . . . 0.0 111.094 -178.09 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 93' ' ' ARG . . . . . . . . . . . . . 28.9 mmt180 -73.09 -6.56 46.47 Favored 'General case' 0 C--N 1.328 -0.35 0 N-CA-C 112.94 0.718 . . . . 0.0 112.94 -175.099 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 94' ' ' ASN . . . . . . . . . . . . . 52.7 m-80 -118.9 -64.66 1.25 Allowed 'General case' 0 C--N 1.327 -0.403 0 C-N-CA 119.537 -0.865 . . . . 0.0 112.721 -179.402 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 95' ' ' HIS . . . . . . . . . . . . . 82.7 m-70 -88.98 -20.49 24.39 Favored 'General case' 0 C--N 1.325 -0.469 0 N-CA-C 112.617 0.599 . . . . 0.0 112.617 -173.838 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 96' ' ' LEU . . . . . 0.614 ' HB2' ' HA ' ' A' ' 92' ' ' CYS . 83.4 mt -99.05 7.14 46.22 Favored 'General case' 0 C--N 1.325 -0.463 0 C-N-CA 120.946 -0.302 . . . . 0.0 111.065 -178.751 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 97' ' ' SER . . . . . 0.545 ' N ' ' HD2' ' A' ' 98' ' ' PRO . 50.2 m -57.63 -49.26 94.78 Favored Pre-proline 0 CA--C 1.537 0.453 0 CA-C-N 116.383 -0.371 . . . . 0.0 111.896 178.907 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 98' ' ' PRO . . . . . 0.545 ' HD2' ' N ' ' A' ' 97' ' ' SER . 9.5 Cg_endo -53.9 -40.07 82.13 Favored 'Trans proline' 0 C--N 1.358 1.037 0 C-N-CA 122.047 1.831 . . . . 0.0 112.458 176.727 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 99' ' ' LEU . . . . . 0.558 HD23 ' HD2' ' A' ' 102' ' ' LYS . 90.6 mt -75.28 -29.53 60.16 Favored 'General case' 0 C--N 1.332 -0.188 0 CA-C-N 116.255 -0.43 . . . . 0.0 111.107 -178.736 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 100' ' ' TYR . . . . . . . . . . . . . 23.4 t80 -55.74 -29.82 60.19 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 115.759 -0.655 . . . . 0.0 111.701 -174.318 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 101' ' ' MET . . . . . . . . . . . . . 65.2 mtt -106.77 10.75 30.72 Favored 'General case' 0 C--N 1.326 -0.44 0 CA-C-O 120.663 0.268 . . . . 0.0 111.571 -178.16 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 102' ' ' LYS . . . . . 0.558 ' HD2' HD23 ' A' ' 99' ' ' LEU . 68.3 mttm -97.03 134.41 40.42 Favored 'General case' 0 C--N 1.326 -0.424 0 N-CA-C 110.217 -0.29 . . . . 0.0 110.217 177.628 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 103' ' ' SER . . . . . 0.6 ' HA ' ' HA ' ' A' ' 63' ' ' SER . 68.0 m -73.52 152.28 40.72 Favored 'General case' 0 C--N 1.323 -0.568 0 N-CA-C 109.298 -0.631 . . . . 0.0 109.298 172.823 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 104' ' ' LEU . . . . . 0.442 ' HA ' HD12 ' A' ' 107' ' ' ILE . 82.2 mt -53.51 -35.9 61.16 Favored 'General case' 0 C--N 1.33 -0.276 0 N-CA-C 112.265 0.469 . . . . 0.0 112.265 -174.64 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 105' ' ' SER . . . . . . . . . . . . . 2.7 p -79.55 -6.81 57.79 Favored 'General case' 0 C--N 1.325 -0.474 0 N-CA-C 111.95 0.352 . . . . 0.0 111.95 -177.748 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 106' ' ' GLU . . . . . 0.532 ' OE1' ' HB2' ' A' ' 103' ' ' SER . 1.9 mp0 -112.21 7.21 19.4 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-O 120.746 0.308 . . . . 0.0 110.974 178.704 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 107' ' ' ILE . . . . . 0.517 HD11 ' HB2' ' A' ' 64' ' ' PHE . 81.8 mt -88.99 117.02 31.54 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.46 0 CA-C-O 121.106 0.479 . . . . 0.0 110.464 179.553 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 108' ' ' LEU . . . . . . . . . . . . . 85.6 mt -95.25 134.34 24.69 Favored Pre-proline 0 C--N 1.322 -0.609 0 CA-C-N 115.877 -0.601 . . . . 0.0 110.273 -179.868 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 109' ' ' PRO . . . . . . . . . . . . . 40.1 Cg_exo -58.79 -34.4 98.98 Favored 'Trans proline' 0 C--N 1.343 0.264 0 C-N-CA 122.643 2.229 . . . . 0.0 111.735 176.771 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 110' ' ' ALA . . . . . . . . . . . . . . . -70.64 -23.4 62.53 Favored 'General case' 0 C--N 1.33 -0.243 0 CA-C-N 115.624 -0.716 . . . . 0.0 111.106 178.702 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 111' ' ' ASP . . . . . 0.537 ' OD2' ' HE3' ' A' ' 102' ' ' LYS . 31.1 t70 -71.86 -42.97 66.25 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-O 121.181 0.515 . . . . 0.0 109.631 -179.932 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 112' ' ' ILE . . . . . 0.471 HD12 ' HB2' ' A' ' 150' ' ' PRO . 37.4 mt -67.89 -39.7 82.21 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.437 0 CA-C-N 115.69 -0.686 . . . . 0.0 110.186 176.689 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 113' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -59.86 -47.19 86.76 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 115.607 -0.724 . . . . 0.0 110.055 179.081 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 114' ' ' SER . . . . . . . . . . . . . 13.1 p -65.91 -27.56 68.28 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 116.261 -0.427 . . . . 0.0 111.148 -179.261 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 115' ' ' ILE . . . . . 0.519 HG13 ' O ' ' A' ' 111' ' ' ASP . 76.7 mt -61.19 -43.33 96.19 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.231 0 CA-C-O 121.198 0.523 . . . . 0.0 110.399 173.515 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 116' ' ' ILE . . . . . . . . . . . . . 50.7 mm -63.18 -33.35 60.42 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.599 0 CA-C-O 121.22 0.534 . . . . 0.0 110.17 177.228 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 117' ' ' ASN . . . . . . . . . . . . . 0.2 OUTLIER -75.56 -29.18 59.27 Favored 'General case' 0 C--N 1.326 -0.429 0 CA-C-N 115.799 -0.637 . . . . 0.0 110.77 -179.151 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 118' ' ' GLU . . . . . 0.488 ' HG3' ' HA ' ' A' ' 115' ' ' ILE . 3.1 pp20? -87.81 -8.99 55.19 Favored 'General case' 0 C--N 1.33 -0.245 0 C-N-CA 120.599 -0.441 . . . . 0.0 110.887 179.587 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 119' ' ' THR . . . . . . . . . . . . . 34.6 m -80.83 117.77 21.77 Favored 'General case' 0 N--CA 1.449 -0.5 0 N-CA-C 109.472 -0.566 . . . . 0.0 109.472 174.307 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 120' ' ' LYS . . . . . . . . . . . . . 67.3 mttm -98.29 32.14 2.57 Favored 'General case' 0 C--N 1.324 -0.534 0 CA-C-O 121.37 0.605 . . . . 0.0 110.77 -175.734 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 121' ' ' LEU . . . . . 0.414 HD23 HG21 ' A' ' 125' ' ' THR . 10.8 mp -100.86 -175.57 2.92 Favored 'General case' 0 C--N 1.322 -0.619 0 CA-C-N 115.642 -0.708 . . . . 0.0 110.266 178.998 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 122' ' ' ALA . . . . . 0.533 ' O ' ' HG ' ' A' ' 126' ' ' LEU . . . -75.03 164.56 26.41 Favored 'General case' 0 C--N 1.325 -0.495 0 CA-C-O 121.142 0.496 . . . . 0.0 111.888 -175.462 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 123' ' ' LYS . . . . . . . . . . . . . 64.6 tttp -59.86 -42.16 93.06 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 115.28 -0.873 . . . . 0.0 111.879 -175.784 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 124' ' ' ASN . . . . . . . . . . . . . 26.8 p-10 -63.29 -34.3 77.39 Favored 'General case' 0 C--N 1.326 -0.436 0 CA-C-O 120.822 0.344 . . . . 0.0 110.988 179.947 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 125' ' ' THR . . . . . 0.414 HG21 HD23 ' A' ' 121' ' ' LEU . 17.2 m -73.1 -38.02 66.51 Favored 'General case' 0 C--N 1.326 -0.428 0 CA-C-O 120.794 0.33 . . . . 0.0 110.358 177.989 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 126' ' ' LEU . . . . . 0.533 ' HG ' ' O ' ' A' ' 122' ' ' ALA . 89.5 mt -58.96 -49.01 79.49 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-O 121.146 0.498 . . . . 0.0 110.686 178.556 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 127' ' ' LYS . . . . . 0.534 ' HA ' ' HB3' ' A' ' 130' ' ' ARG . 16.4 ptmt -74.91 -20.25 59.79 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-N 116.072 -0.513 . . . . 0.0 110.93 -177.089 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 128' ' ' ALA . . . . . . . . . . . . . . . -66.57 -41.76 88.08 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-O 120.757 0.313 . . . . 0.0 110.62 174.822 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 129' ' ' ILE . . . . . . . . . . . . . 46.9 mt -64.86 -40.28 88.53 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.24 0 N-CA-C 109.192 -0.67 . . . . 0.0 109.192 175.057 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 130' ' ' ARG . . . . . 0.534 ' HB3' ' HA ' ' A' ' 127' ' ' LYS . 13.5 tpt85 -55.02 -45.41 75.16 Favored 'General case' 0 CA--C 1.533 0.314 0 CA-C-N 115.13 -0.941 . . . . 0.0 111.092 173.427 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 131' ' ' ASN . . . . . . . . . . . . . 12.9 m-80 -66.84 -47.04 73.2 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.366 -0.379 . . . . 0.0 111.251 178.637 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 132' ' ' THR . . . . . . . . . . . . . 40.3 m -57.9 -53.18 61.1 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.28 -0.418 . . . . 0.0 111.201 -178.786 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 133' ' ' ALA . . . . . . . . . . . . . . . -60.67 -36.25 78.27 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.234 -0.439 . . . . 0.0 111.034 -178.82 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 134' ' ' SER . . . . . 0.519 ' O ' ' HG3' ' A' ' 138' ' ' ARG . 39.0 t -60.31 -50.0 75.38 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.252 -0.431 . . . . 0.0 110.798 179.925 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 135' ' ' GLN . . . . . . . . . . . . . 75.4 mt-30 -59.47 -37.28 77.78 Favored 'General case' 0 C--N 1.331 -0.216 0 CA-C-N 116.384 -0.371 . . . . 0.0 110.832 -177.993 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 136' ' ' ILE . . . . . . . . . . . . . 71.0 mt -64.55 -47.35 89.49 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.386 0 CA-C-N 116.034 -0.53 . . . . 0.0 110.769 178.879 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 137' ' ' PHE . . . . . 0.459 ' O ' HG13 ' A' ' 141' ' ' ILE . 41.7 m-85 -65.98 -35.08 79.6 Favored 'General case' 0 C--N 1.331 -0.224 0 CA-C-N 116.544 -0.298 . . . . 0.0 111.41 179.543 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 138' ' ' ARG . . . . . 0.519 ' HG3' ' O ' ' A' ' 134' ' ' SER . 45.0 mtp-105 -61.9 -38.84 89.87 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-O 120.888 0.375 . . . . 0.0 110.492 178.157 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 139' ' ' LEU . . . . . . . . . . . . . 50.2 tp -60.55 -36.88 79.54 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-N 115.878 -0.601 . . . . 0.0 110.355 178.072 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 140' ' ' ALA . . . . . . . . . . . . . . . -69.6 -37.75 77.03 Favored 'General case' 0 C--N 1.327 -0.37 0 CA-C-N 115.961 -0.563 . . . . 0.0 110.365 177.353 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 141' ' ' ILE . . . . . 0.459 HG13 ' O ' ' A' ' 137' ' ' PHE . 70.2 mt -63.26 -44.46 99.21 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.277 0 CA-C-N 116.061 -0.518 . . . . 0.0 110.403 175.955 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 142' ' ' GLU . . . . . . . . . . . . . 51.8 mt-10 -62.14 -27.99 69.33 Favored 'General case' 0 C--N 1.331 -0.224 0 CA-C-N 116.129 -0.487 . . . . 0.0 111.59 178.632 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 143' ' ' ASN . . . . . 0.514 ' C ' ' HD2' ' A' ' 144' ' ' ARG . 34.9 m-80 -97.26 21.18 10.33 Favored 'General case' 0 C--N 1.324 -0.511 0 CA-C-N 116.143 -0.481 . . . . 0.0 110.783 178.439 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 144' ' ' ARG . . . . . 0.514 ' HD2' ' C ' ' A' ' 143' ' ' ASN . 0.0 OUTLIER 38.48 39.18 0.29 Allowed 'General case' 0 N--CA 1.472 0.648 0 C-N-CA 124.347 1.059 . . . . 0.0 112.496 -177.497 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' A' A ' 145' ' ' ALA . . . . . . . . . . . . . . . -88.33 -32.88 18.2 Favored 'General case' 0 C--N 1.325 -0.466 0 CA-C-N 115.808 -0.633 . . . . 0.0 109.613 176.983 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 146' ' ' ILE . . . . . 0.511 HG12 ' H ' ' A' ' 148' ' ' PHE . 16.6 tt -149.47 133.56 8.69 Favored 'Isoleucine or valine' 0 N--CA 1.449 -0.514 0 CA-C-N 115.283 -0.871 . . . . 0.0 109.439 177.506 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 147' ' ' ASP . . . . . . . . . . . . . 35.2 t70 -102.56 24.18 10.83 Favored 'General case' 0 C--N 1.325 -0.496 0 CA-C-O 122.09 0.948 . . . . 0.0 109.484 179.636 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 148' ' ' PHE . . . . . 0.511 ' H ' HG12 ' A' ' 146' ' ' ILE . 68.7 t80 -132.7 133.26 43.31 Favored 'General case' 0 C--N 1.319 -0.718 0 CA-C-N 114.927 -1.033 . . . . 0.0 109.64 -174.312 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 149' ' ' ASN . . . . . . . . . . . . . 18.5 t-20 -116.16 99.57 52.78 Favored Pre-proline 0 C--N 1.323 -0.571 0 N-CA-C 110.283 -0.266 . . . . 0.0 110.283 -179.84 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 150' ' ' PRO . . . . . 0.471 ' HB2' HD12 ' A' ' 112' ' ' ILE . 22.0 Cg_exo -65.67 -26.08 53.75 Favored 'Trans proline' 0 C--O 1.23 0.124 0 C-N-CA 122.68 2.253 . . . . 0.0 112.283 -178.818 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 151' ' ' ALA . . . . . . . . . . . . . . . -69.92 -20.89 63.33 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 115.995 -0.548 . . . . 0.0 111.333 -177.469 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 152' ' ' ASP . . . . . . . . . . . . . 25.2 t70 -64.15 -29.79 70.89 Favored 'General case' 0 C--O 1.234 0.253 0 CA-C-N 116.122 -0.49 . . . . 0.0 110.863 179.807 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 153' ' ' TYR . . . . . . . . . . . . . 78.7 m-85 -87.73 -5.19 58.78 Favored 'General case' 0 C--N 1.327 -0.383 0 CA-C-N 115.709 -0.678 . . . . 0.0 111.17 -176.175 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 154' ' ' VAL . . . . . . . . . . . . . 66.0 t -79.5 107.42 11.91 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.445 0 CA-C-O 120.929 0.395 . . . . 0.0 110.214 -179.399 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 155' ' ' ARG . . . . . . . . . . . . . 89.4 mtt180 -91.09 133.75 35.08 Favored 'General case' 0 C--N 1.323 -0.585 0 CA-C-N 116.104 -0.498 . . . . 0.0 110.54 -178.432 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 156' ' ' ILE . . . . . . . . . . . . . 50.6 mm -91.94 116.49 66.56 Favored Pre-proline 0 C--N 1.325 -0.495 0 CA-C-N 116.114 -0.494 . . . . 0.0 110.491 -176.951 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 157' ' ' PRO . . . . . . . . . . . . . 31.9 Cg_endo . . . . . 0 C--O 1.235 0.355 0 C-N-CA 122.97 2.447 . . . . 0.0 113.219 -175.86 . . . . . . . . 0 0 . 1 . 008 nuclear nobuild core ' A' A ' 63' ' ' SER . . . . . . . . . . . . . 72.4 p . . . . . 0 N--CA 1.448 -0.545 0 N-CA-C 109.565 -0.531 . . . . 0.0 109.565 . . . . . . . . . 0 0 . 1 . 008 nuclear nobuild core ' A' A ' 64' ' ' PHE . . . . . 0.491 ' HB2' HD11 ' A' ' 107' ' ' ILE . 87.1 t80 -60.25 -35.71 76.12 Favored 'General case' 0 C--N 1.329 -0.299 0 N-CA-C 109.896 -0.409 . . . . 0.0 109.896 176.642 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 65' ' ' GLY . . . . . . . . . . . . . . . -62.01 -39.32 97.42 Favored Glycine 0 N--CA 1.452 -0.267 0 C-N-CA 121.13 -0.557 . . . . 0.0 112.106 176.964 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 66' ' ' ASP . . . . . 0.401 ' O ' ' HG3' ' A' ' 70' ' ' LYS . 8.6 m-20 -63.39 -52.08 63.14 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-O 120.908 0.385 . . . . 0.0 110.445 177.958 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 67' ' ' TRP . . . . . . . . . . . . . 95.9 m95 -67.19 -35.3 79.33 Favored 'General case' 0 C--N 1.326 -0.433 0 CA-C-N 115.921 -0.582 . . . . 0.0 111.37 -178.011 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 68' ' ' ALA . . . . . 0.671 ' O ' ' HG ' ' A' ' 72' ' ' LEU . . . -61.07 -51.09 70.62 Favored 'General case' 0 C--N 1.326 -0.449 0 N-CA-C 110.065 -0.346 . . . . 0.0 110.065 175.806 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 69' ' ' GLU . . . . . . . . . . . . . 11.9 tp10 -61.29 -37.86 84.72 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.099 -0.5 . . . . 0.0 110.665 -179.379 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 70' ' ' LYS . . . . . 0.401 ' HG3' ' O ' ' A' ' 66' ' ' ASP . 57.2 mtpt -66.57 -45.8 78.11 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.465 -0.334 . . . . 0.0 110.79 176.956 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 71' ' ' PHE . . . . . . . . . . . . . 89.9 t80 -61.77 -42.29 98.79 Favored 'General case' 0 C--N 1.327 -0.381 0 CA-C-N 116.241 -0.436 . . . . 0.0 110.384 179.215 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 72' ' ' LEU . . . . . 0.671 ' HG ' ' O ' ' A' ' 68' ' ' ALA . 91.7 mt -62.82 -44.23 96.7 Favored 'General case' 0 C--N 1.326 -0.439 0 CA-C-N 115.978 -0.555 . . . . 0.0 110.751 178.335 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 73' ' ' LYS . . . . . . . . . . . . . 22.7 tptp -65.67 -37.16 85.72 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-O 121.137 0.494 . . . . 0.0 110.057 179.794 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 74' ' ' SER . . . . . . . . . . . . . 9.8 t -65.44 -44.57 86.88 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 115.688 -0.687 . . . . 0.0 110.183 177.766 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 75' ' ' LYS . . . . . . . . . . . . . 20.6 mmtt -68.17 -31.55 71.18 Favored 'General case' 0 C--N 1.331 -0.204 0 CA-C-N 116.371 -0.377 . . . . 0.0 110.983 178.796 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 76' ' ' GLU . . . . . . . . . . . . . 38.9 tt0 -57.64 -49.13 77.47 Favored 'General case' 0 C--N 1.324 -0.51 0 CA-C-N 115.92 -0.582 . . . . 0.0 110.097 174.947 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 77' ' ' ALA . . . . . . . . . . . . . . . -74.69 -29.13 61.11 Favored 'General case' 0 C--N 1.327 -0.382 0 CA-C-N 115.705 -0.68 . . . . 0.0 111.34 178.824 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 78' ' ' ASP . . . . . . . . . . . . . 19.8 t70 -55.34 -45.45 76.42 Favored 'General case' 0 N--CA 1.465 0.32 0 CA-C-N 116.098 -0.501 . . . . 0.0 110.564 177.058 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 79' ' ' GLY . . . . . . . . . . . . . . . 128.41 62.46 0.12 Allowed Glycine 0 N--CA 1.446 -0.697 0 C-N-CA 120.679 -0.772 . . . . 0.0 112.308 176.906 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 80' ' ' VAL . . . . . . . . . . . . . 34.4 m -115.66 155.17 17.02 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.589 0 CA-C-O 120.677 0.275 . . . . 0.0 110.562 177.403 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 81' ' ' SER . . . . . . . . . . . . . 31.0 t -65.06 153.75 39.82 Favored 'General case' 0 C--N 1.324 -0.532 0 CA-C-N 115.817 -0.629 . . . . 0.0 110.261 175.818 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 82' ' ' VAL . . . . . . . . . . . . . 10.2 p -60.03 -36.83 69.79 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.318 0 CA-C-O 120.818 0.342 . . . . 0.0 110.325 177.453 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 83' ' ' SER . . . . . . . . . . . . . 34.2 t -69.43 -34.48 74.51 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-O 121.185 0.517 . . . . 0.0 109.973 178.254 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 84' ' ' GLN . . . . . . . . . . . . . 8.0 tp-100 -65.97 -40.63 91.41 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 115.825 -0.625 . . . . 0.0 109.852 178.23 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 85' ' ' LEU . . . . . 0.42 HD11 ' HB3' ' A' ' 72' ' ' LEU . 54.4 tp -70.41 -43.65 69.53 Favored 'General case' 0 C--N 1.326 -0.42 0 CA-C-N 115.987 -0.551 . . . . 0.0 110.831 178.229 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 86' ' ' ASN . . . . . . . . . . . . . 97.3 m-20 -60.45 -44.34 95.96 Favored 'General case' 0 C--N 1.332 -0.16 0 CA-C-N 116.437 -0.347 . . . . 0.0 110.922 179.498 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 87' ' ' SER . . . . . . . . . . . . . 8.4 p -61.58 -38.2 86.66 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.669 -0.241 . . . . 0.0 110.798 -179.735 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 88' ' ' TYR . . . . . 0.408 ' HA ' ' CD2' ' A' ' 91' ' ' TYR . 18.0 m-30 -57.89 -46.05 85.5 Favored 'General case' 0 C--O 1.231 0.1 0 CA-C-O 120.983 0.421 . . . . 0.0 110.32 173.81 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 89' ' ' LYS . . . . . 0.593 ' HA ' ' SG ' ' A' ' 92' ' ' CYS . 60.0 mttm -63.24 -38.1 89.85 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 115.681 -0.69 . . . . 0.0 110.872 179.264 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 90' ' ' ASN . . . . . . . . . . . . . 9.4 m120 -60.02 -32.49 70.94 Favored 'General case' 0 C--N 1.327 -0.401 0 CA-C-O 120.753 0.311 . . . . 0.0 111.085 177.408 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 91' ' ' TYR . . . . . 0.408 ' CD2' ' HA ' ' A' ' 88' ' ' TYR . 21.1 m-85 -70.38 -52.6 21.27 Favored 'General case' 0 C--O 1.235 0.327 0 CA-C-O 120.735 0.302 . . . . 0.0 110.619 178.17 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 92' ' ' CYS . . . . . 0.704 ' HA ' ' HB2' ' A' ' 96' ' ' LEU . 21.2 p -75.79 -39.18 57.4 Favored 'General case' 0 C--N 1.33 -0.253 0 N-CA-C 112.256 0.465 . . . . 0.0 112.256 -172.903 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 93' ' ' ARG . . . . . . . . . . . . . 43.8 ttt-85 -69.87 -47.92 60.72 Favored 'General case' 0 C--N 1.324 -0.51 0 CA-C-O 120.866 0.365 . . . . 0.0 111.502 -176.902 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 94' ' ' ASN . . . . . . . . . . . . . 17.7 m120 -87.54 -57.63 2.88 Favored 'General case' 0 C--N 1.325 -0.469 0 N-CA-C 112.205 0.446 . . . . 0.0 112.205 -173.282 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 95' ' ' HIS . . . . . . . . . . . . . 8.5 m80 -86.46 -40.57 15.19 Favored 'General case' 0 C--N 1.327 -0.389 0 N-CA-C 113.263 0.838 . . . . 0.0 113.263 -173.292 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 96' ' ' LEU . . . . . 0.704 ' HB2' ' HA ' ' A' ' 92' ' ' CYS . 76.6 mt -87.0 21.45 2.3 Favored 'General case' 0 C--N 1.325 -0.459 0 C-N-CA 120.704 -0.398 . . . . 0.0 110.69 -179.276 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 97' ' ' SER . . . . . 0.565 ' OG ' ' HD3' ' A' ' 98' ' ' PRO . 1.8 p -55.65 -45.29 99.9 Favored Pre-proline 0 CA--C 1.54 0.56 0 N-CA-C 113.003 0.742 . . . . 0.0 113.003 -179.006 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 98' ' ' PRO . . . . . 0.565 ' HD3' ' OG ' ' A' ' 97' ' ' SER . 32.2 Cg_exo -58.28 -38.23 91.75 Favored 'Trans proline' 0 C--N 1.36 1.18 0 C-N-CA 121.581 1.521 . . . . 0.0 111.688 177.488 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 99' ' ' LEU . . . . . 0.576 HD22 HG23 ' A' ' 107' ' ' ILE . 34.9 mt -77.44 -34.34 54.57 Favored 'General case' 0 C--N 1.325 -0.459 0 CA-C-N 115.809 -0.632 . . . . 0.0 110.34 -178.055 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 100' ' ' TYR . . . . . . . . . . . . . 5.7 t80 -55.5 -30.55 60.86 Favored 'General case' 0 C--N 1.326 -0.436 0 CA-C-N 115.279 -0.873 . . . . 0.0 111.226 -175.922 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 101' ' ' MET . . . . . . . . . . . . . 21.6 mmt -100.69 4.2 42.99 Favored 'General case' 0 C--N 1.326 -0.438 0 CA-C-N 116.346 -0.388 . . . . 0.0 111.403 -177.044 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 102' ' ' LYS . . . . . 0.487 ' HG3' ' O ' ' A' ' 98' ' ' PRO . 99.0 mttt -107.39 160.88 15.3 Favored 'General case' 0 C--N 1.325 -0.49 0 CA-C-O 121.055 0.455 . . . . 0.0 111.193 -178.309 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 103' ' ' SER . . . . . 0.408 ' O ' HG13 ' A' ' 107' ' ' ILE . 27.9 t -88.55 162.51 16.35 Favored 'General case' 0 C--N 1.325 -0.48 0 CA-C-N 115.862 -0.608 . . . . 0.0 109.998 176.531 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 104' ' ' LEU . . . . . 0.412 ' HB3' HD12 ' A' ' 146' ' ' ILE . 67.0 mt -61.61 -29.72 70.23 Favored 'General case' 0 C--N 1.326 -0.421 0 CA-C-N 116.039 -0.528 . . . . 0.0 111.81 -174.646 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 105' ' ' SER . . . . . . . . . . . . . 19.9 p -84.84 -15.86 43.31 Favored 'General case' 0 C--N 1.325 -0.462 0 CA-C-N 116.38 -0.373 . . . . 0.0 111.332 -178.318 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 106' ' ' GLU . . . . . . . . . . . . . 47.5 mt-10 -94.97 -24.23 17.04 Favored 'General case' 0 C--N 1.327 -0.393 0 CA-C-O 121.09 0.471 . . . . 0.0 110.719 -176.319 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 107' ' ' ILE . . . . . 0.576 HG23 HD22 ' A' ' 99' ' ' LEU . 82.4 mt -71.2 113.97 8.55 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.58 0 CA-C-N 115.624 -0.716 . . . . 0.0 110.695 -179.917 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 108' ' ' LEU . . . . . . . . . . . . . 88.5 mt -96.49 147.74 33.41 Favored Pre-proline 0 C--N 1.321 -0.646 0 CA-C-N 115.573 -0.739 . . . . 0.0 110.434 -179.985 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 109' ' ' PRO . . . . . 0.745 ' HB3' ' HB3' ' A' ' 153' ' ' TYR . 15.8 Cg_endo -58.55 -35.73 98.28 Favored 'Trans proline' 0 C--N 1.343 0.24 0 C-N-CA 122.653 2.236 . . . . 0.0 112.068 178.514 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 110' ' ' ALA . . . . . . . . . . . . . . . -68.51 -31.45 70.71 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 116.041 -0.527 . . . . 0.0 110.892 179.829 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 111' ' ' ASP . . . . . . . . . . . . . 24.6 t70 -68.9 -46.98 66.96 Favored 'General case' 0 C--N 1.327 -0.396 0 CA-C-O 121.22 0.533 . . . . 0.0 109.631 179.534 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 112' ' ' ILE . . . . . . . . . . . . . 30.7 mt -62.34 -41.17 90.6 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.291 0 CA-C-N 115.633 -0.712 . . . . 0.0 109.926 175.505 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 113' ' ' GLN . . . . . . . . . . . . . 24.3 tp60 -57.09 -42.8 81.42 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-N 115.524 -0.762 . . . . 0.0 110.207 178.002 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 114' ' ' SER . . . . . . . . . . . . . 36.5 m -59.19 -38.79 80.71 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 115.971 -0.559 . . . . 0.0 110.778 179.342 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 115' ' ' ILE . . . . . . . . . . . . . 73.3 mt -64.08 -47.99 87.83 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.358 0 CA-C-N 116.238 -0.437 . . . . 0.0 110.759 176.938 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 116' ' ' ILE . . . . . . . . . . . . . 48.1 mm -59.99 -41.72 87.13 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.442 0 CA-C-O 121.001 0.429 . . . . 0.0 110.79 179.78 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 117' ' ' ASN . . . . . . . . . . . . . 9.2 m-20 -65.82 -38.96 90.32 Favored 'General case' 0 C--N 1.327 -0.408 0 CA-C-N 115.707 -0.679 . . . . 0.0 112.111 -177.321 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 118' ' ' GLU . . . . . . . . . . . . . 10.8 pt-20 -80.74 -22.09 40.55 Favored 'General case' 0 C--O 1.234 0.285 0 C-N-CA 120.973 -0.291 . . . . 0.0 111.649 -176.454 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 119' ' ' THR . . . . . 0.469 HG22 ' H ' ' A' ' 121' ' ' LEU . 86.9 m -68.0 112.76 5.18 Favored 'General case' 0 C--N 1.325 -0.459 0 CA-C-O 121.137 0.494 . . . . 0.0 110.788 -177.95 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 120' ' ' LYS . . . . . . . . . . . . . 21.5 ptmt -91.08 26.46 2.14 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 115.896 -0.593 . . . . 0.0 111.263 -177.236 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 121' ' ' LEU . . . . . 0.469 ' H ' HG22 ' A' ' 119' ' ' THR . 85.7 mt -90.28 173.4 8.16 Favored 'General case' 0 C--N 1.32 -0.712 0 N-CA-C 109.571 -0.529 . . . . 0.0 109.571 179.307 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 122' ' ' ALA . . . . . . . . . . . . . . . -61.29 151.25 32.44 Favored 'General case' 0 C--N 1.326 -0.439 0 CA-C-O 120.78 0.324 . . . . 0.0 111.125 -178.015 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 123' ' ' LYS . . . . . . . . . . . . . 85.9 tttt -57.26 -36.5 71.07 Favored 'General case' 0 C--N 1.327 -0.41 0 CA-C-N 115.999 -0.546 . . . . 0.0 111.215 -178.932 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 124' ' ' ASN . . . . . . . . . . . . . 31.3 p30 -64.87 -25.21 67.8 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-O 121.084 0.468 . . . . 0.0 111.092 177.38 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 125' ' ' THR . . . . . 0.453 ' O ' HG13 ' A' ' 129' ' ' ILE . 16.6 m -81.92 -36.99 27.48 Favored 'General case' 0 N--CA 1.45 -0.464 0 CA-C-N 116.061 -0.518 . . . . 0.0 109.814 178.681 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 126' ' ' LEU . . . . . . . . . . . . . 94.2 mt -58.79 -45.89 88.82 Favored 'General case' 0 C--N 1.33 -0.246 0 CA-C-N 116.002 -0.545 . . . . 0.0 109.622 174.083 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 127' ' ' LYS . . . . . . . . . . . . . 50.1 mttm -62.16 -35.08 77.72 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-N 115.382 -0.827 . . . . 0.0 111.219 176.785 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 128' ' ' ALA . . . . . . . . . . . . . . . -65.72 -47.8 74.11 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.367 -0.379 . . . . 0.0 110.806 178.554 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 129' ' ' ILE . . . . . 0.453 HG13 ' O ' ' A' ' 125' ' ' THR . 58.3 mt -62.02 -45.68 98.17 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.226 0 CA-C-N 116.289 -0.414 . . . . 0.0 109.92 178.032 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 130' ' ' ARG . . . . . . . . . . . . . 8.9 tpt85 -55.95 -54.27 46.74 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-N 115.512 -0.767 . . . . 0.0 111.19 177.057 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 131' ' ' ASN . . . . . . . . . . . . . 8.8 t30 -57.71 -47.41 82.47 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 116.478 -0.328 . . . . 0.0 111.289 -177.312 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 132' ' ' THR . . . . . 0.478 ' O ' HG13 ' A' ' 136' ' ' ILE . 30.8 m -57.77 -51.79 68.12 Favored 'General case' 0 C--N 1.324 -0.517 0 CA-C-N 115.971 -0.559 . . . . 0.0 110.855 -178.993 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 133' ' ' ALA . . . . . . . . . . . . . . . -61.96 -41.07 97.59 Favored 'General case' 0 C--N 1.331 -0.206 0 CA-C-N 116.183 -0.462 . . . . 0.0 111.103 -179.96 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 134' ' ' SER . . . . . 0.621 ' O ' ' HG3' ' A' ' 138' ' ' ARG . 50.0 m -58.24 -49.59 76.55 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.022 -0.536 . . . . 0.0 111.284 -178.327 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 135' ' ' GLN . . . . . . . . . . . . . 22.0 mt-30 -66.62 -32.25 73.46 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.517 -0.31 . . . . 0.0 111.205 -177.162 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 136' ' ' ILE . . . . . 0.478 HG13 ' O ' ' A' ' 132' ' ' THR . 82.9 mt -61.57 -47.11 94.89 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.231 0 CA-C-O 120.799 0.333 . . . . 0.0 110.518 177.155 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 137' ' ' PHE . . . . . 0.436 ' HZ ' HG21 ' A' ' 107' ' ' ILE . 54.3 m-85 -64.99 -39.74 93.93 Favored 'General case' 0 C--N 1.327 -0.401 0 CA-C-N 116.325 -0.398 . . . . 0.0 111.432 178.53 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 138' ' ' ARG . . . . . 0.621 ' HG3' ' O ' ' A' ' 134' ' ' SER . 41.0 mtp180 -67.67 -31.25 71.09 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-O 120.779 0.323 . . . . 0.0 110.409 -179.761 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 139' ' ' LEU . . . . . . . . . . . . . 60.8 tp -62.8 -40.73 98.27 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-O 121.245 0.545 . . . . 0.0 109.852 174.994 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 140' ' ' ALA . . . . . . . . . . . . . . . -64.34 -35.28 80.36 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-N 115.652 -0.704 . . . . 0.0 110.682 177.637 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 141' ' ' ILE . . . . . 0.544 ' HA ' ' O ' ' A' ' 146' ' ' ILE . 70.4 mt -63.3 -44.04 98.92 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.224 0 CA-C-O 120.858 0.361 . . . . 0.0 110.462 175.126 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 142' ' ' GLU . . . . . . . . . . . . . 19.1 mm-40 -67.57 -25.47 65.8 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.148 -0.478 . . . . 0.0 111.538 179.796 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 143' ' ' ASN . . . . . 0.449 HD22 ' N ' ' A' ' 143' ' ' ASN . 0.9 OUTLIER -94.12 5.04 52.99 Favored 'General case' 0 C--N 1.323 -0.58 0 CA-C-N 116.278 -0.419 . . . . 0.0 110.446 176.423 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' A' A ' 144' ' ' ARG . . . . . . . . . . . . . 57.5 mtp85 64.62 25.22 13.1 Favored 'General case' 0 N--CA 1.465 0.313 0 CA-C-N 115.517 -0.765 . . . . 0.0 112.787 174.001 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 145' ' ' ALA . . . . . . . . . . . . . . . -83.43 -27.52 29.48 Favored 'General case' 0 C--N 1.325 -0.46 0 CA-C-O 121.294 0.569 . . . . 0.0 109.993 176.384 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 146' ' ' ILE . . . . . 0.544 ' O ' ' HA ' ' A' ' 141' ' ' ILE . 18.1 tt -145.91 154.56 13.05 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.461 0 CA-C-N 115.653 -0.703 . . . . 0.0 109.185 178.728 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 147' ' ' ASP . . . . . . . . . . . . . 4.9 p-10 -103.44 -5.2 23.11 Favored 'General case' 0 N--CA 1.467 0.393 0 N-CA-C 111.963 0.357 . . . . 0.0 111.963 -174.455 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 148' ' ' PHE . . . . . 0.423 ' H ' HG12 ' A' ' 146' ' ' ILE . 76.2 t80 -155.66 145.23 21.11 Favored 'General case' 0 C--N 1.324 -0.513 0 N-CA-C 110.166 -0.309 . . . . 0.0 110.166 -176.7 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 149' ' ' ASN . . . . . 0.415 ' HA ' ' HD2' ' A' ' 150' ' ' PRO . 20.0 p-10 -107.28 112.27 62.87 Favored Pre-proline 0 C--N 1.323 -0.563 0 CA-C-O 121.053 0.454 . . . . 0.0 110.943 178.99 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 150' ' ' PRO . . . . . 0.415 ' HD2' ' HA ' ' A' ' 149' ' ' ASN . 35.6 Cg_endo -65.34 -11.0 28.17 Favored 'Trans proline' 0 N--CA 1.473 0.323 0 C-N-CA 122.969 2.446 . . . . 0.0 112.291 179.31 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 151' ' ' ALA . . . . . . . . . . . . . . . -67.5 -31.85 72.26 Favored 'General case' 0 C--N 1.327 -0.387 0 CA-C-N 115.968 -0.56 . . . . 0.0 110.775 178.088 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 152' ' ' ASP . . . . . . . . . . . . . 25.9 t70 -72.91 -15.77 61.57 Favored 'General case' 0 N--CA 1.464 0.262 0 CA-C-O 121.589 0.709 . . . . 0.0 110.04 179.594 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 153' ' ' TYR . . . . . 0.745 ' HB3' ' HB3' ' A' ' 109' ' ' PRO . 3.1 t80 -84.26 -20.82 31.56 Favored 'General case' 0 C--N 1.325 -0.48 0 CA-C-N 115.234 -0.894 . . . . 0.0 109.458 179.444 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 154' ' ' VAL . . . . . . . . . . . . . 59.1 t -72.85 129.54 35.92 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.423 0 CA-C-N 115.726 -0.67 . . . . 0.0 110.812 -178.768 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 155' ' ' ARG . . . . . 0.406 ' HE ' ' HB2' ' A' ' 155' ' ' ARG . 59.2 mtm180 -86.6 146.99 26.12 Favored 'General case' 0 C--N 1.324 -0.538 0 CA-C-N 116.218 -0.446 . . . . 0.0 110.675 -178.3 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 156' ' ' ILE . . . . . . . . . . . . . 37.8 mm -108.36 113.49 60.27 Favored Pre-proline 0 C--N 1.317 -0.823 0 CA-C-N 115.669 -0.696 . . . . 0.0 109.517 172.754 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 157' ' ' PRO . . . . . . . . . . . . . 51.1 Cg_exo . . . . . 0 C--N 1.344 0.325 0 C-N-CA 122.542 2.162 . . . . 0.0 111.62 -179.982 . . . . . . . . 0 0 . 1 . 009 nuclear nobuild core ' A' A ' 63' ' ' SER . . . . . 0.55 ' HA ' ' HA ' ' A' ' 103' ' ' SER . 1.3 m . . . . . 0 N--CA 1.451 -0.414 0 N-CA-C 109.366 -0.605 . . . . 0.0 109.366 . . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 64' ' ' PHE . . . . . 0.583 ' HB2' HD11 ' A' ' 107' ' ' ILE . 56.0 t80 -63.44 -44.58 94.15 Favored 'General case' 0 C--N 1.324 -0.504 0 C-N-CA 120.959 -0.297 . . . . 0.0 110.434 -179.319 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 65' ' ' GLY . . . . . . . . . . . . . . . -65.35 -29.76 76.02 Favored Glycine 0 C--N 1.331 0.289 0 C-N-CA 120.845 -0.693 . . . . 0.0 112.062 177.654 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 66' ' ' ASP . . . . . . . . . . . . . 12.2 t0 -65.89 -54.16 30.21 Favored 'General case' 0 C--O 1.24 0.579 0 CA-C-O 121.475 0.655 . . . . 0.0 110.209 177.91 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 67' ' ' TRP . . . . . . . . . . . . . 96.3 m95 -70.62 -23.78 62.61 Favored 'General case' 0 C--N 1.325 -0.463 0 CA-C-N 115.802 -0.635 . . . . 0.0 110.91 178.162 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 68' ' ' ALA . . . . . . . . . . . . . . . -62.61 -48.81 77.77 Favored 'General case' 0 C--O 1.225 -0.208 0 CA-C-N 116.406 -0.361 . . . . 0.0 110.671 176.419 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 69' ' ' GLU . . . . . . . . . . . . . 43.6 tt0 -59.05 -44.57 91.82 Favored 'General case' 0 C--O 1.234 0.281 0 C-N-CA 120.856 -0.338 . . . . 0.0 110.114 177.382 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 70' ' ' LYS . . . . . . . . . . . . . 24.5 ttmm -58.91 -43.02 91.0 Favored 'General case' 0 CA--C 1.535 0.399 0 CA-C-N 116.105 -0.498 . . . . 0.0 110.955 179.151 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 71' ' ' PHE . . . . . . . . . . . . . 82.3 t80 -72.11 -44.56 62.99 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-O 120.88 0.371 . . . . 0.0 111.332 -179.626 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 72' ' ' LEU . . . . . 0.505 HD23 ' HG2' ' A' ' 89' ' ' LYS . 7.3 mp -61.38 -39.44 90.67 Favored 'General case' 0 C--N 1.325 -0.472 0 CA-C-N 116.332 -0.395 . . . . 0.0 111.32 -178.297 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 73' ' ' LYS . . . . . 0.486 ' O ' ' HB3' ' A' ' 76' ' ' GLU . 57.3 tttp -77.21 -33.32 56.27 Favored 'General case' 0 C--N 1.326 -0.429 0 C-N-CA 120.644 -0.422 . . . . 0.0 111.416 -178.403 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 74' ' ' SER . . . . . . . . . . . . . 12.3 p -68.76 -29.34 67.71 Favored 'General case' 0 C--N 1.324 -0.513 0 C-N-CA 120.268 -0.573 . . . . 0.0 109.847 176.679 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 75' ' ' LYS . . . . . 0.517 ' O ' HG22 ' A' ' 80' ' ' VAL . 43.3 mmtt -77.39 -34.73 54.84 Favored 'General case' 0 C--N 1.331 -0.217 0 CA-C-N 116.267 -0.424 . . . . 0.0 110.529 173.14 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 76' ' ' GLU . . . . . 0.486 ' HB3' ' O ' ' A' ' 73' ' ' LYS . 34.6 tt0 -51.75 -47.61 64.03 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 116.018 -0.537 . . . . 0.0 110.057 172.444 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 77' ' ' ALA . . . . . . . . . . . . . . . -84.56 -12.65 53.71 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 115.677 -0.692 . . . . 0.0 111.751 178.847 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 78' ' ' ASP . . . . . . . . . . . . . 29.5 t70 -65.99 -35.85 81.7 Favored 'General case' 0 N--CA 1.467 0.386 0 CA-C-O 120.876 0.369 . . . . 0.0 110.473 178.773 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 79' ' ' GLY . . . . . . . . . . . . . . . 133.76 2.07 3.61 Favored Glycine 0 N--CA 1.447 -0.567 0 C-N-CA 120.073 -1.06 . . . . 0.0 113.447 176.047 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 80' ' ' VAL . . . . . 0.517 HG22 ' O ' ' A' ' 75' ' ' LYS . 28.4 m -70.15 136.96 25.0 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.339 0 CA-C-N 117.324 0.562 . . . . 0.0 110.377 179.499 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 81' ' ' SER . . . . . . . . . . . . . 23.3 t -72.62 164.7 26.07 Favored 'General case' 0 C--N 1.322 -0.607 0 CA-C-O 121.147 0.498 . . . . 0.0 110.224 179.947 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 82' ' ' VAL . . . . . . . . . . . . . 28.8 m -57.08 -29.69 32.35 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.609 0 CA-C-N 115.305 -0.861 . . . . 0.0 111.7 -177.177 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 83' ' ' SER . . . . . . . . . . . . . 5.9 p -62.71 -48.01 81.13 Favored 'General case' 0 C--N 1.326 -0.432 0 CA-C-O 121.173 0.511 . . . . 0.0 110.701 177.337 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 84' ' ' GLN . . . . . . . . . . . . . 6.8 tp-100 -73.83 -37.13 64.94 Favored 'General case' 0 C--N 1.325 -0.484 0 CA-C-N 115.793 -0.64 . . . . 0.0 110.074 -179.954 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 85' ' ' LEU . . . . . . . . . . . . . 43.5 tp -62.49 -44.79 95.54 Favored 'General case' 0 C--N 1.326 -0.442 0 CA-C-N 115.836 -0.62 . . . . 0.0 110.655 178.734 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 86' ' ' ASN . . . . . . . . . . . . . 83.5 m-20 -61.52 -37.02 82.18 Favored 'General case' 0 CA--C 1.519 -0.214 0 CA-C-N 116.487 -0.324 . . . . 0.0 110.377 176.265 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 87' ' ' SER . . . . . . . . . . . . . 27.2 t -56.1 -49.34 74.14 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 116.176 -0.466 . . . . 0.0 110.284 178.753 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 88' ' ' TYR . . . . . . . . . . . . . 32.3 m-85 -58.47 -41.28 84.85 Favored 'General case' 0 C--O 1.233 0.188 0 CA-C-O 120.87 0.366 . . . . 0.0 110.895 178.908 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 89' ' ' LYS . . . . . 0.566 ' HA ' ' SG ' ' A' ' 92' ' ' CYS . 85.1 mttt -70.76 -31.65 68.53 Favored 'General case' 0 C--N 1.327 -0.386 0 CA-C-N 116.197 -0.456 . . . . 0.0 111.294 -177.675 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 90' ' ' ASN . . . . . . . . . . . . . 27.6 m-80 -64.55 -36.17 83.36 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-O 120.97 0.414 . . . . 0.0 110.384 175.61 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 91' ' ' TYR . . . . . . . . . . . . . 42.4 m-85 -67.01 -48.9 66.97 Favored 'General case' 0 C--N 1.326 -0.415 0 CA-C-N 116.279 -0.419 . . . . 0.0 111.306 179.43 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 92' ' ' CYS . . . . . 0.611 ' HA ' ' HB2' ' A' ' 96' ' ' LEU . 26.1 p -72.56 -32.99 66.49 Favored 'General case' 0 C--N 1.331 -0.238 0 N-CA-C 111.849 0.315 . . . . 0.0 111.849 -175.63 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 93' ' ' ARG . . . . . . . . . . . . . 99.7 mtt180 -78.53 -38.99 39.23 Favored 'General case' 0 C--N 1.328 -0.365 0 N-CA-C 112.022 0.378 . . . . 0.0 112.022 -178.358 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 94' ' ' ASN . . . . . . . . . . . . . 17.4 m120 -99.62 -60.4 1.54 Allowed 'General case' 0 C--N 1.327 -0.384 0 N-CA-C 112.539 0.57 . . . . 0.0 112.539 -175.19 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 95' ' ' HIS . . . . . . . . . . . . . 6.1 m80 -78.79 -47.73 16.17 Favored 'General case' 0 C--N 1.325 -0.463 0 N-CA-C 112.502 0.556 . . . . 0.0 112.502 -172.4 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 96' ' ' LEU . . . . . 0.611 ' HB2' ' HA ' ' A' ' 92' ' ' CYS . 86.6 mt -91.59 21.53 4.6 Favored 'General case' 0 C--N 1.32 -0.698 0 CA-C-N 116.718 -0.219 . . . . 0.0 111.188 -175.386 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 97' ' ' SER . . . . . 0.525 ' N ' ' HD2' ' A' ' 98' ' ' PRO . 3.1 p -59.94 -43.22 94.06 Favored Pre-proline 0 CA--C 1.544 0.739 0 N-CA-C 112.667 0.617 . . . . 0.0 112.667 -179.719 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 98' ' ' PRO . . . . . 0.525 ' HD2' ' N ' ' A' ' 97' ' ' SER . 22.9 Cg_endo -63.41 -32.03 71.97 Favored 'Trans proline' 0 C--N 1.362 1.241 0 C-N-CA 121.59 1.527 . . . . 0.0 112.195 175.951 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 99' ' ' LEU . . . . . 0.65 ' HA ' ' HD2' ' A' ' 102' ' ' LYS . 10.8 mp -80.1 -31.45 39.2 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.407 -0.36 . . . . 0.0 110.51 179.682 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 100' ' ' TYR . . . . . . . . . . . . . 36.1 t80 -54.39 -34.63 61.66 Favored 'General case' 0 C--N 1.327 -0.374 0 CA-C-N 115.673 -0.694 . . . . 0.0 111.193 -178.258 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 101' ' ' MET . . . . . . . . . . . . . 22.5 mmt -91.83 -4.29 55.04 Favored 'General case' 0 C--N 1.331 -0.228 0 CA-C-N 115.791 -0.64 . . . . 0.0 111.06 -176.661 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 102' ' ' LYS . . . . . 0.65 ' HD2' ' HA ' ' A' ' 99' ' ' LEU . 51.8 mttm -87.93 150.01 23.73 Favored 'General case' 0 C--N 1.323 -0.566 0 CA-C-N 116.132 -0.485 . . . . 0.0 110.71 179.662 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 103' ' ' SER . . . . . 0.55 ' HA ' ' HA ' ' A' ' 63' ' ' SER . 8.7 m -82.52 162.98 21.83 Favored 'General case' 0 C--N 1.322 -0.597 0 N-CA-C 107.972 -1.121 . . . . 0.0 107.972 167.622 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 104' ' ' LEU . . . . . . . . . . . . . 95.2 mt -52.54 -39.31 61.28 Favored 'General case' 0 C--N 1.324 -0.535 0 N-CA-C 111.983 0.364 . . . . 0.0 111.983 -177.53 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 105' ' ' SER . . . . . . . . . . . . . 9.0 m -83.65 0.24 47.76 Favored 'General case' 0 C--N 1.326 -0.446 0 N-CA-C 111.933 0.345 . . . . 0.0 111.933 -177.641 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 106' ' ' GLU . . . . . . . . . . . . . 44.9 mt-10 -102.92 -3.24 26.44 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-O 121.026 0.441 . . . . 0.0 110.253 178.4 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 107' ' ' ILE . . . . . 0.606 HG21 ' HZ ' ' A' ' 137' ' ' PHE . 62.0 mt -94.13 112.57 27.15 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.645 0 CA-C-N 115.998 -0.547 . . . . 0.0 110.5 -177.741 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 108' ' ' LEU . . . . . . . . . . . . . 64.5 mt -96.09 146.15 30.81 Favored Pre-proline 0 C--N 1.318 -0.769 0 CA-C-N 115.887 -0.597 . . . . 0.0 110.004 179.856 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 109' ' ' PRO . . . . . . . . . . . . . 42.0 Cg_exo -57.91 -28.39 82.56 Favored 'Trans proline' 0 N--CA 1.464 -0.245 0 C-N-CA 122.317 2.011 . . . . 0.0 111.33 175.437 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 110' ' ' ALA . . . . . . . . . . . . . . . -65.6 -34.73 78.92 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-N 115.724 -0.671 . . . . 0.0 110.983 177.083 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 111' ' ' ASP . . . . . 0.455 ' O ' HG13 ' A' ' 115' ' ' ILE . 70.6 m-20 -61.6 -46.24 90.68 Favored 'General case' 0 CA--C 1.516 -0.354 0 CA-C-O 121.027 0.441 . . . . 0.0 109.814 178.864 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 112' ' ' ILE . . . . . 0.542 ' O ' HG12 ' A' ' 116' ' ' ILE . 46.0 mt -69.73 -45.16 78.3 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.585 0 CA-C-N 115.892 -0.595 . . . . 0.0 110.293 179.67 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 113' ' ' GLN . . . . . . . . . . . . . 7.0 tp-100 -57.81 -43.45 85.71 Favored 'General case' 0 C--N 1.332 -0.18 0 CA-C-N 116.374 -0.376 . . . . 0.0 111.143 179.721 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 114' ' ' SER . . . . . 0.504 ' O ' ' HG2' ' A' ' 118' ' ' GLU . 13.5 p -66.33 -37.56 85.64 Favored 'General case' 0 C--N 1.327 -0.399 0 C-N-CA 120.903 -0.319 . . . . 0.0 110.814 -179.906 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 115' ' ' ILE . . . . . 0.455 HG13 ' O ' ' A' ' 111' ' ' ASP . 69.0 mt -63.47 -41.92 94.39 Favored 'Isoleucine or valine' 0 N--CA 1.465 0.288 0 CA-C-O 120.731 0.301 . . . . 0.0 110.548 176.184 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 116' ' ' ILE . . . . . 0.542 HG12 ' O ' ' A' ' 112' ' ' ILE . 50.0 mm -65.01 -26.33 39.76 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.323 0 CA-C-O 121.307 0.575 . . . . 0.0 110.439 178.005 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 117' ' ' ASN . . . . . . . . . . . . . 8.8 t30 -86.63 -37.17 18.31 Favored 'General case' 0 C--N 1.325 -0.499 0 CA-C-N 115.759 -0.655 . . . . 0.0 111.435 -179.916 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 118' ' ' GLU . . . . . 0.504 ' HG2' ' O ' ' A' ' 114' ' ' SER . 33.9 mm-40 -79.78 -29.21 40.31 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-N 116.514 -0.312 . . . . 0.0 111.388 -176.212 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 119' ' ' THR . . . . . 0.492 ' HB ' HD21 ' A' ' 126' ' ' LEU . 62.0 m -76.03 111.31 11.3 Favored 'General case' 0 C--N 1.323 -0.573 0 CA-C-O 121.415 0.626 . . . . 0.0 109.752 176.83 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 120' ' ' LYS . . . . . . . . . . . . . 45.4 mtmt -96.11 31.59 2.13 Favored 'General case' 0 C--N 1.322 -0.599 0 CA-C-N 115.499 -0.773 . . . . 0.0 110.766 -174.157 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 121' ' ' LEU . . . . . 0.428 HD13 HG23 ' A' ' 119' ' ' THR . 11.2 mp -90.09 -174.93 4.39 Favored 'General case' 0 C--N 1.321 -0.641 0 CA-C-N 115.296 -0.865 . . . . 0.0 110.235 178.11 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 122' ' ' ALA . . . . . . . . . . . . . . . -62.33 152.62 33.31 Favored 'General case' 0 C--N 1.326 -0.439 0 CA-C-N 115.955 -0.566 . . . . 0.0 111.581 -177.301 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 123' ' ' LYS . . . . . 0.78 ' HE3' ' HA ' ' A' ' 123' ' ' LYS . 1.0 OUTLIER -56.88 -39.65 74.75 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 115.508 -0.769 . . . . 0.0 110.791 -177.784 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' A' A ' 124' ' ' ASN . . . . . . . . . . . . . 17.7 m120 -55.85 -47.33 77.47 Favored 'General case' 0 C--N 1.331 -0.217 0 CA-C-N 116.056 -0.52 . . . . 0.0 111.156 179.594 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 125' ' ' THR . . . . . 0.56 ' O ' HG13 ' A' ' 129' ' ' ILE . 19.0 m -59.41 -44.94 92.75 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.054 -0.521 . . . . 0.0 110.715 -178.955 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 126' ' ' LEU . . . . . 0.492 HD21 ' HB ' ' A' ' 119' ' ' THR . 97.5 mt -61.53 -41.68 97.7 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 115.932 -0.576 . . . . 0.0 111.033 179.553 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 127' ' ' LYS . . . . . 0.458 ' HG3' ' O ' ' A' ' 123' ' ' LYS . 51.5 mtpt -66.35 -37.53 85.53 Favored 'General case' 0 C--N 1.326 -0.437 0 CA-C-N 115.872 -0.604 . . . . 0.0 110.359 179.626 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 128' ' ' ALA . . . . . . . . . . . . . . . -67.3 -36.14 80.91 Favored 'General case' 0 C--N 1.326 -0.428 0 CA-C-N 116.055 -0.52 . . . . 0.0 111.149 179.442 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 129' ' ' ILE . . . . . 0.56 HG13 ' O ' ' A' ' 125' ' ' THR . 80.2 mt -58.86 -51.96 66.04 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.277 0 CA-C-O 120.851 0.358 . . . . 0.0 110.432 177.355 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 130' ' ' ARG . . . . . 0.408 HH11 ' HD3' ' A' ' 130' ' ' ARG . 39.8 ttt-85 -62.94 -44.07 97.07 Favored 'General case' 0 C--N 1.331 -0.203 0 CA-C-N 116.045 -0.525 . . . . 0.0 110.602 178.606 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 131' ' ' ASN . . . . . . . . . . . . . 47.5 t30 -57.5 -47.0 83.1 Favored 'General case' 0 N--CA 1.465 0.278 0 CA-C-N 116.111 -0.495 . . . . 0.0 111.277 -179.297 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 132' ' ' THR . . . . . . . . . . . . . 34.6 m -61.31 -49.17 78.11 Favored 'General case' 0 C--N 1.326 -0.413 0 CA-C-N 116.34 -0.391 . . . . 0.0 110.816 -179.748 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 133' ' ' ALA . . . . . . . . . . . . . . . -62.75 -41.72 99.34 Favored 'General case' 0 C--N 1.331 -0.211 0 CA-C-N 116.274 -0.421 . . . . 0.0 111.126 -179.173 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 134' ' ' SER . . . . . . . . . . . . . 32.7 t -60.04 -42.41 94.39 Favored 'General case' 0 C--N 1.327 -0.402 0 CA-C-N 116.182 -0.463 . . . . 0.0 110.993 -178.189 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 135' ' ' GLN . . . . . . . . . . . . . 49.8 mt-30 -65.13 -35.68 81.89 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-N 116.382 -0.372 . . . . 0.0 110.709 179.953 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 136' ' ' ILE . . . . . . . . . . . . . 74.4 mt -65.32 -44.37 94.8 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.272 0 CA-C-N 116.338 -0.392 . . . . 0.0 110.44 177.143 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 137' ' ' PHE . . . . . 0.606 ' HZ ' HG21 ' A' ' 107' ' ' ILE . 50.1 m-85 -62.02 -39.47 92.38 Favored 'General case' 0 N--CA 1.461 0.119 0 CA-C-N 116.3 -0.409 . . . . 0.0 110.675 177.243 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 138' ' ' ARG . . . . . 0.599 ' O ' ' HG2' ' A' ' 142' ' ' GLU . 73.9 mtp180 -58.64 -44.8 90.16 Favored 'General case' 0 C--N 1.33 -0.242 0 CA-C-N 116.395 -0.366 . . . . 0.0 110.768 177.645 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 139' ' ' LEU . . . . . . . . . . . . . 53.9 tp -59.13 -36.93 76.05 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-O 121.061 0.457 . . . . 0.0 110.686 179.232 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 140' ' ' ALA . . . . . . . . . . . . . . . -67.97 -41.0 83.06 Favored 'General case' 0 C--N 1.326 -0.417 0 CA-C-N 116.096 -0.502 . . . . 0.0 110.515 176.792 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 141' ' ' ILE . . . . . 0.57 ' HA ' ' O ' ' A' ' 146' ' ' ILE . 72.2 mt -61.12 -44.33 98.09 Favored 'Isoleucine or valine' 0 C--O 1.234 0.239 0 CA-C-N 116.254 -0.43 . . . . 0.0 110.482 176.482 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 142' ' ' GLU . . . . . 0.599 ' HG2' ' O ' ' A' ' 138' ' ' ARG . 24.8 mm-40 -54.57 -43.99 72.54 Favored 'General case' 0 C--N 1.33 -0.241 0 CA-C-N 115.993 -0.549 . . . . 0.0 110.862 178.458 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 143' ' ' ASN . . . . . . . . . . . . . 42.5 m-80 -90.0 14.05 13.22 Favored 'General case' 0 C--N 1.325 -0.496 0 CA-C-N 115.695 -0.684 . . . . 0.0 111.558 -176.718 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 144' ' ' ARG . . . . . . . . . . . . . 92.6 mtt180 61.98 32.14 17.82 Favored 'General case' 0 N--CA 1.467 0.419 0 N-CA-C 112.144 0.424 . . . . 0.0 112.144 174.367 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 145' ' ' ALA . . . . . . . . . . . . . . . -89.8 -29.95 18.3 Favored 'General case' 0 C--N 1.324 -0.513 0 CA-C-O 121.219 0.533 . . . . 0.0 110.416 177.047 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 146' ' ' ILE . . . . . 0.57 ' O ' ' HA ' ' A' ' 141' ' ' ILE . 16.4 tt -147.32 155.94 10.58 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.69 0 N-CA-C 108.457 -0.942 . . . . 0.0 108.457 177.941 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 147' ' ' ASP . . . . . . . . . . . . . 16.9 t70 -122.34 18.72 10.61 Favored 'General case' 0 C--N 1.323 -0.57 0 CA-C-O 121.122 0.486 . . . . 0.0 111.569 -176.446 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 148' ' ' PHE . . . . . 0.428 ' H ' HG12 ' A' ' 146' ' ' ILE . 49.7 p90 -149.29 154.77 39.51 Favored 'General case' 0 C--N 1.321 -0.635 0 N-CA-C 110.147 -0.316 . . . . 0.0 110.147 176.797 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 149' ' ' ASN . . . . . . . . . . . . . 57.3 t-20 -118.72 96.84 50.42 Favored Pre-proline 0 C--N 1.324 -0.51 0 CA-C-N 116.271 -0.422 . . . . 0.0 110.427 -176.696 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 150' ' ' PRO . . . . . . . . . . . . . 31.9 Cg_exo -59.33 -33.63 97.72 Favored 'Trans proline' 0 C--N 1.342 0.188 0 C-N-CA 122.897 2.398 . . . . 0.0 111.939 179.312 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 151' ' ' ALA . . . . . 0.402 ' HA ' HG23 ' A' ' 154' ' ' VAL . . . -69.37 -32.06 70.86 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.12 -0.491 . . . . 0.0 110.68 -179.555 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 152' ' ' ASP . . . . . . . . . . . . . 30.6 t70 -70.84 -22.72 62.28 Favored 'General case' 0 C--N 1.326 -0.421 0 CA-C-O 121.226 0.536 . . . . 0.0 109.91 178.624 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 153' ' ' TYR . . . . . . . . . . . . . 75.5 t80 -82.85 -16.08 49.05 Favored 'General case' 0 C--N 1.324 -0.512 0 CA-C-N 115.518 -0.765 . . . . 0.0 110.213 -179.04 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 154' ' ' VAL . . . . . 0.402 HG23 ' HA ' ' A' ' 151' ' ' ALA . 24.2 t -68.98 132.44 33.04 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.304 0 CA-C-N 116.25 -0.432 . . . . 0.0 110.298 176.145 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 155' ' ' ARG . . . . . . . . . . . . . 17.3 tpp180 -109.41 119.49 39.62 Favored 'General case' 0 C--N 1.318 -0.79 0 N-CA-C 109.816 -0.438 . . . . 0.0 109.816 173.897 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 156' ' ' ILE . . . . . . . . . . . . . 33.1 mm -66.02 124.48 87.87 Favored Pre-proline 0 C--N 1.327 -0.396 0 CA-C-N 115.658 -0.701 . . . . 0.0 109.731 174.121 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 157' ' ' PRO . . . . . . . . . . . . . 14.7 Cg_exo . . . . . 0 N--CA 1.455 -0.748 0 C-N-CA 121.92 1.747 . . . . 0.0 110.91 173.41 . . . . . . . . 0 0 . 1 . 010 nuclear nobuild core ' A' A ' 63' ' ' SER . . . . . . . . . . . . . 29.1 t . . . . . 0 N--CA 1.452 -0.358 0 N-CA-C 109.703 -0.48 . . . . 0.0 109.703 . . . . . . . . . 0 0 . 1 . 010 nuclear nobuild core ' A' A ' 64' ' ' PHE . . . . . 0.533 ' HB2' HD11 ' A' ' 107' ' ' ILE . 73.4 t80 -60.11 -30.04 69.0 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-O 120.76 0.314 . . . . 0.0 110.427 179.194 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 65' ' ' GLY . . . . . 0.461 ' HA2' ' CD1' ' A' ' 100' ' ' TYR . . . -61.11 -41.04 99.34 Favored Glycine 0 N--CA 1.449 -0.472 0 C-N-CA 121.08 -0.581 . . . . 0.0 112.217 176.675 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 66' ' ' ASP . . . . . 0.509 ' O ' ' HG2' ' A' ' 70' ' ' LYS . 33.9 t70 -66.69 -42.58 86.23 Favored 'General case' 0 C--N 1.325 -0.463 0 N-CA-C 109.767 -0.457 . . . . 0.0 109.767 178.185 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 67' ' ' TRP . . . . . . . . . . . . . 93.8 m95 -67.72 -27.82 67.13 Favored 'General case' 0 C--N 1.331 -0.23 0 CA-C-N 115.827 -0.624 . . . . 0.0 111.54 -179.961 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 68' ' ' ALA . . . . . 0.49 ' O ' ' HG ' ' A' ' 72' ' ' LEU . . . -62.22 -49.55 75.3 Favored 'General case' 0 C--N 1.328 -0.355 0 N-CA-C 109.779 -0.452 . . . . 0.0 109.779 174.291 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 69' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER -61.83 -37.64 85.19 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.087 -0.506 . . . . 0.0 110.65 175.262 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 70' ' ' LYS . . . . . 0.509 ' HG2' ' O ' ' A' ' 66' ' ' ASP . 27.0 mmmt -57.58 -52.09 66.83 Favored 'General case' 0 N--CA 1.464 0.254 0 CA-C-N 116.356 -0.384 . . . . 0.0 110.47 176.364 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 71' ' ' PHE . . . . . . . . . . . . . 92.0 t80 -62.12 -40.3 95.44 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 115.998 -0.546 . . . . 0.0 110.829 -179.669 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 72' ' ' LEU . . . . . 0.49 ' HG ' ' O ' ' A' ' 68' ' ' ALA . 79.5 mt -61.74 -51.65 67.48 Favored 'General case' 0 C--N 1.326 -0.456 0 CA-C-N 116.223 -0.444 . . . . 0.0 111.097 179.496 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 73' ' ' LYS . . . . . 0.454 ' HA ' ' HB3' ' A' ' 76' ' ' GLU . 55.0 tttp -71.44 -24.06 61.95 Favored 'General case' 0 C--N 1.326 -0.441 0 C-N-CA 120.216 -0.594 . . . . 0.0 110.59 -179.165 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 74' ' ' SER . . . . . . . . . . . . . 33.5 t -60.26 -45.47 93.19 Favored 'General case' 0 C--N 1.328 -0.358 0 N-CA-C 109.795 -0.446 . . . . 0.0 109.795 173.745 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 75' ' ' LYS . . . . . . . . . . . . . 27.5 mmtm -76.11 -30.35 58.2 Favored 'General case' 0 C--N 1.327 -0.399 0 CA-C-N 116.384 -0.371 . . . . 0.0 110.855 177.605 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 76' ' ' GLU . . . . . 0.454 ' HB3' ' HA ' ' A' ' 73' ' ' LYS . 2.7 tm-20 -58.08 -53.43 58.38 Favored 'General case' 0 C--N 1.327 -0.379 0 CA-C-N 116.092 -0.504 . . . . 0.0 109.722 173.969 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 77' ' ' ALA . . . . . . . . . . . . . . . -71.33 -27.04 63.09 Favored 'General case' 0 C--N 1.325 -0.473 0 CA-C-N 115.721 -0.672 . . . . 0.0 111.229 179.322 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 78' ' ' ASP . . . . . . . . . . . . . 17.4 t70 -64.08 -49.09 73.62 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.114 -0.494 . . . . 0.0 110.528 178.117 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 79' ' ' GLY . . . . . . . . . . . . . . . 131.32 55.15 0.09 OUTLIER Glycine 0 N--CA 1.448 -0.555 0 C-N-CA 120.633 -0.794 . . . . 0.0 112.975 177.084 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 80' ' ' VAL . . . . . 0.631 HG23 ' HG ' ' A' ' 85' ' ' LEU . 22.8 m -112.16 168.91 4.69 Favored 'Isoleucine or valine' 0 C--O 1.237 0.431 0 O-C-N 122.462 -0.434 . . . . 0.0 110.732 175.328 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 81' ' ' SER . . . . . . . . . . . . . 74.9 p -83.08 169.31 16.03 Favored 'General case' 0 C--N 1.322 -0.612 0 CA-C-N 115.929 -0.578 . . . . 0.0 110.944 -178.721 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 82' ' ' VAL . . . . . . . . . . . . . 94.3 t -64.33 -37.83 80.98 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.431 0 N-CA-C 109.379 -0.601 . . . . 0.0 109.379 173.817 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 83' ' ' SER . . . . . . . . . . . . . 13.6 t -60.38 -47.65 85.13 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 115.758 -0.655 . . . . 0.0 110.536 178.657 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 84' ' ' GLN . . . . . 0.412 ' HG3' ' CE2' ' A' ' 88' ' ' TYR . 6.7 tp-100 -63.71 -45.1 91.51 Favored 'General case' 0 C--N 1.332 -0.157 0 CA-C-N 116.369 -0.378 . . . . 0.0 110.396 179.704 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 85' ' ' LEU . . . . . 0.631 ' HG ' HG23 ' A' ' 80' ' ' VAL . 19.1 mt -62.46 -36.07 81.28 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.225 -0.443 . . . . 0.0 111.266 177.418 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 86' ' ' ASN . . . . . . . . . . . . . 53.7 t30 -72.77 -29.95 63.72 Favored 'General case' 0 C--N 1.322 -0.621 0 CA-C-N 115.837 -0.62 . . . . 0.0 109.856 -177.9 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 87' ' ' SER . . . . . 0.413 ' O ' ' HD1' ' A' ' 91' ' ' TYR . 42.4 t -64.27 -49.94 69.87 Favored 'General case' 0 N--CA 1.452 -0.363 0 CA-C-N 115.655 -0.702 . . . . 0.0 109.682 172.877 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 88' ' ' TYR . . . . . 0.412 ' CE2' ' HG3' ' A' ' 84' ' ' GLN . 25.7 m-85 -59.86 -38.72 82.95 Favored 'General case' 0 C--N 1.331 -0.234 0 CA-C-N 116.208 -0.451 . . . . 0.0 111.265 179.733 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 89' ' ' LYS . . . . . 0.467 ' HG3' ' O ' ' A' ' 85' ' ' LEU . 64.6 mttp -57.92 -44.58 86.94 Favored 'General case' 0 C--N 1.333 -0.115 0 CA-C-O 120.801 0.334 . . . . 0.0 110.89 177.625 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 90' ' ' ASN . . . . . . . . . . . . . 20.7 t-20 -64.49 -42.9 95.57 Favored 'General case' 0 C--N 1.325 -0.487 0 CA-C-N 116.038 -0.528 . . . . 0.0 111.048 -177.295 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 91' ' ' TYR . . . . . 0.413 ' HD1' ' O ' ' A' ' 87' ' ' SER . 11.8 m-85 -66.54 -46.65 75.41 Favored 'General case' 0 C--N 1.324 -0.524 0 N-CA-C 111.719 0.266 . . . . 0.0 111.719 -177.926 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 92' ' ' CYS . . . . . 0.499 ' HA ' HD12 ' A' ' 96' ' ' LEU . 24.5 p -75.98 -25.68 56.04 Favored 'General case' 0 C--N 1.327 -0.391 0 N-CA-C 111.883 0.327 . . . . 0.0 111.883 -175.122 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 93' ' ' ARG . . . . . 0.409 ' HB2' ' O ' ' A' ' 89' ' ' LYS . 51.3 mtt85 -98.12 -31.87 11.89 Favored 'General case' 0 C--N 1.325 -0.494 0 N-CA-C 112.912 0.708 . . . . 0.0 112.912 -176.116 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 94' ' ' ASN . . . . . . . . . . . . . 16.7 m120 -95.31 -45.26 7.22 Favored 'General case' 0 C--N 1.325 -0.469 0 C-N-CA 120.581 -0.448 . . . . 0.0 111.608 -179.285 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 95' ' ' HIS . . . . . . . . . . . . . 77.4 m-70 -84.96 -44.46 13.09 Favored 'General case' 0 C--N 1.327 -0.39 0 CA-C-O 120.881 0.372 . . . . 0.0 110.501 -177.611 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 96' ' ' LEU . . . . . 0.499 HD12 ' HA ' ' A' ' 92' ' ' CYS . 79.8 mt -91.72 26.8 2.24 Favored 'General case' 0 C--N 1.324 -0.534 0 CA-C-N 116.107 -0.497 . . . . 0.0 110.061 179.854 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 97' ' ' SER . . . . . 0.585 ' OG ' ' HD3' ' A' ' 98' ' ' PRO . 1.4 p -54.43 -48.04 95.97 Favored Pre-proline 0 CA--C 1.542 0.657 0 N-CA-C 113.276 0.843 . . . . 0.0 113.276 -176.841 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 98' ' ' PRO . . . . . 0.585 ' HD3' ' OG ' ' A' ' 97' ' ' SER . 13.1 Cg_exo -69.18 -13.96 37.07 Favored 'Trans proline' 0 C--N 1.356 0.934 0 C-N-CA 121.873 1.715 . . . . 0.0 112.233 -178.837 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 99' ' ' LEU . . . . . 0.482 HD12 HD22 ' A' ' 96' ' ' LEU . 61.2 mt -95.02 -30.84 13.89 Favored 'General case' 0 C--N 1.324 -0.516 0 CA-C-N 116.353 -0.385 . . . . 0.0 110.418 -178.519 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 100' ' ' TYR . . . . . 0.461 ' CD1' ' HA2' ' A' ' 65' ' ' GLY . 84.4 t80 -56.5 -32.77 65.35 Favored 'General case' 0 C--N 1.331 -0.203 0 CA-C-N 115.855 -0.612 . . . . 0.0 111.716 -176.458 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 101' ' ' MET . . . . . . . . . . . . . 25.6 ttt -98.92 1.19 45.41 Favored 'General case' 0 C--N 1.323 -0.575 0 CA-C-O 120.871 0.367 . . . . 0.0 111.406 -176.051 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 102' ' ' LYS . . . . . 0.477 ' HG3' ' O ' ' A' ' 98' ' ' PRO . 77.8 mttt -90.42 145.65 24.76 Favored 'General case' 0 C--N 1.322 -0.595 0 CA-C-O 121.482 0.658 . . . . 0.0 111.813 -178.561 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 103' ' ' SER . . . . . 0.426 ' O ' HG13 ' A' ' 107' ' ' ILE . 44.8 t -66.88 145.02 55.91 Favored 'General case' 0 C--N 1.323 -0.576 0 CA-C-N 115.236 -0.893 . . . . 0.0 109.183 173.0 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 104' ' ' LEU . . . . . . . . . . . . . 41.9 tp -56.85 -51.19 69.98 Favored 'General case' 0 C--N 1.328 -0.353 0 N-CA-C 112.536 0.569 . . . . 0.0 112.536 -170.043 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 105' ' ' SER . . . . . . . . . . . . . 4.8 m -74.29 -11.35 60.24 Favored 'General case' 0 C--N 1.327 -0.382 0 CA-C-O 121.001 0.429 . . . . 0.0 111.388 -175.966 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 106' ' ' GLU . . . . . . . . . . . . . 2.1 mp0 -96.84 5.64 50.17 Favored 'General case' 0 C--N 1.326 -0.416 0 CA-C-N 116.071 -0.513 . . . . 0.0 111.434 -174.688 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 107' ' ' ILE . . . . . 0.533 HD11 ' HB2' ' A' ' 64' ' ' PHE . 70.2 mt -89.57 137.6 21.02 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.455 0 CA-C-O 120.992 0.425 . . . . 0.0 111.0 -179.695 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 108' ' ' LEU . . . . . 0.44 ' N ' HD22 ' A' ' 108' ' ' LEU . 2.1 mm? -108.66 148.32 37.51 Favored Pre-proline 0 C--N 1.325 -0.482 0 CA-C-N 115.777 -0.647 . . . . 0.0 110.294 -179.863 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 109' ' ' PRO . . . . . . . . . . . . . 27.5 Cg_endo -63.59 -22.52 70.44 Favored 'Trans proline' 0 C--N 1.343 0.239 0 C-N-CA 122.182 1.921 . . . . 0.0 111.031 174.296 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 110' ' ' ALA . . . . . . . . . . . . . . . -63.76 -41.81 97.92 Favored 'General case' 0 N--CA 1.454 -0.255 0 CA-C-N 115.464 -0.789 . . . . 0.0 111.16 -179.641 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 111' ' ' ASP . . . . . 0.483 ' O ' HG13 ' A' ' 115' ' ' ILE . 20.2 m-20 -58.33 -44.43 88.68 Favored 'General case' 0 N--CA 1.465 0.288 0 CA-C-O 121.189 0.519 . . . . 0.0 110.897 178.837 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 112' ' ' ILE . . . . . 0.581 HG21 HH22 ' A' ' 130' ' ' ARG . 12.7 mt -72.09 -33.89 48.49 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.59 0 CA-C-N 115.863 -0.608 . . . . 0.0 110.652 -176.373 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 113' ' ' GLN . . . . . . . . . . . . . 25.1 tp60 -64.92 -40.55 95.23 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 115.996 -0.547 . . . . 0.0 110.626 -179.619 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 114' ' ' SER . . . . . . . . . . . . . 6.8 p -72.52 -36.13 68.26 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 116.46 -0.336 . . . . 0.0 110.935 179.616 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 115' ' ' ILE . . . . . 0.483 HG13 ' O ' ' A' ' 111' ' ' ASP . 77.5 mt -56.4 -46.78 82.1 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.158 0 CA-C-O 120.896 0.379 . . . . 0.0 110.292 175.729 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 116' ' ' ILE . . . . . . . . . . . . . 49.1 mm -67.22 -35.59 74.47 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.316 0 CA-C-N 116.094 -0.503 . . . . 0.0 110.686 178.661 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 117' ' ' ASN . . . . . . . . . . . . . 50.8 t30 -66.05 -40.93 91.34 Favored 'General case' 0 C--N 1.327 -0.398 0 CA-C-N 116.158 -0.473 . . . . 0.0 111.171 -179.735 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 118' ' ' GLU . . . . . . . . . . . . . 43.0 mt-10 -84.91 -19.3 32.47 Favored 'General case' 0 C--N 1.326 -0.444 0 CA-C-N 116.169 -0.468 . . . . 0.0 111.787 -176.605 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 119' ' ' THR . . . . . . . . . . . . . 69.6 m -84.04 112.94 20.65 Favored 'General case' 0 C--N 1.326 -0.444 0 CA-C-O 121.209 0.528 . . . . 0.0 109.763 175.042 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 120' ' ' LYS . . . . . 0.405 ' HB3' ' HE2' ' A' ' 120' ' ' LYS . 11.4 ptpt -110.34 86.29 2.28 Favored 'General case' 0 C--N 1.32 -0.696 0 CA-C-O 121.817 0.818 . . . . 0.0 110.887 -177.614 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 121' ' ' LEU . . . . . . . . . . . . . 96.0 mt -133.16 -175.04 3.66 Favored 'General case' 0 C--N 1.322 -0.622 0 CA-C-N 114.65 -1.159 . . . . 0.0 109.122 179.29 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 122' ' ' ALA . . . . . . . . . . . . . . . -58.52 145.58 38.55 Favored 'General case' 0 C--N 1.326 -0.419 0 O-C-N 123.123 0.264 . . . . 0.0 110.644 178.009 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 123' ' ' LYS . . . . . . . . . . . . . 21.4 ptmt -60.75 -33.93 73.67 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.662 -0.244 . . . . 0.0 111.537 -175.563 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 124' ' ' ASN . . . . . . . . . . . . . 1.9 p-10 -68.66 -27.15 65.74 Favored 'General case' 0 N--CA 1.463 0.208 0 CA-C-O 121.127 0.489 . . . . 0.0 110.036 178.925 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 125' ' ' THR . . . . . 0.402 ' O ' HG13 ' A' ' 129' ' ' ILE . 20.7 m -78.22 -34.63 49.19 Favored 'General case' 0 N--CA 1.452 -0.356 0 CA-C-N 115.932 -0.576 . . . . 0.0 109.828 178.877 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 126' ' ' LEU . . . . . . . . . . . . . 91.8 mt -67.42 -38.14 84.15 Favored 'General case' 0 C--N 1.327 -0.407 0 CA-C-N 115.809 -0.632 . . . . 0.0 109.879 175.723 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 127' ' ' LYS . . . . . 0.572 ' HG2' HG21 ' A' ' 156' ' ' ILE . 50.2 mtpt -70.4 -26.61 63.77 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.009 -0.541 . . . . 0.0 110.706 176.184 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 128' ' ' ALA . . . . . . . . . . . . . . . -67.09 -41.19 86.73 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-O 120.845 0.355 . . . . 0.0 110.132 174.97 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 129' ' ' ILE . . . . . 0.402 HG13 ' O ' ' A' ' 125' ' ' THR . 62.6 mt -65.29 -43.33 95.15 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.289 0 CA-C-N 116.017 -0.538 . . . . 0.0 109.791 175.628 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 130' ' ' ARG . . . . . 0.672 ' HA ' ' CZ ' ' A' ' 130' ' ' ARG . 0.5 OUTLIER -58.39 -49.92 75.53 Favored 'General case' 0 C--N 1.331 -0.229 0 CA-C-N 115.562 -0.745 . . . . 0.0 110.435 176.721 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' A' A ' 131' ' ' ASN . . . . . . . . . . . . . 5.4 t30 -55.96 -55.86 27.6 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 115.677 -0.692 . . . . 0.0 111.233 178.041 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 132' ' ' THR . . . . . 0.498 ' O ' HG13 ' A' ' 136' ' ' ILE . 37.3 m -56.12 -53.56 55.62 Favored 'General case' 0 C--N 1.327 -0.373 0 CA-C-N 116.055 -0.52 . . . . 0.0 111.488 -175.16 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 133' ' ' ALA . . . . . . . . . . . . . . . -63.2 -37.57 87.74 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.52 -0.309 . . . . 0.0 111.133 -177.858 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 134' ' ' SER . . . . . 0.469 ' O ' ' HG3' ' A' ' 138' ' ' ARG . 8.3 t -66.26 -44.3 84.02 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.433 -0.349 . . . . 0.0 110.512 -177.486 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 135' ' ' GLN . . . . . . . . . . . . . 44.5 mt-30 -62.93 -33.53 75.53 Favored 'General case' 0 C--O 1.233 0.199 0 CA-C-O 120.669 0.271 . . . . 0.0 110.914 -179.078 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 136' ' ' ILE . . . . . 0.498 HG13 ' O ' ' A' ' 132' ' ' THR . 66.3 mt -63.61 -48.44 86.75 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.218 0 CA-C-N 116.347 -0.388 . . . . 0.0 110.696 176.95 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 137' ' ' PHE . . . . . 0.419 ' O ' HG13 ' A' ' 141' ' ' ILE . 56.4 m-85 -66.25 -37.53 85.71 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-N 116.635 -0.257 . . . . 0.0 110.879 178.579 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 138' ' ' ARG . . . . . 0.469 ' HG3' ' O ' ' A' ' 134' ' ' SER . 41.4 mtp-105 -60.03 -40.3 88.85 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-N 116.449 -0.342 . . . . 0.0 110.454 176.871 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 139' ' ' LEU . . . . . . . . . . . . . 62.1 tp -62.73 -38.56 90.97 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 115.947 -0.569 . . . . 0.0 110.225 177.35 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 140' ' ' ALA . . . . . . . . . . . . . . . -63.94 -41.55 97.58 Favored 'General case' 0 C--N 1.326 -0.427 0 CA-C-N 115.942 -0.572 . . . . 0.0 110.522 176.408 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 141' ' ' ILE . . . . . 0.419 HG13 ' O ' ' A' ' 137' ' ' PHE . 58.9 mt -63.62 -39.04 83.88 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.267 0 CA-C-N 116.565 -0.289 . . . . 0.0 111.021 174.76 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 142' ' ' GLU . . . . . 0.449 ' HG3' ' O ' ' A' ' 138' ' ' ARG . 48.8 mt-10 -60.87 -39.29 88.65 Favored 'General case' 0 N--CA 1.462 0.157 0 CA-C-O 120.858 0.361 . . . . 0.0 110.626 177.169 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 143' ' ' ASN . . . . . 0.44 HD22 ' N ' ' A' ' 143' ' ' ASN . 0.9 OUTLIER -84.87 0.94 49.25 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.204 -0.453 . . . . 0.0 110.189 177.074 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' A' A ' 144' ' ' ARG . . . . . . . . . . . . . 99.5 mtt180 55.15 44.7 27.41 Favored 'General case' 0 C--O 1.232 0.139 0 CA-C-N 115.341 -0.845 . . . . 0.0 111.713 179.222 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 145' ' ' ALA . . . . . . . . . . . . . . . -88.21 -55.59 3.68 Favored 'General case' 0 C--N 1.327 -0.4 0 CA-C-N 115.44 -0.8 . . . . 0.0 109.632 173.897 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 146' ' ' ILE . . . . . 0.446 HG12 ' H ' ' A' ' 148' ' ' PHE . 18.3 tt -104.85 147.49 10.68 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.44 0 N-CA-C 109.359 -0.608 . . . . 0.0 109.359 175.966 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 147' ' ' ASP . . . . . . . . . . . . . 27.2 t70 -87.7 -6.3 58.28 Favored 'General case' 0 C--N 1.324 -0.52 0 CA-C-N 116.4 -0.364 . . . . 0.0 111.891 -172.593 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 148' ' ' PHE . . . . . 0.446 ' H ' HG12 ' A' ' 146' ' ' ILE . 33.0 p90 -155.33 168.7 26.23 Favored 'General case' 0 C--N 1.325 -0.458 0 CA-C-O 120.885 0.374 . . . . 0.0 111.023 -174.003 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 149' ' ' ASN . . . . . . . . . . . . . 29.6 t30 -115.15 102.16 54.63 Favored Pre-proline 0 C--N 1.324 -0.527 0 CA-C-N 115.857 -0.611 . . . . 0.0 110.163 178.303 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 150' ' ' PRO . . . . . . . . . . . . . 40.7 Cg_endo -68.04 -17.96 46.0 Favored 'Trans proline' 0 C--N 1.343 0.254 0 C-N-CA 122.787 2.324 . . . . 0.0 112.48 -178.367 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 151' ' ' ALA . . . . . 0.462 ' HB1' HH21 ' A' ' 130' ' ' ARG . . . -71.54 -20.35 62.04 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 116.269 -0.423 . . . . 0.0 110.942 -179.453 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 152' ' ' ASP . . . . . . . . . . . . . 36.7 t70 -72.92 -15.39 61.58 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 115.821 -0.627 . . . . 0.0 110.822 -178.301 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 153' ' ' TYR . . . . . . . . . . . . . 88.4 m-85 -92.21 2.51 56.56 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.061 -0.518 . . . . 0.0 111.255 -177.922 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 154' ' ' VAL . . . . . . . . . . . . . 81.1 t -90.99 121.86 41.8 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.449 0 CA-C-O 120.752 0.31 . . . . 0.0 111.107 -177.505 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 155' ' ' ARG . . . . . . . . . . . . . 12.4 ttm180 -80.97 134.12 35.64 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 116.155 -0.475 . . . . 0.0 110.03 177.865 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 156' ' ' ILE . . . . . 0.572 HG21 ' HG2' ' A' ' 127' ' ' LYS . 46.1 mm -105.95 130.26 23.28 Favored Pre-proline 0 C--N 1.325 -0.484 0 CA-C-N 116.174 -0.466 . . . . 0.0 109.765 176.613 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 157' ' ' PRO . . . . . . . . . . . . . 18.4 Cg_endo . . . . . 0 C--N 1.344 0.335 0 C-N-CA 122.343 2.029 . . . . 0.0 111.912 179.323 . . . . . . . . 0 0 . 1 . 011 nuclear nobuild core ' A' A ' 63' ' ' SER . . . . . 0.511 ' HA ' ' HA ' ' A' ' 103' ' ' SER . 97.7 p . . . . . 0 N--CA 1.452 -0.333 0 N-CA-C 109.556 -0.535 . . . . 0.0 109.556 . . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 64' ' ' PHE . . . . . . . . . . . . . 82.4 t80 -62.02 -28.74 69.79 Favored 'General case' 0 C--N 1.324 -0.542 0 CA-C-O 120.994 0.426 . . . . 0.0 109.987 178.021 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 65' ' ' GLY . . . . . . . . . . . . . . . -63.8 -37.57 94.87 Favored Glycine 0 N--CA 1.449 -0.497 0 CA-C-N 115.941 -0.572 . . . . 0.0 112.144 176.711 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 66' ' ' ASP . . . . . . . . . . . . . 56.1 m-20 -65.31 -43.77 90.02 Favored 'General case' 0 C--O 1.234 0.243 0 CA-C-O 120.958 0.408 . . . . 0.0 109.957 178.308 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 67' ' ' TRP . . . . . . . . . . . . . 99.4 m95 -69.6 -36.74 76.5 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 115.787 -0.642 . . . . 0.0 111.059 178.371 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 68' ' ' ALA . . . . . 0.469 ' O ' ' HG ' ' A' ' 72' ' ' LEU . . . -59.13 -43.4 92.0 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-O 120.868 0.366 . . . . 0.0 110.544 176.998 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 69' ' ' GLU . . . . . 0.466 ' O ' ' HG2' ' A' ' 73' ' ' LYS . 36.6 tt0 -62.4 -44.77 95.66 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.229 -0.442 . . . . 0.0 110.166 175.506 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 70' ' ' LYS . . . . . 0.455 ' HG2' HD21 ' A' ' 139' ' ' LEU . 64.2 tttp -59.42 -39.99 85.27 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 115.886 -0.597 . . . . 0.0 110.66 -179.963 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 71' ' ' PHE . . . . . . . . . . . . . 68.7 t80 -63.62 -44.42 93.98 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.207 -0.451 . . . . 0.0 110.142 176.619 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 72' ' ' LEU . . . . . 0.469 ' HG ' ' O ' ' A' ' 68' ' ' ALA . 82.8 mt -64.62 -36.65 84.92 Favored 'General case' 0 C--N 1.325 -0.486 0 CA-C-N 116.177 -0.465 . . . . 0.0 110.982 -179.913 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 73' ' ' LYS . . . . . 0.466 ' HG2' ' O ' ' A' ' 69' ' ' GLU . 33.3 mmtp -70.6 -40.84 72.97 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-O 120.681 0.277 . . . . 0.0 111.268 -179.912 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 74' ' ' SER . . . . . . . . . . . . . 8.1 p -71.97 -34.56 69.05 Favored 'General case' 0 C--N 1.324 -0.535 0 CA-C-O 120.829 0.347 . . . . 0.0 110.513 179.169 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 75' ' ' LYS . . . . . 0.52 ' HE3' HG11 ' A' ' 80' ' ' VAL . 46.1 tptt -74.02 -30.24 62.34 Favored 'General case' 0 N--CA 1.444 -0.752 0 CA-C-O 120.928 0.394 . . . . 0.0 110.065 177.087 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 76' ' ' GLU . . . . . . . . . . . . . 33.9 tt0 -59.48 -50.24 74.69 Favored 'General case' 0 C--N 1.327 -0.403 0 CA-C-O 121.183 0.516 . . . . 0.0 109.628 171.291 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 77' ' ' ALA . . . . . . . . . . . . . . . -72.69 -10.96 60.41 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-N 115.332 -0.849 . . . . 0.0 111.06 179.131 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 78' ' ' ASP . . . . . 0.504 ' HB3' ' O ' ' A' ' 75' ' ' LYS . 27.9 t70 -73.54 -15.83 61.29 Favored 'General case' 0 C--N 1.326 -0.439 0 CA-C-N 115.844 -0.616 . . . . 0.0 109.983 175.649 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 79' ' ' GLY . . . . . . . . . . . . . . . 91.87 60.42 1.27 Allowed Glycine 0 N--CA 1.446 -0.655 0 CA-C-N 115.762 -0.654 . . . . 0.0 112.06 177.354 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 80' ' ' VAL . . . . . 0.52 HG11 ' HE3' ' A' ' 75' ' ' LYS . 34.9 m -115.79 152.42 17.47 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.433 0 CA-C-O 120.87 0.367 . . . . 0.0 110.74 178.76 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 81' ' ' SER . . . . . . . . . . . . . 31.2 t -64.45 153.01 40.09 Favored 'General case' 0 C--N 1.322 -0.627 0 CA-C-N 115.732 -0.667 . . . . 0.0 109.829 175.668 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 82' ' ' VAL . . . . . . . . . . . . . 59.2 t -62.56 -43.53 98.51 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.336 0 CA-C-O 120.874 0.369 . . . . 0.0 110.575 -179.203 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 83' ' ' SER . . . . . . . . . . . . . 18.0 t -64.48 -30.71 71.74 Favored 'General case' 0 C--N 1.326 -0.428 0 CA-C-N 116.135 -0.484 . . . . 0.0 110.421 177.509 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 84' ' ' GLN . . . . . . . . . . . . . 47.9 tp60 -71.86 -38.79 70.01 Favored 'General case' 0 C--N 1.332 -0.187 0 CA-C-N 116.076 -0.511 . . . . 0.0 109.738 176.961 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 85' ' ' LEU . . . . . 0.405 ' HA ' ' HD2' ' A' ' 88' ' ' TYR . 40.1 tp -66.56 -38.76 87.77 Favored 'General case' 0 C--N 1.327 -0.389 0 CA-C-N 115.878 -0.601 . . . . 0.0 110.217 176.226 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 86' ' ' ASN . . . . . . . . . . . . . 86.0 m-20 -64.47 -26.87 68.63 Favored 'General case' 0 C--O 1.233 0.201 0 CA-C-N 116.129 -0.487 . . . . 0.0 110.716 176.382 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 87' ' ' SER . . . . . . . . . . . . . 13.0 t -65.71 -48.54 71.65 Favored 'General case' 0 C--N 1.324 -0.501 0 N-CA-C 109.711 -0.477 . . . . 0.0 109.711 175.771 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 88' ' ' TYR . . . . . 0.405 ' HD2' ' HA ' ' A' ' 85' ' ' LEU . 77.7 m-85 -62.45 -35.5 79.49 Favored 'General case' 0 N--CA 1.464 0.25 0 CA-C-O 121.084 0.468 . . . . 0.0 110.38 175.638 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 89' ' ' LYS . . . . . . . . . . . . . 39.1 ttmt -61.2 -37.17 82.01 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-N 115.709 -0.678 . . . . 0.0 110.154 178.809 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 90' ' ' ASN . . . . . 0.484 ' O ' ' HB3' ' A' ' 94' ' ' ASN . 26.6 t-20 -65.49 -39.2 91.63 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 115.79 -0.641 . . . . 0.0 110.414 177.66 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 91' ' ' TYR . . . . . . . . . . . . . 56.5 m-85 -63.91 -59.75 4.13 Favored 'General case' 0 C--N 1.327 -0.409 0 CA-C-N 116.363 -0.38 . . . . 0.0 110.879 176.96 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 92' ' ' CYS . . . . . 0.508 ' HA ' HD12 ' A' ' 96' ' ' LEU . 58.3 m -63.55 -46.71 84.71 Favored 'General case' 0 C--N 1.326 -0.456 0 N-CA-C 112.594 0.59 . . . . 0.0 112.594 -173.485 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 93' ' ' ARG . . . . . . . . . . . . . 40.8 ttm180 -86.13 -39.98 16.15 Favored 'General case' 0 C--N 1.327 -0.405 0 N-CA-C 112.355 0.502 . . . . 0.0 112.355 -172.71 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 94' ' ' ASN . . . . . 0.484 ' HB3' ' O ' ' A' ' 90' ' ' ASN . 49.8 t30 -92.78 -52.81 4.44 Favored 'General case' 0 C--N 1.328 -0.368 0 C-N-CA 120.726 -0.39 . . . . 0.0 111.842 -173.876 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 95' ' ' HIS . . . . . . . . . . . . . 8.8 m80 -77.71 -36.17 51.27 Favored 'General case' 0 C--N 1.326 -0.427 0 C-N-CA 120.789 -0.364 . . . . 0.0 111.57 -176.204 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 96' ' ' LEU . . . . . 0.508 HD12 ' HA ' ' A' ' 92' ' ' CYS . 84.3 mt -98.16 27.05 4.83 Favored 'General case' 0 C--N 1.321 -0.65 0 CA-C-N 116.441 -0.345 . . . . 0.0 110.37 178.678 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 97' ' ' SER . . . . . 0.512 ' N ' ' HD2' ' A' ' 98' ' ' PRO . 1.8 p -53.01 -46.72 97.47 Favored Pre-proline 0 CA--C 1.543 0.686 0 N-CA-C 113.444 0.905 . . . . 0.0 113.444 -175.884 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 98' ' ' PRO . . . . . 0.512 ' HD2' ' N ' ' A' ' 97' ' ' SER . 18.3 Cg_endo -60.43 -34.24 93.32 Favored 'Trans proline' 0 C--N 1.359 1.091 0 C-N-CA 121.771 1.647 . . . . 0.0 112.106 178.301 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 99' ' ' LEU . . . . . 0.539 HD22 HG23 ' A' ' 107' ' ' ILE . 41.1 mt -83.81 -28.78 27.85 Favored 'General case' 0 C--N 1.325 -0.475 0 CA-C-O 121.071 0.462 . . . . 0.0 110.366 -177.668 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 100' ' ' TYR . . . . . . . . . . . . . 44.1 t80 -59.38 -25.79 64.55 Favored 'General case' 0 C--N 1.325 -0.497 0 CA-C-N 115.218 -0.901 . . . . 0.0 111.603 -176.802 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 101' ' ' MET . . . . . . . . . . . . . 22.5 ptp -104.17 5.18 34.76 Favored 'General case' 0 C--N 1.327 -0.385 0 CA-C-N 116.347 -0.388 . . . . 0.0 111.24 -178.867 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 102' ' ' LYS . . . . . 0.539 ' HB3' ' HB3' ' A' ' 106' ' ' GLU . 64.0 mttm -105.43 166.96 10.06 Favored 'General case' 0 C--N 1.324 -0.501 0 CA-C-N 116.55 -0.295 . . . . 0.0 110.521 -179.561 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 103' ' ' SER . . . . . 0.511 ' HA ' ' HA ' ' A' ' 63' ' ' SER . 50.9 p -94.97 170.8 9.17 Favored 'General case' 0 C--N 1.32 -0.688 0 N-CA-C 109.613 -0.514 . . . . 0.0 109.613 173.806 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 104' ' ' LEU . . . . . . . . . . . . . 96.5 mt -58.69 -31.04 67.86 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-O 120.747 0.308 . . . . 0.0 111.028 179.222 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 105' ' ' SER . . . . . . . . . . . . . 14.0 m -86.91 -20.99 26.57 Favored 'General case' 0 C--N 1.327 -0.391 0 CA-C-N 116.344 -0.389 . . . . 0.0 111.112 -179.109 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 106' ' ' GLU . . . . . 0.539 ' HB3' ' HB3' ' A' ' 102' ' ' LYS . 0.6 OUTLIER -83.04 -25.23 32.31 Favored 'General case' 0 C--N 1.326 -0.433 0 CA-C-O 121.219 0.533 . . . . 0.0 110.443 -176.901 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild core ' A' A ' 107' ' ' ILE . . . . . 0.539 HG23 HD22 ' A' ' 99' ' ' LEU . 78.9 mt -70.84 127.11 32.36 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.571 0 CA-C-N 115.929 -0.578 . . . . 0.0 111.329 -179.004 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 108' ' ' LEU . . . . . 0.422 ' HA ' ' HD3' ' A' ' 109' ' ' PRO . 93.5 mt -100.44 137.89 20.05 Favored Pre-proline 0 C--N 1.326 -0.452 0 CA-C-N 115.691 -0.686 . . . . 0.0 110.457 176.669 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 109' ' ' PRO . . . . . 0.422 ' HD3' ' HA ' ' A' ' 108' ' ' LEU . 44.2 Cg_exo -56.62 -44.04 49.32 Favored 'Trans proline' 0 CA--C 1.53 0.315 0 C-N-CA 122.709 2.273 . . . . 0.0 112.528 178.97 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 110' ' ' ALA . . . . . . . . . . . . . . . -65.78 -27.99 68.69 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-O 120.818 0.342 . . . . 0.0 111.469 -178.502 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 111' ' ' ASP . . . . . 0.539 ' O ' HG13 ' A' ' 115' ' ' ILE . 10.3 t70 -68.68 -39.82 80.37 Favored 'General case' 0 C--N 1.325 -0.486 0 CA-C-O 121.383 0.611 . . . . 0.0 109.703 179.996 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 112' ' ' ILE . . . . . 0.521 ' HB ' HG21 ' A' ' 154' ' ' VAL . 40.5 mt -67.62 -38.25 80.14 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.39 0 CA-C-N 115.583 -0.735 . . . . 0.0 109.829 175.178 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 113' ' ' GLN . . . . . 0.434 ' HA ' HG13 ' A' ' 154' ' ' VAL . 25.2 tp60 -62.88 -41.23 99.33 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-N 115.466 -0.788 . . . . 0.0 110.794 -179.012 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 114' ' ' SER . . . . . 0.415 ' HA ' ' HB3' ' A' ' 117' ' ' ASN . 41.3 p -70.1 -30.66 67.93 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.761 -0.2 . . . . 0.0 111.024 -179.516 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 115' ' ' ILE . . . . . 0.539 HG13 ' O ' ' A' ' 111' ' ' ASP . 83.6 mt -56.55 -55.32 20.03 Favored 'Isoleucine or valine' 0 N--CA 1.463 0.193 0 CA-C-O 120.951 0.405 . . . . 0.0 110.045 174.442 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 116' ' ' ILE . . . . . 0.422 HG23 ' HB3' ' A' ' 126' ' ' LEU . 45.2 mm -64.71 -30.04 49.12 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.378 0 CA-C-N 115.815 -0.63 . . . . 0.0 110.432 179.569 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 117' ' ' ASN . . . . . 0.415 ' HB3' ' HA ' ' A' ' 114' ' ' SER . 8.1 t30 -66.37 -43.25 86.49 Favored 'General case' 0 C--N 1.324 -0.505 0 CA-C-N 115.564 -0.744 . . . . 0.0 111.524 -178.587 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 118' ' ' GLU . . . . . . . . . . . . . 39.3 mt-10 -91.61 -30.46 16.35 Favored 'General case' 0 C--N 1.327 -0.39 0 N-CA-C 112.41 0.522 . . . . 0.0 112.41 -175.897 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 119' ' ' THR . . . . . . . . . . . . . 63.4 m -64.99 111.9 3.07 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-O 120.96 0.409 . . . . 0.0 110.356 -178.68 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 120' ' ' LYS . . . . . . . . . . . . . 91.2 mttt -92.93 79.58 4.63 Favored 'General case' 0 C--N 1.326 -0.42 0 CA-C-O 121.309 0.576 . . . . 0.0 110.734 -176.896 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 121' ' ' LEU . . . . . . . . . . . . . 76.5 mt -126.97 -175.66 3.48 Favored 'General case' 0 C--N 1.321 -0.658 0 CA-C-N 115.5 -0.773 . . . . 0.0 109.612 177.559 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 122' ' ' ALA . . . . . . . . . . . . . . . -65.53 152.28 44.42 Favored 'General case' 0 C--N 1.325 -0.495 0 CA-C-N 116.497 -0.319 . . . . 0.0 110.328 178.812 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 123' ' ' LYS . . . . . . . . . . . . . 0.4 OUTLIER -63.56 -35.66 81.22 Favored 'General case' 0 C--N 1.325 -0.491 0 CA-C-N 116.273 -0.421 . . . . 0.0 110.238 -176.043 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 124' ' ' ASN . . . . . 0.783 ' HA ' ' HE3' ' A' ' 127' ' ' LYS . 11.6 t30 -69.61 -35.69 75.5 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 116.176 -0.465 . . . . 0.0 110.246 177.979 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 125' ' ' THR . . . . . 0.545 ' O ' HG13 ' A' ' 129' ' ' ILE . 8.6 m -65.43 -44.25 87.92 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.226 -0.443 . . . . 0.0 110.274 177.015 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 126' ' ' LEU . . . . . 0.422 ' HB3' HG23 ' A' ' 116' ' ' ILE . 98.6 mt -61.55 -43.27 99.16 Favored 'General case' 0 C--N 1.33 -0.246 0 CA-C-N 115.911 -0.586 . . . . 0.0 110.57 178.665 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 127' ' ' LYS . . . . . 0.783 ' HE3' ' HA ' ' A' ' 124' ' ' ASN . 44.9 mtmt -60.87 -40.06 91.53 Favored 'General case' 0 C--N 1.331 -0.219 0 CA-C-N 116.118 -0.492 . . . . 0.0 110.519 175.824 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 128' ' ' ALA . . . . . . . . . . . . . . . -64.47 -34.38 78.06 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 116.086 -0.506 . . . . 0.0 110.995 179.48 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 129' ' ' ILE . . . . . 0.545 HG13 ' O ' ' A' ' 125' ' ' THR . 71.3 mt -63.26 -53.42 46.04 Favored 'Isoleucine or valine' 0 C--O 1.234 0.244 0 CA-C-N 116.565 -0.289 . . . . 0.0 110.347 177.196 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 130' ' ' ARG . . . . . . . . . . . . . 40.4 ttp180 -62.85 -40.69 98.23 Favored 'General case' 0 CA--C 1.521 -0.154 0 CA-C-O 120.793 0.33 . . . . 0.0 110.126 178.455 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 131' ' ' ASN . . . . . 0.632 ' O ' ' HG2' ' A' ' 135' ' ' GLN . 7.5 t30 -54.98 -55.91 25.55 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-N 115.777 -0.647 . . . . 0.0 110.832 178.538 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 132' ' ' THR . . . . . 0.465 ' O ' HG13 ' A' ' 136' ' ' ILE . 32.0 m -57.04 -45.6 83.04 Favored 'General case' 0 C--N 1.326 -0.433 0 CA-C-N 116.295 -0.412 . . . . 0.0 110.79 -178.705 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 133' ' ' ALA . . . . . . . . . . . . . . . -63.34 -48.67 77.03 Favored 'General case' 0 C--N 1.332 -0.193 0 CA-C-N 116.325 -0.398 . . . . 0.0 111.56 179.796 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 134' ' ' SER . . . . . 0.585 ' O ' ' HG3' ' A' ' 138' ' ' ARG . 26.9 p -66.53 -32.0 73.08 Favored 'General case' 0 C--N 1.327 -0.39 0 CA-C-N 116.633 -0.258 . . . . 0.0 111.27 -177.108 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 135' ' ' GLN . . . . . 0.632 ' HG2' ' O ' ' A' ' 131' ' ' ASN . 11.0 mm100 -65.53 -38.24 89.08 Favored 'General case' 0 C--N 1.331 -0.205 0 C-N-CA 120.967 -0.293 . . . . 0.0 110.36 176.777 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 136' ' ' ILE . . . . . 0.465 HG13 ' O ' ' A' ' 132' ' ' THR . 76.3 mt -64.0 -39.9 87.11 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.262 0 CA-C-N 116.285 -0.416 . . . . 0.0 109.986 176.699 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 137' ' ' PHE . . . . . 0.523 ' O ' HG13 ' A' ' 141' ' ' ILE . 44.2 m-85 -62.86 -42.89 99.92 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.183 -0.462 . . . . 0.0 110.638 175.435 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 138' ' ' ARG . . . . . 0.585 ' HG3' ' O ' ' A' ' 134' ' ' SER . 42.4 mtt180 -60.84 -38.56 85.91 Favored 'General case' 0 N--CA 1.465 0.283 0 CA-C-O 120.804 0.335 . . . . 0.0 110.537 178.559 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 139' ' ' LEU . . . . . 0.455 HD21 ' HG2' ' A' ' 70' ' ' LYS . 65.5 tp -56.45 -38.65 71.92 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 115.821 -0.627 . . . . 0.0 110.519 177.071 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 140' ' ' ALA . . . . . . . . . . . . . . . -74.87 -33.27 62.07 Favored 'General case' 0 C--N 1.325 -0.47 0 CA-C-N 115.872 -0.604 . . . . 0.0 110.706 177.43 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 141' ' ' ILE . . . . . 0.65 ' HA ' ' O ' ' A' ' 146' ' ' ILE . 73.6 mt -64.35 -43.59 97.12 Favored 'Isoleucine or valine' 0 C--O 1.233 0.228 0 CA-C-N 116.08 -0.509 . . . . 0.0 111.01 177.983 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 142' ' ' GLU . . . . . 0.48 ' HG3' ' O ' ' A' ' 138' ' ' ARG . 48.4 mt-10 -60.69 -39.33 88.08 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.113 -0.494 . . . . 0.0 110.657 178.976 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 143' ' ' ASN . . . . . . . . . . . . . 43.7 m-80 -83.97 3.09 35.77 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 115.782 -0.645 . . . . 0.0 110.622 179.555 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 144' ' ' ARG . . . . . . . . . . . . . 99.5 mtt180 60.87 28.66 18.42 Favored 'General case' 0 C--O 1.234 0.267 0 CA-C-N 115.423 -0.808 . . . . 0.0 111.762 174.014 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 145' ' ' ALA . . . . . . . . . . . . . . . -78.25 -37.77 44.43 Favored 'General case' 0 C--N 1.326 -0.428 0 CA-C-N 115.672 -0.694 . . . . 0.0 109.224 174.276 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 146' ' ' ILE . . . . . 0.65 ' O ' ' HA ' ' A' ' 141' ' ' ILE . 13.8 tt -144.73 140.26 23.47 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.626 0 CA-C-N 115.011 -0.995 . . . . 0.0 108.847 175.961 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 147' ' ' ASP . . . . . . . . . . . . . 31.6 t70 -117.1 46.12 1.74 Allowed 'General case' 0 C--N 1.318 -0.791 0 N-CA-C 108.75 -0.833 . . . . 0.0 108.75 178.53 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 148' ' ' PHE . . . . . . . . . . . . . 70.5 t80 -151.42 123.9 8.39 Favored 'General case' 0 C--N 1.322 -0.603 0 CA-C-N 114.851 -1.068 . . . . 0.0 109.321 -177.105 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 149' ' ' ASN . . . . . . . . . . . . . 49.0 t-20 -110.74 98.12 36.26 Favored Pre-proline 0 C--N 1.321 -0.634 0 N-CA-C 110.119 -0.326 . . . . 0.0 110.119 -179.354 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 150' ' ' PRO . . . . . . . . . . . . . 26.6 Cg_exo -62.37 -33.2 80.64 Favored 'Trans proline' 0 C--O 1.232 0.181 0 C-N-CA 122.689 2.259 . . . . 0.0 111.98 -179.335 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 151' ' ' ALA . . . . . . . . . . . . . . . -73.46 -18.11 61.16 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 115.988 -0.551 . . . . 0.0 111.386 -176.51 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 152' ' ' ASP . . . . . . . . . . . . . 34.6 t70 -72.49 -24.3 61.15 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-O 121.288 0.566 . . . . 0.0 110.234 179.216 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 153' ' ' TYR . . . . . . . . . . . . . 62.5 m-85 -89.91 -4.41 57.54 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-N 115.954 -0.567 . . . . 0.0 110.138 179.916 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 154' ' ' VAL . . . . . 0.521 HG21 ' HB ' ' A' ' 112' ' ' ILE . 60.3 t -89.67 139.11 18.01 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.544 0 CA-C-N 115.531 -0.759 . . . . 0.0 109.495 176.437 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 155' ' ' ARG . . . . . . . . . . . . . 15.9 ptt180 -124.58 155.55 38.9 Favored 'General case' 0 C--N 1.321 -0.648 0 C-N-CA 120.554 -0.458 . . . . 0.0 110.963 179.855 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 156' ' ' ILE . . . . . 0.424 ' HA ' ' HD3' ' A' ' 157' ' ' PRO . 2.4 mp -96.43 116.29 66.07 Favored Pre-proline 0 C--N 1.324 -0.51 0 CA-C-N 115.843 -0.617 . . . . 0.0 109.986 179.734 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 157' ' ' PRO . . . . . 0.424 ' HD3' ' HA ' ' A' ' 156' ' ' ILE . 14.2 Cg_exo . . . . . 0 N--CA 1.456 -0.685 0 C-N-CA 122.591 2.194 . . . . 0.0 111.181 177.191 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 63' ' ' SER . . . . . 0.596 ' HB2' ' HB2' ' A' ' 66' ' ' ASP . 5.5 m . . . . . 0 N--CA 1.454 -0.24 0 N-CA-C 109.784 -0.451 . . . . 0.0 109.784 . . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 64' ' ' PHE . . . . . 0.491 ' HB2' HD11 ' A' ' 107' ' ' ILE . 80.0 t80 -64.23 -50.37 68.28 Favored 'General case' 0 C--N 1.328 -0.365 0 N-CA-C 109.989 -0.374 . . . . 0.0 109.989 178.588 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 65' ' ' GLY . . . . . . . . . . . . . . . -62.87 -27.67 70.58 Favored Glycine 0 C--N 1.33 0.247 0 C-N-CA 120.816 -0.707 . . . . 0.0 112.193 177.378 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 66' ' ' ASP . . . . . 0.596 ' HB2' ' HB2' ' A' ' 63' ' ' SER . 8.1 t70 -62.68 -53.28 56.88 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-O 121.107 0.479 . . . . 0.0 110.34 177.692 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 67' ' ' TRP . . . . . . . . . . . . . 90.8 m95 -75.22 -27.26 59.47 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 115.788 -0.642 . . . . 0.0 111.256 -179.922 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 68' ' ' ALA . . . . . 0.557 ' O ' ' HG ' ' A' ' 72' ' ' LEU . . . -60.34 -48.54 81.33 Favored 'General case' 0 C--N 1.326 -0.419 0 N-CA-C 110.025 -0.361 . . . . 0.0 110.025 174.995 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 69' ' ' GLU . . . . . . . . . . . . . 17.8 tp10 -56.68 -44.06 81.07 Favored 'General case' 0 C--O 1.233 0.236 0 CA-C-N 115.885 -0.598 . . . . 0.0 110.527 175.358 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 70' ' ' LYS . . . . . . . . . . . . . 59.2 mttp -61.27 -45.1 95.91 Favored 'General case' 0 C--N 1.326 -0.416 0 CA-C-N 116.07 -0.514 . . . . 0.0 110.832 177.597 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 71' ' ' PHE . . . . . . . . . . . . . 69.8 t80 -66.04 -42.79 89.12 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.352 -0.385 . . . . 0.0 111.058 -178.974 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 72' ' ' LEU . . . . . 0.557 ' HG ' ' O ' ' A' ' 68' ' ' ALA . 88.6 mt -63.74 -49.94 71.05 Favored 'General case' 0 C--N 1.326 -0.417 0 CA-C-O 120.857 0.361 . . . . 0.0 110.667 179.805 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 73' ' ' LYS . . . . . . . . . . . . . 5.7 ttpm? -69.32 -32.32 71.36 Favored 'General case' 0 C--N 1.323 -0.548 0 CA-C-N 116.173 -0.467 . . . . 0.0 111.406 -175.653 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 74' ' ' SER . . . . . . . . . . . . . 37.9 p -71.04 -32.25 68.94 Favored 'General case' 0 C--N 1.328 -0.327 0 C-N-CA 120.628 -0.429 . . . . 0.0 110.216 175.955 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 75' ' ' LYS . . . . . 0.402 ' O ' HG22 ' A' ' 80' ' ' VAL . 39.5 mmtt -70.59 -35.92 73.27 Favored 'General case' 0 C--O 1.233 0.203 0 CA-C-O 120.801 0.334 . . . . 0.0 110.687 174.082 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 76' ' ' GLU . . . . . . . . . . . . . 33.9 tt0 -56.22 -44.8 79.9 Favored 'General case' 0 C--N 1.327 -0.403 0 CA-C-N 116.011 -0.54 . . . . 0.0 110.175 176.083 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 77' ' ' ALA . . . . . . . . . . . . . . . -80.96 -24.1 38.32 Favored 'General case' 0 C--N 1.326 -0.423 0 CA-C-N 115.818 -0.628 . . . . 0.0 111.276 177.417 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 78' ' ' ASP . . . . . . . . . . . . . 15.6 t70 -57.35 -54.6 45.03 Favored 'General case' 0 N--CA 1.466 0.343 0 CA-C-N 116.108 -0.496 . . . . 0.0 110.735 179.192 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 79' ' ' GLY . . . . . . . . . . . . . . . 146.52 56.37 0.02 OUTLIER Glycine 0 N--CA 1.443 -0.884 0 C-N-CA 120.335 -0.936 . . . . 0.0 112.656 178.2 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 80' ' ' VAL . . . . . 0.619 ' HB ' ' HB2' ' A' ' 84' ' ' GLN . 32.9 m -121.2 148.88 24.27 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.642 0 CA-C-O 120.763 0.316 . . . . 0.0 110.223 176.67 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 81' ' ' SER . . . . . . . . . . . . . 13.1 p -81.94 172.78 12.88 Favored 'General case' 0 C--N 1.319 -0.733 0 CA-C-N 116.146 -0.479 . . . . 0.0 110.076 176.789 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 82' ' ' VAL . . . . . . . . . . . . . 7.9 p -58.7 -40.08 78.38 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.47 0 CA-C-N 116.49 -0.323 . . . . 0.0 111.463 -176.178 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 83' ' ' SER . . . . . . . . . . . . . 13.7 t -62.86 -33.43 75.25 Favored 'General case' 0 C--N 1.331 -0.206 0 CA-C-O 120.623 0.249 . . . . 0.0 110.734 -178.631 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 84' ' ' GLN . . . . . 0.619 ' HB2' ' HB ' ' A' ' 80' ' ' VAL . 17.1 mm100 -68.35 -57.49 5.83 Favored 'General case' 0 C--N 1.332 -0.191 0 N-CA-C 109.896 -0.409 . . . . 0.0 109.896 177.464 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 85' ' ' LEU . . . . . 0.49 HD21 ' O ' ' A' ' 72' ' ' LEU . 0.2 OUTLIER -58.93 -39.87 82.86 Favored 'General case' 0 C--N 1.325 -0.462 0 CA-C-N 116.051 -0.522 . . . . 0.0 110.507 -176.618 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild core ' A' A ' 86' ' ' ASN . . . . . . . . . . . . . 62.7 t30 -63.83 -35.67 81.38 Favored 'General case' 0 C--N 1.326 -0.453 0 CA-C-N 115.865 -0.607 . . . . 0.0 110.832 -179.486 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 87' ' ' SER . . . . . . . . . . . . . 75.9 p -78.55 -36.85 44.08 Favored 'General case' 0 CA--C 1.531 0.239 0 C-N-CA 121.033 -0.267 . . . . 0.0 111.143 178.448 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 88' ' ' TYR . . . . . . . . . . . . . 29.8 m-85 -56.6 -47.69 79.05 Favored 'General case' 0 N--CA 1.463 0.182 0 CA-C-O 121.381 0.61 . . . . 0.0 109.728 173.791 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 89' ' ' LYS . . . . . 0.434 ' HB2' ' HE2' ' A' ' 89' ' ' LYS . 21.9 ttmm -64.64 -41.81 95.9 Favored 'General case' 0 C--N 1.327 -0.392 0 CA-C-N 115.173 -0.921 . . . . 0.0 110.554 178.859 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 90' ' ' ASN . . . . . . . . . . . . . 20.3 t30 -53.41 -50.02 66.04 Favored 'General case' 0 C--O 1.237 0.427 0 CA-C-O 120.945 0.402 . . . . 0.0 111.094 177.831 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 91' ' ' TYR . . . . . 0.423 ' O ' ' HB2' ' A' ' 95' ' ' HIS . 34.0 m-85 -60.39 -48.97 79.46 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.335 -0.393 . . . . 0.0 111.112 179.599 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 92' ' ' CYS . . . . . 0.554 ' HA ' ' HB2' ' A' ' 96' ' ' LEU . 51.2 t -71.14 -24.99 62.37 Favored 'General case' 0 C--N 1.324 -0.532 0 CA-C-O 120.878 0.37 . . . . 0.0 111.609 -176.299 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 93' ' ' ARG . . . . . 0.413 ' O ' ' HB3' ' A' ' 97' ' ' SER . 37.5 ttt180 -77.31 -52.24 9.52 Favored 'General case' 0 C--N 1.324 -0.512 0 CA-C-N 116.371 -0.377 . . . . 0.0 111.844 -174.951 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 94' ' ' ASN . . . . . . . . . . . . . 3.5 t-20 -103.65 -36.45 7.9 Favored 'General case' 0 C--N 1.33 -0.269 0 C-N-CA 120.937 -0.305 . . . . 0.0 111.812 -175.211 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 95' ' ' HIS . . . . . 0.423 ' HB2' ' O ' ' A' ' 91' ' ' TYR . 42.6 m80 -85.71 -21.14 28.44 Favored 'General case' 0 C--N 1.322 -0.605 0 C-N-CA 120.688 -0.405 . . . . 0.0 111.344 -175.544 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 96' ' ' LEU . . . . . 0.554 ' HB2' ' HA ' ' A' ' 92' ' ' CYS . 89.7 mt -117.66 24.52 11.02 Favored 'General case' 0 C--N 1.324 -0.511 0 CA-C-O 121.124 0.487 . . . . 0.0 110.173 177.123 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 97' ' ' SER . . . . . 0.587 ' OG ' ' HD3' ' A' ' 98' ' ' PRO . 8.1 p -61.16 -43.12 89.37 Favored Pre-proline 0 CA--C 1.541 0.63 0 N-CA-C 113.272 0.841 . . . . 0.0 113.272 -177.548 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 98' ' ' PRO . . . . . 0.587 ' HD3' ' OG ' ' A' ' 97' ' ' SER . 17.5 Cg_exo -66.9 -15.06 46.02 Favored 'Trans proline' 0 C--N 1.361 1.208 0 C-N-CA 121.711 1.607 . . . . 0.0 112.028 -179.924 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 99' ' ' LEU . . . . . 0.405 HD12 HD22 ' A' ' 96' ' ' LEU . 49.9 mt -98.33 -33.69 10.97 Favored 'General case' 0 C--N 1.324 -0.501 0 CA-C-N 115.942 -0.572 . . . . 0.0 110.575 -178.835 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 100' ' ' TYR . . . . . . . . . . . . . 45.0 t80 -53.94 -43.44 69.81 Favored 'General case' 0 N--CA 1.465 0.279 0 CA-C-N 115.931 -0.577 . . . . 0.0 111.956 -175.434 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 101' ' ' MET . . . . . . . . . . . . . 0.7 OUTLIER -80.18 -16.13 55.51 Favored 'General case' 0 C--N 1.328 -0.335 0 N-CA-C 112.175 0.435 . . . . 0.0 112.175 -176.601 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 102' ' ' LYS . . . . . . . . . . . . . 95.4 mttt -88.95 153.64 20.87 Favored 'General case' 0 C--N 1.325 -0.5 0 CA-C-O 121.204 0.526 . . . . 0.0 110.975 -176.731 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 103' ' ' SER . . . . . 0.603 ' HB2' ' CG ' ' A' ' 106' ' ' GLU . 3.1 m -69.69 148.09 49.71 Favored 'General case' 0 C--N 1.324 -0.521 0 CA-C-N 115.651 -0.704 . . . . 0.0 109.174 175.003 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 104' ' ' LEU . . . . . . . . . . . . . 25.1 tp -59.87 -55.37 34.99 Favored 'General case' 0 C--N 1.323 -0.548 0 CA-C-O 120.803 0.335 . . . . 0.0 111.582 -171.466 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 105' ' ' SER . . . . . . . . . . . . . 34.4 t -73.09 -11.87 60.7 Favored 'General case' 0 C--N 1.325 -0.465 0 CA-C-N 116.212 -0.449 . . . . 0.0 111.45 -176.741 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 106' ' ' GLU . . . . . 0.603 ' CG ' ' HB2' ' A' ' 103' ' ' SER . 6.6 mm-40 -88.29 -15.55 35.48 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-O 120.686 0.279 . . . . 0.0 110.657 -178.465 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 107' ' ' ILE . . . . . 0.531 HG13 ' O ' ' A' ' 103' ' ' SER . 81.5 mt -69.78 129.27 34.05 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.376 0 CA-C-N 116.246 -0.433 . . . . 0.0 110.691 -179.49 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 108' ' ' LEU . . . . . . . . . . . . . 65.6 mt -88.3 146.01 37.04 Favored Pre-proline 0 C--N 1.322 -0.618 0 CA-C-N 115.916 -0.583 . . . . 0.0 109.871 178.267 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 109' ' ' PRO . . . . . . . . . . . . . 52.6 Cg_exo -55.38 -31.05 75.79 Favored 'Trans proline' 0 N--CA 1.463 -0.318 0 C-N-CA 122.184 1.923 . . . . 0.0 111.123 173.387 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 110' ' ' ALA . . . . . . . . . . . . . . . -60.98 -37.93 84.21 Favored 'General case' 0 N--CA 1.453 -0.287 0 CA-C-N 115.342 -0.844 . . . . 0.0 111.434 178.319 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 111' ' ' ASP . . . . . 0.432 ' O ' HG13 ' A' ' 115' ' ' ILE . 5.9 m-20 -58.46 -56.58 20.24 Favored 'General case' 0 N--CA 1.466 0.329 0 CA-C-O 120.9 0.381 . . . . 0.0 110.999 -179.247 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 112' ' ' ILE . . . . . . . . . . . . . 18.6 mt -65.43 -43.35 94.66 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.514 0 CA-C-N 115.578 -0.737 . . . . 0.0 110.684 -176.332 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 113' ' ' GLN . . . . . 0.473 ' HA ' HG13 ' A' ' 154' ' ' VAL . 24.7 tp60 -61.96 -40.95 97.32 Favored 'General case' 0 C--N 1.332 -0.195 0 CA-C-N 116.227 -0.442 . . . . 0.0 110.524 -179.927 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 114' ' ' SER . . . . . 0.429 ' O ' ' HG2' ' A' ' 118' ' ' GLU . 48.3 t -59.42 -46.22 89.33 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.088 -0.505 . . . . 0.0 110.492 178.194 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 115' ' ' ILE . . . . . 0.432 HG13 ' O ' ' A' ' 111' ' ' ASP . 79.2 mt -58.87 -57.63 10.37 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.224 0 CA-C-N 116.162 -0.472 . . . . 0.0 110.683 179.812 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 116' ' ' ILE . . . . . . . . . . . . . 47.3 mm -57.86 -38.48 66.22 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.371 0 CA-C-N 116.196 -0.456 . . . . 0.0 111.55 -177.51 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 117' ' ' ASN . . . . . . . . . . . . . 7.8 t30 -65.93 -38.32 88.35 Favored 'General case' 0 C--N 1.327 -0.384 0 CA-C-N 116.457 -0.338 . . . . 0.0 111.707 -175.452 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 118' ' ' GLU . . . . . 0.429 ' HG2' ' O ' ' A' ' 114' ' ' SER . 11.0 pt-20 -96.43 -12.41 24.28 Favored 'General case' 0 C--N 1.33 -0.279 0 N-CA-C 112.239 0.459 . . . . 0.0 112.239 -176.255 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 119' ' ' THR . . . . . . . . . . . . . 90.3 m -68.95 113.7 6.59 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-O 121.259 0.552 . . . . 0.0 110.103 177.98 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 120' ' ' LYS . . . . . . . . . . . . . 47.9 mttp -93.8 81.28 4.22 Favored 'General case' 0 C--N 1.322 -0.618 0 CA-C-N 115.726 -0.67 . . . . 0.0 110.429 -174.924 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 121' ' ' LEU . . . . . . . . . . . . . 85.2 mt -133.86 -175.48 3.85 Favored 'General case' 0 C--N 1.325 -0.499 0 CA-C-N 115.308 -0.86 . . . . 0.0 109.695 179.825 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 122' ' ' ALA . . . . . . . . . . . . . . . -71.78 158.3 36.36 Favored 'General case' 0 C--N 1.325 -0.489 0 CA-C-O 120.83 0.348 . . . . 0.0 111.097 -179.045 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 123' ' ' LYS . . . . . . . . . . . . . 54.9 mtpt -60.04 -40.2 88.54 Favored 'General case' 0 C--N 1.33 -0.244 0 CA-C-N 115.858 -0.61 . . . . 0.0 111.3 -176.08 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 124' ' ' ASN . . . . . . . . . . . . . 20.4 p-10 -73.36 -30.52 63.36 Favored 'General case' 0 C--N 1.326 -0.442 0 CA-C-N 116.077 -0.51 . . . . 0.0 110.726 -179.76 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 125' ' ' THR . . . . . 0.403 ' O ' HG13 ' A' ' 129' ' ' ILE . 8.0 m -70.5 -41.17 73.02 Favored 'General case' 0 C--N 1.323 -0.578 0 CA-C-N 116.326 -0.397 . . . . 0.0 110.623 178.982 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 126' ' ' LEU . . . . . . . . . . . . . 91.1 mt -61.74 -44.02 97.71 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 116.105 -0.498 . . . . 0.0 110.675 178.348 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 127' ' ' LYS . . . . . 0.629 ' HG2' HG13 ' A' ' 156' ' ' ILE . 87.8 mttt -64.45 -39.0 92.99 Favored 'General case' 0 C--N 1.331 -0.213 0 CA-C-N 116.126 -0.488 . . . . 0.0 111.005 178.985 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 128' ' ' ALA . . . . . . . . . . . . . . . -58.32 -44.41 88.62 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.276 -0.42 . . . . 0.0 110.895 -179.874 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 129' ' ' ILE . . . . . 0.403 HG13 ' O ' ' A' ' 125' ' ' THR . 65.2 mt -61.97 -47.81 91.45 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.37 0 CA-C-N 115.86 -0.609 . . . . 0.0 110.446 179.024 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 130' ' ' ARG . . . . . 0.415 HH11 ' HD2' ' A' ' 130' ' ' ARG . 10.4 ttp180 -64.95 -43.82 91.46 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 115.864 -0.607 . . . . 0.0 110.952 -178.188 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 131' ' ' ASN . . . . . . . . . . . . . 9.9 t30 -62.12 -44.56 96.38 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.421 -0.354 . . . . 0.0 111.084 -179.317 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 132' ' ' THR . . . . . 0.485 ' O ' HG13 ' A' ' 136' ' ' ILE . 35.8 m -58.17 -48.22 80.98 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.268 -0.424 . . . . 0.0 110.292 178.844 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 133' ' ' ALA . . . . . . . . . . . . . . . -65.1 -38.83 91.98 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.131 -0.486 . . . . 0.0 110.991 178.905 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 134' ' ' SER . . . . . 0.443 ' HA ' ' HB3' ' A' ' 151' ' ' ALA . 18.5 t -61.76 -41.92 98.31 Favored 'General case' 0 C--N 1.327 -0.393 0 CA-C-N 116.048 -0.524 . . . . 0.0 110.622 -179.199 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 135' ' ' GLN . . . . . . . . . . . . . 49.7 mt-30 -66.8 -31.0 71.35 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 116.544 -0.298 . . . . 0.0 111.322 178.101 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 136' ' ' ILE . . . . . 0.485 HG13 ' O ' ' A' ' 132' ' ' THR . 76.1 mt -65.95 -50.93 66.44 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.225 0 CA-C-O 120.807 0.337 . . . . 0.0 110.202 176.761 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 137' ' ' PHE . . . . . 0.491 ' O ' HG13 ' A' ' 141' ' ' ILE . 66.0 m-85 -62.7 -37.46 86.57 Favored 'General case' 0 C--N 1.331 -0.213 0 CA-C-N 116.279 -0.418 . . . . 0.0 110.539 176.431 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 138' ' ' ARG . . . . . . . . . . . . . 26.5 ttp85 -60.1 -44.28 94.94 Favored 'General case' 0 N--CA 1.45 -0.469 0 CA-C-N 116.11 -0.496 . . . . 0.0 110.549 178.88 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 139' ' ' LEU . . . . . . . . . . . . . 65.9 tp -60.29 -34.92 74.44 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 115.678 -0.692 . . . . 0.0 110.562 177.87 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 140' ' ' ALA . . . . . 0.481 ' HB1' ' HB3' ' A' ' 145' ' ' ALA . . . -72.62 -34.65 67.48 Favored 'General case' 0 C--N 1.323 -0.579 0 CA-C-N 115.975 -0.557 . . . . 0.0 110.868 178.512 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 141' ' ' ILE . . . . . 0.562 ' HA ' ' O ' ' A' ' 146' ' ' ILE . 81.7 mt -60.31 -49.96 82.18 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.235 0 CA-C-N 116.708 -0.224 . . . . 0.0 111.281 176.982 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 142' ' ' GLU . . . . . . . . . . . . . 14.9 pt-20 -70.08 -18.78 63.28 Favored 'General case' 0 N--CA 1.464 0.252 0 CA-C-O 120.943 0.402 . . . . 0.0 111.298 -179.216 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 143' ' ' ASN . . . . . . . . . . . . . 20.8 m-80 -97.74 6.22 48.18 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.37 -0.377 . . . . 0.0 110.515 175.32 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 144' ' ' ARG . . . . . . . . . . . . . 44.7 mtt180 60.1 32.45 20.97 Favored 'General case' 0 N--CA 1.464 0.26 0 CA-C-N 115.65 -0.705 . . . . 0.0 112.037 173.966 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 145' ' ' ALA . . . . . 0.481 ' HB3' ' HB1' ' A' ' 140' ' ' ALA . . . -88.4 -32.09 18.51 Favored 'General case' 0 C--N 1.324 -0.524 0 CA-C-O 121.073 0.463 . . . . 0.0 109.754 175.009 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 146' ' ' ILE . . . . . 0.562 ' O ' ' HA ' ' A' ' 141' ' ' ILE . 16.5 tt -143.11 144.5 23.81 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.444 0 CA-C-N 115.32 -0.854 . . . . 0.0 108.882 176.293 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 147' ' ' ASP . . . . . . . . . . . . . 34.6 t70 -96.89 -0.45 47.67 Favored 'General case' 0 C--N 1.323 -0.551 0 CA-C-O 120.953 0.406 . . . . 0.0 111.887 -172.823 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 148' ' ' PHE . . . . . 0.453 ' H ' HG12 ' A' ' 146' ' ' ILE . 46.7 p90 -144.43 163.28 34.27 Favored 'General case' 0 C--N 1.324 -0.52 0 O-C-N 122.026 -0.421 . . . . 0.0 111.07 -175.949 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 149' ' ' ASN . . . . . 0.505 ' HB2' HD11 ' A' ' 141' ' ' ILE . 47.1 t-20 -120.67 89.84 45.36 Favored Pre-proline 0 C--N 1.328 -0.365 0 CA-C-N 116.24 -0.436 . . . . 0.0 110.394 -177.492 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 150' ' ' PRO . . . . . . . . . . . . . 35.9 Cg_endo -66.15 -22.08 54.69 Favored 'Trans proline' 0 C--N 1.343 0.246 0 C-N-CA 122.59 2.193 . . . . 0.0 112.173 -178.223 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 151' ' ' ALA . . . . . 0.443 ' HB3' ' HA ' ' A' ' 134' ' ' SER . . . -70.75 -30.66 67.22 Favored 'General case' 0 C--N 1.327 -0.399 0 CA-C-N 116.269 -0.423 . . . . 0.0 110.553 179.694 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 152' ' ' ASP . . . . . . . . . . . . . 9.3 t70 -77.81 -15.29 59.19 Favored 'General case' 0 C--N 1.329 -0.306 0 N-CA-C 109.195 -0.669 . . . . 0.0 109.195 178.561 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 153' ' ' TYR . . . . . . . . . . . . . 73.3 t80 -83.18 -16.44 46.58 Favored 'General case' 0 C--N 1.327 -0.411 0 CA-C-N 115.656 -0.702 . . . . 0.0 109.453 177.396 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 154' ' ' VAL . . . . . 0.473 HG13 ' HA ' ' A' ' 113' ' ' GLN . 63.2 t -71.83 136.26 26.13 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.422 0 CA-C-N 115.724 -0.671 . . . . 0.0 110.006 177.474 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 155' ' ' ARG . . . . . 0.424 HH11 ' HD2' ' A' ' 155' ' ' ARG . 40.4 mtt180 -98.43 141.43 31.31 Favored 'General case' 0 C--N 1.322 -0.627 0 CA-C-N 115.838 -0.619 . . . . 0.0 111.167 -177.535 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 156' ' ' ILE . . . . . 0.629 HG13 ' HG2' ' A' ' 127' ' ' LYS . 46.8 mm -98.22 107.27 40.51 Favored Pre-proline 0 C--N 1.321 -0.672 0 N-CA-C 108.593 -0.891 . . . . 0.0 108.593 170.922 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 157' ' ' PRO . . . . . . . . . . . . . 58.8 Cg_endo . . . . . 0 N--CA 1.451 -0.976 0 C-N-CA 121.281 1.321 . . . . 0.0 113.288 -173.754 . . . . . . . . 0 0 . 1 . 013 nuclear nobuild core ' A' A ' 63' ' ' SER . . . . . 0.599 ' HA ' ' HA ' ' A' ' 103' ' ' SER . 18.7 m . . . . . 0 C--O 1.242 0.693 0 CA-C-O 121.408 0.623 . . . . 0.0 111.177 . . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 64' ' ' PHE . . . . . 0.433 ' HB2' HD11 ' A' ' 107' ' ' ILE . 79.5 t80 -60.01 -37.18 78.97 Favored 'General case' 0 C--N 1.325 -0.484 0 CA-C-N 115.206 -0.906 . . . . 0.0 110.32 179.479 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 65' ' ' GLY . . . . . . . . . . . . . . . -58.19 -40.83 94.33 Favored Glycine 0 N--CA 1.451 -0.305 0 C-N-CA 121.145 -0.55 . . . . 0.0 112.692 177.606 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 66' ' ' ASP . . . . . . . . . . . . . 7.3 m-20 -59.9 -53.2 60.62 Favored 'General case' 0 C--O 1.236 0.357 0 CA-C-O 121.375 0.607 . . . . 0.0 110.756 179.04 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 67' ' ' TRP . . . . . 0.424 ' CE3' ' HD3' ' A' ' 70' ' ' LYS . 87.4 m95 -76.91 -23.25 52.52 Favored 'General case' 0 C--N 1.325 -0.494 0 CA-C-N 115.614 -0.721 . . . . 0.0 111.955 -175.804 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 68' ' ' ALA . . . . . 0.597 ' O ' ' HG ' ' A' ' 72' ' ' LEU . . . -63.51 -48.59 76.95 Favored 'General case' 0 C--N 1.325 -0.473 0 CA-C-O 120.837 0.351 . . . . 0.0 110.573 175.969 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 69' ' ' GLU . . . . . 0.515 ' HA ' HD12 ' A' ' 72' ' ' LEU . 26.4 mt-10 -74.2 -22.12 59.52 Favored 'General case' 0 C--N 1.327 -0.375 0 CA-C-N 116.469 -0.332 . . . . 0.0 110.939 -179.965 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 70' ' ' LYS . . . . . 0.424 ' HD3' ' CE3' ' A' ' 67' ' ' TRP . 60.9 tttp -68.19 -41.81 80.87 Favored 'General case' 0 C--N 1.326 -0.43 0 N-CA-C 109.568 -0.53 . . . . 0.0 109.568 172.637 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 71' ' ' PHE . . . . . . . . . . . . . 61.9 t80 -61.61 -44.09 97.65 Favored 'General case' 0 N--CA 1.454 -0.251 0 CA-C-N 116.038 -0.528 . . . . 0.0 109.935 174.2 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 72' ' ' LEU . . . . . 0.597 ' HG ' ' O ' ' A' ' 68' ' ' ALA . 87.3 mt -56.87 -43.96 81.74 Favored 'General case' 0 C--N 1.327 -0.38 0 CA-C-N 116.162 -0.472 . . . . 0.0 110.361 176.802 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 73' ' ' LYS . . . . . . . . . . . . . 24.8 ttmm -64.49 -37.08 86.29 Favored 'General case' 0 C--N 1.326 -0.422 0 CA-C-N 115.763 -0.653 . . . . 0.0 111.207 -179.358 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 74' ' ' SER . . . . . . . . . . . . . 96.8 p -68.89 -34.13 74.92 Favored 'General case' 0 C--O 1.226 -0.181 0 C-N-CA 120.588 -0.445 . . . . 0.0 110.458 179.288 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 75' ' ' LYS . . . . . 0.659 ' HE2' ' HA ' ' A' ' 75' ' ' LYS . 11.3 mmpt? -70.04 -39.47 75.72 Favored 'General case' 0 C--O 1.233 0.189 0 CA-C-O 121.117 0.484 . . . . 0.0 109.989 175.589 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 76' ' ' GLU . . . . . . . . . . . . . 33.2 tt0 -57.17 -46.05 83.13 Favored 'General case' 0 C--N 1.324 -0.517 0 CA-C-N 115.222 -0.899 . . . . 0.0 110.867 177.394 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 77' ' ' ALA . . . . . . . . . . . . . . . -80.31 -20.07 45.15 Favored 'General case' 0 C--N 1.323 -0.567 0 CA-C-N 115.762 -0.654 . . . . 0.0 111.518 179.638 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 78' ' ' ASP . . . . . . . . . . . . . 20.6 t70 -68.22 -53.22 26.3 Favored 'General case' 0 C--N 1.327 -0.384 0 CA-C-O 121.003 0.43 . . . . 0.0 110.604 -179.894 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 79' ' ' GLY . . . . . . . . . . . . . . . 137.51 65.77 0.05 OUTLIER Glycine 0 N--CA 1.447 -0.595 0 C-N-CA 120.518 -0.848 . . . . 0.0 112.42 179.539 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 80' ' ' VAL . . . . . . . . . . . . . 35.0 m -121.69 150.19 24.94 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.558 0 CA-C-O 120.737 0.303 . . . . 0.0 110.407 177.253 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 81' ' ' SER . . . . . . . . . . . . . 45.9 t -76.09 168.57 19.8 Favored 'General case' 0 C--N 1.324 -0.501 0 CA-C-N 116.398 -0.365 . . . . 0.0 110.252 179.02 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 82' ' ' VAL . . . . . . . . . . . . . 67.4 t -56.87 -51.07 72.54 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.215 0 CA-C-N 116.381 -0.372 . . . . 0.0 110.782 -178.657 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 83' ' ' SER . . . . . . . . . . . . . 14.9 m -59.73 -28.07 67.03 Favored 'General case' 0 C--N 1.327 -0.381 0 CA-C-N 116.361 -0.381 . . . . 0.0 111.358 -178.912 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 84' ' ' GLN . . . . . . . . . . . . . 6.5 tp-100 -80.48 -48.18 13.19 Favored 'General case' 0 C--N 1.327 -0.38 0 CA-C-O 120.824 0.345 . . . . 0.0 110.458 -179.328 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 85' ' ' LEU . . . . . . . . . . . . . 51.2 tp -64.55 -42.36 95.75 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-O 121.105 0.479 . . . . 0.0 110.229 178.738 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 86' ' ' ASN . . . . . . . . . . . . . 50.2 t30 -63.42 -33.9 76.56 Favored 'General case' 0 C--N 1.325 -0.457 0 CA-C-N 115.626 -0.715 . . . . 0.0 110.062 177.627 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 87' ' ' SER . . . . . . . . . . . . . 9.1 t -63.31 -45.19 92.46 Favored 'General case' 0 C--N 1.329 -0.283 0 N-CA-C 109.634 -0.506 . . . . 0.0 109.634 175.7 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 88' ' ' TYR . . . . . . . . . . . . . 18.5 m-85 -58.88 -43.61 90.96 Favored 'General case' 0 C--O 1.234 0.289 0 CA-C-N 116.465 -0.334 . . . . 0.0 110.531 176.708 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 89' ' ' LYS . . . . . 0.591 ' HG2' HD13 ' A' ' 72' ' ' LEU . 67.5 mttm -60.59 -42.35 96.57 Favored 'General case' 0 C--N 1.332 -0.163 0 CA-C-N 116.138 -0.483 . . . . 0.0 110.398 176.983 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 90' ' ' ASN . . . . . . . . . . . . . 26.3 t30 -56.95 -44.84 82.98 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.002 -0.545 . . . . 0.0 111.17 178.144 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 91' ' ' TYR . . . . . . . . . . . . . 63.3 m-85 -63.52 -49.2 74.47 Favored 'General case' 0 C--N 1.325 -0.458 0 C-N-CA 120.891 -0.323 . . . . 0.0 111.094 179.384 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 92' ' ' CYS . . . . . 0.471 ' HA ' HD12 ' A' ' 96' ' ' LEU . 58.6 m -65.88 -42.54 90.21 Favored 'General case' 0 C--N 1.326 -0.443 0 CA-C-O 121.064 0.459 . . . . 0.0 111.574 -177.308 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 93' ' ' ARG . . . . . . . . . . . . . 10.0 ttt180 -82.35 -51.06 8.24 Favored 'General case' 0 C--N 1.323 -0.553 0 N-CA-C 112.434 0.531 . . . . 0.0 112.434 -174.353 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 94' ' ' ASN . . . . . . . . . . . . . 31.9 t30 -89.53 -40.5 12.6 Favored 'General case' 0 C--N 1.325 -0.475 0 N-CA-C 112.121 0.415 . . . . 0.0 112.121 -172.04 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 95' ' ' HIS . . . . . . . . . . . . . 82.4 m-70 -85.46 -34.38 21.66 Favored 'General case' 0 C--N 1.322 -0.629 0 O-C-N 122.056 -0.402 . . . . 0.0 111.435 -176.755 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 96' ' ' LEU . . . . . 0.472 HD22 HD22 ' A' ' 99' ' ' LEU . 86.9 mt -106.46 27.07 9.13 Favored 'General case' 0 C--N 1.323 -0.574 0 CA-C-N 116.374 -0.376 . . . . 0.0 111.164 -176.647 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 97' ' ' SER . . . . . 0.444 ' N ' ' HD2' ' A' ' 98' ' ' PRO . 15.3 m -46.92 -53.05 29.04 Favored Pre-proline 0 CA--C 1.541 0.608 0 N-CA-C 112.715 0.635 . . . . 0.0 112.715 -178.985 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 98' ' ' PRO . . . . . 0.444 ' HD2' ' N ' ' A' ' 97' ' ' SER . 38.0 Cg_endo -66.44 -20.82 54.24 Favored 'Trans proline' 0 C--N 1.356 0.954 0 C-N-CA 121.936 1.757 . . . . 0.0 113.285 -178.185 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 99' ' ' LEU . . . . . 0.571 HD21 HG12 ' A' ' 112' ' ' ILE . 11.2 mp -88.89 -27.79 20.76 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-O 120.903 0.383 . . . . 0.0 110.476 -179.559 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 100' ' ' TYR . . . . . . . . . . . . . 5.9 t80 -57.76 -31.75 66.8 Favored 'General case' 0 C--N 1.325 -0.472 0 CA-C-N 115.541 -0.754 . . . . 0.0 111.394 -174.962 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 101' ' ' MET . . . . . . . . . . . . . 66.3 mtt -102.17 14.05 33.01 Favored 'General case' 0 C--N 1.327 -0.394 0 CA-C-N 116.217 -0.447 . . . . 0.0 111.334 -178.447 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 102' ' ' LYS . . . . . . . . . . . . . 96.5 mttt -103.26 151.11 23.05 Favored 'General case' 0 C--N 1.326 -0.422 0 N-CA-C 110.136 -0.32 . . . . 0.0 110.136 176.825 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 103' ' ' SER . . . . . 0.599 ' HA ' ' HA ' ' A' ' 63' ' ' SER . 46.6 t -75.85 161.41 29.02 Favored 'General case' 0 C--N 1.322 -0.588 0 N-CA-C 109.084 -0.71 . . . . 0.0 109.084 171.296 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 104' ' ' LEU . . . . . 0.42 ' HB3' HD12 ' A' ' 146' ' ' ILE . 90.3 mt -58.91 -28.93 66.66 Favored 'General case' 0 C--N 1.323 -0.56 0 CA-C-O 121.041 0.448 . . . . 0.0 110.613 179.208 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 105' ' ' SER . . . . . . . . . . . . . 26.4 t -87.97 -7.57 56.91 Favored 'General case' 0 CA--C 1.534 0.357 0 CA-C-N 115.98 -0.555 . . . . 0.0 111.472 -179.269 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 106' ' ' GLU . . . . . 0.528 ' HG3' ' HB3' ' A' ' 103' ' ' SER . 45.2 mt-10 -96.67 -6.38 36.68 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-O 120.792 0.33 . . . . 0.0 111.049 -177.553 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 107' ' ' ILE . . . . . 0.433 HD11 ' HB2' ' A' ' 64' ' ' PHE . 72.4 mt -93.89 122.23 45.2 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.594 0 CA-C-O 120.972 0.415 . . . . 0.0 110.778 -176.963 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 108' ' ' LEU . . . . . 0.428 ' HB2' ' HB2' ' A' ' 111' ' ' ASP . 86.4 mt -96.72 143.79 26.72 Favored Pre-proline 0 C--N 1.326 -0.445 0 CA-C-N 115.944 -0.571 . . . . 0.0 110.641 -178.88 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 109' ' ' PRO . . . . . 0.603 ' HB3' ' HB2' ' A' ' 153' ' ' TYR . 50.2 Cg_exo -55.31 -45.33 40.95 Favored 'Trans proline' 0 CA--C 1.531 0.374 0 C-N-CA 122.81 2.34 . . . . 0.0 112.378 176.823 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 110' ' ' ALA . . . . . . . . . . . . . . . -69.34 -25.11 64.04 Favored 'General case' 0 C--N 1.332 -0.186 0 CA-C-N 116.497 -0.32 . . . . 0.0 111.134 -179.46 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 111' ' ' ASP . . . . . 0.428 ' HB2' ' HB2' ' A' ' 108' ' ' LEU . 38.2 t70 -65.99 -45.14 82.7 Favored 'General case' 0 C--N 1.326 -0.437 0 CA-C-O 121.131 0.491 . . . . 0.0 109.785 179.309 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 112' ' ' ILE . . . . . 0.571 HG12 HD21 ' A' ' 99' ' ' LEU . 19.2 mt -69.14 -39.95 79.98 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.295 0 CA-C-N 115.752 -0.658 . . . . 0.0 110.071 176.557 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 113' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -58.18 -43.22 87.4 Favored 'General case' 0 C--N 1.331 -0.215 0 CA-C-N 115.892 -0.595 . . . . 0.0 109.89 178.877 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 114' ' ' SER . . . . . . . . . . . . . 40.8 t -56.12 -50.25 71.63 Favored 'General case' 0 C--N 1.331 -0.231 0 CA-C-N 116.039 -0.528 . . . . 0.0 110.226 177.052 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 115' ' ' ILE . . . . . . . . . . . . . 67.1 mt -58.15 -44.44 87.59 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.193 0 CA-C-N 116.372 -0.376 . . . . 0.0 111.002 179.309 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 116' ' ' ILE . . . . . 0.411 HG12 ' O ' ' A' ' 112' ' ' ILE . 47.3 mm -62.81 -41.35 92.17 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.326 0 CA-C-O 120.821 0.343 . . . . 0.0 111.1 -179.93 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 117' ' ' ASN . . . . . . . . . . . . . 8.4 t30 -69.98 -33.67 72.37 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-N 116.391 -0.368 . . . . 0.0 111.165 -179.251 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 118' ' ' GLU . . . . . . . . . . . . . 28.3 mm-40 -80.1 -21.94 42.74 Favored 'General case' 0 C--N 1.327 -0.396 0 CA-C-N 116.251 -0.431 . . . . 0.0 110.846 179.48 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 119' ' ' THR . . . . . . . . . . . . . 61.7 m -78.38 111.04 13.98 Favored 'General case' 0 N--CA 1.448 -0.526 0 N-CA-C 108.937 -0.764 . . . . 0.0 108.937 173.897 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 120' ' ' LYS . . . . . 0.456 ' C ' HD12 ' A' ' 121' ' ' LEU . 96.2 mttt -111.61 78.22 1.1 Allowed 'General case' 0 C--N 1.32 -0.693 0 CA-C-O 121.992 0.901 . . . . 0.0 110.993 -173.001 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 121' ' ' LEU . . . . . 0.458 HD22 HG21 ' A' ' 125' ' ' THR . 8.0 mp -131.61 -174.44 3.41 Favored 'General case' 0 C--N 1.326 -0.426 0 CA-C-N 114.093 -1.412 . . . . 0.0 108.825 178.462 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 122' ' ' ALA . . . . . . . . . . . . . . . -59.88 148.54 34.49 Favored 'General case' 0 C--N 1.326 -0.431 0 CA-C-O 120.611 0.243 . . . . 0.0 110.568 177.296 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 123' ' ' LYS . . . . . . . . . . . . . 56.0 mtmt -60.79 -29.46 69.46 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-N 116.332 -0.395 . . . . 0.0 111.241 -176.719 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 124' ' ' ASN . . . . . . . . . . . . . 0.2 OUTLIER -59.93 -37.97 81.02 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.193 -0.458 . . . . 0.0 109.882 176.959 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 125' ' ' THR . . . . . 0.458 HG21 HD22 ' A' ' 121' ' ' LEU . 17.7 m -71.82 -39.63 69.67 Favored 'General case' 0 C--N 1.327 -0.394 0 CA-C-N 115.921 -0.582 . . . . 0.0 110.361 179.512 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 126' ' ' LEU . . . . . . . . . . . . . 93.3 mt -61.72 -40.91 96.73 Favored 'General case' 0 C--N 1.327 -0.383 0 CA-C-N 116.051 -0.522 . . . . 0.0 110.345 177.802 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 127' ' ' LYS . . . . . . . . . . . . . 90.6 mttt -66.18 -31.83 72.9 Favored 'General case' 0 C--N 1.327 -0.377 0 CA-C-N 116.025 -0.534 . . . . 0.0 111.399 177.961 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 128' ' ' ALA . . . . . . . . . . . . . . . -62.25 -43.96 97.64 Favored 'General case' 0 C--N 1.325 -0.457 0 CA-C-O 120.766 0.317 . . . . 0.0 110.602 178.923 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 129' ' ' ILE . . . . . . . . . . . . . 35.4 mt -67.16 -43.67 88.37 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.313 0 CA-C-N 116.145 -0.479 . . . . 0.0 109.736 177.264 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 130' ' ' ARG . . . . . 0.588 ' HB2' HD11 ' A' ' 156' ' ' ILE . 16.4 tpt85 -55.8 -51.74 66.39 Favored 'General case' 0 C--N 1.331 -0.219 0 CA-C-N 115.35 -0.841 . . . . 0.0 111.005 178.159 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 131' ' ' ASN . . . . . . . . . . . . . 14.4 m-80 -58.59 -54.41 47.42 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.202 -0.454 . . . . 0.0 111.109 179.986 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 132' ' ' THR . . . . . 0.419 ' O ' HG13 ' A' ' 136' ' ' ILE . 33.6 m -52.9 -50.7 63.38 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-N 116.136 -0.483 . . . . 0.0 111.255 -178.519 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 133' ' ' ALA . . . . . . . . . . . . . . . -61.45 -48.46 81.06 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.301 -0.409 . . . . 0.0 111.39 -178.266 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 134' ' ' SER . . . . . 0.498 ' O ' ' HG2' ' A' ' 138' ' ' ARG . 52.9 p -62.44 -36.35 82.15 Favored 'General case' 0 C--N 1.331 -0.214 0 CA-C-N 116.569 -0.287 . . . . 0.0 111.157 -177.918 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 135' ' ' GLN . . . . . 0.436 ' HA ' ' HG2' ' A' ' 138' ' ' ARG . 14.7 mm100 -66.37 -36.26 82.43 Favored 'General case' 0 C--N 1.333 -0.138 0 CA-C-N 116.576 -0.284 . . . . 0.0 111.266 -178.723 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 136' ' ' ILE . . . . . 0.419 HG13 ' O ' ' A' ' 132' ' ' THR . 79.5 mt -66.75 -45.68 87.42 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.505 0 CA-C-O 120.786 0.327 . . . . 0.0 110.73 179.624 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 137' ' ' PHE . . . . . 0.477 ' O ' HG13 ' A' ' 141' ' ' ILE . 58.5 m-85 -67.47 -45.21 76.6 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.373 -0.376 . . . . 0.0 111.566 -178.962 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 138' ' ' ARG . . . . . 0.498 ' HG2' ' O ' ' A' ' 134' ' ' SER . 13.3 ptm180 -65.17 -33.02 75.02 Favored 'General case' 0 N--CA 1.463 0.19 0 C-N-CA 120.796 -0.362 . . . . 0.0 110.77 -179.327 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 139' ' ' LEU . . . . . . . . . . . . . 54.6 tp -63.93 -41.19 97.71 Favored 'General case' 0 C--N 1.33 -0.239 0 CA-C-O 121.014 0.435 . . . . 0.0 109.901 176.608 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 140' ' ' ALA . . . . . . . . . . . . . . . -64.62 -37.67 88.37 Favored 'General case' 0 C--N 1.326 -0.42 0 CA-C-N 116.033 -0.531 . . . . 0.0 110.499 176.629 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 141' ' ' ILE . . . . . 0.477 HG13 ' O ' ' A' ' 137' ' ' PHE . 78.4 mt -63.7 -42.86 97.43 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.299 0 CA-C-N 116.22 -0.445 . . . . 0.0 110.469 177.138 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 142' ' ' GLU . . . . . 0.459 ' HG3' ' O ' ' A' ' 138' ' ' ARG . 43.5 mt-10 -69.07 -8.9 49.44 Favored 'General case' 0 N--CA 1.463 0.219 0 CA-C-N 116.248 -0.433 . . . . 0.0 111.558 179.758 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 143' ' ' ASN . . . . . . . . . . . . . 43.2 m-80 -114.38 14.52 17.95 Favored 'General case' 0 C--N 1.327 -0.378 0 CA-C-N 116.656 -0.247 . . . . 0.0 111.425 177.617 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 144' ' ' ARG . . . . . . . . . . . . . 99.4 mtt180 62.12 26.24 15.76 Favored 'General case' 0 N--CA 1.471 0.59 0 O-C-N 123.434 0.459 . . . . 0.0 112.063 176.738 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 145' ' ' ALA . . . . . . . . . . . . . . . -90.48 -23.52 20.94 Favored 'General case' 0 C--N 1.324 -0.537 0 CA-C-O 120.823 0.344 . . . . 0.0 110.924 -179.35 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 146' ' ' ILE . . . . . 0.466 ' O ' ' HA ' ' A' ' 141' ' ' ILE . 13.3 tt -159.95 157.62 2.83 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.596 0 N-CA-C 109.231 -0.655 . . . . 0.0 109.231 178.131 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 147' ' ' ASP . . . . . . . . . . . . . 31.2 t70 -126.62 27.54 6.08 Favored 'General case' 0 C--N 1.322 -0.598 0 CA-C-O 121.849 0.833 . . . . 0.0 110.188 -179.436 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 148' ' ' PHE . . . . . 0.437 ' H ' HG12 ' A' ' 146' ' ' ILE . 78.2 t80 -141.26 132.73 26.85 Favored 'General case' 0 C--N 1.319 -0.732 0 CA-C-N 115.579 -0.737 . . . . 0.0 109.589 -179.906 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 149' ' ' ASN . . . . . . . . . . . . . 48.6 t-20 -114.93 92.6 31.14 Favored Pre-proline 0 C--N 1.322 -0.607 0 CA-C-N 116.488 -0.324 . . . . 0.0 110.322 -179.657 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 150' ' ' PRO . . . . . . . . . . . . . 23.7 Cg_exo -64.71 -27.9 60.21 Favored 'Trans proline' 0 C--N 1.344 0.297 0 C-N-CA 122.803 2.335 . . . . 0.0 112.243 -178.714 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 151' ' ' ALA . . . . . 0.424 ' HA ' HG23 ' A' ' 154' ' ' VAL . . . -73.5 -21.32 60.44 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.087 -0.506 . . . . 0.0 111.219 -177.063 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 152' ' ' ASP . . . . . . . . . . . . . 3.9 t70 -76.58 -17.08 59.4 Favored 'General case' 0 C--N 1.326 -0.455 0 CA-C-O 121.357 0.599 . . . . 0.0 109.865 -179.877 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 153' ' ' TYR . . . . . 0.603 ' HB2' ' HB3' ' A' ' 109' ' ' PRO . 47.3 m-85 -93.45 2.45 56.47 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-N 115.737 -0.665 . . . . 0.0 110.799 179.133 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 154' ' ' VAL . . . . . 0.424 HG23 ' HA ' ' A' ' 151' ' ' ALA . 98.6 t -83.31 115.92 26.53 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.485 0 CA-C-N 116.299 -0.41 . . . . 0.0 110.639 -178.92 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 155' ' ' ARG . . . . . . . . . . . . . 39.8 ttm-85 -77.88 132.94 38.18 Favored 'General case' 0 C--N 1.322 -0.626 0 CA-C-N 115.802 -0.635 . . . . 0.0 110.526 179.406 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 156' ' ' ILE . . . . . 0.588 HD11 ' HB2' ' A' ' 130' ' ' ARG . 45.1 mm -96.85 120.7 61.2 Favored Pre-proline 0 C--N 1.322 -0.59 0 N-CA-C 109.458 -0.571 . . . . 0.0 109.458 174.729 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 157' ' ' PRO . . . . . 0.437 ' HD3' ' HA ' ' A' ' 156' ' ' ILE . 35.7 Cg_exo . . . . . 0 N--CA 1.463 -0.313 0 C-N-CA 122.655 2.237 . . . . 0.0 112.588 -178.034 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 63' ' ' SER . . . . . 0.563 ' HA ' ' HA ' ' A' ' 103' ' ' SER . 87.5 p . . . . . 0 N--CA 1.448 -0.562 0 CA-C-O 120.813 0.339 . . . . 0.0 110.428 . . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 64' ' ' PHE . . . . . 0.585 ' HB2' HD11 ' A' ' 107' ' ' ILE . 64.9 t80 -60.84 -31.82 71.24 Favored 'General case' 0 C--N 1.323 -0.573 0 N-CA-C 109.229 -0.656 . . . . 0.0 109.229 175.647 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 65' ' ' GLY . . . . . . . . . . . . . . . -61.03 -32.67 81.13 Favored Glycine 0 N--CA 1.451 -0.363 0 CA-C-N 115.969 -0.56 . . . . 0.0 112.505 176.934 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 66' ' ' ASP . . . . . . . . . . . . . 24.9 m-20 -68.9 -55.3 11.48 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-O 121.208 0.527 . . . . 0.0 110.18 177.195 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 67' ' ' TRP . . . . . . . . . . . . . 99.4 m95 -68.18 -32.32 72.48 Favored 'General case' 0 C--N 1.326 -0.431 0 CA-C-N 115.705 -0.68 . . . . 0.0 111.869 -176.813 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 68' ' ' ALA . . . . . 0.61 ' O ' ' HG ' ' A' ' 72' ' ' LEU . . . -64.21 -47.43 79.77 Favored 'General case' 0 C--N 1.326 -0.432 0 N-CA-C 110.17 -0.308 . . . . 0.0 110.17 176.706 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 69' ' ' GLU . . . . . . . . . . . . . 7.5 tp10 -63.3 -40.08 96.35 Favored 'General case' 0 C--N 1.329 -0.297 0 N-CA-C 109.497 -0.557 . . . . 0.0 109.497 177.838 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 70' ' ' LYS . . . . . . . . . . . . . 10.7 tppt? -56.12 -49.6 73.43 Favored 'General case' 0 C--N 1.331 -0.223 0 CA-C-N 115.622 -0.717 . . . . 0.0 110.36 174.519 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 71' ' ' PHE . . . . . . . . . . . . . 80.3 t80 -64.71 -46.68 81.29 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 116.123 -0.49 . . . . 0.0 111.477 -179.08 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 72' ' ' LEU . . . . . 0.61 ' HG ' ' O ' ' A' ' 68' ' ' ALA . 85.7 mt -61.02 -43.63 98.61 Favored 'General case' 0 C--N 1.327 -0.396 0 CA-C-O 121.01 0.433 . . . . 0.0 110.422 179.776 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 73' ' ' LYS . . . . . . . . . . . . . 58.3 tttm -67.43 -26.53 66.46 Favored 'General case' 0 C--N 1.326 -0.42 0 CA-C-O 121.192 0.52 . . . . 0.0 110.155 179.015 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 74' ' ' SER . . . . . . . . . . . . . 60.7 m -68.39 -37.8 80.73 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 116.122 -0.49 . . . . 0.0 110.01 174.716 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 75' ' ' LYS . . . . . . . . . . . . . 71.4 mmtt -69.67 -34.03 73.4 Favored 'General case' 0 C--O 1.233 0.19 0 CA-C-N 116.346 -0.388 . . . . 0.0 110.892 177.575 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 76' ' ' GLU . . . . . . . . . . . . . 6.8 tp10 -54.27 -49.55 69.31 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-O 121.095 0.474 . . . . 0.0 109.847 173.591 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 77' ' ' ALA . . . . . . . . . . . . . . . -80.26 -16.66 54.21 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 115.961 -0.563 . . . . 0.0 111.325 179.781 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 78' ' ' ASP . . . . . . . . . . . . . 19.9 t70 -69.57 -34.38 74.08 Favored 'General case' 0 N--CA 1.464 0.24 0 CA-C-O 121.016 0.436 . . . . 0.0 110.196 -179.15 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 79' ' ' GLY . . . . . . . . . . . . . . . 108.09 37.16 2.2 Favored Glycine 0 N--CA 1.449 -0.5 0 C-N-CA 120.497 -0.859 . . . . 0.0 113.375 174.159 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 80' ' ' VAL . . . . . 0.508 ' HB ' ' HB2' ' A' ' 84' ' ' GLN . 17.7 m -88.51 155.73 3.15 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.503 0 CA-C-N 116.973 0.387 . . . . 0.0 110.431 175.511 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 81' ' ' SER . . . . . . . . . . . . . 19.5 m -66.44 159.12 27.76 Favored 'General case' 0 C--N 1.325 -0.49 0 N-CA-C 109.943 -0.391 . . . . 0.0 109.943 177.402 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 82' ' ' VAL . . . . . . . . . . . . . 61.2 t -56.75 -36.71 50.12 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.27 0 CA-C-O 120.905 0.383 . . . . 0.0 110.538 -178.966 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 83' ' ' SER . . . . . . . . . . . . . 14.4 m -57.27 -42.09 80.94 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 115.962 -0.563 . . . . 0.0 110.969 177.352 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 84' ' ' GLN . . . . . 0.508 ' HB2' ' HB ' ' A' ' 80' ' ' VAL . 75.9 mm-40 -64.88 -56.61 12.36 Favored 'General case' 0 CA--C 1.518 -0.269 0 CA-C-N 116.718 -0.219 . . . . 0.0 110.44 -179.951 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 85' ' ' LEU . . . . . . . . . . . . . 53.7 tp -57.82 -39.13 76.9 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.131 -0.486 . . . . 0.0 110.866 -177.657 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 86' ' ' ASN . . . . . . . . . . . . . 24.4 t-20 -61.14 -47.65 85.26 Favored 'General case' 0 C--N 1.327 -0.37 0 CA-C-N 115.864 -0.607 . . . . 0.0 110.074 177.215 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 87' ' ' SER . . . . . . . . . . . . . 49.7 m -64.78 -42.01 95.41 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-N 116.384 -0.371 . . . . 0.0 111.101 179.051 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 88' ' ' TYR . . . . . . . . . . . . . 29.4 m-85 -57.53 -48.68 78.62 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-O 120.976 0.417 . . . . 0.0 110.835 178.683 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 89' ' ' LYS . . . . . . . . . . . . . 22.0 ttmm -72.36 -32.35 66.39 Favored 'General case' 0 C--N 1.326 -0.415 0 CA-C-N 116.131 -0.486 . . . . 0.0 110.82 179.599 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 90' ' ' ASN . . . . . . . . . . . . . 62.0 t30 -66.46 -46.4 76.51 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-O 121.124 0.488 . . . . 0.0 110.447 178.739 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 91' ' ' TYR . . . . . 0.412 ' HD2' HG12 ' A' ' 129' ' ' ILE . 5.1 m-85 -62.42 -37.99 87.96 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.043 -0.526 . . . . 0.0 110.442 177.813 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 92' ' ' CYS . . . . . 0.558 ' HA ' ' HB2' ' A' ' 96' ' ' LEU . 53.2 t -67.59 -36.73 81.45 Favored 'General case' 0 C--N 1.327 -0.412 0 CA-C-N 115.929 -0.578 . . . . 0.0 110.723 177.966 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 93' ' ' ARG . . . . . 0.5 ' O ' ' HB3' ' A' ' 97' ' ' SER . 39.3 ttt180 -71.51 -44.97 63.69 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-O 121.029 0.442 . . . . 0.0 110.815 179.758 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 94' ' ' ASN . . . . . . . . . . . . . 95.1 m-20 -81.19 -61.2 2.02 Favored 'General case' 0 C--N 1.325 -0.499 0 N-CA-C 112.219 0.452 . . . . 0.0 112.219 -175.414 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 95' ' ' HIS . . . . . . . . . . . . . 95.0 m-70 -85.52 -40.34 16.44 Favored 'General case' 0 C--N 1.327 -0.385 0 CA-C-O 120.704 0.288 . . . . 0.0 111.697 -170.272 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 96' ' ' LEU . . . . . 0.558 ' HB2' ' HA ' ' A' ' 92' ' ' CYS . 74.9 mt -91.87 16.99 9.78 Favored 'General case' 0 C--N 1.325 -0.48 0 CA-C-N 116.622 -0.263 . . . . 0.0 111.279 -174.074 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 97' ' ' SER . . . . . 0.586 ' OG ' ' HD3' ' A' ' 98' ' ' PRO . 3.5 p -61.16 -45.7 95.79 Favored Pre-proline 0 CA--C 1.544 0.741 0 N-CA-C 113.123 0.786 . . . . 0.0 113.123 -177.661 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 98' ' ' PRO . . . . . 0.586 ' HD3' ' OG ' ' A' ' 97' ' ' SER . 21.9 Cg_exo -63.6 -33.66 66.56 Favored 'Trans proline' 0 C--N 1.361 1.211 0 C-N-CA 121.657 1.572 . . . . 0.0 111.622 179.133 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 99' ' ' LEU . . . . . 0.451 ' O ' ' HB3' ' A' ' 64' ' ' PHE . 40.4 mt -74.27 -40.22 62.47 Favored 'General case' 0 C--N 1.323 -0.572 0 CA-C-N 115.523 -0.762 . . . . 0.0 109.759 179.849 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 100' ' ' TYR . . . . . . . . . . . . . 36.0 t80 -51.71 -40.89 60.97 Favored 'General case' 0 C--N 1.33 -0.248 0 CA-C-N 115.235 -0.893 . . . . 0.0 111.394 -178.3 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 101' ' ' MET . . . . . . . . . . . . . 24.8 mmt -91.34 11.56 23.3 Favored 'General case' 0 C--N 1.326 -0.425 0 CA-C-N 116.325 -0.398 . . . . 0.0 112.047 -177.13 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 102' ' ' LYS . . . . . . . . . . . . . 66.0 mttt -105.8 150.33 25.65 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-O 120.862 0.363 . . . . 0.0 110.916 176.807 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 103' ' ' SER . . . . . 0.563 ' HA ' ' HA ' ' A' ' 63' ' ' SER . 24.1 t -72.93 150.33 42.64 Favored 'General case' 0 C--N 1.324 -0.526 0 N-CA-C 109.224 -0.658 . . . . 0.0 109.224 171.816 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 104' ' ' LEU . . . . . . . . . . . . . 26.2 tp -56.69 -29.48 62.42 Favored 'General case' 0 C--N 1.324 -0.543 0 CA-C-O 120.933 0.397 . . . . 0.0 112.045 -175.399 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 105' ' ' SER . . . . . . . . . . . . . 40.3 t -83.65 -22.34 32.18 Favored 'General case' 0 C--N 1.326 -0.415 0 N-CA-C 112.211 0.448 . . . . 0.0 112.211 -175.545 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 106' ' ' GLU . . . . . . . . . . . . . 12.1 pt-20 -97.94 6.08 48.13 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-O 120.817 0.341 . . . . 0.0 111.22 -174.298 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 107' ' ' ILE . . . . . 0.594 HG21 ' HZ ' ' A' ' 137' ' ' PHE . 63.4 mt -83.5 121.5 36.34 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.575 0 CA-C-N 116.296 -0.411 . . . . 0.0 110.1 178.93 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 108' ' ' LEU . . . . . . . . . . . . . 84.8 mt -103.44 151.16 38.6 Favored Pre-proline 0 C--N 1.32 -0.698 0 CA-C-N 116.062 -0.517 . . . . 0.0 110.073 179.991 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 109' ' ' PRO . . . . . . . . . . . . . 31.3 Cg_exo -59.88 -27.9 85.97 Favored 'Trans proline' 0 C--N 1.343 0.266 0 C-N-CA 122.27 1.98 . . . . 0.0 111.042 174.47 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 110' ' ' ALA . . . . . . . . . . . . . . . -61.66 -41.14 97.12 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 115.244 -0.889 . . . . 0.0 111.003 178.576 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 111' ' ' ASP . . . . . . . . . . . . . 33.3 m-20 -52.9 -58.41 7.03 Favored 'General case' 0 C--O 1.236 0.351 0 CA-C-O 121.423 0.63 . . . . 0.0 110.547 178.842 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 112' ' ' ILE . . . . . 0.449 HG12 HD11 ' A' ' 99' ' ' LEU . 21.4 mt -66.23 -40.59 87.32 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.557 0 CA-C-N 114.871 -1.059 . . . . 0.0 111.141 -174.651 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 113' ' ' GLN . . . . . . . . . . . . . 17.3 tm0? -65.01 -39.43 93.43 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.404 -0.362 . . . . 0.0 110.401 -178.29 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 114' ' ' SER . . . . . . . . . . . . . 50.0 m -60.57 -38.29 84.08 Favored 'General case' 0 C--O 1.233 0.226 0 CA-C-O 121.041 0.448 . . . . 0.0 110.485 178.039 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 115' ' ' ILE . . . . . . . . . . . . . 78.3 mt -60.12 -46.14 94.84 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.239 0 CA-C-N 115.938 -0.573 . . . . 0.0 110.432 176.592 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 116' ' ' ILE . . . . . . . . . . . . . 51.2 mm -60.33 -37.06 72.72 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.277 0 CA-C-N 115.992 -0.549 . . . . 0.0 111.043 -179.984 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 117' ' ' ASN . . . . . . . . . . . . . 93.6 m-20 -60.79 -44.49 96.75 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.492 -0.322 . . . . 0.0 111.169 179.124 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 118' ' ' GLU . . . . . . . . . . . . . 48.9 mt-10 -80.95 -18.25 47.68 Favored 'General case' 0 C--N 1.327 -0.377 0 CA-C-N 116.292 -0.413 . . . . 0.0 111.506 -176.982 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 119' ' ' THR . . . . . 0.403 ' CG2' HD13 ' A' ' 121' ' ' LEU . 29.2 m -90.86 111.8 23.37 Favored 'General case' 0 C--N 1.324 -0.539 0 CA-C-O 121.054 0.454 . . . . 0.0 110.48 -178.807 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 120' ' ' LYS . . . . . 0.448 ' C ' HD12 ' A' ' 121' ' ' LEU . 48.7 mtpt -106.82 86.9 2.4 Favored 'General case' 0 C--N 1.327 -0.4 0 CA-C-O 120.991 0.424 . . . . 0.0 110.828 -178.491 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 121' ' ' LEU . . . . . 0.448 HD12 ' C ' ' A' ' 120' ' ' LYS . 7.8 mp -132.75 -174.87 3.59 Favored 'General case' 0 C--N 1.323 -0.554 0 CA-C-N 115.547 -0.751 . . . . 0.0 109.622 177.62 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 122' ' ' ALA . . . . . . . . . . . . . . . -65.37 152.69 43.25 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-O 120.629 0.252 . . . . 0.0 111.247 178.927 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 123' ' ' LYS . . . . . 0.468 ' HB2' ' NZ ' ' A' ' 123' ' ' LYS . 9.5 mtmp? -55.85 -43.17 76.79 Favored 'General case' 0 C--N 1.331 -0.235 0 CA-C-N 115.998 -0.546 . . . . 0.0 110.735 -178.428 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 124' ' ' ASN . . . . . . . . . . . . . 3.2 m-20 -61.19 -37.81 84.28 Favored 'General case' 0 C--N 1.327 -0.408 0 CA-C-N 115.362 -0.836 . . . . 0.0 110.774 -178.124 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 125' ' ' THR . . . . . 0.44 ' O ' HG13 ' A' ' 129' ' ' ILE . 10.8 m -69.96 -41.58 74.32 Favored 'General case' 0 C--N 1.325 -0.457 0 CA-C-N 116.201 -0.454 . . . . 0.0 110.532 178.64 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 126' ' ' LEU . . . . . . . . . . . . . 92.5 mt -61.96 -43.68 98.34 Favored 'General case' 0 C--O 1.235 0.292 0 CA-C-N 116.08 -0.509 . . . . 0.0 110.741 179.184 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 127' ' ' LYS . . . . . . . . . . . . . 52.3 mtpt -68.93 -30.99 69.56 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.27 -0.423 . . . . 0.0 110.756 179.133 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 128' ' ' ALA . . . . . . . . . . . . . . . -64.11 -45.74 87.29 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.321 -0.4 . . . . 0.0 110.57 176.94 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 129' ' ' ILE . . . . . 0.44 HG13 ' O ' ' A' ' 125' ' ' THR . 70.1 mt -59.25 -50.25 80.48 Favored 'Isoleucine or valine' 0 C--O 1.235 0.319 0 CA-C-N 116.103 -0.499 . . . . 0.0 110.414 177.865 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 130' ' ' ARG . . . . . . . . . . . . . 45.7 ttt-85 -61.88 -40.97 97.23 Favored 'General case' 0 C--N 1.327 -0.384 0 CA-C-N 115.758 -0.656 . . . . 0.0 111.039 179.427 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 131' ' ' ASN . . . . . . . . . . . . . 63.8 t30 -62.8 -44.81 95.18 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-O 120.648 0.261 . . . . 0.0 110.45 -179.314 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 132' ' ' THR . . . . . 0.481 ' O ' HG13 ' A' ' 136' ' ' ILE . 39.2 m -55.1 -52.7 62.43 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 115.774 -0.648 . . . . 0.0 110.482 178.695 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 133' ' ' ALA . . . . . . . . . . . . . . . -65.45 -38.98 91.47 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.219 -0.446 . . . . 0.0 110.803 179.098 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 134' ' ' SER . . . . . . . . . . . . . 26.9 t -60.28 -43.23 96.4 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 115.964 -0.562 . . . . 0.0 110.84 -179.45 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 135' ' ' GLN . . . . . 0.463 HE21 ' HB3' ' A' ' 135' ' ' GLN . 9.1 mt-30 -67.55 -30.66 70.35 Favored 'General case' 0 C--N 1.33 -0.28 0 C-N-CA 121.133 -0.227 . . . . 0.0 110.791 179.178 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 136' ' ' ILE . . . . . 0.481 HG13 ' O ' ' A' ' 132' ' ' THR . 86.8 mt -65.13 -45.21 94.8 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.333 0 CA-C-N 116.346 -0.388 . . . . 0.0 110.203 175.959 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 137' ' ' PHE . . . . . 0.594 ' HZ ' HG21 ' A' ' 107' ' ' ILE . 60.0 m-85 -65.35 -44.98 85.98 Favored 'General case' 0 C--N 1.331 -0.208 0 CA-C-N 116.292 -0.413 . . . . 0.0 110.353 175.603 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 138' ' ' ARG . . . . . 0.46 ' O ' ' HG3' ' A' ' 142' ' ' GLU . 29.0 mtp180 -55.39 -41.19 72.31 Favored 'General case' 0 C--O 1.223 -0.31 0 CA-C-N 116.029 -0.532 . . . . 0.0 111.092 177.053 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 139' ' ' LEU . . . . . . . . . . . . . 29.4 tp -59.36 -43.09 92.87 Favored 'General case' 0 C--N 1.321 -0.645 0 CA-C-N 115.999 -0.546 . . . . 0.0 110.525 179.829 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 140' ' ' ALA . . . . . . . . . . . . . . . -68.0 -31.47 71.19 Favored 'General case' 0 C--N 1.331 -0.217 0 CA-C-N 116.348 -0.387 . . . . 0.0 110.255 176.443 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 141' ' ' ILE . . . . . 0.659 ' HA ' ' O ' ' A' ' 146' ' ' ILE . 79.7 mt -66.54 -45.93 87.59 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.236 0 CA-C-N 116.275 -0.42 . . . . 0.0 110.465 175.585 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 142' ' ' GLU . . . . . 0.46 ' HG3' ' O ' ' A' ' 138' ' ' ARG . 43.3 mt-10 -67.73 -21.65 65.28 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-O 121.021 0.439 . . . . 0.0 110.774 -179.843 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 143' ' ' ASN . . . . . 0.435 HD22 ' N ' ' A' ' 143' ' ' ASN . 0.9 OUTLIER -94.83 1.42 55.37 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.138 -0.483 . . . . 0.0 110.643 175.991 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild core ' A' A ' 144' ' ' ARG . . . . . 0.414 HH11 ' HD2' ' A' ' 144' ' ' ARG . 29.3 mtp85 59.58 36.91 22.82 Favored 'General case' 0 N--CA 1.465 0.304 0 CA-C-N 115.721 -0.672 . . . . 0.0 112.444 178.37 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 145' ' ' ALA . . . . . . . . . . . . . . . -90.4 -24.68 20.71 Favored 'General case' 0 C--N 1.323 -0.556 0 CA-C-O 121.547 0.689 . . . . 0.0 109.455 173.413 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 146' ' ' ILE . . . . . 0.659 ' O ' ' HA ' ' A' ' 141' ' ' ILE . 11.4 tt -156.84 157.96 3.48 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.569 0 N-CA-C 108.007 -1.108 . . . . 0.0 108.007 177.567 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 147' ' ' ASP . . . . . . . . . . . . . 7.3 p-10 -123.83 21.81 9.04 Favored 'General case' 0 C--N 1.322 -0.604 0 CA-C-O 121.1 0.476 . . . . 0.0 110.862 179.628 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 148' ' ' PHE . . . . . 0.477 ' H ' HG12 ' A' ' 146' ' ' ILE . 73.7 m-85 -121.6 151.06 40.81 Favored 'General case' 0 C--N 1.326 -0.433 0 CA-C-N 115.877 -0.601 . . . . 0.0 109.986 178.537 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 149' ' ' ASN . . . . . . . . . . . . . 53.7 t-20 -124.6 87.77 54.17 Favored Pre-proline 0 C--N 1.321 -0.658 0 N-CA-C 109.682 -0.488 . . . . 0.0 109.682 173.552 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 150' ' ' PRO . . . . . . . . . . . . . 77.6 Cg_exo -52.18 -34.64 59.72 Favored 'Trans proline' 0 C--N 1.344 0.329 0 C-N-CA 122.958 2.439 . . . . 0.0 112.925 177.408 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 151' ' ' ALA . . . . . . . . . . . . . . . -71.39 -26.06 62.62 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.321 -0.399 . . . . 0.0 110.982 -177.31 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 152' ' ' ASP . . . . . . . . . . . . . 39.0 t70 -74.98 -18.25 60.4 Favored 'General case' 0 C--N 1.325 -0.476 0 CA-C-O 120.815 0.341 . . . . 0.0 110.601 -179.59 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 153' ' ' TYR . . . . . . . . . . . . . 96.3 m-85 -83.81 -11.48 56.99 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.284 -0.416 . . . . 0.0 110.863 179.057 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 154' ' ' VAL . . . . . . . . . . . . . 57.4 t -64.63 123.83 18.25 Favored 'Isoleucine or valine' 0 C--O 1.235 0.336 0 CA-C-O 120.876 0.37 . . . . 0.0 111.364 -177.507 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 155' ' ' ARG . . . . . . . . . . . . . 88.7 mtt180 -73.04 117.72 15.11 Favored 'General case' 0 C--N 1.325 -0.488 0 CA-C-N 115.828 -0.624 . . . . 0.0 110.404 174.603 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 156' ' ' ILE . . . . . . . . . . . . . 37.2 mm -92.47 119.6 67.95 Favored Pre-proline 0 C--N 1.318 -0.778 0 N-CA-C 109.317 -0.623 . . . . 0.0 109.317 173.453 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 157' ' ' PRO . . . . . . . . . . . . . 42.1 Cg_endo . . . . . 0 N--CA 1.457 -0.637 0 C-N-CA 122.107 1.871 . . . . 0.0 112.237 -178.851 . . . . . . . . 0 0 . 1 . 015 nuclear nobuild core ' A' A ' 63' ' ' SER . . . . . . . . . . . . . 36.1 t . . . . . 0 C--O 1.237 0.435 0 CA-C-O 120.971 0.415 . . . . 0.0 110.522 . . . . . . . . . 0 0 . 1 . 015 nuclear nobuild core ' A' A ' 64' ' ' PHE . . . . . . . . . . . . . 81.2 t80 -63.74 -30.12 71.26 Favored 'General case' 0 C--N 1.327 -0.411 0 CA-C-N 115.857 -0.61 . . . . 0.0 109.723 177.254 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 65' ' ' GLY . . . . . . . . . . . . . . . -62.93 -36.15 93.03 Favored Glycine 0 N--CA 1.448 -0.559 0 C-N-CA 120.862 -0.685 . . . . 0.0 112.157 178.205 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 66' ' ' ASP . . . . . . . . . . . . . 22.7 t70 -69.6 -43.19 73.27 Favored 'General case' 0 C--N 1.327 -0.398 0 CA-C-O 120.931 0.396 . . . . 0.0 110.371 179.515 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 67' ' ' TRP . . . . . . . . . . . . . 83.8 m95 -72.33 -28.02 62.8 Favored 'General case' 0 C--N 1.325 -0.488 0 CA-C-N 116.153 -0.476 . . . . 0.0 111.392 179.477 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 68' ' ' ALA . . . . . 0.489 ' O ' ' HG ' ' A' ' 72' ' ' LEU . . . -65.82 -44.87 84.28 Favored 'General case' 0 C--N 1.329 -0.302 0 N-CA-C 109.57 -0.53 . . . . 0.0 109.57 173.312 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 69' ' ' GLU . . . . . . . . . . . . . 10.3 tp10 -59.46 -46.39 88.92 Favored 'General case' 0 C--O 1.234 0.244 0 CA-C-N 115.605 -0.725 . . . . 0.0 109.998 175.17 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 70' ' ' LYS . . . . . . . . . . . . . 54.7 mttp -63.35 -34.54 77.94 Favored 'General case' 0 C--N 1.331 -0.228 0 CA-C-N 115.793 -0.639 . . . . 0.0 111.645 178.663 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 71' ' ' PHE . . . . . . . . . . . . . 62.7 t80 -67.17 -43.72 81.53 Favored 'General case' 0 C--N 1.326 -0.421 0 CA-C-O 120.887 0.375 . . . . 0.0 110.578 178.809 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 72' ' ' LEU . . . . . 0.489 ' HG ' ' O ' ' A' ' 68' ' ' ALA . 85.7 mt -62.21 -44.21 97.1 Favored 'General case' 0 C--N 1.324 -0.543 0 CA-C-N 116.111 -0.495 . . . . 0.0 110.397 178.355 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 73' ' ' LYS . . . . . . . . . . . . . 35.6 mttp -72.55 -36.37 68.24 Favored 'General case' 0 C--N 1.327 -0.377 0 CA-C-N 116.001 -0.545 . . . . 0.0 112.233 -178.695 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 74' ' ' SER . . . . . . . . . . . . . 35.1 p -66.27 -34.37 77.84 Favored 'General case' 0 C--N 1.328 -0.336 0 C-N-CA 120.725 -0.39 . . . . 0.0 110.31 178.022 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 75' ' ' LYS . . . . . 0.43 ' HD3' ' HA ' ' A' ' 75' ' ' LYS . 25.8 mmtp -75.07 -32.88 61.6 Favored 'General case' 0 C--N 1.332 -0.187 0 CA-C-O 120.894 0.378 . . . . 0.0 110.903 174.958 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 76' ' ' GLU . . . . . . . . . . . . . 43.1 tt0 -63.46 -38.94 93.06 Favored 'General case' 0 C--N 1.323 -0.56 0 CA-C-O 121.219 0.533 . . . . 0.0 110.098 175.198 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 77' ' ' ALA . . . . . . . . . . . . . . . -76.4 -28.99 56.92 Favored 'General case' 0 C--N 1.325 -0.487 0 CA-C-N 115.841 -0.618 . . . . 0.0 110.741 174.578 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 78' ' ' ASP . . . . . 0.407 ' HB3' ' HA ' ' A' ' 75' ' ' LYS . 16.4 t70 -65.37 -46.3 80.7 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 115.898 -0.592 . . . . 0.0 110.357 178.056 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 79' ' ' GLY . . . . . . . . . . . . . . . 121.77 58.28 0.22 Allowed Glycine 0 N--CA 1.445 -0.714 0 C-N-CA 120.858 -0.687 . . . . 0.0 112.378 177.827 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 80' ' ' VAL . . . . . . . . . . . . . 29.8 m -100.65 141.36 17.59 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.5 0 CA-C-O 120.714 0.292 . . . . 0.0 110.533 177.492 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 81' ' ' SER . . . . . . . . . . . . . 32.0 m -57.56 156.17 8.6 Favored 'General case' 0 C--N 1.326 -0.438 0 CA-C-N 115.815 -0.629 . . . . 0.0 110.932 178.645 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 82' ' ' VAL . . . . . . . . . . . . . 7.1 p -58.2 -44.59 88.13 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.281 0 CA-C-N 116.651 -0.249 . . . . 0.0 111.504 -175.506 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 83' ' ' SER . . . . . . . . . . . . . 22.3 m -66.01 -33.13 75.11 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-O 120.771 0.32 . . . . 0.0 110.258 179.041 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 84' ' ' GLN . . . . . . . . . . . . . 52.6 tp60 -68.47 -39.17 81.5 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 115.798 -0.637 . . . . 0.0 110.26 -179.177 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 85' ' ' LEU . . . . . . . . . . . . . 49.1 tp -68.24 -33.49 74.48 Favored 'General case' 0 C--N 1.325 -0.483 0 CA-C-N 116.12 -0.491 . . . . 0.0 110.2 177.166 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 86' ' ' ASN . . . . . . . . . . . . . 90.5 m-20 -76.76 -30.64 56.61 Favored 'General case' 0 C--N 1.327 -0.4 0 CA-C-N 116.111 -0.495 . . . . 0.0 111.144 -179.791 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 87' ' ' SER . . . . . . . . . . . . . 2.9 p -69.75 -38.89 76.96 Favored 'General case' 0 N--CA 1.453 -0.28 0 C-N-CA 120.535 -0.466 . . . . 0.0 109.959 175.25 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 88' ' ' TYR . . . . . . . . . . . . . 16.3 m-85 -60.5 -43.06 97.43 Favored 'General case' 0 C--O 1.232 0.183 0 N-CA-C 109.491 -0.559 . . . . 0.0 109.491 171.32 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 89' ' ' LYS . . . . . 0.428 ' HD3' HD13 ' A' ' 72' ' ' LEU . 1.5 tppp? -54.81 -43.87 73.3 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 115.01 -0.996 . . . . 0.0 110.004 177.392 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 90' ' ' ASN . . . . . . . . . . . . . 48.1 t30 -63.94 -57.18 10.53 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 115.07 -0.968 . . . . 0.0 111.307 -178.571 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 91' ' ' TYR . . . . . . . . . . . . . 31.3 m-85 -54.48 -45.42 73.19 Favored 'General case' 0 C--O 1.235 0.33 0 CA-C-O 120.614 0.245 . . . . 0.0 111.551 -176.411 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 92' ' ' CYS . . . . . . . . . . . . . 62.1 m -68.13 -42.35 80.32 Favored 'General case' 0 C--N 1.326 -0.416 0 N-CA-C 112.518 0.562 . . . . 0.0 112.518 -175.235 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 93' ' ' ARG . . . . . 0.435 ' O ' ' HB3' ' A' ' 97' ' ' SER . 52.0 ttt180 -94.89 -24.85 16.83 Favored 'General case' 0 C--N 1.326 -0.419 0 C-N-CA 120.158 -0.617 . . . . 0.0 112.133 -172.698 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 94' ' ' ASN . . . . . . . . . . . . . 49.8 t-20 -85.79 -61.64 1.71 Allowed 'General case' 0 C--N 1.324 -0.521 0 C-N-CA 120.816 -0.354 . . . . 0.0 110.709 -178.159 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 95' ' ' HIS . . . . . . . . . . . . . 14.3 m80 -86.94 -40.73 14.54 Favored 'General case' 0 C--N 1.326 -0.415 0 N-CA-C 112.387 0.514 . . . . 0.0 112.387 -176.558 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 96' ' ' LEU . . . . . 0.513 HD22 HD12 ' A' ' 99' ' ' LEU . 89.7 mt -88.31 20.91 3.05 Favored 'General case' 0 C--N 1.327 -0.393 0 CA-C-O 120.828 0.346 . . . . 0.0 111.141 -177.037 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 97' ' ' SER . . . . . 0.527 ' N ' ' HD2' ' A' ' 98' ' ' PRO . 1.6 p -58.51 -45.55 99.66 Favored Pre-proline 0 CA--C 1.543 0.681 0 N-CA-C 112.925 0.713 . . . . 0.0 112.925 -177.901 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 98' ' ' PRO . . . . . 0.527 ' HD2' ' N ' ' A' ' 97' ' ' SER . 18.1 Cg_endo -61.28 -34.44 87.9 Favored 'Trans proline' 0 C--N 1.361 1.186 0 C-N-CA 121.623 1.549 . . . . 0.0 112.215 178.091 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 99' ' ' LEU . . . . . 0.513 HD12 HD22 ' A' ' 96' ' ' LEU . 80.6 mt -74.1 -33.37 63.6 Favored 'General case' 0 C--N 1.326 -0.42 0 CA-C-O 120.968 0.413 . . . . 0.0 110.451 -179.288 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 100' ' ' TYR . . . . . . . . . . . . . 38.2 t80 -60.14 -26.29 66.16 Favored 'General case' 0 CA--C 1.532 0.272 0 CA-C-N 115.688 -0.687 . . . . 0.0 110.301 178.551 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 101' ' ' MET . . . . . . . . . . . . . 55.0 mtt -96.54 6.92 47.74 Favored 'General case' 0 C--O 1.236 0.361 0 CA-C-N 115.666 -0.697 . . . . 0.0 111.005 -178.439 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 102' ' ' LYS . . . . . 0.528 ' HE3' HG12 ' A' ' 107' ' ' ILE . 27.3 mtpp -109.15 166.7 10.65 Favored 'General case' 0 C--N 1.324 -0.518 0 CA-C-N 116.172 -0.467 . . . . 0.0 110.984 -179.068 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 103' ' ' SER . . . . . 0.584 ' HB3' ' HG2' ' A' ' 106' ' ' GLU . 20.0 t -94.13 149.12 21.53 Favored 'General case' 0 N--CA 1.449 -0.495 0 N-CA-C 108.743 -0.836 . . . . 0.0 108.743 176.796 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 104' ' ' LEU . . . . . 0.515 HD21 ' HB1' ' A' ' 140' ' ' ALA . 35.9 tp -52.54 -52.3 55.44 Favored 'General case' 0 C--N 1.322 -0.615 0 N-CA-C 112.78 0.659 . . . . 0.0 112.78 -170.147 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 105' ' ' SER . . . . . . . . . . . . . 38.4 m -82.91 -7.36 59.67 Favored 'General case' 0 C--N 1.322 -0.61 0 N-CA-C 112.905 0.706 . . . . 0.0 112.905 -172.828 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 106' ' ' GLU . . . . . 0.584 ' HG2' ' HB3' ' A' ' 103' ' ' SER . 1.1 pp20? -106.48 15.42 25.95 Favored 'General case' 0 C--O 1.233 0.196 0 CA-C-O 121.233 0.54 . . . . 0.0 111.19 -178.899 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 107' ' ' ILE . . . . . 0.528 HG12 ' HE3' ' A' ' 102' ' ' LYS . 80.0 mt -88.14 134.57 27.69 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.56 0 CA-C-N 115.866 -0.606 . . . . 0.0 109.664 173.061 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 108' ' ' LEU . . . . . . . . . . . . . 97.9 mt -105.21 150.21 38.58 Favored Pre-proline 0 C--N 1.327 -0.413 0 CA-C-N 116.465 -0.334 . . . . 0.0 110.479 178.505 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 109' ' ' PRO . . . . . . . . . . . . . 36.5 Cg_exo -60.88 -26.27 82.8 Favored 'Trans proline' 0 C--N 1.343 0.275 0 C-N-CA 122.491 2.127 . . . . 0.0 111.257 175.136 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 110' ' ' ALA . . . . . . . . . . . . . . . -64.77 -38.94 92.69 Favored 'General case' 0 C--N 1.331 -0.227 0 CA-C-N 115.495 -0.775 . . . . 0.0 110.958 178.786 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 111' ' ' ASP . . . . . . . . . . . . . 41.5 m-20 -61.88 -49.66 75.35 Favored 'General case' 0 CA--C 1.52 -0.209 0 CA-C-O 121.074 0.464 . . . . 0.0 109.935 177.759 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 112' ' ' ILE . . . . . 0.44 ' O ' HG12 ' A' ' 116' ' ' ILE . 39.2 mt -62.31 -43.46 98.08 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.249 0 CA-C-N 115.556 -0.747 . . . . 0.0 110.871 -179.193 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 113' ' ' GLN . . . . . . . . . . . . . 7.8 tp-100 -61.34 -38.61 87.56 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.364 -0.38 . . . . 0.0 110.642 178.908 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 114' ' ' SER . . . . . . . . . . . . . 48.2 m -62.72 -41.32 99.1 Favored 'General case' 0 C--N 1.326 -0.42 0 CA-C-N 116.137 -0.483 . . . . 0.0 110.253 177.14 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 115' ' ' ILE . . . . . 0.433 HD11 ' HG2' ' A' ' 98' ' ' PRO . 74.4 mt -62.53 -44.2 99.1 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.214 0 CA-C-N 116.338 -0.392 . . . . 0.0 110.454 176.982 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 116' ' ' ILE . . . . . 0.44 HG12 ' O ' ' A' ' 112' ' ' ILE . 45.4 mm -58.96 -46.88 91.24 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.337 0 CA-C-N 116.034 -0.53 . . . . 0.0 110.915 178.717 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 117' ' ' ASN . . . . . . . . . . . . . 28.7 t-20 -75.07 -23.16 58.0 Favored 'General case' 0 C--N 1.326 -0.442 0 CA-C-N 116.388 -0.369 . . . . 0.0 111.227 -178.189 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 118' ' ' GLU . . . . . . . . . . . . . 7.6 mm-40 -79.7 -20.71 45.9 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-O 120.755 0.312 . . . . 0.0 110.42 175.075 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 119' ' ' THR . . . . . . . . . . . . . 80.9 m -73.48 112.9 10.0 Favored 'General case' 0 N--CA 1.449 -0.488 0 N-CA-C 109.661 -0.496 . . . . 0.0 109.661 175.456 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 120' ' ' LYS . . . . . . . . . . . . . 6.5 ptmt -93.55 26.55 2.98 Favored 'General case' 0 C--N 1.321 -0.639 0 CA-C-N 115.863 -0.608 . . . . 0.0 111.364 -174.846 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 121' ' ' LEU . . . . . . . . . . . . . 3.8 mm? -95.95 -175.82 3.52 Favored 'General case' 0 C--N 1.327 -0.398 0 CA-C-N 115.763 -0.653 . . . . 0.0 110.374 178.879 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 122' ' ' ALA . . . . . 0.406 ' O ' ' HG ' ' A' ' 126' ' ' LEU . . . -87.58 174.03 8.71 Favored 'General case' 0 C--N 1.327 -0.391 0 N-CA-C 112.38 0.511 . . . . 0.0 112.38 -173.521 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 123' ' ' LYS . . . . . . . . . . . . . 14.4 tttm -48.24 -48.22 35.38 Favored 'General case' 0 N--CA 1.467 0.382 0 CA-C-N 115.198 -0.91 . . . . 0.0 113.037 -178.122 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 124' ' ' ASN . . . . . . . . . . . . . 7.1 m-20 -63.52 -40.78 97.94 Favored 'General case' 0 C--N 1.326 -0.418 0 CA-C-O 120.533 0.206 . . . . 0.0 111.354 -176.204 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 125' ' ' THR . . . . . . . . . . . . . 13.3 m -66.77 -39.59 87.92 Favored 'General case' 0 C--N 1.325 -0.46 0 CA-C-O 120.739 0.304 . . . . 0.0 110.739 179.071 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 126' ' ' LEU . . . . . 0.406 ' HG ' ' O ' ' A' ' 122' ' ' ALA . 94.1 mt -59.93 -45.81 91.39 Favored 'General case' 0 N--CA 1.462 0.165 0 CA-C-O 121.197 0.522 . . . . 0.0 110.644 179.239 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 127' ' ' LYS . . . . . . . . . . . . . 58.0 mttm -71.08 -29.68 65.61 Favored 'General case' 0 C--N 1.326 -0.453 0 CA-C-N 115.712 -0.677 . . . . 0.0 111.274 -178.926 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 128' ' ' ALA . . . . . . . . . . . . . . . -62.48 -47.06 85.64 Favored 'General case' 0 C--N 1.326 -0.444 0 CA-C-N 116.223 -0.444 . . . . 0.0 110.322 175.753 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 129' ' ' ILE . . . . . . . . . . . . . 57.9 mt -65.15 -41.07 90.82 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.332 0 CA-C-N 116.112 -0.494 . . . . 0.0 110.021 176.734 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 130' ' ' ARG . . . . . 0.767 HH12 ' HB1' ' A' ' 151' ' ' ALA . 3.8 tpm_? -57.08 -56.21 24.75 Favored 'General case' 0 C--N 1.33 -0.24 0 CA-C-N 115.57 -0.741 . . . . 0.0 111.102 178.796 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 131' ' ' ASN . . . . . 0.498 ' O ' ' HG2' ' A' ' 135' ' ' GLN . 58.1 t30 -59.22 -46.5 88.3 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.359 -0.382 . . . . 0.0 110.822 -178.174 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 132' ' ' THR . . . . . 0.422 ' O ' HG13 ' A' ' 136' ' ' ILE . 61.0 m -56.67 -53.58 56.0 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.314 -0.403 . . . . 0.0 111.224 -179.312 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 133' ' ' ALA . . . . . . . . . . . . . . . -62.48 -34.7 77.35 Favored 'General case' 0 C--N 1.331 -0.217 0 CA-C-O 121.093 0.473 . . . . 0.0 110.965 -179.808 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 134' ' ' SER . . . . . . . . . . . . . 14.0 t -63.27 -46.58 86.16 Favored 'General case' 0 C--N 1.327 -0.374 0 CA-C-N 115.891 -0.595 . . . . 0.0 110.198 179.534 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 135' ' ' GLN . . . . . 0.498 ' HG2' ' O ' ' A' ' 131' ' ' ASN . 82.6 mm-40 -60.2 -39.73 87.59 Favored 'General case' 0 C--N 1.332 -0.175 0 CA-C-N 116.19 -0.459 . . . . 0.0 111.246 -178.952 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 136' ' ' ILE . . . . . 0.422 HG13 ' O ' ' A' ' 132' ' ' THR . 62.8 mt -59.16 -49.73 82.32 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.253 0 CA-C-N 116.343 -0.39 . . . . 0.0 110.733 -179.881 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 137' ' ' PHE . . . . . 0.562 ' O ' HG13 ' A' ' 141' ' ' ILE . 52.8 m-85 -63.29 -41.69 98.99 Favored 'General case' 0 C--N 1.331 -0.217 0 CA-C-N 116.344 -0.389 . . . . 0.0 110.764 177.625 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 138' ' ' ARG . . . . . 0.453 ' O ' ' HG2' ' A' ' 142' ' ' GLU . 72.9 mtp180 -59.79 -42.98 94.58 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.067 -0.515 . . . . 0.0 111.137 179.571 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 139' ' ' LEU . . . . . . . . . . . . . 50.3 tp -60.21 -39.0 85.06 Favored 'General case' 0 C--N 1.325 -0.481 0 CA-C-N 116.091 -0.504 . . . . 0.0 110.685 178.069 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 140' ' ' ALA . . . . . 0.515 ' HB1' HD21 ' A' ' 104' ' ' LEU . . . -67.57 -39.73 84.88 Favored 'General case' 0 C--N 1.326 -0.434 0 CA-C-N 116.193 -0.458 . . . . 0.0 110.668 178.014 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 141' ' ' ILE . . . . . 0.562 HG13 ' O ' ' A' ' 137' ' ' PHE . 66.5 mt -62.96 -39.42 85.06 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.27 0 CA-C-N 116.064 -0.517 . . . . 0.0 110.662 177.007 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 142' ' ' GLU . . . . . 0.453 ' HG2' ' O ' ' A' ' 138' ' ' ARG . 35.8 mm-40 -54.5 -45.07 73.19 Favored 'General case' 0 N--CA 1.463 0.196 0 CA-C-O 121.161 0.505 . . . . 0.0 111.053 177.521 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 143' ' ' ASN . . . . . . . . . . . . . 41.0 m-80 -85.78 6.55 27.5 Favored 'General case' 0 C--N 1.327 -0.409 0 CA-C-N 115.683 -0.69 . . . . 0.0 110.676 -178.34 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 144' ' ' ARG . . . . . 0.4 HH11 ' HD2' ' A' ' 144' ' ' ARG . 41.1 mtp85 58.02 28.09 15.77 Favored 'General case' 0 N--CA 1.465 0.315 0 CA-C-N 115.706 -0.679 . . . . 0.0 112.106 179.54 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 145' ' ' ALA . . . . . . . . . . . . . . . -76.53 -23.01 53.63 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-O 121.739 0.78 . . . . 0.0 109.496 174.663 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 146' ' ' ILE . . . . . 0.549 ' O ' ' HA ' ' A' ' 141' ' ' ILE . 14.6 tt -149.77 144.01 17.77 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.713 0 CA-C-N 114.772 -1.103 . . . . 0.0 108.169 173.578 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 147' ' ' ASP . . . . . . . . . . . . . 30.4 t70 -116.55 27.3 9.28 Favored 'General case' 0 C--N 1.319 -0.755 0 CA-C-O 122.117 0.961 . . . . 0.0 109.158 -179.233 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 148' ' ' PHE . . . . . 0.484 ' H ' HG12 ' A' ' 146' ' ' ILE . 69.8 t80 -137.39 136.97 38.35 Favored 'General case' 0 C--N 1.318 -0.786 0 CA-C-N 114.603 -1.18 . . . . 0.0 109.032 -175.755 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 149' ' ' ASN . . . . . . . . . . . . . 3.8 t-20 -120.19 90.06 44.11 Favored Pre-proline 0 C--N 1.322 -0.616 0 C-N-CA 120.89 -0.324 . . . . 0.0 110.74 -177.318 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 150' ' ' PRO . . . . . . . . . . . . . 21.7 Cg_exo -64.45 -22.85 65.32 Favored 'Trans proline' 0 C--N 1.345 0.35 0 C-N-CA 122.559 2.173 . . . . 0.0 111.108 178.542 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 151' ' ' ALA . . . . . 0.767 ' HB1' HH12 ' A' ' 130' ' ' ARG . . . -66.11 -27.45 68.06 Favored 'General case' 0 N--CA 1.45 -0.428 0 CA-C-N 115.062 -0.972 . . . . 0.0 111.514 -177.819 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 152' ' ' ASP . . . . . . . . . . . . . 14.6 t70 -71.69 -25.35 62.07 Favored 'General case' 0 C--N 1.327 -0.401 0 CA-C-O 121.07 0.462 . . . . 0.0 110.498 -177.354 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 153' ' ' TYR . . . . . . . . . . . . . 92.4 m-85 -87.41 0.15 55.93 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 115.893 -0.594 . . . . 0.0 110.977 -178.464 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 154' ' ' VAL . . . . . . . . . . . . . 55.9 t -88.34 107.24 17.38 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.416 0 N-CA-C 109.967 -0.383 . . . . 0.0 109.967 178.822 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 155' ' ' ARG . . . . . . . . . . . . . 10.4 tpt180 -89.49 130.44 35.83 Favored 'General case' 0 C--N 1.323 -0.554 0 CA-C-N 116.0 -0.545 . . . . 0.0 110.892 -177.374 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 156' ' ' ILE . . . . . . . . . . . . . 48.0 mm -96.81 115.61 65.76 Favored Pre-proline 0 C--N 1.323 -0.545 0 CA-C-N 116.116 -0.493 . . . . 0.0 110.052 175.021 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 157' ' ' PRO . . . . . . . . . . . . . 93.9 Cg_endo . . . . . 0 N--CA 1.458 -0.57 0 C-N-CA 122.708 2.272 . . . . 0.0 112.318 176.933 . . . . . . . . 0 0 . 1 . 016 nuclear nobuild core ' A' A ' 63' ' ' SER . . . . . . . . . . . . . 19.4 m . . . . . 0 C--O 1.234 0.279 0 N-CA-C 110.152 -0.314 . . . . 0.0 110.152 . . . . . . . . . 0 0 . 1 . 016 nuclear nobuild core ' A' A ' 64' ' ' PHE . . . . . . . . . . . . . 77.8 t80 -59.04 -33.01 70.27 Favored 'General case' 0 N--CA 1.464 0.236 0 CA-C-O 120.68 0.276 . . . . 0.0 110.578 -177.491 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 65' ' ' GLY . . . . . . . . . . . . . . . -57.87 -41.21 94.03 Favored Glycine 0 N--CA 1.448 -0.559 0 C-N-CA 120.856 -0.688 . . . . 0.0 112.366 176.495 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 66' ' ' ASP . . . . . 0.59 ' O ' ' HG3' ' A' ' 70' ' ' LYS . 6.8 t0 -72.66 -41.27 65.61 Favored 'General case' 0 C--N 1.327 -0.392 0 N-CA-C 109.618 -0.512 . . . . 0.0 109.618 179.78 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 67' ' ' TRP . . . . . . . . . . . . . 97.6 m95 -59.71 -38.33 81.32 Favored 'General case' 0 N--CA 1.464 0.268 0 CA-C-N 116.344 -0.389 . . . . 0.0 110.751 177.184 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 68' ' ' ALA . . . . . . . . . . . . . . . -61.23 -44.5 97.16 Favored 'General case' 0 C--N 1.326 -0.435 0 CA-C-N 116.293 -0.412 . . . . 0.0 110.081 176.314 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 69' ' ' GLU . . . . . . . . . . . . . 28.7 tt0 -62.26 -41.17 98.21 Favored 'General case' 0 CA--C 1.53 0.175 0 CA-C-N 116.116 -0.493 . . . . 0.0 110.024 176.943 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 70' ' ' LYS . . . . . 0.59 ' HG3' ' O ' ' A' ' 66' ' ' ASP . 51.8 mttm -57.34 -44.31 84.16 Favored 'General case' 0 C--O 1.232 0.158 0 CA-C-N 116.354 -0.385 . . . . 0.0 110.587 177.711 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 71' ' ' PHE . . . . . . . . . . . . . 89.2 t80 -60.4 -52.52 64.89 Favored 'General case' 0 C--N 1.331 -0.22 0 CA-C-N 115.905 -0.589 . . . . 0.0 110.63 -179.709 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 72' ' ' LEU . . . . . 0.468 HD12 HD13 ' A' ' 85' ' ' LEU . 4.2 mm? -59.65 -47.4 85.77 Favored 'General case' 0 C--N 1.331 -0.231 0 CA-C-N 116.292 -0.413 . . . . 0.0 110.755 178.856 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 73' ' ' LYS . . . . . 0.444 ' HB2' ' HE3' ' A' ' 73' ' ' LYS . 36.0 ttmt -56.43 -46.64 80.16 Favored 'General case' 0 C--N 1.325 -0.469 0 CA-C-N 115.556 -0.747 . . . . 0.0 110.547 179.774 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 74' ' ' SER . . . . . . . . . . . . . 42.0 m -68.15 -43.79 77.46 Favored 'General case' 0 C--N 1.327 -0.395 0 CA-C-N 115.778 -0.646 . . . . 0.0 111.186 -179.69 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 75' ' ' LYS . . . . . 0.453 ' O ' HG22 ' A' ' 80' ' ' VAL . 3.6 mmtm -69.18 -32.5 71.85 Favored 'General case' 0 C--N 1.331 -0.215 0 CA-C-N 116.701 -0.227 . . . . 0.0 111.423 -177.64 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 76' ' ' GLU . . . . . . . . . . . . . 39.3 tt0 -58.27 -50.68 72.74 Favored 'General case' 0 C--N 1.327 -0.413 0 CA-C-O 121.009 0.433 . . . . 0.0 109.978 173.975 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 77' ' ' ALA . . . . . . . . . . . . . . . -75.45 -10.06 59.12 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 115.689 -0.687 . . . . 0.0 111.108 179.137 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 78' ' ' ASP . . . . . . . . . . . . . 34.5 t70 -76.13 -11.81 60.0 Favored 'General case' 0 C--N 1.324 -0.502 0 CA-C-N 115.727 -0.67 . . . . 0.0 110.885 -177.925 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 79' ' ' GLY . . . . . . . . . . . . . . . 103.55 33.99 3.99 Favored Glycine 0 N--CA 1.451 -0.366 0 C-N-CA 120.632 -0.794 . . . . 0.0 113.332 174.012 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 80' ' ' VAL . . . . . 0.453 HG22 ' O ' ' A' ' 75' ' ' LYS . 31.4 m -101.09 159.53 3.93 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.411 0 CA-C-N 116.935 0.368 . . . . 0.0 110.549 176.653 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 81' ' ' SER . . . . . . . . . . . . . 7.1 p -81.78 174.95 10.84 Favored 'General case' 0 C--N 1.324 -0.54 0 CA-C-N 116.164 -0.471 . . . . 0.0 110.868 179.195 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 82' ' ' VAL . . . . . . . . . . . . . 61.0 t -68.29 -41.66 83.9 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.397 0 CA-C-N 116.341 -0.391 . . . . 0.0 110.615 -177.707 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 83' ' ' SER . . . . . . . . . . . . . 53.0 p -58.9 -39.19 80.74 Favored 'General case' 0 C--N 1.332 -0.188 0 CA-C-O 121.248 0.547 . . . . 0.0 110.507 177.964 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 84' ' ' GLN . . . . . . . . . . . . . 6.5 tp-100 -66.52 -47.98 71.21 Favored 'General case' 0 C--N 1.325 -0.465 0 CA-C-N 115.65 -0.705 . . . . 0.0 110.146 177.822 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 85' ' ' LEU . . . . . 0.468 HD13 HD12 ' A' ' 72' ' ' LEU . 0.6 OUTLIER -62.47 -43.43 98.84 Favored 'General case' 0 C--N 1.326 -0.432 0 CA-C-N 115.599 -0.728 . . . . 0.0 110.559 -178.364 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild core ' A' A ' 86' ' ' ASN . . . . . . . . . . . . . 11.8 m120 -61.44 -38.85 88.68 Favored 'General case' 0 N--CA 1.465 0.297 0 CA-C-O 120.689 0.28 . . . . 0.0 111.005 179.409 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 87' ' ' SER . . . . . . . . . . . . . 49.6 m -60.2 -44.38 95.16 Favored 'General case' 0 C--N 1.327 -0.378 0 CA-C-N 116.32 -0.4 . . . . 0.0 110.772 -179.707 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 88' ' ' TYR . . . . . 0.441 ' HB2' HD11 ' A' ' 72' ' ' LEU . 25.8 m-85 -62.56 -37.97 88.23 Favored 'General case' 0 C--N 1.331 -0.235 0 CA-C-N 116.452 -0.34 . . . . 0.0 110.495 177.706 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 89' ' ' LYS . . . . . 0.62 ' HA ' ' SG ' ' A' ' 92' ' ' CYS . 56.3 mtpt -66.09 -36.74 83.99 Favored 'General case' 0 C--N 1.331 -0.226 0 CA-C-N 116.201 -0.454 . . . . 0.0 110.589 178.522 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 90' ' ' ASN . . . . . 0.507 ' O ' ' HB2' ' A' ' 94' ' ' ASN . 27.3 t-20 -60.98 -33.34 73.07 Favored 'General case' 0 C--N 1.327 -0.382 0 CA-C-O 121.347 0.594 . . . . 0.0 110.375 176.234 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 91' ' ' TYR . . . . . . . . . . . . . 24.1 m-85 -72.18 -50.58 26.57 Favored 'General case' 0 C--N 1.322 -0.616 0 CA-C-N 116.064 -0.516 . . . . 0.0 110.841 178.783 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 92' ' ' CYS . . . . . 0.62 ' SG ' ' HA ' ' A' ' 89' ' ' LYS . 24.9 p -76.81 -40.82 46.73 Favored 'General case' 0 C--N 1.328 -0.331 0 N-CA-C 112.226 0.454 . . . . 0.0 112.226 -174.593 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 93' ' ' ARG . . . . . . . . . . . . . 35.6 ttt180 -78.17 -52.75 8.23 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-O 120.812 0.339 . . . . 0.0 111.834 -176.68 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 94' ' ' ASN . . . . . 0.507 ' HB2' ' O ' ' A' ' 90' ' ' ASN . 3.9 m-20 -77.88 -50.21 12.7 Favored 'General case' 0 C--N 1.324 -0.508 0 CA-C-O 120.976 0.417 . . . . 0.0 111.161 -173.266 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 95' ' ' HIS . . . . . . . . . . . . . 76.0 m80 -86.9 -54.12 4.52 Favored 'General case' 0 C--N 1.323 -0.564 0 CA-C-N 116.193 -0.458 . . . . 0.0 112.101 -173.827 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 96' ' ' LEU . . . . . 0.559 ' HB2' ' HA ' ' A' ' 92' ' ' CYS . 81.8 mt -87.54 26.81 1.2 Allowed 'General case' 0 C--N 1.326 -0.415 0 N-CA-C 111.789 0.292 . . . . 0.0 111.789 -173.471 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 97' ' ' SER . . . . . 0.534 ' N ' ' HD2' ' A' ' 98' ' ' PRO . 0.0 OUTLIER -56.66 -48.05 97.91 Favored Pre-proline 0 CA--C 1.54 0.595 0 N-CA-C 112.595 0.591 . . . . 0.0 112.595 -179.16 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild core ' A' A ' 98' ' ' PRO . . . . . 0.534 ' HD2' ' N ' ' A' ' 97' ' ' SER . 15.7 Cg_endo -58.62 -36.54 97.12 Favored 'Trans proline' 0 C--N 1.358 1.037 0 C-N-CA 122.032 1.821 . . . . 0.0 112.336 176.409 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 99' ' ' LEU . . . . . 0.434 HD22 HD22 ' A' ' 96' ' ' LEU . 8.1 mp -70.09 -33.65 72.15 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-N 116.304 -0.407 . . . . 0.0 110.503 -179.342 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 100' ' ' TYR . . . . . . . . . . . . . 62.9 t80 -57.42 -29.79 64.44 Favored 'General case' 0 C--N 1.327 -0.391 0 CA-C-N 115.541 -0.754 . . . . 0.0 110.926 179.272 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 101' ' ' MET . . . . . . . . . . . . . 47.4 ttm -86.6 -18.61 30.99 Favored 'General case' 0 C--N 1.325 -0.468 0 CA-C-N 116.008 -0.542 . . . . 0.0 110.88 -177.344 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 102' ' ' LYS . . . . . . . . . . . . . 89.2 mttt -91.02 165.2 13.66 Favored 'General case' 0 C--N 1.325 -0.495 0 CA-C-O 121.453 0.644 . . . . 0.0 111.944 -174.348 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 103' ' ' SER . . . . . 0.472 ' O ' HG13 ' A' ' 107' ' ' ILE . 18.1 t -95.02 172.2 8.29 Favored 'General case' 0 C--N 1.323 -0.582 0 CA-C-N 115.396 -0.82 . . . . 0.0 109.051 169.336 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 104' ' ' LEU . . . . . . . . . . . . . 89.0 mt -59.07 -43.72 91.8 Favored 'General case' 0 C--N 1.325 -0.458 0 N-CA-C 111.993 0.368 . . . . 0.0 111.993 -174.686 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 105' ' ' SER . . . . . . . . . . . . . 24.1 t -85.04 1.97 45.32 Favored 'General case' 0 C--N 1.326 -0.447 0 CA-C-O 121.099 0.476 . . . . 0.0 110.74 -177.315 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 106' ' ' GLU . . . . . . . . . . . . . 19.7 tp10 -102.36 -14.06 17.07 Favored 'General case' 0 C--N 1.322 -0.63 0 CA-C-O 121.268 0.556 . . . . 0.0 110.531 -178.128 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 107' ' ' ILE . . . . . 0.472 HG13 ' O ' ' A' ' 103' ' ' SER . 68.3 mt -83.81 140.38 16.27 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.45 0 CA-C-N 116.09 -0.504 . . . . 0.0 110.953 -178.626 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 108' ' ' LEU . . . . . . . . . . . . . 76.1 mt -110.81 151.22 42.76 Favored Pre-proline 0 C--N 1.324 -0.513 0 CA-C-N 116.023 -0.535 . . . . 0.0 109.71 178.161 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 109' ' ' PRO . . . . . . . . . . . . . 18.9 Cg_endo -61.08 -26.8 83.43 Favored 'Trans proline' 0 N--CA 1.464 -0.212 0 C-N-CA 121.979 1.786 . . . . 0.0 111.166 174.633 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 110' ' ' ALA . . . . . 0.425 ' HA ' ' HB3' ' A' ' 113' ' ' GLN . . . -71.48 -26.34 62.65 Favored 'General case' 0 N--CA 1.453 -0.288 0 CA-C-N 115.351 -0.841 . . . . 0.0 111.683 -178.78 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 111' ' ' ASP . . . . . 0.466 ' O ' HG13 ' A' ' 115' ' ' ILE . 29.7 m-20 -57.74 -57.15 14.02 Favored 'General case' 0 N--CA 1.463 0.223 0 CA-C-O 121.272 0.558 . . . . 0.0 109.648 176.426 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 112' ' ' ILE . . . . . . . . . . . . . 19.5 mt -67.23 -37.49 79.22 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.538 0 CA-C-N 115.449 -0.796 . . . . 0.0 110.337 -179.162 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 113' ' ' GLN . . . . . 0.425 ' HB3' ' HA ' ' A' ' 110' ' ' ALA . 23.4 tp60 -58.27 -50.12 74.71 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 115.864 -0.607 . . . . 0.0 111.446 179.651 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 114' ' ' SER . . . . . . . . . . . . . 31.6 p -64.7 -35.2 80.27 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 116.335 -0.393 . . . . 0.0 110.956 -177.963 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 115' ' ' ILE . . . . . 0.466 HG13 ' O ' ' A' ' 111' ' ' ASP . 92.7 mt -60.44 -53.3 50.69 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.299 0 CA-C-O 120.694 0.283 . . . . 0.0 110.359 175.979 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 116' ' ' ILE . . . . . . . . . . . . . 47.5 mm -60.16 -41.95 88.47 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.289 0 CA-C-N 116.121 -0.49 . . . . 0.0 110.924 -179.435 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 117' ' ' ASN . . . . . . . . . . . . . 27.9 t-20 -65.49 -32.67 74.41 Favored 'General case' 0 C--N 1.326 -0.447 0 CA-C-N 116.066 -0.515 . . . . 0.0 111.926 -176.896 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 118' ' ' GLU . . . . . . . . . . . . . 21.3 mt-10 -103.17 4.18 36.6 Favored 'General case' 0 C--N 1.329 -0.311 0 N-CA-C 112.176 0.436 . . . . 0.0 112.176 -177.663 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 119' ' ' THR . . . . . . . . . . . . . 96.7 m -97.85 112.06 24.12 Favored 'General case' 0 C--N 1.322 -0.596 0 CA-C-O 121.176 0.512 . . . . 0.0 110.239 173.636 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 120' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -93.86 88.62 5.82 Favored 'General case' 0 C--N 1.325 -0.458 0 CA-C-N 115.943 -0.571 . . . . 0.0 110.362 -177.869 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 121' ' ' LEU . . . . . 0.415 HD13 HG21 ' A' ' 125' ' ' THR . 57.6 mt -138.69 -174.7 3.9 Favored 'General case' 0 C--N 1.32 -0.694 0 CA-C-N 115.392 -0.822 . . . . 0.0 110.025 179.541 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 122' ' ' ALA . . . . . . . . . . . . . . . -64.85 147.39 53.36 Favored 'General case' 0 C--N 1.322 -0.612 0 CA-C-N 116.277 -0.42 . . . . 0.0 110.465 178.439 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 123' ' ' LYS . . . . . 0.403 ' O ' ' HG3' ' A' ' 127' ' ' LYS . 52.6 mttp -55.94 -33.96 65.21 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 115.997 -0.547 . . . . 0.0 111.353 -179.345 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 124' ' ' ASN . . . . . . . . . . . . . 65.5 t30 -64.74 -38.49 91.17 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 115.978 -0.555 . . . . 0.0 110.413 -179.987 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 125' ' ' THR . . . . . 0.475 ' O ' HG13 ' A' ' 129' ' ' ILE . 7.3 m -68.25 -37.52 80.85 Favored 'General case' 0 C--N 1.326 -0.417 0 CA-C-N 115.774 -0.648 . . . . 0.0 110.801 -179.444 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 126' ' ' LEU . . . . . . . . . . . . . 88.5 mt -61.84 -41.8 98.26 Favored 'General case' 0 C--O 1.234 0.289 0 CA-C-O 121.144 0.497 . . . . 0.0 110.221 178.595 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 127' ' ' LYS . . . . . 0.403 ' HG3' ' O ' ' A' ' 123' ' ' LYS . 93.5 mttt -63.49 -44.68 93.66 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 115.663 -0.698 . . . . 0.0 110.201 177.142 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 128' ' ' ALA . . . . . . . . . . . . . . . -57.57 -40.45 78.98 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 115.717 -0.674 . . . . 0.0 111.477 -178.404 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 129' ' ' ILE . . . . . 0.475 HG13 ' O ' ' A' ' 125' ' ' THR . 67.3 mt -62.63 -50.19 80.77 Favored 'Isoleucine or valine' 0 C--O 1.235 0.295 0 CA-C-N 116.478 -0.328 . . . . 0.0 110.687 178.809 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 130' ' ' ARG . . . . . . . . . . . . . 13.7 ttt180 -61.63 -45.68 93.02 Favored 'General case' 0 C--O 1.231 0.107 0 CA-C-N 116.467 -0.333 . . . . 0.0 110.782 178.106 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 131' ' ' ASN . . . . . . . . . . . . . 7.1 m-20 -58.29 -49.54 76.77 Favored 'General case' 0 C--N 1.325 -0.457 0 CA-C-N 116.36 -0.382 . . . . 0.0 111.49 -179.061 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 132' ' ' THR . . . . . 0.484 ' O ' HG13 ' A' ' 136' ' ' ILE . 52.9 m -54.76 -50.72 67.76 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 116.227 -0.442 . . . . 0.0 110.594 178.268 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 133' ' ' ALA . . . . . . . . . . . . . . . -61.06 -40.91 95.46 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.209 -0.451 . . . . 0.0 111.103 179.436 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 134' ' ' SER . . . . . 0.455 ' O ' ' HG3' ' A' ' 138' ' ' ARG . 58.7 m -59.29 -45.57 90.9 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.044 -0.526 . . . . 0.0 111.123 -179.884 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 135' ' ' GLN . . . . . . . . . . . . . 12.3 mm100 -66.0 -34.85 79.04 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.399 -0.364 . . . . 0.0 111.071 -177.716 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 136' ' ' ILE . . . . . 0.484 HG13 ' O ' ' A' ' 132' ' ' THR . 64.3 mt -64.68 -43.81 96.61 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.264 0 CA-C-O 120.843 0.354 . . . . 0.0 110.166 177.219 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 137' ' ' PHE . . . . . 0.531 ' O ' HG13 ' A' ' 141' ' ' ILE . 43.5 m-85 -63.9 -39.86 95.16 Favored 'General case' 0 C--N 1.332 -0.18 0 CA-C-N 116.179 -0.464 . . . . 0.0 110.671 176.346 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 138' ' ' ARG . . . . . 0.455 ' HG3' ' O ' ' A' ' 134' ' ' SER . 79.0 mtt180 -64.0 -36.38 83.8 Favored 'General case' 0 C--N 1.332 -0.185 0 CA-C-O 120.738 0.304 . . . . 0.0 110.634 178.605 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 139' ' ' LEU . . . . . . . . . . . . . 54.8 tp -59.22 -41.52 88.84 Favored 'General case' 0 C--N 1.326 -0.423 0 CA-C-N 116.056 -0.52 . . . . 0.0 110.043 176.13 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 140' ' ' ALA . . . . . . . . . . . . . . . -67.0 -36.3 81.86 Favored 'General case' 0 C--N 1.327 -0.385 0 CA-C-N 116.243 -0.435 . . . . 0.0 110.537 176.715 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 141' ' ' ILE . . . . . 0.604 ' HA ' ' O ' ' A' ' 146' ' ' ILE . 77.3 mt -63.51 -45.58 97.4 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.301 0 CA-C-N 116.083 -0.508 . . . . 0.0 110.582 176.776 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 142' ' ' GLU . . . . . . . . . . . . . 46.4 mt-10 -63.16 -27.66 69.52 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.015 -0.539 . . . . 0.0 111.159 179.534 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 143' ' ' ASN . . . . . . . . . . . . . 35.1 m-80 -95.97 11.85 32.48 Favored 'General case' 0 C--N 1.326 -0.421 0 CA-C-N 116.284 -0.416 . . . . 0.0 110.821 179.43 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 144' ' ' ARG . . . . . . . . . . . . . 81.5 mtm180 60.88 25.24 15.19 Favored 'General case' 0 N--CA 1.469 0.498 0 CA-C-N 115.7 -0.682 . . . . 0.0 112.553 174.589 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 145' ' ' ALA . . . . . . . . . . . . . . . -80.41 -42.35 22.92 Favored 'General case' 0 C--N 1.323 -0.553 0 CA-C-O 121.25 0.548 . . . . 0.0 110.309 177.835 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 146' ' ' ILE . . . . . 0.604 ' O ' ' HA ' ' A' ' 141' ' ' ILE . 13.7 tt -147.13 152.19 13.28 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.542 0 CA-C-N 115.677 -0.692 . . . . 0.0 109.336 179.412 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 147' ' ' ASP . . . . . . . . . . . . . 25.9 t70 -125.83 70.06 1.2 Allowed 'General case' 0 C--N 1.321 -0.634 0 N-CA-C 109.314 -0.625 . . . . 0.0 109.314 175.096 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 148' ' ' PHE . . . . . . . . . . . . . 61.5 t80 -169.48 133.8 1.37 Allowed 'General case' 0 C--N 1.324 -0.535 0 CA-C-N 115.618 -0.719 . . . . 0.0 109.647 -177.905 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 149' ' ' ASN . . . . . 0.417 HD21 ' HA ' ' A' ' 134' ' ' SER . 4.5 t-20 -115.7 96.3 46.06 Favored Pre-proline 0 C--N 1.322 -0.591 0 CA-C-N 116.478 -0.328 . . . . 0.0 110.737 179.369 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 150' ' ' PRO . . . . . . . . . . . . . 17.3 Cg_exo -67.4 -21.47 47.03 Favored 'Trans proline' 0 C--N 1.344 0.311 0 C-N-CA 122.852 2.368 . . . . 0.0 112.07 179.682 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 151' ' ' ALA . . . . . 0.407 ' HA ' HG23 ' A' ' 154' ' ' VAL . . . -72.18 -15.8 61.96 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-N 115.972 -0.558 . . . . 0.0 111.246 -178.582 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 152' ' ' ASP . . . . . . . . . . . . . 25.2 t70 -72.01 -19.56 61.84 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-O 121.212 0.53 . . . . 0.0 110.568 179.997 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 153' ' ' TYR . . . . . . . . . . . . . 97.8 m-85 -93.38 1.52 56.87 Favored 'General case' 0 C--N 1.326 -0.435 0 CA-C-N 115.958 -0.565 . . . . 0.0 111.251 -177.573 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 154' ' ' VAL . . . . . 0.407 HG23 ' HA ' ' A' ' 151' ' ' ALA . 48.8 t -77.2 110.82 13.3 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.373 0 CA-C-N 116.374 -0.376 . . . . 0.0 110.334 179.615 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 155' ' ' ARG . . . . . . . . . . . . . 77.0 mtt-85 -77.22 135.39 38.48 Favored 'General case' 0 C--N 1.321 -0.637 0 CA-C-N 116.181 -0.463 . . . . 0.0 110.273 179.279 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 156' ' ' ILE . . . . . . . . . . . . . 49.8 mm -105.06 104.92 49.48 Favored Pre-proline 0 C--N 1.321 -0.646 0 CA-C-N 115.736 -0.665 . . . . 0.0 109.77 -179.113 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 157' ' ' PRO . . . . . . . . . . . . . 58.2 Cg_endo . . . . . 0 N--CA 1.461 -0.394 0 C-N-CA 122.412 2.075 . . . . 0.0 112.227 -177.937 . . . . . . . . 0 0 . 1 . 017 nuclear nobuild core ' A' A ' 63' ' ' SER . . . . . . . . . . . . . 21.9 p . . . . . 0 N--CA 1.451 -0.392 0 N-CA-C 110.077 -0.342 . . . . 0.0 110.077 . . . . . . . . . 0 0 . 1 . 017 nuclear nobuild core ' A' A ' 64' ' ' PHE . . . . . 0.408 ' HB3' ' O ' ' A' ' 99' ' ' LEU . 83.0 t80 -61.84 -42.44 99.04 Favored 'General case' 0 C--N 1.326 -0.445 0 CA-C-N 116.448 -0.342 . . . . 0.0 110.746 -177.055 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 65' ' ' GLY . . . . . . . . . . . . . . . -63.46 -30.64 78.21 Favored Glycine 0 C--N 1.329 0.188 0 C-N-CA 120.898 -0.668 . . . . 0.0 113.019 -178.534 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 66' ' ' ASP . . . . . . . . . . . . . 23.7 t70 -71.31 -45.18 63.64 Favored 'General case' 0 C--N 1.326 -0.434 0 CA-C-O 121.067 0.46 . . . . 0.0 110.574 -179.525 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 67' ' ' TRP . . . . . 0.44 ' HA ' ' HE2' ' A' ' 70' ' ' LYS . 83.2 m95 -74.79 -28.89 60.92 Favored 'General case' 0 C--N 1.325 -0.493 0 CA-C-N 116.285 -0.416 . . . . 0.0 110.942 178.559 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 68' ' ' ALA . . . . . . . . . . . . . . . -64.28 -37.15 86.48 Favored 'General case' 0 C--N 1.331 -0.219 0 CA-C-O 121.008 0.432 . . . . 0.0 110.142 173.971 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 69' ' ' GLU . . . . . . . . . . . . . 43.4 tt0 -59.08 -48.64 80.85 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 115.661 -0.699 . . . . 0.0 109.964 175.661 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 70' ' ' LYS . . . . . 0.44 ' HE2' ' HA ' ' A' ' 67' ' ' TRP . 19.2 mtmm -62.45 -31.63 72.38 Favored 'General case' 0 C--N 1.328 -0.326 0 CA-C-N 115.665 -0.698 . . . . 0.0 111.427 177.428 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 71' ' ' PHE . . . . . 0.417 ' CE2' HG23 ' A' ' 132' ' ' THR . 92.1 t80 -68.14 -45.13 74.44 Favored 'General case' 0 C--O 1.235 0.298 0 CA-C-O 120.578 0.228 . . . . 0.0 111.072 178.78 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 72' ' ' LEU . . . . . . . . . . . . . 8.0 mp -60.07 -42.5 94.69 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-O 121.09 0.471 . . . . 0.0 110.637 177.668 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 73' ' ' LYS . . . . . . . . . . . . . 58.2 mtpt -72.6 -24.6 61.1 Favored 'General case' 0 C--N 1.325 -0.457 0 CA-C-N 115.874 -0.603 . . . . 0.0 110.707 179.207 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 74' ' ' SER . . . . . . . . . . . . . 26.7 t -68.44 -51.32 44.97 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 115.89 -0.596 . . . . 0.0 110.277 177.634 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 75' ' ' LYS . . . . . 0.423 ' O ' HG22 ' A' ' 80' ' ' VAL . 5.2 mptp? -68.42 -27.93 66.62 Favored 'General case' 0 C--O 1.234 0.241 0 CA-C-O 120.865 0.364 . . . . 0.0 110.719 178.741 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 76' ' ' GLU . . . . . . . . . . . . . 36.0 tt0 -56.48 -47.84 78.39 Favored 'General case' 0 C--N 1.324 -0.534 0 CA-C-N 115.803 -0.635 . . . . 0.0 109.772 172.07 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 77' ' ' ALA . . . . . . . . . . . . . . . -75.06 -23.72 58.1 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 115.645 -0.707 . . . . 0.0 111.164 177.904 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 78' ' ' ASP . . . . . . . . . . . . . 20.2 t70 -63.58 -31.61 72.83 Favored 'General case' 0 N--CA 1.464 0.237 0 CA-C-O 121.194 0.521 . . . . 0.0 110.581 178.318 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 79' ' ' GLY . . . . . . . . . . . . . . . 105.14 21.06 9.17 Favored Glycine 0 N--CA 1.446 -0.656 0 C-N-CA 120.636 -0.792 . . . . 0.0 112.795 176.229 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 80' ' ' VAL . . . . . 0.423 HG22 ' O ' ' A' ' 75' ' ' LYS . 25.7 m -71.02 153.5 8.3 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.451 0 CA-C-O 120.838 0.352 . . . . 0.0 110.29 178.986 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 81' ' ' SER . . . . . . . . . . . . . 10.7 p -68.77 160.58 30.16 Favored 'General case' 0 C--N 1.323 -0.573 0 CA-C-N 116.131 -0.486 . . . . 0.0 110.67 179.476 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 82' ' ' VAL . . . . . . . . . . . . . 13.3 p -61.51 -34.35 61.13 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.393 0 CA-C-O 120.735 0.302 . . . . 0.0 110.514 179.6 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 83' ' ' SER . . . . . . . . . . . . . 4.0 p -66.79 -42.29 86.23 Favored 'General case' 0 C--O 1.236 0.387 0 CA-C-O 121.087 0.47 . . . . 0.0 110.282 177.497 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 84' ' ' GLN . . . . . . . . . . . . . 6.3 tp-100 -64.65 -43.87 92.25 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 115.809 -0.632 . . . . 0.0 110.019 176.936 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 85' ' ' LEU . . . . . 0.491 ' O ' ' HG3' ' A' ' 89' ' ' LYS . 52.7 tp -62.68 -45.15 94.12 Favored 'General case' 0 C--N 1.326 -0.431 0 CA-C-N 115.921 -0.581 . . . . 0.0 110.496 178.4 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 86' ' ' ASN . . . . . . . . . . . . . 78.1 m-20 -57.15 -35.49 69.59 Favored 'General case' 0 N--CA 1.464 0.233 0 CA-C-N 116.459 -0.337 . . . . 0.0 110.808 177.325 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 87' ' ' SER . . . . . . . . . . . . . 48.2 m -60.54 -45.36 94.17 Favored 'General case' 0 C--N 1.327 -0.393 0 CA-C-N 116.318 -0.401 . . . . 0.0 110.29 177.827 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 88' ' ' TYR . . . . . . . . . . . . . 54.1 m-85 -66.24 -38.85 88.86 Favored 'General case' 0 C--N 1.331 -0.229 0 CA-C-O 120.926 0.393 . . . . 0.0 110.842 179.126 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 89' ' ' LYS . . . . . 0.491 ' HG3' ' O ' ' A' ' 85' ' ' LEU . 51.7 mtpt -64.29 -40.96 97.02 Favored 'General case' 0 C--N 1.324 -0.504 0 CA-C-N 116.15 -0.477 . . . . 0.0 110.223 178.106 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 90' ' ' ASN . . . . . 0.493 ' O ' ' HB2' ' A' ' 94' ' ' ASN . 0.9 OUTLIER -66.2 -28.89 69.1 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.073 -0.512 . . . . 0.0 110.897 177.617 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild core ' A' A ' 91' ' ' TYR . . . . . . . . . . . . . 19.7 m-85 -71.88 -50.21 31.31 Favored 'General case' 0 C--N 1.323 -0.574 0 N-CA-C 109.905 -0.405 . . . . 0.0 109.905 174.381 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 92' ' ' CYS . . . . . 0.527 ' HA ' ' HB2' ' A' ' 96' ' ' LEU . 40.5 t -67.25 -54.62 19.29 Favored 'General case' 0 C--N 1.325 -0.458 0 CA-C-N 116.093 -0.503 . . . . 0.0 112.324 -176.601 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 93' ' ' ARG . . . . . 0.527 ' O ' ' HB3' ' A' ' 97' ' ' SER . 7.8 mpt_? -71.33 -36.82 71.7 Favored 'General case' 0 C--N 1.328 -0.361 0 N-CA-C 112.542 0.571 . . . . 0.0 112.542 -172.539 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 94' ' ' ASN . . . . . 0.493 ' HB2' ' O ' ' A' ' 90' ' ' ASN . 3.4 m-20 -93.72 -55.94 3.07 Favored 'General case' 0 C--N 1.324 -0.525 0 CA-C-O 120.871 0.367 . . . . 0.0 111.73 -175.412 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 95' ' ' HIS . . . . . . . . . . . . . 79.6 m80 -84.92 -47.18 10.55 Favored 'General case' 0 C--N 1.323 -0.549 0 CA-C-N 116.212 -0.449 . . . . 0.0 111.515 -170.346 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 96' ' ' LEU . . . . . 0.527 ' HB2' ' HA ' ' A' ' 92' ' ' CYS . 88.6 mt -88.62 19.51 3.91 Favored 'General case' 0 C--N 1.324 -0.536 0 CA-C-N 116.388 -0.369 . . . . 0.0 111.035 -178.237 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 97' ' ' SER . . . . . 0.558 ' OG ' ' HD3' ' A' ' 98' ' ' PRO . 12.4 p -60.76 -42.09 85.79 Favored Pre-proline 0 CA--C 1.542 0.664 0 N-CA-C 113.102 0.778 . . . . 0.0 113.102 -177.986 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 98' ' ' PRO . . . . . 0.558 ' HD3' ' OG ' ' A' ' 97' ' ' SER . 17.3 Cg_exo -65.81 -33.57 43.07 Favored 'Trans proline' 0 C--N 1.359 1.079 0 C-N-CA 121.424 1.416 . . . . 0.0 111.737 178.396 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 99' ' ' LEU . . . . . 0.408 ' O ' ' HB3' ' A' ' 64' ' ' PHE . 68.0 mt -79.72 -29.11 40.55 Favored 'General case' 0 C--N 1.327 -0.382 0 CA-C-N 115.742 -0.663 . . . . 0.0 110.679 -177.221 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 100' ' ' TYR . . . . . . . . . . . . . 46.9 t80 -52.79 -40.31 63.09 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 115.775 -0.648 . . . . 0.0 110.916 179.794 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 101' ' ' MET . . . . . . . . . . . . . 21.0 ptp -95.81 14.16 24.23 Favored 'General case' 0 C--N 1.323 -0.567 0 CA-C-N 115.931 -0.577 . . . . 0.0 111.423 -176.51 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 102' ' ' LYS . . . . . 0.505 ' HG3' ' O ' ' A' ' 98' ' ' PRO . 96.7 mttt -104.33 152.88 21.72 Favored 'General case' 0 C--N 1.324 -0.536 0 CA-C-O 121.054 0.454 . . . . 0.0 111.016 178.442 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 103' ' ' SER . . . . . 0.435 ' O ' ' HG2' ' A' ' 106' ' ' GLU . 37.9 t -70.74 146.37 49.88 Favored 'General case' 0 C--N 1.322 -0.615 0 CA-C-N 115.57 -0.741 . . . . 0.0 109.576 176.416 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 104' ' ' LEU . . . . . . . . . . . . . 30.6 tp -60.47 -31.87 70.87 Favored 'General case' 0 C--N 1.323 -0.574 0 CA-C-N 116.21 -0.45 . . . . 0.0 111.038 -176.56 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 105' ' ' SER . . . . . . . . . . . . . 56.3 p -87.89 -17.35 31.59 Favored 'General case' 0 C--N 1.329 -0.319 0 N-CA-C 112.29 0.478 . . . . 0.0 112.29 -176.019 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 106' ' ' GLU . . . . . 0.435 ' HG2' ' O ' ' A' ' 103' ' ' SER . 8.4 pt-20 -89.03 -18.53 27.14 Favored 'General case' 0 N--CA 1.464 0.234 0 C-N-CA 120.755 -0.378 . . . . 0.0 111.289 -174.263 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 107' ' ' ILE . . . . . 0.434 HG13 ' O ' ' A' ' 103' ' ' SER . 66.3 mt -73.0 111.08 6.87 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.467 0 CA-C-O 120.993 0.425 . . . . 0.0 110.961 -176.412 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 108' ' ' LEU . . . . . 0.44 ' HA ' ' HD3' ' A' ' 109' ' ' PRO . 1.7 pp -97.46 145.4 29.61 Favored Pre-proline 0 C--N 1.323 -0.58 0 CA-C-N 115.83 -0.623 . . . . 0.0 110.102 176.951 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 109' ' ' PRO . . . . . 0.442 ' HG3' ' HA ' ' A' ' 150' ' ' PRO . 52.4 Cg_exo -54.96 -33.19 81.83 Favored 'Trans proline' 0 C--N 1.343 0.283 0 C-N-CA 123.438 2.759 . . . . 0.0 113.74 -174.516 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 110' ' ' ALA . . . . . . . . . . . . . . . -59.62 -32.32 70.31 Favored 'General case' 0 C--N 1.331 -0.209 0 CA-C-O 120.697 0.284 . . . . 0.0 111.43 -178.98 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 111' ' ' ASP . . . . . 0.437 ' H ' HD12 ' A' ' 108' ' ' LEU . 38.7 t70 -73.41 -46.82 46.47 Favored 'General case' 0 C--N 1.325 -0.473 0 CA-C-O 121.05 0.453 . . . . 0.0 110.374 -177.159 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 112' ' ' ILE . . . . . . . . . . . . . 27.9 mt -62.01 -39.93 85.49 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.399 0 CA-C-N 115.686 -0.688 . . . . 0.0 110.223 177.992 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 113' ' ' GLN . . . . . 0.42 ' O ' ' HB ' ' A' ' 116' ' ' ILE . 14.6 tm0? -65.54 -35.12 79.92 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 115.889 -0.596 . . . . 0.0 109.857 179.175 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 114' ' ' SER . . . . . 0.471 ' O ' ' HG2' ' A' ' 118' ' ' GLU . 57.5 m -64.74 -38.95 92.74 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.434 -0.348 . . . . 0.0 110.453 177.225 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 115' ' ' ILE . . . . . . . . . . . . . 67.7 mt -62.42 -36.55 75.38 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.337 0 CA-C-O 121.175 0.512 . . . . 0.0 109.951 176.235 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 116' ' ' ILE . . . . . 0.42 ' HB ' ' O ' ' A' ' 113' ' ' GLN . 42.1 mm -61.69 -42.09 92.96 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.338 0 CA-C-N 115.675 -0.693 . . . . 0.0 110.339 175.21 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 117' ' ' ASN . . . . . . . . . . . . . 83.9 m-20 -66.47 -32.02 73.13 Favored 'General case' 0 N--CA 1.466 0.368 0 CA-C-N 116.121 -0.491 . . . . 0.0 110.908 178.627 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 118' ' ' GLU . . . . . 0.471 ' HG2' ' O ' ' A' ' 114' ' ' SER . 65.9 mm-40 -80.63 -17.84 49.98 Favored 'General case' 0 C--N 1.327 -0.383 0 CA-C-N 116.146 -0.479 . . . . 0.0 111.011 -178.306 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 119' ' ' THR . . . . . . . . . . . . . 36.4 m -87.97 113.71 23.88 Favored 'General case' 0 C--N 1.321 -0.638 0 CA-C-N 116.13 -0.486 . . . . 0.0 109.871 178.69 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 120' ' ' LYS . . . . . . . . . . . . . 59.5 pttt -90.53 29.19 1.33 Allowed 'General case' 0 C--N 1.326 -0.424 0 CA-C-N 116.005 -0.543 . . . . 0.0 111.322 -175.294 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 121' ' ' LEU . . . . . 0.541 HD13 HG21 ' A' ' 125' ' ' THR . 95.9 mt -91.92 162.27 14.48 Favored 'General case' 0 C--N 1.32 -0.707 0 CA-C-N 116.167 -0.47 . . . . 0.0 109.999 179.348 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 122' ' ' ALA . . . . . . . . . . . . . . . -64.81 163.22 14.61 Favored 'General case' 0 C--N 1.326 -0.431 0 CA-C-O 120.979 0.419 . . . . 0.0 111.714 -176.967 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 123' ' ' LYS . . . . . 0.501 ' O ' ' HG3' ' A' ' 127' ' ' LYS . 19.7 pttp -55.05 -35.65 64.72 Favored 'General case' 0 C--N 1.331 -0.197 0 CA-C-N 115.624 -0.717 . . . . 0.0 111.897 -177.804 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 124' ' ' ASN . . . . . . . . . . . . . 48.5 t-20 -56.99 -52.14 66.46 Favored 'General case' 0 C--O 1.234 0.249 0 CA-C-O 121.156 0.503 . . . . 0.0 110.16 178.975 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 125' ' ' THR . . . . . 0.541 HG21 HD13 ' A' ' 121' ' ' LEU . 1.3 m -66.77 -37.2 84.12 Favored 'General case' 0 N--CA 1.449 -0.493 0 CA-C-N 115.801 -0.636 . . . . 0.0 110.809 -178.814 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 126' ' ' LEU . . . . . . . . . . . . . 90.9 mt -61.22 -43.52 98.75 Favored 'General case' 0 C--O 1.234 0.28 0 CA-C-N 116.274 -0.421 . . . . 0.0 110.873 178.52 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 127' ' ' LYS . . . . . 0.532 ' HG2' HG21 ' A' ' 156' ' ' ILE . 47.6 mtpt -64.15 -41.53 97.14 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.307 -0.406 . . . . 0.0 110.455 178.21 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 128' ' ' ALA . . . . . . . . . . . . . . . -60.36 -44.09 95.9 Favored 'General case' 0 C--O 1.234 0.246 0 CA-C-N 116.168 -0.469 . . . . 0.0 111.173 179.855 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 129' ' ' ILE . . . . . 0.463 HG13 ' O ' ' A' ' 125' ' ' THR . 77.6 mt -62.54 -45.79 97.96 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.291 0 CA-C-N 116.249 -0.432 . . . . 0.0 110.27 177.728 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 130' ' ' ARG . . . . . 0.543 ' CZ ' ' HA ' ' A' ' 152' ' ' ASP . 0.3 OUTLIER -65.21 -40.59 94.35 Favored 'General case' 0 C--N 1.331 -0.206 0 CA-C-N 116.056 -0.52 . . . . 0.0 110.485 -179.139 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild core ' A' A ' 131' ' ' ASN . . . . . 0.602 ' O ' ' HG2' ' A' ' 135' ' ' GLN . 9.2 m120 -59.67 -52.31 66.08 Favored 'General case' 0 CA--C 1.518 -0.26 0 CA-C-N 116.291 -0.413 . . . . 0.0 110.298 177.25 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 132' ' ' THR . . . . . 0.49 ' O ' HG13 ' A' ' 136' ' ' ILE . 55.1 m -51.7 -49.41 62.49 Favored 'General case' 0 C--N 1.329 -0.316 0 O-C-N 123.678 0.611 . . . . 0.0 110.785 178.74 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 133' ' ' ALA . . . . . . . . . . . . . . . -63.81 -44.15 94.12 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.19 -0.459 . . . . 0.0 111.508 -179.744 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 134' ' ' SER . . . . . . . . . . . . . 34.6 p -66.71 -29.51 69.52 Favored 'General case' 0 C--N 1.33 -0.254 0 C-N-CA 121.168 -0.213 . . . . 0.0 111.463 -177.141 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 135' ' ' GLN . . . . . 0.602 ' HG2' ' O ' ' A' ' 131' ' ' ASN . 11.1 mm100 -73.03 -32.68 65.25 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-O 120.784 0.326 . . . . 0.0 110.237 178.094 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 136' ' ' ILE . . . . . 0.49 HG13 ' O ' ' A' ' 132' ' ' THR . 75.2 mt -64.33 -48.06 86.97 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.21 0 CA-C-N 116.159 -0.473 . . . . 0.0 110.058 176.265 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 137' ' ' PHE . . . . . 0.513 ' O ' HG13 ' A' ' 141' ' ' ILE . 62.5 m-85 -62.38 -40.73 97.4 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.147 -0.479 . . . . 0.0 110.532 176.241 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 138' ' ' ARG . . . . . 0.419 HH11 ' HD2' ' A' ' 138' ' ' ARG . 9.7 mtp180 -57.02 -43.1 81.53 Favored 'General case' 0 CA--C 1.519 -0.247 0 CA-C-N 116.331 -0.395 . . . . 0.0 111.109 176.56 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 139' ' ' LEU . . . . . . . . . . . . . 41.2 tp -60.63 -35.76 76.97 Favored 'General case' 0 C--N 1.326 -0.451 0 CA-C-N 116.004 -0.544 . . . . 0.0 110.34 178.938 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 140' ' ' ALA . . . . . . . . . . . . . . . -72.74 -38.76 67.3 Favored 'General case' 0 C--N 1.324 -0.535 0 CA-C-N 116.12 -0.491 . . . . 0.0 110.652 176.555 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 141' ' ' ILE . . . . . 0.637 ' HA ' ' O ' ' A' ' 146' ' ' ILE . 76.1 mt -64.49 -47.37 89.55 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.272 0 CA-C-N 116.535 -0.302 . . . . 0.0 111.502 179.282 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 142' ' ' GLU . . . . . . . . . . . . . 13.0 pt-20 -67.15 -24.6 65.91 Favored 'General case' 0 C--N 1.33 -0.242 0 CA-C-O 120.787 0.327 . . . . 0.0 111.493 -176.796 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 143' ' ' ASN . . . . . . . . . . . . . 37.8 m-80 -99.11 9.45 43.47 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-O 120.823 0.344 . . . . 0.0 110.408 177.791 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 144' ' ' ARG . . . . . . . . . . . . . 25.9 mtm180 59.47 50.93 6.99 Favored 'General case' 0 N--CA 1.463 0.196 0 CA-C-N 115.53 -0.759 . . . . 0.0 112.707 174.827 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 145' ' ' ALA . . . . . . . . . . . . . . . -101.99 -35.36 8.99 Favored 'General case' 0 C--N 1.323 -0.549 0 CA-C-O 121.446 0.641 . . . . 0.0 109.624 170.384 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 146' ' ' ILE . . . . . 0.637 ' O ' ' HA ' ' A' ' 141' ' ' ILE . 13.5 tt -144.32 158.34 15.25 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.458 0 N-CA-C 108.663 -0.865 . . . . 0.0 108.663 176.322 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 147' ' ' ASP . . . . . . . . . . . . . 7.8 p-10 -121.57 16.72 11.22 Favored 'General case' 0 C--N 1.324 -0.536 0 CA-C-O 121.002 0.429 . . . . 0.0 110.766 -177.992 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 148' ' ' PHE . . . . . 0.465 ' H ' HG12 ' A' ' 146' ' ' ILE . 67.6 t80 -135.55 137.6 42.18 Favored 'General case' 0 C--N 1.324 -0.531 0 CA-C-N 116.012 -0.54 . . . . 0.0 109.757 -176.609 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 149' ' ' ASN . . . . . . . . . . . . . 43.0 t-20 -115.47 89.69 22.92 Favored Pre-proline 0 C--N 1.324 -0.538 0 CA-C-N 116.558 -0.292 . . . . 0.0 110.557 -179.311 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 150' ' ' PRO . . . . . 0.442 ' HA ' ' HG3' ' A' ' 109' ' ' PRO . 28.1 Cg_exo -61.71 -32.12 86.48 Favored 'Trans proline' 0 C--N 1.345 0.382 0 C-N-CA 122.78 2.32 . . . . 0.0 111.861 -179.208 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 151' ' ' ALA . . . . . . . . . . . . . . . -67.53 -30.57 70.27 Favored 'General case' 0 C--N 1.326 -0.445 0 CA-C-N 115.768 -0.651 . . . . 0.0 110.969 -177.932 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 152' ' ' ASP . . . . . 0.543 ' HA ' ' CZ ' ' A' ' 130' ' ' ARG . 33.6 t70 -77.03 -22.3 53.24 Favored 'General case' 0 C--N 1.326 -0.447 0 CA-C-O 121.419 0.628 . . . . 0.0 110.159 179.912 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 153' ' ' TYR . . . . . . . . . . . . . 29.6 t80 -85.14 -1.47 56.92 Favored 'General case' 0 C--N 1.324 -0.519 0 CA-C-N 115.562 -0.744 . . . . 0.0 109.786 178.997 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 154' ' ' VAL . . . . . . . . . . . . . 86.8 t -70.82 118.61 15.7 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.316 0 CA-C-N 115.959 -0.564 . . . . 0.0 109.499 173.412 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 155' ' ' ARG . . . . . . . . . . . . . 28.5 ttt85 -84.68 111.57 19.69 Favored 'General case' 0 C--N 1.319 -0.724 0 CA-C-N 116.115 -0.493 . . . . 0.0 110.355 -176.98 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 156' ' ' ILE . . . . . 0.532 HG21 ' HG2' ' A' ' 127' ' ' LYS . 47.6 mm -89.53 120.64 69.6 Favored Pre-proline 0 C--N 1.324 -0.505 0 CA-C-N 115.604 -0.726 . . . . 0.0 110.109 -178.727 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 157' ' ' PRO . . . . . 0.434 ' HD3' ' HA ' ' A' ' 156' ' ' ILE . 6.5 Cg_exo . . . . . 0 N--CA 1.453 -0.861 0 C-N-CA 122.298 1.999 . . . . 0.0 111.123 177.376 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 63' ' ' SER . . . . . 0.56 ' HA ' ' HA ' ' A' ' 103' ' ' SER . 7.6 m . . . . . 0 N--CA 1.454 -0.252 0 N-CA-C 109.844 -0.428 . . . . 0.0 109.844 . . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 64' ' ' PHE . . . . . 0.539 ' HB2' HD11 ' A' ' 107' ' ' ILE . 84.1 t80 -64.42 -42.52 95.99 Favored 'General case' 0 C--N 1.326 -0.455 0 N-CA-C 109.834 -0.432 . . . . 0.0 109.834 178.639 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 65' ' ' GLY . . . . . . . . . . . . . . . -62.8 -29.43 73.97 Favored Glycine 0 N--CA 1.45 -0.424 0 C-N-CA 120.784 -0.722 . . . . 0.0 112.083 176.137 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 66' ' ' ASP . . . . . . . . . . . . . 20.1 t70 -68.04 -48.13 66.5 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-O 120.837 0.351 . . . . 0.0 110.083 177.386 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 67' ' ' TRP . . . . . . . . . . . . . 52.8 m95 -70.99 -30.49 66.76 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 115.94 -0.573 . . . . 0.0 111.573 178.497 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 68' ' ' ALA . . . . . 0.511 ' O ' ' HG ' ' A' ' 72' ' ' LEU . . . -60.01 -49.34 78.04 Favored 'General case' 0 C--N 1.328 -0.359 0 N-CA-C 109.812 -0.44 . . . . 0.0 109.812 173.813 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 69' ' ' GLU . . . . . . . . . . . . . 5.6 mm-40 -58.19 -41.72 84.54 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 115.976 -0.556 . . . . 0.0 110.843 175.918 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 70' ' ' LYS . . . . . . . . . . . . . 61.6 tttm -62.45 -47.93 81.89 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.3 -0.409 . . . . 0.0 110.219 179.299 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 71' ' ' PHE . . . . . . . . . . . . . 33.7 t80 -59.56 -49.61 77.12 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 115.96 -0.564 . . . . 0.0 110.742 176.955 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 72' ' ' LEU . . . . . 0.511 ' HG ' ' O ' ' A' ' 68' ' ' ALA . 91.6 mt -61.01 -35.74 77.67 Favored 'General case' 0 C--N 1.327 -0.401 0 CA-C-N 116.281 -0.418 . . . . 0.0 111.154 -178.918 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 73' ' ' LYS . . . . . 0.401 ' HD3' ' HA ' ' A' ' 73' ' ' LYS . 61.8 mmtt -72.45 -41.64 65.89 Favored 'General case' 0 C--N 1.327 -0.376 0 C-N-CA 121.234 -0.186 . . . . 0.0 111.379 178.52 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 74' ' ' SER . . . . . . . . . . . . . 12.3 p -68.17 -29.43 68.31 Favored 'General case' 0 C--N 1.327 -0.396 0 CA-C-O 120.956 0.408 . . . . 0.0 110.399 177.139 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 75' ' ' LYS . . . . . . . . . . . . . 45.5 tptt -78.22 -31.43 49.36 Favored 'General case' 0 N--CA 1.446 -0.666 0 CA-C-O 121.085 0.469 . . . . 0.0 110.028 177.154 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 76' ' ' GLU . . . . . . . . . . . . . 37.1 tt0 -63.78 -40.34 96.44 Favored 'General case' 0 C--N 1.326 -0.431 0 CA-C-N 115.768 -0.651 . . . . 0.0 109.863 175.485 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 77' ' ' ALA . . . . . . . . . . . . . . . -80.02 -18.02 51.28 Favored 'General case' 0 C--N 1.327 -0.412 0 CA-C-N 115.891 -0.595 . . . . 0.0 111.123 176.318 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 78' ' ' ASP . . . . . . . . . . . . . 28.5 t70 -68.45 -21.41 64.65 Favored 'General case' 0 N--CA 1.465 0.3 0 CA-C-N 115.913 -0.585 . . . . 0.0 110.538 178.771 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 79' ' ' GLY . . . . . . . . . . . . . . . 102.51 71.26 0.89 Allowed Glycine 0 N--CA 1.447 -0.622 0 C-N-CA 120.734 -0.746 . . . . 0.0 112.276 177.387 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 80' ' ' VAL . . . . . . . . . . . . . 28.0 m -123.87 148.62 27.93 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.5 0 CA-C-O 121.083 0.468 . . . . 0.0 110.763 179.765 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 81' ' ' SER . . . . . . . . . . . . . 14.6 m -75.9 162.46 28.1 Favored 'General case' 0 C--N 1.322 -0.618 0 CA-C-N 115.649 -0.705 . . . . 0.0 109.941 177.093 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 82' ' ' VAL . . . . . . . . . . . . . 57.0 t -58.12 -45.23 88.58 Favored 'Isoleucine or valine' 0 C--O 1.222 -0.375 0 CA-C-N 116.414 -0.357 . . . . 0.0 111.195 -176.566 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 83' ' ' SER . . . . . . . . . . . . . 17.2 t -65.46 -32.65 74.37 Favored 'General case' 0 C--N 1.326 -0.419 0 CA-C-O 120.874 0.368 . . . . 0.0 111.272 -177.955 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 84' ' ' GLN . . . . . . . . . . . . . 8.7 tp-100 -69.85 -42.61 73.33 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-O 121.074 0.464 . . . . 0.0 110.314 179.258 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 85' ' ' LEU . . . . . . . . . . . . . 25.5 tp -75.07 -26.73 59.57 Favored 'General case' 0 C--N 1.321 -0.641 0 CA-C-O 121.282 0.563 . . . . 0.0 109.924 178.556 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 86' ' ' ASN . . . . . . . . . . . . . 26.5 t-20 -64.54 -47.7 77.81 Favored 'General case' 0 C--N 1.325 -0.464 0 CA-C-N 115.314 -0.857 . . . . 0.0 110.454 176.498 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 87' ' ' SER . . . . . . . . . . . . . 11.3 p -65.14 -35.89 82.55 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.295 -0.411 . . . . 0.0 110.623 179.75 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 88' ' ' TYR . . . . . . . . . . . . . 11.5 m-85 -57.99 -43.77 86.78 Favored 'General case' 0 C--O 1.234 0.28 0 CA-C-O 120.858 0.361 . . . . 0.0 110.393 174.265 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 89' ' ' LYS . . . . . . . . . . . . . 63.9 mttp -62.69 -38.57 90.92 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 116.044 -0.525 . . . . 0.0 110.605 176.617 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 90' ' ' ASN . . . . . 0.415 ' O ' ' HB3' ' A' ' 94' ' ' ASN . 95.4 m-20 -62.64 -42.94 99.88 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.201 -0.454 . . . . 0.0 111.242 -178.9 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 91' ' ' TYR . . . . . . . . . . . . . 43.3 m-85 -59.25 -45.67 90.56 Favored 'General case' 0 C--O 1.235 0.334 0 CA-C-O 121.09 0.471 . . . . 0.0 110.14 177.217 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 92' ' ' CYS . . . . . 0.613 ' HA ' ' HB2' ' A' ' 96' ' ' LEU . 57.9 m -71.45 -43.52 66.53 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 115.626 -0.715 . . . . 0.0 112.014 -175.552 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 93' ' ' ARG . . . . . . . . . . . . . 18.8 mtp180 -84.58 -7.77 59.14 Favored 'General case' 0 C--N 1.325 -0.457 0 N-CA-C 112.454 0.538 . . . . 0.0 112.454 -173.576 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 94' ' ' ASN . . . . . 0.415 ' HB3' ' O ' ' A' ' 90' ' ' ASN . 12.3 t-20 -111.1 -61.26 1.72 Allowed 'General case' 0 C--N 1.328 -0.355 0 CA-C-O 120.769 0.319 . . . . 0.0 111.859 179.006 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 95' ' ' HIS . . . . . . . . . . . . . 0.2 OUTLIER -87.67 -34.57 18.39 Favored 'General case' 0 C--N 1.324 -0.531 0 N-CA-C 112.363 0.505 . . . . 0.0 112.363 -175.473 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 96' ' ' LEU . . . . . 0.613 ' HB2' ' HA ' ' A' ' 92' ' ' CYS . 85.4 mt -91.65 12.45 21.05 Favored 'General case' 0 C--N 1.324 -0.507 0 C-N-CA 121.215 -0.194 . . . . 0.0 111.212 -176.809 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 97' ' ' SER . . . . . 0.511 ' N ' ' HD2' ' A' ' 98' ' ' PRO . 18.6 m -50.85 -50.2 75.46 Favored Pre-proline 0 CA--C 1.539 0.541 0 N-CA-C 112.284 0.476 . . . . 0.0 112.284 179.483 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 98' ' ' PRO . . . . . 0.511 ' HD2' ' N ' ' A' ' 97' ' ' SER . 13.8 Cg_endo -58.09 -41.33 68.85 Favored 'Trans proline' 0 C--N 1.358 1.034 0 C-N-CA 121.962 1.775 . . . . 0.0 112.585 177.622 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 99' ' ' LEU . . . . . 0.406 ' O ' ' HB3' ' A' ' 64' ' ' PHE . 11.2 mp -79.8 -29.74 40.37 Favored 'General case' 0 C--N 1.326 -0.416 0 CA-C-N 116.459 -0.337 . . . . 0.0 111.801 -174.972 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 100' ' ' TYR . . . . . . . . . . . . . 46.3 t80 -52.74 -40.73 63.35 Favored 'General case' 0 C--N 1.328 -0.349 0 C-N-CA 122.795 0.438 . . . . 0.0 111.434 -176.738 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 101' ' ' MET . . . . . . . . . . . . . 64.5 mtt -89.94 -0.53 57.62 Favored 'General case' 0 C--N 1.325 -0.469 0 CA-C-N 116.258 -0.428 . . . . 0.0 111.69 -176.755 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 102' ' ' LYS . . . . . 0.458 ' HG3' ' O ' ' A' ' 98' ' ' PRO . 97.3 mttt -91.13 161.89 14.9 Favored 'General case' 0 C--N 1.326 -0.444 0 CA-C-O 121.047 0.451 . . . . 0.0 110.438 179.493 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 103' ' ' SER . . . . . 0.56 ' HA ' ' HA ' ' A' ' 63' ' ' SER . 29.0 t -82.12 154.87 25.33 Favored 'General case' 0 N--CA 1.447 -0.598 0 N-CA-C 108.881 -0.785 . . . . 0.0 108.881 172.423 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 104' ' ' LEU . . . . . . . . . . . . . 23.6 tp -61.62 -25.35 67.3 Favored 'General case' 0 C--N 1.321 -0.671 0 CA-C-O 121.092 0.473 . . . . 0.0 110.4 -179.041 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 105' ' ' SER . . . . . . . . . . . . . 35.5 t -86.27 -14.4 43.87 Favored 'General case' 0 C--N 1.327 -0.377 0 CA-C-N 116.003 -0.544 . . . . 0.0 111.375 178.855 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 106' ' ' GLU . . . . . 0.525 ' HG3' ' HB3' ' A' ' 103' ' ' SER . 49.4 mt-10 -93.03 4.72 53.52 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-O 120.861 0.362 . . . . 0.0 111.113 -177.258 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 107' ' ' ILE . . . . . 0.55 HG21 ' HZ ' ' A' ' 137' ' ' PHE . 74.7 mt -95.81 118.13 41.42 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.756 0 CA-C-O 121.23 0.538 . . . . 0.0 111.035 -177.456 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 108' ' ' LEU . . . . . . . . . . . . . 7.6 mp -97.05 138.88 21.27 Favored Pre-proline 0 C--N 1.323 -0.582 0 CA-C-N 115.364 -0.835 . . . . 0.0 110.038 -179.992 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 109' ' ' PRO . . . . . . . . . . . . . 11.2 Cg_endo -56.7 -35.74 97.82 Favored 'Trans proline' 0 C--O 1.234 0.322 0 C-N-CA 122.63 2.22 . . . . 0.0 112.268 177.404 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 110' ' ' ALA . . . . . . . . . . . . . . . -70.61 -29.67 66.13 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.236 -0.438 . . . . 0.0 111.232 179.788 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 111' ' ' ASP . . . . . . . . . . . . . 33.2 t70 -68.27 -41.52 80.92 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-O 121.073 0.463 . . . . 0.0 110.048 179.997 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 112' ' ' ILE . . . . . . . . . . . . . 18.7 mt -67.1 -43.04 88.99 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.355 0 CA-C-N 115.809 -0.632 . . . . 0.0 109.698 176.385 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 113' ' ' GLN . . . . . 0.596 ' HG2' ' HA ' ' A' ' 154' ' ' VAL . 0.0 OUTLIER -55.16 -41.62 72.1 Favored 'General case' 0 C--O 1.233 0.211 0 CA-C-N 115.627 -0.715 . . . . 0.0 111.023 176.568 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild core ' A' A ' 114' ' ' SER . . . . . . . . . . . . . 14.3 t -59.75 -46.54 88.85 Favored 'General case' 0 N--CA 1.453 -0.319 0 CA-C-N 116.101 -0.5 . . . . 0.0 110.387 178.889 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 115' ' ' ILE . . . . . . . . . . . . . 69.3 mt -55.88 -51.93 54.91 Favored 'Isoleucine or valine' 0 C--O 1.233 0.225 0 CA-C-O 120.919 0.39 . . . . 0.0 110.918 -179.485 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 116' ' ' ILE . . . . . . . . . . . . . 49.8 mm -62.08 -39.38 83.6 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.322 0 CA-C-N 115.902 -0.59 . . . . 0.0 111.225 -178.421 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 117' ' ' ASN . . . . . 0.416 HD22 ' C ' ' A' ' 117' ' ' ASN . 0.2 OUTLIER -69.81 -39.27 76.62 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-O 120.929 0.395 . . . . 0.0 110.503 -178.873 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild core ' A' A ' 118' ' ' GLU . . . . . . . . . . . . . 49.5 mt-10 -80.76 -8.7 59.75 Favored 'General case' 0 C--N 1.327 -0.374 0 CA-C-N 116.368 -0.378 . . . . 0.0 111.271 -177.192 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 119' ' ' THR . . . . . . . . . . . . . 89.5 m -89.88 123.47 33.85 Favored 'General case' 0 C--N 1.326 -0.438 0 CA-C-O 120.834 0.349 . . . . 0.0 110.912 176.17 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 120' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -98.9 80.52 2.51 Favored 'General case' 0 C--N 1.326 -0.443 0 CA-C-O 121.041 0.448 . . . . 0.0 110.692 178.358 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 121' ' ' LEU . . . . . . . . . . . . . 65.1 mt -132.54 -175.77 3.87 Favored 'General case' 0 C--N 1.324 -0.543 0 CA-C-N 115.713 -0.676 . . . . 0.0 109.747 178.463 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 122' ' ' ALA . . . . . . . . . . . . . . . -72.6 146.04 46.92 Favored 'General case' 0 C--N 1.325 -0.499 0 CA-C-N 116.434 -0.348 . . . . 0.0 110.33 177.722 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 123' ' ' LYS . . . . . 0.516 ' O ' ' HG3' ' A' ' 127' ' ' LYS . 59.6 pttt -58.54 -29.53 66.41 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-O 120.844 0.354 . . . . 0.0 110.915 -179.71 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 124' ' ' ASN . . . . . . . . . . . . . 14.4 m120 -68.34 -40.47 81.56 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.178 -0.465 . . . . 0.0 110.48 178.642 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 125' ' ' THR . . . . . . . . . . . . . 6.2 m -67.67 -35.76 79.46 Favored 'General case' 0 C--N 1.327 -0.378 0 CA-C-N 116.095 -0.502 . . . . 0.0 110.219 179.273 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 126' ' ' LEU . . . . . . . . . . . . . 90.7 mt -64.72 -37.17 86.7 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 115.885 -0.598 . . . . 0.0 110.493 178.068 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 127' ' ' LYS . . . . . 0.516 ' HG3' ' O ' ' A' ' 123' ' ' LYS . 97.7 mttt -68.58 -28.87 67.33 Favored 'General case' 0 C--N 1.332 -0.192 0 CA-C-N 116.092 -0.503 . . . . 0.0 110.835 178.032 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 128' ' ' ALA . . . . . . . . . . . . . . . -65.79 -43.86 87.45 Favored 'General case' 0 C--N 1.327 -0.378 0 CA-C-O 120.981 0.42 . . . . 0.0 110.492 176.606 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 129' ' ' ILE . . . . . . . . . . . . . 47.9 mt -64.71 -47.08 90.22 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.221 0 CA-C-N 115.909 -0.587 . . . . 0.0 109.773 176.166 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 130' ' ' ARG . . . . . 0.409 HH11 ' HD3' ' A' ' 130' ' ' ARG . 5.5 tpt180 -52.87 -45.05 67.28 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 115.587 -0.733 . . . . 0.0 110.882 174.768 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 131' ' ' ASN . . . . . . . . . . . . . 10.5 t30 -61.97 -55.95 24.15 Favored 'General case' 0 C--N 1.326 -0.445 0 CA-C-N 116.144 -0.48 . . . . 0.0 111.744 -176.872 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 132' ' ' THR . . . . . 0.408 ' O ' HG13 ' A' ' 136' ' ' ILE . 14.9 t -65.59 -33.03 74.96 Favored 'General case' 0 CA--C 1.531 0.222 0 C-N-CA 120.84 -0.344 . . . . 0.0 110.938 -175.371 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 133' ' ' ALA . . . . . . . . . . . . . . . -69.75 -46.39 65.97 Favored 'General case' 0 C--N 1.331 -0.205 0 CA-C-O 120.919 0.39 . . . . 0.0 110.515 178.358 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 134' ' ' SER . . . . . . . . . . . . . 22.9 t -61.0 -37.67 83.32 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 115.893 -0.594 . . . . 0.0 110.27 -179.977 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 135' ' ' GLN . . . . . . . . . . . . . 1.1 mp0 -59.08 -45.34 91.08 Favored 'General case' 0 C--N 1.331 -0.232 0 CA-C-N 116.401 -0.363 . . . . 0.0 111.042 176.489 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 136' ' ' ILE . . . . . 0.408 HG13 ' O ' ' A' ' 132' ' ' THR . 73.1 mt -65.03 -47.79 86.55 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.296 0 CA-C-O 120.904 0.383 . . . . 0.0 110.691 179.017 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 137' ' ' PHE . . . . . 0.55 ' HZ ' HG21 ' A' ' 107' ' ' ILE . 41.8 m-85 -62.28 -47.06 85.98 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 116.195 -0.457 . . . . 0.0 111.696 -179.645 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 138' ' ' ARG . . . . . 0.419 ' O ' ' HG2' ' A' ' 142' ' ' GLU . 11.3 ptm180 -74.05 -21.03 60.1 Favored 'General case' 0 C--N 1.327 -0.385 0 C-N-CA 120.538 -0.465 . . . . 0.0 110.853 -176.39 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 139' ' ' LEU . . . . . . . . . . . . . 62.6 tp -63.59 -41.8 98.32 Favored 'General case' 0 C--O 1.234 0.266 0 N-CA-C 109.232 -0.655 . . . . 0.0 109.232 173.256 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 140' ' ' ALA . . . . . 0.501 ' HB1' ' HB3' ' A' ' 145' ' ' ALA . . . -65.24 -32.57 74.31 Favored 'General case' 0 C--N 1.326 -0.429 0 CA-C-N 115.495 -0.775 . . . . 0.0 110.152 176.211 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 141' ' ' ILE . . . . . . . . . . . . . 60.4 mt -64.94 -44.16 96.15 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.29 0 CA-C-N 116.233 -0.44 . . . . 0.0 110.191 175.653 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 142' ' ' GLU . . . . . 0.419 ' HG2' ' O ' ' A' ' 138' ' ' ARG . 34.3 mm-40 -63.33 -29.31 70.64 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-O 121.088 0.471 . . . . 0.0 110.716 177.71 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 143' ' ' ASN . . . . . 0.469 HD22 ' N ' ' A' ' 143' ' ' ASN . 0.9 OUTLIER -93.23 0.85 57.2 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.064 -0.517 . . . . 0.0 111.003 -179.031 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild core ' A' A ' 144' ' ' ARG . . . . . . . . . . . . . 35.1 mtp85 57.47 36.0 26.5 Favored 'General case' 0 N--CA 1.464 0.26 0 CA-C-N 115.752 -0.658 . . . . 0.0 112.272 -178.933 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 145' ' ' ALA . . . . . 0.501 ' HB3' ' HB1' ' A' ' 140' ' ' ALA . . . -82.29 -33.73 28.97 Favored 'General case' 0 C--N 1.325 -0.5 0 N-CA-C 109.268 -0.641 . . . . 0.0 109.268 173.357 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 146' ' ' ILE . . . . . . . . . . . . . 9.8 tt -159.22 125.63 0.54 Allowed 'Isoleucine or valine' 0 C--N 1.324 -0.526 0 CA-C-N 114.873 -1.058 . . . . 0.0 109.433 178.998 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 147' ' ' ASP . . . . . . . . . . . . . 20.9 t70 -99.1 68.46 1.68 Allowed 'General case' 0 C--N 1.319 -0.738 0 CA-C-O 121.662 0.744 . . . . 0.0 109.624 178.575 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 148' ' ' PHE . . . . . 0.482 ' O ' ' HD3' ' A' ' 150' ' ' PRO . 55.8 t80 -169.38 126.44 0.92 Allowed 'General case' 0 C--N 1.321 -0.667 0 CA-C-N 115.086 -0.961 . . . . 0.0 109.178 -179.158 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 149' ' ' ASN . . . . . . . . . . . . . 48.8 t-20 -108.52 95.96 17.85 Favored Pre-proline 0 C--N 1.323 -0.57 0 N-CA-C 110.076 -0.342 . . . . 0.0 110.076 179.272 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 150' ' ' PRO . . . . . 0.482 ' HD3' ' O ' ' A' ' 148' ' ' PHE . 21.6 Cg_exo -65.34 -26.37 56.04 Favored 'Trans proline' 0 C--N 1.342 0.229 0 C-N-CA 122.756 2.304 . . . . 0.0 112.03 -179.626 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 151' ' ' ALA . . . . . . . . . . . . . . . -72.6 -20.38 61.31 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 115.941 -0.572 . . . . 0.0 110.806 -178.032 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 152' ' ' ASP . . . . . . . . . . . . . 28.3 t70 -70.76 -24.91 62.69 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-O 121.089 0.471 . . . . 0.0 110.149 178.488 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 153' ' ' TYR . . . . . . . . . . . . . 58.8 m-85 -83.86 -1.47 54.5 Favored 'General case' 0 C--N 1.327 -0.374 0 CA-C-N 115.772 -0.649 . . . . 0.0 110.51 179.585 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 154' ' ' VAL . . . . . 0.596 ' HA ' ' HG2' ' A' ' 113' ' ' GLN . 55.9 t -88.74 111.52 22.72 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.504 0 CA-C-N 115.807 -0.633 . . . . 0.0 110.311 179.65 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 155' ' ' ARG . . . . . . . . . . . . . 83.9 mtm180 -83.99 141.24 31.35 Favored 'General case' 0 C--N 1.319 -0.742 0 CA-C-N 115.41 -0.814 . . . . 0.0 109.944 179.807 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 156' ' ' ILE . . . . . 0.4 ' HA ' ' HD3' ' A' ' 157' ' ' PRO . 50.7 mm -96.97 113.67 63.35 Favored Pre-proline 0 C--N 1.319 -0.741 0 N-CA-C 109.408 -0.59 . . . . 0.0 109.408 178.704 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 157' ' ' PRO . . . . . 0.4 ' HD3' ' HA ' ' A' ' 156' ' ' ILE . 28.4 Cg_exo . . . . . 0 N--CA 1.46 -0.444 0 C-N-CA 122.53 2.153 . . . . 0.0 112.196 -177.754 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 63' ' ' SER . . . . . . . . . . . . . 78.6 p . . . . . 0 N--CA 1.453 -0.321 0 N-CA-C 109.274 -0.639 . . . . 0.0 109.274 . . . . . . . . . 0 0 . 1 . 019 nuclear nobuild core ' A' A ' 64' ' ' PHE . . . . . 0.476 ' HB3' ' O ' ' A' ' 99' ' ' LEU . 74.6 t80 -63.45 -35.93 82.05 Favored 'General case' 0 C--N 1.327 -0.378 0 C-N-CA 120.862 -0.335 . . . . 0.0 110.384 -177.409 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 65' ' ' GLY . . . . . . . . . . . . . . . -60.0 -38.33 94.05 Favored Glycine 0 N--CA 1.452 -0.249 0 C-N-CA 120.964 -0.636 . . . . 0.0 112.411 178.072 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 66' ' ' ASP . . . . . . . . . . . . . 16.4 m-20 -65.8 -43.57 88.33 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-O 120.917 0.389 . . . . 0.0 110.417 -179.921 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 67' ' ' TRP . . . . . . . . . . . . . 98.7 m95 -73.02 -34.21 66.21 Favored 'General case' 0 C--N 1.326 -0.43 0 CA-C-N 115.938 -0.573 . . . . 0.0 111.026 179.675 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 68' ' ' ALA . . . . . 0.547 ' O ' ' HG ' ' A' ' 72' ' ' LEU . . . -61.02 -44.22 97.73 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-O 120.903 0.382 . . . . 0.0 110.101 175.564 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 69' ' ' GLU . . . . . . . . . . . . . 31.2 tt0 -59.75 -45.98 90.57 Favored 'General case' 0 C--O 1.232 0.14 0 CA-C-N 115.806 -0.634 . . . . 0.0 110.22 175.127 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 70' ' ' LYS . . . . . . . . . . . . . 51.5 tttp -57.69 -42.95 84.69 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-N 115.541 -0.754 . . . . 0.0 110.442 179.326 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 71' ' ' PHE . . . . . . . . . . . . . 77.9 t80 -62.31 -49.99 73.44 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-N 115.77 -0.65 . . . . 0.0 110.627 176.525 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 72' ' ' LEU . . . . . 0.547 ' HG ' ' O ' ' A' ' 68' ' ' ALA . 93.4 mt -56.57 -41.54 77.08 Favored 'General case' 0 C--N 1.327 -0.379 0 CA-C-N 116.163 -0.472 . . . . 0.0 110.794 -179.915 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 73' ' ' LYS . . . . . 0.438 ' HA ' ' HB3' ' A' ' 76' ' ' GLU . 36.9 tttp -77.49 -28.45 52.21 Favored 'General case' 0 C--N 1.324 -0.514 0 CA-C-N 116.024 -0.535 . . . . 0.0 111.441 -175.963 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 74' ' ' SER . . . . . 0.43 ' O ' ' HB2' ' A' ' 78' ' ' ASP . 95.3 p -65.67 -31.43 72.44 Favored 'General case' 0 C--N 1.33 -0.262 0 C-N-CA 120.493 -0.483 . . . . 0.0 109.988 178.254 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 75' ' ' LYS . . . . . . . . . . . . . 0.8 OUTLIER -79.32 -42.0 26.7 Favored 'General case' 0 C--O 1.234 0.262 0 CA-C-N 116.444 -0.344 . . . . 0.0 110.509 173.606 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 76' ' ' GLU . . . . . 0.438 ' HB3' ' HA ' ' A' ' 73' ' ' LYS . 42.8 tt0 -52.43 -50.16 63.12 Favored 'General case' 0 CA--C 1.532 0.261 0 CA-C-N 116.137 -0.483 . . . . 0.0 110.776 175.307 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 77' ' ' ALA . . . . . . . . . . . . . . . -73.79 -30.13 62.57 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 115.958 -0.565 . . . . 0.0 111.726 -178.94 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 78' ' ' ASP . . . . . 0.43 ' HB2' ' O ' ' A' ' 74' ' ' SER . 16.1 t70 -62.03 -40.53 96.03 Favored 'General case' 0 N--CA 1.464 0.237 0 CA-C-O 120.985 0.421 . . . . 0.0 110.436 179.802 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 79' ' ' GLY . . . . . . . . . . . . . . . 121.01 33.26 0.99 Allowed Glycine 0 N--CA 1.447 -0.582 0 C-N-CA 120.702 -0.761 . . . . 0.0 113.269 176.291 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 80' ' ' VAL . . . . . . . . . . . . . 24.3 m -81.22 147.01 6.58 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.451 0 N-CA-C 109.894 -0.41 . . . . 0.0 109.894 176.471 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 81' ' ' SER . . . . . . . . . . . . . 23.2 t -68.14 155.58 39.31 Favored 'General case' 0 C--N 1.321 -0.649 0 CA-C-O 120.939 0.399 . . . . 0.0 110.952 -178.071 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 82' ' ' VAL . . . . . . . . . . . . . 7.5 p -56.8 -33.93 42.27 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.24 0 CA-C-N 115.769 -0.65 . . . . 0.0 111.457 -177.893 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 83' ' ' SER . . . . . . . . . . . . . 16.0 m -60.65 -39.62 89.0 Favored 'General case' 0 C--O 1.235 0.299 0 CA-C-O 121.061 0.458 . . . . 0.0 110.592 178.347 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 84' ' ' GLN . . . . . . . . . . . . . 5.8 tp-100 -76.01 -39.36 55.93 Favored 'General case' 0 C--N 1.327 -0.392 0 CA-C-N 116.175 -0.466 . . . . 0.0 109.912 -179.909 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 85' ' ' LEU . . . . . 0.445 HD22 ' HA ' ' A' ' 85' ' ' LEU . 0.3 OUTLIER -63.03 -40.23 97.12 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.06 -0.518 . . . . 0.0 109.932 178.548 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild core ' A' A ' 86' ' ' ASN . . . . . 0.572 ' HA ' ' HD2' ' A' ' 89' ' ' LYS . 80.2 m-20 -62.58 -37.51 86.46 Favored 'General case' 0 CA--C 1.516 -0.338 0 CA-C-N 116.018 -0.537 . . . . 0.0 110.918 176.201 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 87' ' ' SER . . . . . . . . . . . . . 9.6 t -60.8 -41.82 96.39 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-O 120.888 0.375 . . . . 0.0 110.07 178.435 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 88' ' ' TYR . . . . . . . . . . . . . 34.0 m-85 -60.43 -34.43 73.96 Favored 'General case' 0 C--N 1.332 -0.171 0 CA-C-N 116.05 -0.523 . . . . 0.0 110.755 176.681 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 89' ' ' LYS . . . . . 0.572 ' HD2' ' HA ' ' A' ' 86' ' ' ASN . 56.3 mttm -63.88 -39.35 93.98 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.377 -0.374 . . . . 0.0 110.504 176.255 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 90' ' ' ASN . . . . . . . . . . . . . 23.9 m120 -60.0 -34.84 73.88 Favored 'General case' 0 C--O 1.233 0.228 0 CA-C-O 121.061 0.458 . . . . 0.0 110.495 177.164 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 91' ' ' TYR . . . . . . . . . . . . . 31.3 m-85 -80.75 -62.9 1.53 Allowed 'General case' 0 C--N 1.325 -0.467 0 CA-C-N 116.251 -0.431 . . . . 0.0 110.841 179.295 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 92' ' ' CYS . . . . . 0.454 ' HA ' ' HB2' ' A' ' 96' ' ' LEU . 70.2 m -68.54 -49.53 58.79 Favored 'General case' 0 C--N 1.324 -0.502 0 N-CA-C 112.595 0.591 . . . . 0.0 112.595 -171.4 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 93' ' ' ARG . . . . . 0.55 ' O ' ' HD3' ' A' ' 93' ' ' ARG . 0.7 OUTLIER -83.21 -38.41 22.3 Favored 'General case' 0 C--N 1.32 -0.708 0 C-N-CA 120.681 -0.408 . . . . 0.0 111.069 -171.639 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild core ' A' A ' 94' ' ' ASN . . . . . . . . . . . . . 6.7 t30 -91.8 -41.49 10.63 Favored 'General case' 0 C--N 1.326 -0.431 0 N-CA-C 112.172 0.434 . . . . 0.0 112.172 -172.72 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 95' ' ' HIS . . . . . . . . . . . . . 45.6 m80 -88.7 -49.43 6.86 Favored 'General case' 0 C--N 1.328 -0.343 0 N-CA-C 112.069 0.396 . . . . 0.0 112.069 178.678 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 96' ' ' LEU . . . . . 0.56 ' HG ' HD12 ' A' ' 99' ' ' LEU . 9.9 mp -84.91 26.69 0.82 Allowed 'General case' 0 C--N 1.324 -0.507 0 CA-C-N 116.318 -0.401 . . . . 0.0 111.214 -175.743 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 97' ' ' SER . . . . . 0.501 ' N ' ' HD2' ' A' ' 98' ' ' PRO . 5.2 m -53.96 -52.05 71.58 Favored Pre-proline 0 CA--C 1.538 0.498 0 CA-C-N 116.174 -0.467 . . . . 0.0 112.167 -178.762 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 98' ' ' PRO . . . . . 0.501 ' HD2' ' N ' ' A' ' 97' ' ' SER . 18.8 Cg_endo -59.6 -38.27 83.15 Favored 'Trans proline' 0 C--N 1.355 0.92 0 C-N-CA 121.814 1.676 . . . . 0.0 112.142 178.162 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 99' ' ' LEU . . . . . 0.56 HD12 ' HG ' ' A' ' 96' ' ' LEU . 65.4 mt -69.26 -25.31 64.21 Favored 'General case' 0 C--N 1.327 -0.391 0 CA-C-N 116.103 -0.499 . . . . 0.0 111.157 -176.094 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 100' ' ' TYR . . . . . . . . . . . . . 0.2 OUTLIER -58.05 -34.13 69.76 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.361 -0.381 . . . . 0.0 111.449 179.784 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 101' ' ' MET . . . . . . . . . . . . . 23.8 ttt -98.08 2.99 49.28 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-O 121.499 0.666 . . . . 0.0 110.472 -178.773 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 102' ' ' LYS . . . . . 0.579 ' HB3' ' OE2' ' A' ' 106' ' ' GLU . 8.5 mtpm? -102.98 167.67 9.69 Favored 'General case' 0 C--N 1.322 -0.6 0 CA-C-N 115.872 -0.604 . . . . 0.0 110.277 -179.133 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 103' ' ' SER . . . . . 0.541 ' O ' HG13 ' A' ' 107' ' ' ILE . 44.3 m -110.14 136.03 50.0 Favored 'General case' 0 C--N 1.319 -0.723 0 N-CA-C 109.248 -0.649 . . . . 0.0 109.248 178.936 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 104' ' ' LEU . . . . . . . . . . . . . 1.6 pp -60.58 -13.43 14.18 Favored 'General case' 0 C--N 1.325 -0.487 0 N-CA-C 112.541 0.571 . . . . 0.0 112.541 -175.167 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 105' ' ' SER . . . . . . . . . . . . . 35.3 t -87.08 -14.61 40.92 Favored 'General case' 0 C--N 1.327 -0.404 0 CA-C-N 116.518 -0.31 . . . . 0.0 110.882 178.296 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 106' ' ' GLU . . . . . 0.579 ' OE2' ' HB3' ' A' ' 102' ' ' LYS . 0.8 OUTLIER -123.02 12.44 9.66 Favored 'General case' 0 CA--C 1.532 0.271 0 CA-C-O 121.162 0.506 . . . . 0.0 111.077 179.283 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild core ' A' A ' 107' ' ' ILE . . . . . 0.541 HG13 ' O ' ' A' ' 103' ' ' SER . 77.4 mt -90.06 121.66 40.55 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.276 0 CA-C-N 116.018 -0.537 . . . . 0.0 109.884 173.607 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 108' ' ' LEU . . . . . . . . . . . . . 7.6 mp -85.48 147.52 47.02 Favored Pre-proline 0 C--N 1.323 -0.576 0 CA-C-N 116.105 -0.498 . . . . 0.0 110.723 -178.997 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 109' ' ' PRO . . . . . 0.455 ' HB3' ' HB2' ' A' ' 153' ' ' TYR . 35.2 Cg_exo -59.32 -31.61 95.33 Favored 'Trans proline' 0 N--CA 1.465 -0.191 0 C-N-CA 122.551 2.167 . . . . 0.0 111.249 174.136 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 110' ' ' ALA . . . . . 0.403 ' HA ' ' HB3' ' A' ' 113' ' ' GLN . . . -75.82 -20.91 57.81 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 115.742 -0.663 . . . . 0.0 111.108 179.129 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 111' ' ' ASP . . . . . . . . . . . . . 23.5 t0 -71.83 -48.49 45.8 Favored 'General case' 0 C--N 1.327 -0.413 0 N-CA-C 109.009 -0.737 . . . . 0.0 109.009 178.222 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 112' ' ' ILE . . . . . . . . . . . . . 46.4 mt -63.76 -38.49 82.44 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.284 0 CA-C-N 115.345 -0.843 . . . . 0.0 109.624 173.895 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 113' ' ' GLN . . . . . 0.403 ' HB3' ' HA ' ' A' ' 110' ' ' ALA . 27.2 tp60 -53.86 -44.49 70.4 Favored 'General case' 0 C--N 1.33 -0.241 0 CA-C-N 115.32 -0.855 . . . . 0.0 110.584 176.743 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 114' ' ' SER . . . . . . . . . . . . . 45.0 m -59.11 -46.61 87.86 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 115.821 -0.627 . . . . 0.0 110.509 178.898 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 115' ' ' ILE . . . . . . . . . . . . . 66.2 mt -56.86 -49.64 78.13 Favored 'Isoleucine or valine' 0 C--O 1.234 0.248 0 CA-C-O 120.967 0.413 . . . . 0.0 110.855 177.921 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 116' ' ' ILE . . . . . 0.448 HG13 HG11 ' A' ' 154' ' ' VAL . 47.6 mm -57.59 -42.44 81.27 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.262 0 CA-C-N 115.892 -0.594 . . . . 0.0 111.245 -179.886 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 117' ' ' ASN . . . . . . . . . . . . . 13.2 m120 -71.37 -30.93 66.74 Favored 'General case' 0 C--N 1.326 -0.451 0 CA-C-N 116.328 -0.396 . . . . 0.0 111.438 -176.991 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 118' ' ' GLU . . . . . . . . . . . . . 43.0 mt-10 -89.33 -5.26 57.67 Favored 'General case' 0 C--N 1.326 -0.428 0 CA-C-O 120.735 0.303 . . . . 0.0 111.279 -178.362 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 119' ' ' THR . . . . . . . . . . . . . 98.3 m -79.32 112.37 16.48 Favored 'General case' 0 C--N 1.323 -0.587 0 CA-C-O 121.078 0.466 . . . . 0.0 111.009 176.59 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 120' ' ' LYS . . . . . . . . . . . . . 69.6 mmtt -94.37 83.03 4.11 Favored 'General case' 0 C--N 1.325 -0.487 0 CA-C-N 116.31 -0.405 . . . . 0.0 110.121 176.289 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 121' ' ' LEU . . . . . 0.457 HD13 HG21 ' A' ' 125' ' ' THR . 77.8 mt -145.46 -175.35 4.68 Favored 'General case' 0 C--N 1.323 -0.564 0 CA-C-N 115.744 -0.662 . . . . 0.0 109.768 179.938 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 122' ' ' ALA . . . . . . . . . . . . . . . -62.66 149.49 43.43 Favored 'General case' 0 C--N 1.324 -0.525 0 CA-C-N 116.488 -0.324 . . . . 0.0 110.978 178.565 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 123' ' ' LYS . . . . . . . . . . . . . 17.8 ptpt -61.65 -30.96 71.06 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.132 -0.485 . . . . 0.0 111.475 -177.174 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 124' ' ' ASN . . . . . . . . . . . . . 9.6 t30 -66.29 -40.46 90.05 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-O 120.69 0.281 . . . . 0.0 110.436 176.15 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 125' ' ' THR . . . . . 0.589 ' O ' HG13 ' A' ' 129' ' ' ILE . 53.9 m -64.14 -39.13 93.37 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 116.197 -0.456 . . . . 0.0 110.678 179.151 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 126' ' ' LEU . . . . . . . . . . . . . 89.3 mt -56.58 -48.73 76.77 Favored 'General case' 0 C--O 1.234 0.25 0 CA-C-O 121.254 0.55 . . . . 0.0 110.24 177.253 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 127' ' ' LYS . . . . . . . . . . . . . 98.4 mttt -63.76 -40.03 95.72 Favored 'General case' 0 C--N 1.327 -0.37 0 CA-C-N 115.434 -0.803 . . . . 0.0 110.614 177.535 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 128' ' ' ALA . . . . . . . . . . . . . . . -64.65 -34.66 78.81 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.104 -0.498 . . . . 0.0 111.661 -178.872 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 129' ' ' ILE . . . . . 0.589 HG13 ' O ' ' A' ' 125' ' ' THR . 78.0 mt -62.47 -50.45 79.8 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.282 0 CA-C-O 121.052 0.453 . . . . 0.0 109.951 176.254 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 130' ' ' ARG . . . . . 0.505 ' HD2' ' HB ' ' A' ' 154' ' ' VAL . 47.8 ttt180 -60.72 -44.3 96.78 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 115.693 -0.685 . . . . 0.0 110.472 176.072 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 131' ' ' ASN . . . . . . . . . . . . . 2.8 t-20 -56.24 -48.45 76.5 Favored 'General case' 0 C--N 1.326 -0.413 0 CA-C-N 115.889 -0.596 . . . . 0.0 110.518 178.295 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 132' ' ' THR . . . . . . . . . . . . . 96.7 m -57.41 -51.4 69.55 Favored 'General case' 0 C--N 1.327 -0.404 0 CA-C-N 115.973 -0.558 . . . . 0.0 110.802 177.414 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 133' ' ' ALA . . . . . . . . . . . . . . . -61.1 -42.9 99.36 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 115.909 -0.587 . . . . 0.0 111.446 -178.634 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 134' ' ' SER . . . . . . . . . . . . . 51.1 p -64.18 -30.16 71.23 Favored 'General case' 0 C--N 1.33 -0.263 0 N-CA-C 111.755 0.28 . . . . 0.0 111.755 -176.73 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 135' ' ' GLN . . . . . . . . . . . . . 41.4 mt-30 -71.35 -38.37 71.63 Favored 'General case' 0 C--N 1.328 -0.329 0 C-N-CA 120.924 -0.31 . . . . 0.0 110.298 176.101 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 136' ' ' ILE . . . . . . . . . . . . . 65.7 mt -61.1 -46.11 97.28 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.251 0 CA-C-N 116.196 -0.456 . . . . 0.0 110.452 177.818 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 137' ' ' PHE . . . . . 0.484 ' O ' HG13 ' A' ' 141' ' ' ILE . 64.4 m-85 -66.03 -38.31 88.09 Favored 'General case' 0 C--N 1.33 -0.245 0 CA-C-N 116.355 -0.384 . . . . 0.0 110.827 177.745 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 138' ' ' ARG . . . . . 0.491 ' O ' ' HG3' ' A' ' 142' ' ' GLU . 19.9 mtp85 -59.19 -45.55 90.78 Favored 'General case' 0 CA--C 1.518 -0.279 0 CA-C-O 120.725 0.298 . . . . 0.0 110.739 175.952 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 139' ' ' LEU . . . . . . . . . . . . . 48.4 tp -55.81 -36.4 67.39 Favored 'General case' 0 C--N 1.327 -0.386 0 CA-C-N 115.753 -0.658 . . . . 0.0 110.42 178.697 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 140' ' ' ALA . . . . . 0.518 ' HB1' ' HB3' ' A' ' 145' ' ' ALA . . . -69.88 -45.14 68.33 Favored 'General case' 0 C--N 1.324 -0.518 0 CA-C-N 115.858 -0.61 . . . . 0.0 110.748 176.032 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 141' ' ' ILE . . . . . 0.575 ' HA ' ' O ' ' A' ' 146' ' ' ILE . 78.5 mt -55.86 -46.94 80.28 Favored 'Isoleucine or valine' 0 C--O 1.234 0.275 0 CA-C-O 120.997 0.427 . . . . 0.0 110.94 177.606 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 142' ' ' GLU . . . . . 0.491 ' HG3' ' O ' ' A' ' 138' ' ' ARG . 91.7 mt-10 -63.24 -27.55 69.43 Favored 'General case' 0 C--N 1.326 -0.416 0 CA-C-N 115.844 -0.616 . . . . 0.0 111.373 -177.564 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 143' ' ' ASN . . . . . . . . . . . . . 29.0 m-80 -99.49 14.64 29.14 Favored 'General case' 0 C--N 1.327 -0.402 0 CA-C-N 116.329 -0.396 . . . . 0.0 111.418 -178.704 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 144' ' ' ARG . . . . . . . . . . . . . 16.7 mmm180 65.68 27.94 11.23 Favored 'General case' 0 N--CA 1.468 0.462 0 N-CA-C 112.424 0.527 . . . . 0.0 112.424 176.409 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 145' ' ' ALA . . . . . 0.518 ' HB3' ' HB1' ' A' ' 140' ' ' ALA . . . -84.76 -39.66 18.17 Favored 'General case' 0 C--N 1.323 -0.568 0 CA-C-O 121.157 0.503 . . . . 0.0 110.51 177.918 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 146' ' ' ILE . . . . . 0.575 ' O ' ' HA ' ' A' ' 141' ' ' ILE . 15.5 tt -145.36 155.41 13.5 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.423 0 CA-C-N 115.688 -0.687 . . . . 0.0 109.217 -179.154 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 147' ' ' ASP . . . . . . . . . . . . . 3.8 m-20 -105.01 -1.56 25.58 Favored 'General case' 0 C--N 1.327 -0.401 0 N-CA-C 112.381 0.512 . . . . 0.0 112.381 -175.448 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 148' ' ' PHE . . . . . 0.461 ' H ' HG12 ' A' ' 146' ' ' ILE . 50.0 p90 -142.13 165.34 27.7 Favored 'General case' 0 C--N 1.322 -0.614 0 CA-C-O 120.76 0.314 . . . . 0.0 110.998 -176.569 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 149' ' ' ASN . . . . . . . . . . . . . 44.9 t-20 -119.11 101.8 49.44 Favored Pre-proline 0 C--N 1.322 -0.616 0 CA-C-N 116.021 -0.536 . . . . 0.0 110.549 -176.306 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 150' ' ' PRO . . . . . . . . . . . . . 35.2 Cg_exo -59.35 -32.69 97.1 Favored 'Trans proline' 0 C--N 1.342 0.197 0 C-N-CA 122.838 2.359 . . . . 0.0 112.724 178.915 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 151' ' ' ALA . . . . . 0.529 ' HA ' HG23 ' A' ' 154' ' ' VAL . . . -74.81 -19.47 60.18 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-O 121.047 0.451 . . . . 0.0 110.968 -178.466 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 152' ' ' ASP . . . . . . . . . . . . . 24.8 t70 -71.74 -19.81 61.98 Favored 'General case' 0 C--N 1.325 -0.46 0 CA-C-N 115.762 -0.653 . . . . 0.0 110.033 178.662 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 153' ' ' TYR . . . . . 0.455 ' HB2' ' HB3' ' A' ' 109' ' ' PRO . 68.6 m-85 -95.77 1.77 53.49 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 115.744 -0.662 . . . . 0.0 111.513 -178.238 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 154' ' ' VAL . . . . . 0.529 HG23 ' HA ' ' A' ' 151' ' ' ALA . 98.0 t -72.32 123.53 27.1 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.514 0 CA-C-O 121.043 0.449 . . . . 0.0 110.514 -178.954 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 155' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -86.12 101.58 13.11 Favored 'General case' 0 C--N 1.32 -0.711 0 N-CA-C 109.251 -0.648 . . . . 0.0 109.251 179.279 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 156' ' ' ILE . . . . . 0.415 HD13 ' HD3' ' A' ' 130' ' ' ARG . 0.9 OUTLIER -71.12 131.31 87.17 Favored Pre-proline 0 C--N 1.325 -0.469 0 N-CA-C 109.275 -0.639 . . . . 0.0 109.275 176.146 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild core ' A' A ' 157' ' ' PRO . . . . . . . . . . . . . 92.4 Cg_endo . . . . . 0 N--CA 1.456 -0.685 0 C-N-CA 122.522 2.148 . . . . 0.0 112.856 -176.088 . . . . . . . . 0 0 . 1 . 020 nuclear nobuild core ' A' A ' 63' ' ' SER . . . . . 0.564 ' HA ' ' HA ' ' A' ' 103' ' ' SER . 39.5 t . . . . . 0 N--CA 1.449 -0.525 0 CA-C-O 121.011 0.434 . . . . 0.0 110.341 . . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 64' ' ' PHE . . . . . 0.48 ' HB2' HD11 ' A' ' 107' ' ' ILE . 78.9 t80 -59.85 -31.82 70.12 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 115.82 -0.627 . . . . 0.0 109.999 178.37 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 65' ' ' GLY . . . . . . . . . . . . . . . -59.24 -31.7 70.14 Favored Glycine 0 N--CA 1.447 -0.582 0 CA-C-N 115.685 -0.689 . . . . 0.0 112.571 178.894 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 66' ' ' ASP . . . . . . . . . . . . . 39.0 t70 -79.66 -48.38 13.81 Favored 'General case' 0 C--N 1.329 -0.308 0 C-N-CA 120.911 -0.316 . . . . 0.0 110.491 -179.959 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 67' ' ' TRP . . . . . . . . . . . . . 83.8 m95 -62.16 -36.59 82.31 Favored 'General case' 0 N--CA 1.465 0.282 0 CA-C-N 116.474 -0.33 . . . . 0.0 111.32 179.582 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 68' ' ' ALA . . . . . 0.595 ' O ' ' HG ' ' A' ' 72' ' ' LEU . . . -63.93 -50.92 66.77 Favored 'General case' 0 C--N 1.325 -0.495 0 CA-C-N 116.273 -0.421 . . . . 0.0 110.535 177.28 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 69' ' ' GLU . . . . . . . . . . . . . 14.9 tp10 -61.88 -35.18 77.58 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.083 -0.508 . . . . 0.0 110.07 178.055 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 70' ' ' LYS . . . . . . . . . . . . . 48.5 tttp -59.17 -44.97 92.16 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 115.932 -0.577 . . . . 0.0 110.325 177.145 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 71' ' ' PHE . . . . . . . . . . . . . 79.5 t80 -69.28 -41.22 77.14 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-O 120.98 0.419 . . . . 0.0 110.441 178.912 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 72' ' ' LEU . . . . . 0.595 ' HG ' ' O ' ' A' ' 68' ' ' ALA . 86.1 mt -63.9 -34.28 77.6 Favored 'General case' 0 C--N 1.325 -0.478 0 CA-C-N 116.14 -0.482 . . . . 0.0 110.526 179.647 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 73' ' ' LYS . . . . . 0.452 ' O ' ' HB3' ' A' ' 76' ' ' GLU . 14.0 ttmm -84.08 -33.33 24.43 Favored 'General case' 0 C--N 1.324 -0.543 0 CA-C-N 116.138 -0.483 . . . . 0.0 111.238 -176.505 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 74' ' ' SER . . . . . . . . . . . . . 15.4 p -71.47 -30.58 66.16 Favored 'General case' 0 C--N 1.324 -0.501 0 N-CA-C 110.051 -0.352 . . . . 0.0 110.051 175.982 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 75' ' ' LYS . . . . . 0.506 ' O ' ' HB3' ' A' ' 78' ' ' ASP . 22.0 tptp -76.62 -32.05 57.8 Favored 'General case' 0 N--CA 1.447 -0.612 0 CA-C-O 121.302 0.572 . . . . 0.0 109.475 174.589 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 76' ' ' GLU . . . . . 0.452 ' HB3' ' O ' ' A' ' 73' ' ' LYS . 30.3 tt0 -58.88 -47.87 83.43 Favored 'General case' 0 C--N 1.327 -0.407 0 CA-C-N 115.377 -0.829 . . . . 0.0 110.072 172.921 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 77' ' ' ALA . . . . . . . . . . . . . . . -76.08 -16.24 59.96 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 115.808 -0.633 . . . . 0.0 111.018 178.584 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 78' ' ' ASP . . . . . 0.506 ' HB3' ' O ' ' A' ' 75' ' ' LYS . 3.8 t70 -65.57 -53.78 37.09 Favored 'General case' 0 C--N 1.331 -0.218 0 CA-C-N 116.014 -0.539 . . . . 0.0 110.519 177.101 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 79' ' ' GLY . . . . . . . . . . . . . . . 142.34 63.97 0.03 OUTLIER Glycine 0 N--CA 1.446 -0.69 0 C-N-CA 120.506 -0.854 . . . . 0.0 112.26 178.495 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 80' ' ' VAL . . . . . . . . . . . . . 36.0 m -115.5 158.43 15.86 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.644 0 CA-C-O 120.759 0.314 . . . . 0.0 110.808 179.634 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 81' ' ' SER . . . . . . . . . . . . . 47.5 t -78.72 151.48 32.11 Favored 'General case' 0 C--N 1.321 -0.665 0 N-CA-C 109.487 -0.56 . . . . 0.0 109.487 174.777 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 82' ' ' VAL . . . . . . . . . . . . . 8.3 p -56.68 -34.4 42.57 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.329 0 CA-C-O 120.834 0.35 . . . . 0.0 110.667 177.631 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 83' ' ' SER . . . . . . . . . . . . . 3.4 m -62.98 -42.42 99.83 Favored 'General case' 0 C--O 1.235 0.291 0 CA-C-O 121.425 0.631 . . . . 0.0 110.181 178.199 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 84' ' ' GLN . . . . . 0.431 ' HG3' ' CE2' ' A' ' 88' ' ' TYR . 23.4 tp60 -74.78 -33.78 62.32 Favored 'General case' 0 C--N 1.325 -0.486 0 CA-C-N 115.497 -0.774 . . . . 0.0 110.389 -179.519 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 85' ' ' LEU . . . . . . . . . . . . . 36.7 tp -68.99 -42.97 75.79 Favored 'General case' 0 C--N 1.323 -0.562 0 CA-C-N 116.084 -0.507 . . . . 0.0 110.607 178.966 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 86' ' ' ASN . . . . . . . . . . . . . 86.3 m-20 -60.36 -44.83 95.21 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.32 -0.4 . . . . 0.0 111.075 178.78 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 87' ' ' SER . . . . . . . . . . . . . 2.0 p -63.58 -38.31 90.65 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 116.649 -0.25 . . . . 0.0 111.201 -179.489 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 88' ' ' TYR . . . . . 0.451 ' HB3' HD22 ' A' ' 72' ' ' LEU . 10.7 m-85 -60.48 -47.95 83.9 Favored 'General case' 0 N--CA 1.465 0.282 0 CA-C-O 121.037 0.446 . . . . 0.0 110.515 175.082 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 89' ' ' LYS . . . . . 0.525 ' HG2' HD13 ' A' ' 72' ' ' LEU . 68.4 mttm -63.38 -37.66 88.12 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 115.787 -0.642 . . . . 0.0 110.767 179.64 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 90' ' ' ASN . . . . . 0.516 ' O ' ' HB3' ' A' ' 94' ' ' ASN . 7.4 m-80 -62.48 -47.65 83.05 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.302 -0.408 . . . . 0.0 111.008 177.354 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 91' ' ' TYR . . . . . 0.785 ' HA ' ' HD2' ' A' ' 95' ' ' HIS . 14.0 m-85 -57.23 -45.36 83.95 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-O 120.991 0.424 . . . . 0.0 110.507 175.693 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 92' ' ' CYS . . . . . 0.56 ' SG ' ' HB1' ' A' ' 68' ' ' ALA . 47.8 t -66.54 -54.08 27.63 Favored 'General case' 0 C--N 1.321 -0.668 0 CA-C-N 115.507 -0.769 . . . . 0.0 112.407 -175.561 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 93' ' ' ARG . . . . . . . . . . . . . 31.7 ttm-85 -82.45 -35.02 27.91 Favored 'General case' 0 C--N 1.326 -0.451 0 N-CA-C 111.965 0.357 . . . . 0.0 111.965 -171.751 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 94' ' ' ASN . . . . . 0.516 ' HB3' ' O ' ' A' ' 90' ' ' ASN . 22.0 t-20 -83.97 -51.6 7.01 Favored 'General case' 0 C--N 1.326 -0.43 0 CA-C-O 120.651 0.262 . . . . 0.0 111.582 -176.583 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 95' ' ' HIS . . . . . 0.785 ' HD2' ' HA ' ' A' ' 91' ' ' TYR . 96.5 m-70 -85.49 -42.91 14.03 Favored 'General case' 0 C--N 1.327 -0.371 0 CA-C-O 120.701 0.286 . . . . 0.0 111.452 -174.207 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 96' ' ' LEU . . . . . 0.454 HD21 ' HB2' ' A' ' 133' ' ' ALA . 10.1 mp -91.56 26.73 2.21 Favored 'General case' 0 C--N 1.326 -0.435 0 CA-C-O 120.864 0.364 . . . . 0.0 110.464 -179.794 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 97' ' ' SER . . . . . 0.526 ' OG ' ' HD3' ' A' ' 98' ' ' PRO . 0.5 OUTLIER -55.44 -47.12 99.35 Favored Pre-proline 0 CA--C 1.539 0.526 0 N-CA-C 113.02 0.748 . . . . 0.0 113.02 -178.481 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild core ' A' A ' 98' ' ' PRO . . . . . 0.526 ' HD3' ' OG ' ' A' ' 97' ' ' SER . 38.8 Cg_exo -58.08 -34.91 98.99 Favored 'Trans proline' 0 C--N 1.358 1.066 0 C-N-CA 121.663 1.575 . . . . 0.0 111.967 178.095 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 99' ' ' LEU . . . . . 0.455 HD22 HG23 ' A' ' 107' ' ' ILE . 33.2 mt -79.02 -36.82 40.5 Favored 'General case' 0 C--N 1.327 -0.391 0 CA-C-N 115.874 -0.603 . . . . 0.0 110.282 -177.275 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 100' ' ' TYR . . . . . . . . . . . . . 25.8 t80 -60.47 -24.82 65.56 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 115.509 -0.769 . . . . 0.0 111.072 -177.112 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 101' ' ' MET . . . . . . . . . . . . . 65.4 mtt -97.72 -2.58 40.94 Favored 'General case' 0 C--N 1.327 -0.375 0 CA-C-N 116.21 -0.45 . . . . 0.0 111.784 -177.153 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 102' ' ' LYS . . . . . . . . . . . . . 87.7 mttt -102.53 167.35 9.99 Favored 'General case' 0 C--O 1.237 0.402 0 CA-C-O 121.026 0.441 . . . . 0.0 111.012 -179.312 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 103' ' ' SER . . . . . 0.564 ' HA ' ' HA ' ' A' ' 63' ' ' SER . 5.2 m -83.13 156.77 23.1 Favored 'General case' 0 C--N 1.323 -0.569 0 CA-C-N 115.82 -0.627 . . . . 0.0 109.69 174.702 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 104' ' ' LEU . . . . . . . . . . . . . 52.1 tp -55.83 -45.11 78.44 Favored 'General case' 0 C--N 1.325 -0.457 0 CA-C-N 116.501 -0.318 . . . . 0.0 111.525 -176.828 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 105' ' ' SER . . . . . . . . . . . . . 14.8 m -87.12 0.38 55.36 Favored 'General case' 0 C--N 1.325 -0.493 0 CA-C-N 116.453 -0.34 . . . . 0.0 111.896 -174.572 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 106' ' ' GLU . . . . . . . . . . . . . 44.3 mt-10 -104.02 -2.46 25.98 Favored 'General case' 0 C--N 1.327 -0.377 0 O-C-N 122.247 -0.283 . . . . 0.0 111.624 -178.372 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 107' ' ' ILE . . . . . 0.48 HD11 ' HB2' ' A' ' 64' ' ' PHE . 66.9 mt -81.15 126.82 39.87 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.556 0 CA-C-O 121.133 0.492 . . . . 0.0 111.303 -178.116 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 108' ' ' LEU . . . . . . . . . . . . . 62.9 mt -97.61 147.28 32.78 Favored Pre-proline 0 C--N 1.323 -0.583 0 CA-C-N 115.724 -0.671 . . . . 0.0 110.444 -179.488 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 109' ' ' PRO . . . . . . . . . . . . . 19.1 Cg_endo -60.18 -30.33 91.06 Favored 'Trans proline' 0 N--CA 1.464 -0.241 0 C-N-CA 122.351 2.034 . . . . 0.0 111.352 174.977 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 110' ' ' ALA . . . . . . . . . . . . . . . -65.17 -29.85 70.71 Favored 'General case' 0 N--CA 1.454 -0.257 0 CA-C-N 115.868 -0.605 . . . . 0.0 111.043 178.662 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 111' ' ' ASP . . . . . 0.414 ' O ' HG13 ' A' ' 115' ' ' ILE . 79.2 m-20 -64.91 -51.26 62.85 Favored 'General case' 0 CA--C 1.519 -0.244 0 CA-C-O 121.141 0.496 . . . . 0.0 110.025 179.226 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 112' ' ' ILE . . . . . 0.485 ' O ' HG12 ' A' ' 116' ' ' ILE . 30.6 mt -65.16 -40.61 89.36 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.491 0 CA-C-N 115.67 -0.696 . . . . 0.0 110.15 179.741 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 113' ' ' GLN . . . . . . . . . . . . . 6.7 tp-100 -59.01 -42.54 90.35 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.018 -0.537 . . . . 0.0 110.514 175.663 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 114' ' ' SER . . . . . . . . . . . . . 7.4 t -60.25 -45.58 92.78 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-N 116.257 -0.429 . . . . 0.0 109.862 178.304 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 115' ' ' ILE . . . . . 0.414 HG13 ' O ' ' A' ' 111' ' ' ASP . 75.8 mt -56.69 -47.23 82.76 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.221 0 CA-C-N 116.434 -0.348 . . . . 0.0 110.822 178.401 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 116' ' ' ILE . . . . . 0.485 HG12 ' O ' ' A' ' 112' ' ' ILE . 50.3 mm -61.09 -40.99 87.61 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.36 0 CA-C-O 121.108 0.48 . . . . 0.0 110.876 179.165 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 117' ' ' ASN . . . . . . . . . . . . . 46.8 t-20 -71.6 -42.03 68.21 Favored 'General case' 0 C--N 1.324 -0.515 0 CA-C-N 115.797 -0.638 . . . . 0.0 111.067 -177.032 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 118' ' ' GLU . . . . . . . . . . . . . 46.9 mt-10 -80.65 -16.76 53.21 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.253 -0.43 . . . . 0.0 112.035 -174.467 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 119' ' ' THR . . . . . . . . . . . . . 94.8 m -82.0 112.86 19.46 Favored 'General case' 0 C--N 1.325 -0.481 0 CA-C-O 121.331 0.586 . . . . 0.0 110.96 179.985 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 120' ' ' LYS . . . . . . . . . . . . . 24.1 mtmt -93.47 63.24 3.47 Favored 'General case' 0 C--N 1.323 -0.548 0 CA-C-N 115.441 -0.799 . . . . 0.0 110.544 -177.959 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 121' ' ' LEU . . . . . . . . . . . . . 88.8 mt -126.92 -175.75 3.51 Favored 'General case' 0 C--N 1.322 -0.62 0 CA-C-N 115.16 -0.927 . . . . 0.0 109.939 178.305 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 122' ' ' ALA . . . . . . . . . . . . . . . -64.01 157.12 25.97 Favored 'General case' 0 C--N 1.327 -0.37 0 CA-C-O 120.964 0.411 . . . . 0.0 111.808 -176.729 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 123' ' ' LYS . . . . . . . . . . . . . 48.3 mmtm -62.01 -38.39 88.47 Favored 'General case' 0 C--N 1.331 -0.237 0 CA-C-N 115.979 -0.555 . . . . 0.0 111.12 -177.926 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 124' ' ' ASN . . . . . . . . . . . . . 28.9 p30 -65.45 -27.31 68.42 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.321 -0.399 . . . . 0.0 111.064 179.453 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 125' ' ' THR . . . . . 0.495 ' O ' HG13 ' A' ' 129' ' ' ILE . 10.2 m -76.18 -39.2 55.38 Favored 'General case' 0 C--N 1.325 -0.47 0 CA-C-N 116.257 -0.429 . . . . 0.0 110.061 179.125 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 126' ' ' LEU . . . . . 0.433 ' HB3' HG23 ' A' ' 116' ' ' ILE . 84.5 mt -62.42 -44.83 95.5 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.008 -0.542 . . . . 0.0 110.141 177.289 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 127' ' ' LYS . . . . . . . . . . . . . 98.6 mttt -59.7 -43.53 94.04 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 115.774 -0.648 . . . . 0.0 110.18 177.384 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 128' ' ' ALA . . . . . . . . . . . . . . . -60.71 -39.12 87.36 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 115.7 -0.682 . . . . 0.0 111.308 -178.861 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 129' ' ' ILE . . . . . 0.495 HG13 ' O ' ' A' ' 125' ' ' THR . 87.6 mt -58.36 -51.65 68.73 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.245 0 CA-C-N 116.462 -0.336 . . . . 0.0 110.654 178.394 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 130' ' ' ARG . . . . . 0.705 HH21 ' HA ' ' A' ' 152' ' ' ASP . 33.4 ttt-85 -65.15 -45.97 82.8 Favored 'General case' 0 C--N 1.331 -0.206 0 C-N-CA 120.885 -0.326 . . . . 0.0 110.92 179.079 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 131' ' ' ASN . . . . . . . . . . . . . 10.9 m120 -53.15 -53.06 56.06 Favored 'General case' 0 N--CA 1.466 0.343 0 O-C-N 123.184 0.302 . . . . 0.0 110.833 179.654 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 132' ' ' THR . . . . . 0.533 ' O ' HG12 ' A' ' 136' ' ' ILE . 29.7 m -55.7 -45.23 77.9 Favored 'General case' 0 C--N 1.327 -0.401 0 CA-C-N 116.303 -0.408 . . . . 0.0 110.824 -179.997 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 133' ' ' ALA . . . . . 0.454 ' HB2' HD21 ' A' ' 96' ' ' LEU . . . -64.3 -42.84 96.17 Favored 'General case' 0 C--N 1.331 -0.207 0 CA-C-N 116.21 -0.45 . . . . 0.0 111.388 -179.356 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 134' ' ' SER . . . . . 0.45 ' O ' ' HG3' ' A' ' 138' ' ' ARG . 70.5 p -64.4 -32.69 74.41 Favored 'General case' 0 C--N 1.33 -0.246 0 C-N-CA 121.033 -0.267 . . . . 0.0 110.959 -178.704 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 135' ' ' GLN . . . . . . . . . . . . . 1.2 mp0 -62.88 -41.18 99.3 Favored 'General case' 0 C--N 1.331 -0.206 0 CA-C-O 120.779 0.323 . . . . 0.0 110.245 175.169 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 136' ' ' ILE . . . . . 0.561 HD12 ' HA ' ' A' ' 68' ' ' ALA . 23.1 mm -61.63 -50.77 78.93 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.25 0 CA-C-N 116.014 -0.539 . . . . 0.0 110.402 178.737 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 137' ' ' PHE . . . . . 0.492 ' O ' HG13 ' A' ' 141' ' ' ILE . 62.2 m-85 -62.14 -38.15 87.88 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 115.843 -0.617 . . . . 0.0 111.405 -179.529 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 138' ' ' ARG . . . . . 0.587 ' O ' ' HG2' ' A' ' 142' ' ' GLU . 68.2 mtp180 -64.7 -37.54 87.94 Favored 'General case' 0 C--N 1.329 -0.314 0 C-N-CA 120.823 -0.351 . . . . 0.0 110.877 179.356 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 139' ' ' LEU . . . . . . . . . . . . . 63.4 tp -57.54 -41.77 81.59 Favored 'General case' 0 C--N 1.327 -0.387 0 CA-C-O 121.107 0.479 . . . . 0.0 109.975 176.301 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 140' ' ' ALA . . . . . . . . . . . . . . . -66.6 -38.74 87.63 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 115.716 -0.675 . . . . 0.0 110.711 177.355 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 141' ' ' ILE . . . . . 0.546 ' HA ' ' O ' ' A' ' 146' ' ' ILE . 75.7 mt -64.07 -43.74 97.58 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.268 0 CA-C-N 116.3 -0.409 . . . . 0.0 110.73 177.168 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 142' ' ' GLU . . . . . 0.587 ' HG2' ' O ' ' A' ' 138' ' ' ARG . 39.7 mm-40 -62.77 -30.43 71.44 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.274 -0.421 . . . . 0.0 110.955 179.434 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 143' ' ' ASN . . . . . 0.403 ' N ' HD22 ' A' ' 143' ' ' ASN . 0.9 OUTLIER -91.23 1.9 56.76 Favored 'General case' 0 N--CA 1.464 0.229 0 CA-C-N 116.269 -0.423 . . . . 0.0 110.919 179.987 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild core ' A' A ' 144' ' ' ARG . . . . . . . . . . . . . 24.5 mtp85 57.68 40.92 26.1 Favored 'General case' 0 C--O 1.233 0.233 0 CA-C-N 115.633 -0.712 . . . . 0.0 112.054 -177.892 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 145' ' ' ALA . . . . . . . . . . . . . . . -88.41 -28.78 20.7 Favored 'General case' 0 C--N 1.324 -0.508 0 N-CA-C 109.338 -0.616 . . . . 0.0 109.338 172.435 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 146' ' ' ILE . . . . . 0.546 ' O ' ' HA ' ' A' ' 141' ' ' ILE . 13.4 tt -155.07 146.49 13.18 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.479 0 CA-C-N 115.237 -0.892 . . . . 0.0 108.941 177.493 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 147' ' ' ASP . . . . . . . . . . . . . 7.6 m-20 -110.48 24.02 13.51 Favored 'General case' 0 C--N 1.323 -0.548 0 CA-C-O 121.283 0.563 . . . . 0.0 110.192 179.53 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 148' ' ' PHE . . . . . 0.48 ' H ' HG12 ' A' ' 146' ' ' ILE . 1.2 m-85 -129.97 143.95 51.07 Favored 'General case' 0 C--N 1.323 -0.572 0 CA-C-N 115.631 -0.713 . . . . 0.0 110.336 -178.712 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 149' ' ' ASN . . . . . . . . . . . . . 48.0 t-20 -126.36 91.14 48.39 Favored Pre-proline 0 C--N 1.321 -0.664 0 CA-C-N 116.131 -0.486 . . . . 0.0 110.003 178.494 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 150' ' ' PRO . . . . . . . . . . . . . 35.8 Cg_exo -62.19 -26.52 77.78 Favored 'Trans proline' 0 C--N 1.343 0.258 0 C-N-CA 122.798 2.332 . . . . 0.0 112.082 -179.582 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 151' ' ' ALA . . . . . . . . . . . . . . . -70.21 -27.6 64.62 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 116.124 -0.489 . . . . 0.0 111.179 -177.635 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 152' ' ' ASP . . . . . 0.705 ' HA ' HH21 ' A' ' 130' ' ' ARG . 19.3 t70 -75.58 -17.65 59.98 Favored 'General case' 0 C--N 1.323 -0.552 0 CA-C-O 120.887 0.375 . . . . 0.0 110.514 -179.53 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 153' ' ' TYR . . . . . . . . . . . . . 43.7 m-85 -83.35 -10.84 58.23 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.243 -0.435 . . . . 0.0 110.653 178.819 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 154' ' ' VAL . . . . . . . . . . . . . 41.9 t -72.7 117.77 16.79 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.396 0 CA-C-N 116.101 -0.5 . . . . 0.0 110.945 -178.987 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 155' ' ' ARG . . . . . . . . . . . . . 3.8 mmp_? -89.91 131.68 35.7 Favored 'General case' 0 C--N 1.319 -0.719 0 CA-C-N 116.133 -0.485 . . . . 0.0 110.326 174.016 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 156' ' ' ILE . . . . . 0.427 ' HA ' ' HD2' ' A' ' 157' ' ' PRO . 1.9 mp -91.96 117.08 67.54 Favored Pre-proline 0 C--N 1.31 -1.109 0 N-CA-C 107.988 -1.116 . . . . 0.0 107.988 173.481 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 157' ' ' PRO . . . . . 0.427 ' HD2' ' HA ' ' A' ' 156' ' ' ILE . 5.7 Cg_endo . . . . . 0 C--N 1.345 0.368 0 C-N-CA 123.22 2.613 . . . . 0.0 112.488 -173.657 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 61' ' ' ARG . . . . . . . . . . . . . 9.9 mmm180 . . . . . 0 N--CA 1.484 1.244 0 N-CA-C 111.388 0.144 . . . . 0.0 111.388 . . . . . . . . . 0 0 . 1 . 001 nuclear nobuild full ' A' A ' 62' ' ' ASP . . . . . . . . . . . . . 5.5 m-20 -117.37 106.28 13.05 Favored 'General case' 0 C--N 1.327 -0.399 0 CA-C-O 120.801 0.334 . . . . 0.0 111.177 -175.918 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 63' ' ' SER . . . . . 0.608 ' HA ' ' HA ' ' A' ' 103' ' ' SER . 29.4 p -82.23 145.22 30.15 Favored 'General case' 0 C--N 1.321 -0.662 0 CA-C-N 116.182 -0.463 . . . . 0.0 110.518 -179.138 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 64' ' ' PHE . . . . . 0.504 ' HB2' HD11 ' A' ' 107' ' ' ILE . 83.2 t80 -62.32 -35.62 79.62 Favored 'General case' 0 C--N 1.327 -0.372 0 N-CA-C 109.852 -0.425 . . . . 0.0 109.852 179.174 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 65' ' ' GLY . . . . . . . . . . . . . . . -60.92 -37.57 94.0 Favored Glycine 0 N--CA 1.449 -0.483 0 CA-C-N 115.904 -0.589 . . . . 0.0 112.329 176.964 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 66' ' ' ASP . . . . . . . . . . . . . 9.4 t70 -59.84 -54.39 46.77 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-O 120.894 0.378 . . . . 0.0 110.603 178.063 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 67' ' ' TRP . . . . . . . . . . . . . 87.5 m95 -72.44 -31.38 65.42 Favored 'General case' 0 C--N 1.325 -0.464 0 CA-C-N 115.941 -0.572 . . . . 0.0 111.94 -176.953 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 68' ' ' ALA . . . . . 0.512 ' O ' HD13 ' A' ' 72' ' ' LEU . . . -64.03 -44.87 91.24 Favored 'General case' 0 C--N 1.327 -0.408 0 CA-C-O 120.872 0.368 . . . . 0.0 110.325 176.336 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 69' ' ' GLU . . . . . . . . . . . . . 15.7 tm-20 -62.47 -38.68 90.77 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 115.981 -0.554 . . . . 0.0 110.05 178.916 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 70' ' ' LYS . . . . . . . . . . . . . 90.0 mttt -68.07 -38.49 82.46 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.244 -0.434 . . . . 0.0 111.055 177.399 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 71' ' ' PHE . . . . . . . . . . . . . 87.8 t80 -64.04 -44.15 93.36 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-O 120.958 0.408 . . . . 0.0 110.355 176.786 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 72' ' ' LEU . . . . . 0.518 ' HG ' ' HG2' ' A' ' 89' ' ' LYS . 3.9 mp -56.6 -51.55 68.24 Favored 'General case' 0 C--N 1.327 -0.387 0 CA-C-N 115.735 -0.666 . . . . 0.0 110.421 175.866 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 73' ' ' LYS . . . . . . . . . . . . . 39.9 ttmt -63.01 -37.8 88.63 Favored 'General case' 0 C--N 1.326 -0.423 0 CA-C-N 115.968 -0.56 . . . . 0.0 110.635 179.229 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 74' ' ' SER . . . . . . . . . . . . . 31.4 t -57.68 -51.87 67.75 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.144 -0.48 . . . . 0.0 110.949 177.819 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 75' ' ' LYS . . . . . 0.547 ' HA ' ' HB2' ' A' ' 78' ' ' ASP . 25.9 mmtm -69.84 -30.21 67.65 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-O 120.862 0.363 . . . . 0.0 111.119 -178.044 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 76' ' ' GLU . . . . . . . . . . . . . 35.5 tt0 -64.68 -38.55 91.37 Favored 'General case' 0 C--N 1.323 -0.561 0 CA-C-N 116.105 -0.498 . . . . 0.0 110.195 175.332 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 77' ' ' ALA . . . . . . . . . . . . . . . -80.15 -23.72 40.91 Favored 'General case' 0 C--N 1.325 -0.461 0 CA-C-N 115.83 -0.623 . . . . 0.0 111.158 176.058 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 78' ' ' ASP . . . . . 0.547 ' HB2' ' HA ' ' A' ' 75' ' ' LYS . 11.2 m-20 -67.6 -33.38 74.87 Favored 'General case' 0 CA--C 1.517 -0.294 0 CA-C-N 116.443 -0.344 . . . . 0.0 110.795 177.43 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 79' ' ' GLY . . . . . . . . . . . . . . . 105.7 41.2 1.89 Allowed Glycine 0 N--CA 1.446 -0.669 0 C-N-CA 120.557 -0.83 . . . . 0.0 112.934 176.208 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 80' ' ' VAL . . . . . . . . . . . . . 30.0 m -87.26 158.25 3.15 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.567 0 N-CA-C 109.674 -0.491 . . . . 0.0 109.674 174.549 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 81' ' ' SER . . . . . . . . . . . . . 61.1 m -61.43 146.16 49.33 Favored 'General case' 0 C--N 1.323 -0.561 0 CA-C-N 116.581 -0.282 . . . . 0.0 110.546 177.636 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 82' ' ' VAL . . . . . . . . . . . . . 60.3 t -57.05 -43.17 80.7 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.378 0 CA-C-N 116.384 -0.371 . . . . 0.0 111.03 -178.345 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 83' ' ' SER . . . . . . . . . . . . . 27.9 m -59.65 -39.11 83.3 Favored 'General case' 0 C--N 1.326 -0.441 0 CA-C-N 116.374 -0.375 . . . . 0.0 110.545 176.889 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 84' ' ' GLN . . . . . . . . . . . . . 6.7 tp-100 -69.15 -44.24 72.69 Favored 'General case' 0 C--N 1.326 -0.423 0 CA-C-N 115.964 -0.562 . . . . 0.0 110.091 179.154 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 85' ' ' LEU . . . . . 0.527 ' O ' ' HG3' ' A' ' 89' ' ' LYS . 2.4 tm? -62.64 -43.76 97.98 Favored 'General case' 0 C--N 1.326 -0.438 0 CA-C-N 115.849 -0.614 . . . . 0.0 109.933 178.953 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 86' ' ' ASN . . . . . . . . . . . . . 77.4 m-20 -64.18 -26.94 68.74 Favored 'General case' 0 C--N 1.332 -0.182 0 CA-C-N 116.116 -0.493 . . . . 0.0 111.259 177.564 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 87' ' ' SER . . . . . . . . . . . . . 60.5 m -64.92 -47.27 78.3 Favored 'General case' 0 C--N 1.33 -0.263 0 N-CA-C 109.896 -0.409 . . . . 0.0 109.896 176.403 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 88' ' ' TYR . . . . . . . . . . . . . 44.2 m-85 -58.7 -45.92 88.46 Favored 'General case' 0 C--O 1.232 0.168 0 CA-C-N 116.252 -0.431 . . . . 0.0 110.215 177.298 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 89' ' ' LYS . . . . . 0.527 ' HG3' ' O ' ' A' ' 85' ' ' LEU . 46.5 mtpt -58.71 -44.05 90.27 Favored 'General case' 0 C--N 1.332 -0.19 0 CA-C-N 115.747 -0.661 . . . . 0.0 110.549 179.85 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 90' ' ' ASN . . . . . . . . . . . . . 8.8 t30 -63.66 -39.41 94.26 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 116.196 -0.456 . . . . 0.0 110.832 -179.532 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 91' ' ' TYR . . . . . . . . . . . . . 18.4 m-85 -60.59 -48.65 80.83 Favored 'General case' 0 C--N 1.331 -0.215 0 CA-C-N 116.615 -0.266 . . . . 0.0 111.054 179.895 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 92' ' ' CYS . . . . . 0.619 ' HA ' ' HB2' ' A' ' 96' ' ' LEU . 24.2 p -76.42 -27.47 56.28 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-O 120.711 0.291 . . . . 0.0 111.748 -176.465 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 93' ' ' ARG . . . . . . . . . . . . . 56.0 ttp180 -81.84 -42.9 18.98 Favored 'General case' 0 C--N 1.327 -0.406 0 CA-C-O 120.772 0.32 . . . . 0.0 111.833 -175.914 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 94' ' ' ASN . . . . . . . . . . . . . 13.5 m120 -95.46 -57.27 2.44 Favored 'General case' 0 C--N 1.325 -0.485 0 CA-C-N 116.305 -0.407 . . . . 0.0 111.909 -173.644 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 95' ' ' HIS . . . . . . . . . . . . . 36.6 m80 -78.59 -48.58 14.88 Favored 'General case' 0 C--N 1.327 -0.4 0 CA-C-O 120.849 0.357 . . . . 0.0 111.249 -174.355 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 96' ' ' LEU . . . . . 0.619 ' HB2' ' HA ' ' A' ' 92' ' ' CYS . 66.3 mt -88.82 21.98 2.85 Favored 'General case' 0 C--N 1.324 -0.536 0 CA-C-N 116.342 -0.39 . . . . 0.0 110.253 -179.504 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 97' ' ' SER . . . . . 0.546 ' N ' ' HD2' ' A' ' 98' ' ' PRO . 4.3 t -55.3 -48.26 96.64 Favored Pre-proline 0 CA--C 1.541 0.607 0 CA-C-N 115.881 -0.599 . . . . 0.0 111.477 -178.822 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 98' ' ' PRO . . . . . 0.546 ' HD2' ' N ' ' A' ' 97' ' ' SER . 17.3 Cg_endo -58.97 -33.0 98.57 Favored 'Trans proline' 0 C--N 1.358 1.054 0 C-N-CA 121.988 1.792 . . . . 0.0 112.264 176.314 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 99' ' ' LEU . . . . . 0.545 HD13 HD11 ' A' ' 115' ' ' ILE . 2.5 mp -78.51 -33.57 47.96 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 116.512 -0.313 . . . . 0.0 111.015 -179.129 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 100' ' ' TYR . . . . . . . . . . . . . 19.1 t80 -59.27 -28.07 66.4 Favored 'General case' 0 C--N 1.327 -0.374 0 CA-C-N 115.972 -0.558 . . . . 0.0 111.295 -176.325 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 101' ' ' MET . . . . . . . . . . . . . 27.0 ptt? -95.23 -0.68 52.82 Favored 'General case' 0 C--N 1.327 -0.374 0 CA-C-N 116.161 -0.472 . . . . 0.0 111.379 -179.329 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 102' ' ' LYS . . . . . 0.543 ' HG3' ' O ' ' A' ' 98' ' ' PRO . 91.5 mttt -101.69 162.6 12.78 Favored 'General case' 0 C--N 1.326 -0.45 0 CA-C-O 121.004 0.431 . . . . 0.0 110.562 -178.838 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 103' ' ' SER . . . . . 0.608 ' HA ' ' HA ' ' A' ' 63' ' ' SER . 39.4 t -91.27 158.72 16.41 Favored 'General case' 0 C--N 1.319 -0.722 0 N-CA-C 108.969 -0.752 . . . . 0.0 108.969 172.68 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 104' ' ' LEU . . . . . . . . . . . . . 93.5 mt -56.83 -35.26 68.6 Favored 'General case' 0 C--N 1.325 -0.465 0 CA-C-O 120.824 0.345 . . . . 0.0 111.269 -177.877 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 105' ' ' SER . . . . . . . . . . . . . 25.5 p -77.41 -16.58 58.76 Favored 'General case' 0 C--N 1.324 -0.513 0 CA-C-O 120.968 0.413 . . . . 0.0 111.144 -178.994 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 106' ' ' GLU . . . . . 0.552 ' OE1' ' HB3' ' A' ' 103' ' ' SER . 1.0 OUTLIER -97.08 2.73 51.64 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.119 -0.491 . . . . 0.0 110.875 -178.945 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 107' ' ' ILE . . . . . 0.504 HD11 ' HB2' ' A' ' 64' ' ' PHE . 86.2 mt -96.28 128.92 47.05 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.538 0 CA-C-O 121.101 0.477 . . . . 0.0 110.658 179.749 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 108' ' ' LEU . . . . . 0.708 ' HB2' ' HB2' ' A' ' 111' ' ' ASP . 2.5 mm? -103.48 144.44 28.65 Favored Pre-proline 0 C--N 1.32 -0.682 0 CA-C-N 115.574 -0.739 . . . . 0.0 110.157 -177.937 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 109' ' ' PRO . . . . . . . . . . . . . 32.0 Cg_exo -59.35 -40.73 65.19 Favored 'Trans proline' 0 C--O 1.233 0.26 0 C-N-CA 122.429 2.086 . . . . 0.0 112.035 177.365 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 110' ' ' ALA . . . . . . . . . . . . . . . -75.92 -19.83 58.48 Favored 'General case' 0 C--N 1.332 -0.188 0 CA-C-N 116.295 -0.412 . . . . 0.0 110.794 179.247 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 111' ' ' ASP . . . . . 0.708 ' HB2' ' HB2' ' A' ' 108' ' ' LEU . 33.8 t70 -71.06 -40.83 71.42 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-O 121.299 0.571 . . . . 0.0 109.753 178.769 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 112' ' ' ILE . . . . . 0.52 HG12 HD21 ' A' ' 99' ' ' LEU . 47.9 mt -66.12 -39.34 84.14 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.41 0 CA-C-N 115.71 -0.677 . . . . 0.0 109.759 174.859 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 113' ' ' GLN . . . . . . . . . . . . . 29.6 tp60 -60.83 -31.11 70.54 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 115.388 -0.824 . . . . 0.0 110.095 176.611 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 114' ' ' SER . . . . . . . . . . . . . 22.9 t -67.82 -40.64 83.78 Favored 'General case' 0 C--N 1.33 -0.246 0 CA-C-N 115.866 -0.606 . . . . 0.0 110.29 178.35 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 115' ' ' ILE . . . . . 0.545 HD11 HD13 ' A' ' 99' ' ' LEU . 74.8 mt -59.5 -39.12 78.47 Favored 'Isoleucine or valine' 0 C--O 1.233 0.231 0 CA-C-O 121.012 0.434 . . . . 0.0 110.565 177.105 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 116' ' ' ILE . . . . . . . . . . . . . 47.6 mm -66.44 -31.81 55.24 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.455 0 CA-C-N 115.866 -0.606 . . . . 0.0 110.594 178.143 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 117' ' ' ASN . . . . . . . . . . . . . 8.2 t30 -70.09 -38.08 75.57 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-O 121.069 0.462 . . . . 0.0 110.7 178.269 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 118' ' ' GLU . . . . . . . . . . . . . 39.4 mm-40 -80.14 -30.27 38.97 Favored 'General case' 0 C--N 1.325 -0.494 0 CA-C-N 116.092 -0.503 . . . . 0.0 111.219 -177.677 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 119' ' ' THR . . . . . . . . . . . . . 51.4 m -79.67 110.87 15.42 Favored 'General case' 0 C--N 1.322 -0.591 0 CA-C-O 121.271 0.558 . . . . 0.0 109.851 176.117 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 120' ' ' LYS . . . . . . . . . . . . . 47.4 mttp -111.28 76.83 1.0 Allowed 'General case' 0 C--N 1.317 -0.806 0 CA-C-O 121.46 0.648 . . . . 0.0 110.268 -177.182 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 121' ' ' LEU . . . . . . . . . . . . . 97.9 mt -129.3 -174.88 3.4 Favored 'General case' 0 C--N 1.323 -0.576 0 CA-C-N 114.996 -1.002 . . . . 0.0 109.86 -178.666 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 122' ' ' ALA . . . . . . . . . . . . . . . -62.35 158.2 18.04 Favored 'General case' 0 C--N 1.327 -0.388 0 CA-C-O 120.997 0.427 . . . . 0.0 111.925 -179.001 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 123' ' ' LYS . . . . . . . . . . . . . 93.7 mttt -54.29 -49.6 69.27 Favored 'General case' 0 N--CA 1.464 0.252 0 CA-C-N 115.62 -0.718 . . . . 0.0 111.418 -177.823 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 124' ' ' ASN . . . . . . . . . . . . . 27.8 t-20 -55.13 -40.8 70.96 Favored 'General case' 0 C--N 1.331 -0.234 0 CA-C-N 115.607 -0.724 . . . . 0.0 111.265 -179.038 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 125' ' ' THR . . . . . 0.494 ' O ' HG13 ' A' ' 129' ' ' ILE . 6.5 m -69.13 -44.26 72.71 Favored 'General case' 0 C--N 1.327 -0.393 0 CA-C-N 116.075 -0.512 . . . . 0.0 110.717 -178.447 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 126' ' ' LEU . . . . . . . . . . . . . 87.2 mt -60.26 -45.42 93.36 Favored 'General case' 0 C--O 1.234 0.278 0 CA-C-N 116.26 -0.427 . . . . 0.0 110.907 -179.184 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 127' ' ' LYS . . . . . 0.785 ' HG2' HG13 ' A' ' 156' ' ' ILE . 96.5 mttt -68.28 -36.81 79.95 Favored 'General case' 0 C--N 1.326 -0.44 0 CA-C-N 116.062 -0.517 . . . . 0.0 110.707 179.725 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 128' ' ' ALA . . . . . . . . . . . . . . . -60.34 -41.32 93.35 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.419 -0.355 . . . . 0.0 110.912 179.196 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 129' ' ' ILE . . . . . 0.494 HG13 ' O ' ' A' ' 125' ' ' THR . 80.2 mt -59.87 -49.88 82.21 Favored 'Isoleucine or valine' 0 C--O 1.235 0.301 0 CA-C-N 116.15 -0.477 . . . . 0.0 110.239 177.485 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 130' ' ' ARG . . . . . 0.584 ' NH1' ' HA ' ' A' ' 152' ' ' ASP . 23.3 ttp85 -63.67 -46.11 87.06 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 115.845 -0.616 . . . . 0.0 110.606 -179.216 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 131' ' ' ASN . . . . . . . . . . . . . 92.5 m-20 -58.57 -40.17 82.35 Favored 'General case' 0 N--CA 1.464 0.242 0 CA-C-N 116.302 -0.408 . . . . 0.0 111.086 179.818 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 132' ' ' THR . . . . . 0.424 ' O ' HG13 ' A' ' 136' ' ' ILE . 53.8 m -61.8 -46.61 88.79 Favored 'General case' 0 C--N 1.33 -0.248 0 CA-C-O 120.813 0.34 . . . . 0.0 110.42 177.214 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 133' ' ' ALA . . . . . . . . . . . . . . . -61.15 -44.4 97.38 Favored 'General case' 0 C--N 1.331 -0.233 0 CA-C-N 116.012 -0.54 . . . . 0.0 110.64 178.938 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 134' ' ' SER . . . . . 0.473 ' O ' ' HG3' ' A' ' 138' ' ' ARG . 74.3 m -54.45 -45.9 73.2 Favored 'General case' 0 C--N 1.331 -0.227 0 CA-C-N 116.236 -0.438 . . . . 0.0 111.197 178.665 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 135' ' ' GLN . . . . . . . . . . . . . 75.2 mt-30 -64.9 -38.55 91.35 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-O 120.603 0.24 . . . . 0.0 110.969 -178.855 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 136' ' ' ILE . . . . . 0.424 HG13 ' O ' ' A' ' 132' ' ' THR . 72.4 mt -63.91 -47.01 92.51 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.269 0 CA-C-N 116.485 -0.325 . . . . 0.0 110.704 177.813 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 137' ' ' PHE . . . . . 0.541 ' O ' HG13 ' A' ' 141' ' ' ILE . 46.6 m-85 -63.03 -36.83 84.87 Favored 'General case' 0 C--N 1.331 -0.214 0 CA-C-N 116.303 -0.408 . . . . 0.0 111.004 178.2 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 138' ' ' ARG . . . . . 0.497 ' O ' ' HG3' ' A' ' 142' ' ' GLU . 91.4 mtt180 -61.5 -41.89 97.96 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.742 -0.208 . . . . 0.0 110.819 178.472 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 139' ' ' LEU . . . . . . . . . . . . . 58.2 tp -59.4 -43.02 93.03 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-O 121.147 0.498 . . . . 0.0 110.125 175.213 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 140' ' ' ALA . . . . . . . . . . . . . . . -62.22 -43.64 98.37 Favored 'General case' 0 C--N 1.324 -0.505 0 CA-C-N 115.885 -0.598 . . . . 0.0 110.527 177.201 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 141' ' ' ILE . . . . . 0.541 HG13 ' O ' ' A' ' 137' ' ' PHE . 75.0 mt -61.61 -34.0 59.88 Favored 'Isoleucine or valine' 0 CA--C 1.531 0.238 0 CA-C-N 116.466 -0.334 . . . . 0.0 111.26 176.225 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 142' ' ' GLU . . . . . 0.497 ' HG3' ' O ' ' A' ' 138' ' ' ARG . 43.6 mt-10 -60.37 -41.31 93.48 Favored 'General case' 0 C--N 1.332 -0.17 0 CA-C-O 120.874 0.369 . . . . 0.0 110.692 177.907 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 143' ' ' ASN . . . . . 0.452 HD22 ' N ' ' A' ' 143' ' ' ASN . 0.9 OUTLIER -88.75 -1.58 58.15 Favored 'General case' 0 C--N 1.327 -0.403 0 CA-C-O 121.015 0.436 . . . . 0.0 110.189 176.754 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 144' ' ' ARG . . . . . . . . . . . . . 69.2 mtt180 65.02 27.78 12.54 Favored 'General case' 0 N--CA 1.462 0.155 0 CA-C-N 115.228 -0.897 . . . . 0.0 111.668 177.515 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 145' ' ' ALA . . . . . . . . . . . . . . . -66.62 -43.89 83.51 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 115.685 -0.689 . . . . 0.0 109.508 174.859 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 146' ' ' ILE . . . . . . . . . . . . . 20.5 tt -120.75 151.73 23.72 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.477 0 N-CA-C 108.586 -0.894 . . . . 0.0 108.586 172.632 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 147' ' ' ASP . . . . . . . . . . . . . 39.0 t70 -96.66 -5.86 37.92 Favored 'General case' 0 C--N 1.322 -0.617 0 N-CA-C 112.326 0.491 . . . . 0.0 112.326 -169.723 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 148' ' ' PHE . . . . . . . . . . . . . 47.6 p90 -154.63 171.19 19.89 Favored 'General case' 0 C--N 1.323 -0.558 0 O-C-N 122.18 -0.325 . . . . 0.0 110.783 -173.934 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 149' ' ' ASN . . . . . 0.415 ' HA ' ' HD2' ' A' ' 150' ' ' PRO . 42.9 t-20 -118.51 95.39 48.73 Favored Pre-proline 0 C--N 1.327 -0.393 0 CA-C-N 116.292 -0.413 . . . . 0.0 110.299 -179.011 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 150' ' ' PRO . . . . . 0.415 ' HD2' ' HA ' ' A' ' 149' ' ' ASN . 39.2 Cg_endo -66.61 -22.33 51.02 Favored 'Trans proline' 0 C--N 1.341 0.178 0 C-N-CA 122.817 2.345 . . . . 0.0 112.166 -178.433 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 151' ' ' ALA . . . . . . . . . . . . . . . -70.52 -28.91 65.31 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.227 -0.442 . . . . 0.0 110.564 -179.51 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 152' ' ' ASP . . . . . 0.584 ' HA ' ' NH1' ' A' ' 130' ' ' ARG . 85.6 m-20 -80.01 -10.84 59.8 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-O 121.2 0.524 . . . . 0.0 110.621 179.226 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 153' ' ' TYR . . . . . . . . . . . . . 60.3 t80 -88.9 -16.98 30.55 Favored 'General case' 0 C--N 1.321 -0.661 0 CA-C-N 115.572 -0.74 . . . . 0.0 109.216 174.566 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 154' ' ' VAL . . . . . . . . . . . . . 90.5 t -73.61 130.8 35.67 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.291 0 CA-C-N 115.656 -0.702 . . . . 0.0 109.997 177.535 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 155' ' ' ARG . . . . . . . . . . . . . 71.4 ttt180 -110.7 142.49 42.55 Favored 'General case' 0 C--N 1.318 -0.766 0 N-CA-C 109.523 -0.547 . . . . 0.0 109.523 178.81 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 156' ' ' ILE . . . . . 0.785 HG13 ' HG2' ' A' ' 127' ' ' LYS . 42.3 mm -87.86 116.0 64.81 Favored Pre-proline 0 C--N 1.32 -0.694 0 N-CA-C 109.476 -0.564 . . . . 0.0 109.476 -179.664 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 157' ' ' PRO . . . . . 0.435 ' HD3' ' HA ' ' A' ' 156' ' ' ILE . 24.0 Cg_exo -62.71 130.55 29.98 Favored 'Trans proline' 0 N--CA 1.463 -0.269 0 C-N-CA 122.48 2.12 . . . . 0.0 112.144 -176.561 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 158' ' ' LYS . . . . . . . . . . . . . 10.2 mtmp? -109.13 67.51 0.65 Allowed 'General case' 0 C--N 1.323 -0.563 0 CA-C-N 116.312 -0.404 . . . . 0.0 110.154 179.09 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 159' ' ' ILE . . . . . . . . . . . . . 53.6 mt -78.68 92.57 1.45 Allowed 'Isoleucine or valine' 0 C--N 1.321 -0.638 0 N-CA-C 108.888 -0.782 . . . . 0.0 108.888 176.062 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 160' ' ' ALA . . . . . . . . . . . . . . . -136.33 115.51 12.48 Favored 'General case' 0 C--N 1.318 -0.765 0 CA-C-N 116.001 -0.545 . . . . 0.0 111.257 -172.02 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 161' ' ' LEU . . . . . . . . . . . . . 4.9 mp -106.87 138.56 42.81 Favored 'General case' 0 C--N 1.317 -0.847 0 CA-C-N 115.644 -0.707 . . . . 0.0 109.524 174.332 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 162' ' ' GLU . . . . . . . . . . . . . 4.3 tm-20 -68.93 -27.5 65.81 Favored 'General case' 0 C--N 1.323 -0.577 0 CA-C-N 115.748 -0.66 . . . . 0.0 110.334 -179.252 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 163' ' ' HIS . . . . . . . . . . . . . 33.1 m170 -84.71 139.62 31.87 Favored 'General case' 0 C--N 1.323 -0.563 0 CA-C-N 116.051 -0.522 . . . . 0.0 109.848 175.127 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 164' ' ' HIS . . . . . . . . . . . . . 15.7 m-70 -74.37 151.16 39.77 Favored 'General case' 0 C--N 1.322 -0.629 0 CA-C-N 115.762 -0.654 . . . . 0.0 110.481 -174.743 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 165' ' ' HIS . . . . . 0.418 ' HB2' ' H ' ' A' ' 166' ' ' HIS . 24.2 m80 -91.96 -97.76 0.12 Allowed 'General case' 0 C--N 1.328 -0.358 0 CA-C-O 121.121 0.486 . . . . 0.0 110.892 -173.192 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 166' ' ' HIS . . . . . 0.418 ' H ' ' HB2' ' A' ' 165' ' ' HIS . 89.5 m-70 -110.86 -46.28 3.37 Favored 'General case' 0 CA--C 1.514 -0.406 0 N-CA-C 108.761 -0.829 . . . . 0.0 108.761 177.794 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 167' ' ' HIS . . . . . . . . . . . . . 18.1 m-70 -73.25 114.53 11.55 Favored 'General case' 0 N--CA 1.45 -0.44 0 CA-C-N 115.327 -0.852 . . . . 0.0 108.89 171.485 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 168' ' ' HIS . . . . . . . . . . . . . 56.3 p-80 . . . . . 0 C--O 1.245 0.827 0 CA-C-O 118.231 -0.89 . . . . 0.0 109.562 179.372 . . . . . . . . 0 0 . 1 . 002 nuclear nobuild full ' A' A ' 61' ' ' ARG . . . . . . . . . . . . . 32.5 mmt180 . . . . . 0 N--CA 1.477 0.885 0 N-CA-C 109.978 -0.378 . . . . 0.0 109.978 . . . . . . . . . 0 0 . 1 . 002 nuclear nobuild full ' A' A ' 62' ' ' ASP . . . . . . . . . . . . . 5.0 m-20 -99.65 122.29 42.46 Favored 'General case' 0 C--N 1.322 -0.607 0 CA-C-O 121.081 0.467 . . . . 0.0 110.62 -178.801 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 63' ' ' SER . . . . . . . . . . . . . 22.9 t -89.48 178.33 6.33 Favored 'General case' 0 C--N 1.318 -0.797 0 N-CA-C 109.001 -0.741 . . . . 0.0 109.001 176.869 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 64' ' ' PHE . . . . . 0.433 ' HB2' HD11 ' A' ' 107' ' ' ILE . 73.8 t80 -66.18 -32.53 74.03 Favored 'General case' 0 C--N 1.328 -0.332 0 N-CA-C 109.149 -0.686 . . . . 0.0 109.149 177.386 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 65' ' ' GLY . . . . . . . . . . . . . . . -59.76 -40.21 96.32 Favored Glycine 0 N--CA 1.448 -0.508 0 CA-C-N 115.775 -0.648 . . . . 0.0 111.666 175.427 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 66' ' ' ASP . . . . . 0.424 ' O ' ' HB2' ' A' ' 70' ' ' LYS . 9.1 m-20 -61.96 -45.06 95.3 Favored 'General case' 0 CA--C 1.519 -0.239 0 CA-C-O 120.83 0.347 . . . . 0.0 110.628 178.682 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 67' ' ' TRP . . . . . 0.517 ' HA ' ' HB2' ' A' ' 70' ' ' LYS . 90.2 m95 -78.13 -31.92 50.14 Favored 'General case' 0 C--N 1.327 -0.383 0 CA-C-N 116.275 -0.42 . . . . 0.0 111.861 -176.856 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 68' ' ' ALA . . . . . 0.557 ' HB1' ' HB3' ' A' ' 92' ' ' CYS . . . -63.08 -44.2 96.42 Favored 'General case' 0 C--N 1.325 -0.474 0 N-CA-C 109.687 -0.486 . . . . 0.0 109.687 174.955 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 69' ' ' GLU . . . . . . . . . . . . . 3.7 tp10 -68.56 -38.12 80.49 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 115.639 -0.71 . . . . 0.0 109.885 174.9 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 70' ' ' LYS . . . . . 0.517 ' HB2' ' HA ' ' A' ' 67' ' ' TRP . 1.7 tppt? -57.51 -45.52 84.85 Favored 'General case' 0 C--N 1.331 -0.201 0 CA-C-N 115.86 -0.609 . . . . 0.0 110.343 179.303 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 71' ' ' PHE . . . . . . . . . . . . . 70.1 t80 -62.5 -44.45 96.34 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 115.834 -0.621 . . . . 0.0 110.593 179.651 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 72' ' ' LEU . . . . . 0.529 HD21 ' HA ' ' A' ' 89' ' ' LYS . 8.5 mp -60.33 -48.86 79.92 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.076 -0.511 . . . . 0.0 110.56 177.226 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 73' ' ' LYS . . . . . . . . . . . . . 59.1 mtpt -59.77 -38.52 82.05 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 116.284 -0.416 . . . . 0.0 110.943 178.335 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 74' ' ' SER . . . . . 0.428 ' O ' ' HB2' ' A' ' 78' ' ' ASP . 58.5 m -61.61 -45.03 95.83 Favored 'General case' 0 C--N 1.327 -0.371 0 CA-C-N 116.431 -0.349 . . . . 0.0 110.947 179.36 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 75' ' ' LYS . . . . . . . . . . . . . 72.3 mmtt -71.29 -42.93 68.09 Favored 'General case' 0 C--N 1.327 -0.377 0 CA-C-O 120.757 0.313 . . . . 0.0 111.071 178.774 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 76' ' ' GLU . . . . . . . . . . . . . 9.4 tp10 -57.48 -46.08 84.1 Favored 'General case' 0 C--N 1.327 -0.383 0 CA-C-N 115.825 -0.625 . . . . 0.0 110.513 179.205 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 77' ' ' ALA . . . . . . . . . . . . . . . -79.25 -21.97 45.4 Favored 'General case' 0 C--N 1.327 -0.405 0 CA-C-N 116.022 -0.535 . . . . 0.0 111.497 -178.582 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 78' ' ' ASP . . . . . 0.428 ' HB2' ' O ' ' A' ' 74' ' ' SER . 24.3 t70 -68.8 -54.5 15.49 Favored 'General case' 0 C--N 1.327 -0.378 0 CA-C-O 121.051 0.453 . . . . 0.0 110.28 179.907 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 79' ' ' GLY . . . . . . . . . . . . . . . 137.61 65.22 0.05 OUTLIER Glycine 0 N--CA 1.445 -0.76 0 CA-C-N 115.688 -0.687 . . . . 0.0 112.194 179.482 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 80' ' ' VAL . . . . . . . . . . . . . 35.0 m -119.0 160.01 19.17 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.523 0 N-CA-C 109.882 -0.414 . . . . 0.0 109.882 176.03 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 81' ' ' SER . . . . . . . . . . . . . 8.7 t -72.35 159.56 33.81 Favored 'General case' 0 C--N 1.322 -0.591 0 N-CA-C 110.08 -0.341 . . . . 0.0 110.08 179.693 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 82' ' ' VAL . . . . . . . . . . . . . 48.2 t -59.91 -46.07 94.37 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.322 0 CA-C-O 120.785 0.326 . . . . 0.0 110.699 -177.793 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 83' ' ' SER . . . . . . . . . . . . . 52.7 p -57.09 -40.83 77.72 Favored 'General case' 0 C--N 1.326 -0.414 0 CA-C-N 115.961 -0.563 . . . . 0.0 110.591 178.252 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 84' ' ' GLN . . . . . . . . . . . . . 6.6 tp-100 -65.5 -45.72 82.51 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 115.644 -0.707 . . . . 0.0 110.336 -179.382 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 85' ' ' LEU . . . . . 0.441 HD21 ' O ' ' A' ' 72' ' ' LEU . 1.3 tm? -64.28 -42.36 96.47 Favored 'General case' 0 C--N 1.325 -0.458 0 CA-C-N 116.059 -0.519 . . . . 0.0 109.618 178.767 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 86' ' ' ASN . . . . . . . . . . . . . 5.8 m-20 -66.82 -21.83 66.02 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.259 -0.428 . . . . 0.0 111.426 178.407 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 87' ' ' SER . . . . . . . . . . . . . 50.5 m -67.08 -48.54 67.91 Favored 'General case' 0 C--N 1.326 -0.445 0 N-CA-C 109.466 -0.568 . . . . 0.0 109.466 174.222 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 88' ' ' TYR . . . . . 0.418 ' HA ' ' CD2' ' A' ' 91' ' ' TYR . 47.8 m-85 -66.06 -35.78 81.46 Favored 'General case' 0 C--N 1.334 -0.107 0 CA-C-O 121.324 0.583 . . . . 0.0 109.832 176.689 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 89' ' ' LYS . . . . . 0.529 ' HA ' HD21 ' A' ' 72' ' ' LEU . 34.5 ttmt -60.14 -43.68 95.51 Favored 'General case' 0 C--N 1.325 -0.492 0 CA-C-N 115.208 -0.906 . . . . 0.0 110.389 177.862 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 90' ' ' ASN . . . . . 0.438 ' O ' ' HB2' ' A' ' 94' ' ' ASN . 36.1 t30 -63.46 -33.39 75.46 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 115.929 -0.578 . . . . 0.0 110.749 177.829 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 91' ' ' TYR . . . . . 0.418 ' CD2' ' HA ' ' A' ' 88' ' ' TYR . 23.2 m-85 -69.88 -59.76 2.72 Favored 'General case' 0 C--N 1.324 -0.52 0 CA-C-N 116.462 -0.335 . . . . 0.0 110.36 177.395 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 92' ' ' CYS . . . . . 0.557 ' HB3' ' HB1' ' A' ' 68' ' ' ALA . 82.0 m -66.53 -47.68 72.14 Favored 'General case' 0 C--N 1.326 -0.423 0 N-CA-C 112.778 0.658 . . . . 0.0 112.778 -173.086 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 93' ' ' ARG . . . . . 0.417 HH11 ' HD3' ' A' ' 93' ' ' ARG . 10.4 mmm180 -77.17 -49.12 15.89 Favored 'General case' 0 C--N 1.326 -0.449 0 N-CA-C 111.966 0.358 . . . . 0.0 111.966 -173.669 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 94' ' ' ASN . . . . . 0.438 ' HB2' ' O ' ' A' ' 90' ' ' ASN . 2.6 m-20 -84.8 -50.73 7.32 Favored 'General case' 0 C--N 1.325 -0.496 0 CA-C-N 116.167 -0.47 . . . . 0.0 111.819 -172.209 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 95' ' ' HIS . . . . . . . . . . . . . 78.5 m80 -86.24 -40.93 15.05 Favored 'General case' 0 C--N 1.325 -0.497 0 N-CA-C 112.017 0.377 . . . . 0.0 112.017 -172.391 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 96' ' ' LEU . . . . . 0.518 HD12 ' HA ' ' A' ' 92' ' ' CYS . 96.0 mt -89.17 22.26 2.89 Favored 'General case' 0 C--N 1.323 -0.586 0 CA-C-O 120.956 0.407 . . . . 0.0 110.699 -179.765 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 97' ' ' SER . . . . . 0.488 ' OG ' ' HD3' ' A' ' 98' ' ' PRO . 3.1 p -57.36 -41.49 91.11 Favored Pre-proline 0 CA--C 1.545 0.771 0 N-CA-C 113.188 0.81 . . . . 0.0 113.188 -179.183 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 98' ' ' PRO . . . . . 0.488 ' HD3' ' OG ' ' A' ' 97' ' ' SER . 31.5 Cg_exo -58.46 -35.74 98.32 Favored 'Trans proline' 0 C--N 1.363 1.33 0 C-N-CA 121.631 1.554 . . . . 0.0 112.109 176.965 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 99' ' ' LEU . . . . . . . . . . . . . 49.2 mt -84.63 -30.07 25.22 Favored 'General case' 0 C--N 1.326 -0.45 0 CA-C-N 116.263 -0.426 . . . . 0.0 110.657 -176.85 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 100' ' ' TYR . . . . . . . . . . . . . 17.4 t80 -57.82 -26.69 62.34 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 115.811 -0.631 . . . . 0.0 111.297 -176.495 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 101' ' ' MET . . . . . . . . . . . . . 26.8 ptt? -97.81 1.92 48.81 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.215 -0.448 . . . . 0.0 111.44 -178.115 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 102' ' ' LYS . . . . . . . . . . . . . 95.5 mttt -109.23 149.29 29.62 Favored 'General case' 0 C--N 1.326 -0.435 0 CA-C-O 120.732 0.301 . . . . 0.0 110.527 -178.285 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 103' ' ' SER . . . . . 0.422 ' O ' HG13 ' A' ' 107' ' ' ILE . 62.5 m -70.04 146.95 50.62 Favored 'General case' 0 C--N 1.323 -0.579 0 CA-C-N 116.226 -0.443 . . . . 0.0 110.238 178.867 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 104' ' ' LEU . . . . . . . . . . . . . 26.5 tp -55.28 -33.6 63.36 Favored 'General case' 0 C--N 1.326 -0.419 0 CA-C-N 115.816 -0.629 . . . . 0.0 111.861 -177.272 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 105' ' ' SER . . . . . . . . . . . . . 2.9 p -81.74 -16.59 50.63 Favored 'General case' 0 C--N 1.323 -0.571 0 N-CA-C 112.769 0.655 . . . . 0.0 112.769 -173.756 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 106' ' ' GLU . . . . . . . . . . . . . 20.3 pt-20 -108.21 9.32 28.11 Favored 'General case' 0 C--N 1.329 -0.325 0 C-N-CA 120.798 -0.361 . . . . 0.0 111.884 -172.388 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 107' ' ' ILE . . . . . 0.433 HD11 ' HB2' ' A' ' 64' ' ' PHE . 69.1 mt -88.03 102.68 12.86 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.5 0 CA-C-O 121.152 0.501 . . . . 0.0 110.707 -179.873 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 108' ' ' LEU . . . . . 0.626 ' H ' HD23 ' A' ' 108' ' ' LEU . 2.5 pt? -75.4 143.25 75.9 Favored Pre-proline 0 C--N 1.324 -0.519 0 CA-C-N 115.86 -0.609 . . . . 0.0 110.391 177.104 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 109' ' ' PRO . . . . . 0.456 ' HG3' ' HB3' ' A' ' 150' ' ' PRO . 32.5 Cg_exo -57.13 -31.41 90.33 Favored 'Trans proline' 0 C--N 1.347 0.479 0 C-N-CA 123.053 2.502 . . . . 0.0 112.347 -177.714 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 110' ' ' ALA . . . . . . . . . . . . . . . -61.55 -35.42 77.73 Favored 'General case' 0 C--N 1.327 -0.375 0 CA-C-N 115.677 -0.692 . . . . 0.0 111.375 -178.859 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 111' ' ' ASP . . . . . . . . . . . . . 26.0 t70 -72.06 -37.89 69.56 Favored 'General case' 0 C--O 1.234 0.289 0 CA-C-O 121.031 0.443 . . . . 0.0 110.338 -176.357 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 112' ' ' ILE . . . . . 0.442 ' HB ' HG21 ' A' ' 154' ' ' VAL . 34.9 mt -66.36 -38.39 81.71 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.363 0 CA-C-N 115.928 -0.578 . . . . 0.0 109.444 175.678 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 113' ' ' GLN . . . . . . . . . . . . . 27.3 tp60 -62.19 -37.46 85.36 Favored 'General case' 0 C--N 1.331 -0.216 0 CA-C-N 115.472 -0.786 . . . . 0.0 110.032 177.002 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 114' ' ' SER . . . . . . . . . . . . . 33.8 m -59.72 -40.67 88.8 Favored 'General case' 0 C--N 1.334 -0.09 0 CA-C-N 116.155 -0.475 . . . . 0.0 110.786 177.031 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 115' ' ' ILE . . . . . . . . . . . . . 69.4 mt -61.75 -47.89 91.19 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.303 0 CA-C-N 116.252 -0.431 . . . . 0.0 110.478 178.934 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 116' ' ' ILE . . . . . . . . . . . . . 38.9 mm -70.68 -18.18 20.89 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.31 0 CA-C-O 121.279 0.562 . . . . 0.0 110.653 -179.365 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 117' ' ' ASN . . . . . . . . . . . . . 1.9 m-20 -77.43 -51.29 11.03 Favored 'General case' 0 C--N 1.326 -0.421 0 CA-C-N 116.006 -0.543 . . . . 0.0 111.253 178.646 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 118' ' ' GLU . . . . . . . . . . . . . 25.3 mt-10 -82.93 -30.23 28.54 Favored 'General case' 0 C--O 1.236 0.346 0 N-CA-C 111.957 0.355 . . . . 0.0 111.957 -175.657 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 119' ' ' THR . . . . . . . . . . . . . 62.0 m -70.26 111.55 5.95 Favored 'General case' 0 C--N 1.325 -0.459 0 N-CA-C 109.474 -0.565 . . . . 0.0 109.474 177.031 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 120' ' ' LYS . . . . . . . . . . . . . 35.2 mtmm -111.91 78.29 1.11 Allowed 'General case' 0 C--N 1.323 -0.585 0 CA-C-O 121.658 0.742 . . . . 0.0 111.027 -176.68 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 121' ' ' LEU . . . . . 0.412 ' H ' HD21 ' A' ' 126' ' ' LEU . 4.6 mm? -108.79 -174.84 2.61 Favored 'General case' 0 C--N 1.318 -0.796 0 CA-C-N 114.357 -1.292 . . . . 0.0 108.402 172.949 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 122' ' ' ALA . . . . . . . . . . . . . . . -56.04 134.03 52.24 Favored 'General case' 0 C--N 1.324 -0.523 0 N-CA-C 109.643 -0.503 . . . . 0.0 109.643 172.164 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 123' ' ' LYS . . . . . 0.597 ' HD2' HD11 ' A' ' 159' ' ' ILE . 35.1 mtmm -54.07 -35.53 62.16 Favored 'General case' 0 C--N 1.327 -0.403 0 CA-C-N 116.482 -0.326 . . . . 0.0 111.392 -178.644 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 124' ' ' ASN . . . . . . . . . . . . . 36.7 t30 -57.32 -43.39 83.27 Favored 'General case' 0 C--N 1.327 -0.407 0 CA-C-O 121.115 0.484 . . . . 0.0 110.455 175.961 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 125' ' ' THR . . . . . 0.47 ' O ' HG13 ' A' ' 129' ' ' ILE . 33.4 m -73.32 -34.75 65.85 Favored 'General case' 0 C--N 1.326 -0.432 0 CA-C-N 115.852 -0.613 . . . . 0.0 110.764 179.58 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 126' ' ' LEU . . . . . 0.412 HD21 ' H ' ' A' ' 121' ' ' LEU . 92.2 mt -60.96 -42.17 97.74 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-O 120.981 0.42 . . . . 0.0 110.348 177.061 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 127' ' ' LYS . . . . . 0.53 ' HG3' ' O ' ' A' ' 123' ' ' LYS . 44.7 mtpt -60.12 -45.9 91.45 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 115.703 -0.68 . . . . 0.0 109.996 175.16 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 128' ' ' ALA . . . . . . . . . . . . . . . -58.04 -45.86 86.27 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 115.719 -0.673 . . . . 0.0 111.355 -179.421 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 129' ' ' ILE . . . . . 0.47 HG13 ' O ' ' A' ' 125' ' ' THR . 71.9 mt -59.02 -48.32 87.05 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.228 0 CA-C-O 121.122 0.487 . . . . 0.0 110.439 178.155 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 130' ' ' ARG . . . . . 0.428 ' HD3' ' O ' ' A' ' 151' ' ' ALA . 1.5 tmm_? -62.81 -49.56 74.47 Favored 'General case' 0 C--N 1.326 -0.431 0 CA-C-N 115.672 -0.694 . . . . 0.0 110.333 -178.851 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 131' ' ' ASN . . . . . . . . . . . . . 95.9 m-20 -62.55 -39.25 93.03 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-N 116.165 -0.47 . . . . 0.0 111.195 -176.945 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 132' ' ' THR . . . . . 0.496 ' O ' HG13 ' A' ' 136' ' ' ILE . 56.5 m -59.5 -42.16 91.53 Favored 'General case' 0 C--N 1.327 -0.407 0 CA-C-O 120.796 0.331 . . . . 0.0 110.188 176.941 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 133' ' ' ALA . . . . . . . . . . . . . . . -65.37 -44.09 88.69 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 116.162 -0.472 . . . . 0.0 111.207 179.613 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 134' ' ' SER . . . . . 0.457 ' HA ' ' HB3' ' A' ' 151' ' ' ALA . 10.9 p -64.88 -30.31 71.3 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-O 120.651 0.262 . . . . 0.0 111.123 179.916 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 135' ' ' GLN . . . . . 0.541 ' HA ' ' HG2' ' A' ' 138' ' ' ARG . 2.1 mp0 -71.79 -34.96 69.84 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.423 -0.353 . . . . 0.0 110.515 175.813 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 136' ' ' ILE . . . . . 0.496 HG13 ' O ' ' A' ' 132' ' ' THR . 77.8 mt -63.11 -47.36 92.87 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.459 0 CA-C-N 116.128 -0.487 . . . . 0.0 110.492 175.737 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 137' ' ' PHE . . . . . 0.429 ' O ' HG13 ' A' ' 141' ' ' ILE . 48.7 m-85 -64.81 -38.36 90.72 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 116.18 -0.464 . . . . 0.0 111.712 -179.911 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 138' ' ' ARG . . . . . 0.541 ' HG2' ' HA ' ' A' ' 135' ' ' GLN . 9.4 ptm180 -73.73 -25.87 60.4 Favored 'General case' 0 C--N 1.329 -0.307 0 C-N-CA 120.622 -0.431 . . . . 0.0 110.377 -179.393 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 139' ' ' LEU . . . . . . . . . . . . . 55.9 tp -67.51 -32.56 73.45 Favored 'General case' 0 C--N 1.332 -0.153 0 CA-C-O 121.58 0.705 . . . . 0.0 109.391 173.712 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 140' ' ' ALA . . . . . 0.415 ' HB1' ' HB3' ' A' ' 145' ' ' ALA . . . -72.55 -38.33 68.01 Favored 'General case' 0 C--N 1.322 -0.61 0 CA-C-N 115.46 -0.791 . . . . 0.0 110.452 175.408 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 141' ' ' ILE . . . . . 0.429 HG13 ' O ' ' A' ' 137' ' ' PHE . 75.5 mt -56.93 -47.69 82.78 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.286 0 CA-C-N 116.118 -0.492 . . . . 0.0 111.455 177.335 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 142' ' ' GLU . . . . . . . . . . . . . 11.3 pt-20 -70.44 -6.71 37.79 Favored 'General case' 0 CA--C 1.533 0.302 0 CA-C-O 120.924 0.393 . . . . 0.0 111.671 -177.401 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 143' ' ' ASN . . . . . . . . . . . . . 45.4 m-80 -110.99 9.46 22.18 Favored 'General case' 0 C--N 1.326 -0.456 0 CA-C-O 120.857 0.36 . . . . 0.0 110.399 174.678 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 144' ' ' ARG . . . . . . . . . . . . . 41.1 mtm105 62.18 23.23 13.7 Favored 'General case' 0 N--CA 1.463 0.21 0 CA-C-N 115.346 -0.843 . . . . 0.0 111.427 177.429 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 145' ' ' ALA . . . . . 0.415 ' HB3' ' HB1' ' A' ' 140' ' ' ALA . . . -77.94 -35.48 50.35 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-O 120.981 0.419 . . . . 0.0 110.285 179.407 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 146' ' ' ILE . . . . . 0.449 HG12 ' H ' ' A' ' 148' ' ' PHE . 15.6 tt -144.0 152.0 16.08 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.509 0 CA-C-N 115.783 -0.644 . . . . 0.0 109.313 178.093 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 147' ' ' ASP . . . . . . . . . . . . . 33.4 t70 -113.03 14.93 19.71 Favored 'General case' 0 C--N 1.323 -0.573 0 CA-C-O 121.549 0.69 . . . . 0.0 110.495 -176.416 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 148' ' ' PHE . . . . . 0.449 ' H ' HG12 ' A' ' 146' ' ' ILE . 61.2 t80 -145.13 144.3 30.84 Favored 'General case' 0 C--N 1.321 -0.669 0 CA-C-N 115.643 -0.708 . . . . 0.0 109.576 -174.972 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 149' ' ' ASN . . . . . . . . . . . . . 48.0 t-20 -119.18 88.71 37.94 Favored Pre-proline 0 C--N 1.325 -0.467 0 CA-C-O 120.963 0.411 . . . . 0.0 110.413 179.14 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 150' ' ' PRO . . . . . 0.456 ' HB3' ' HG3' ' A' ' 109' ' ' PRO . 35.8 Cg_exo -59.95 -29.25 88.94 Favored 'Trans proline' 0 C--N 1.342 0.195 0 C-N-CA 122.612 2.208 . . . . 0.0 112.154 -178.549 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 151' ' ' ALA . . . . . 0.457 ' HB3' ' HA ' ' A' ' 134' ' ' SER . . . -70.33 -27.78 64.63 Favored 'General case' 0 N--CA 1.449 -0.483 0 CA-C-N 115.69 -0.687 . . . . 0.0 112.164 -173.218 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 152' ' ' ASP . . . . . . . . . . . . . 0.0 OUTLIER -79.03 -14.37 59.22 Favored 'General case' 0 C--N 1.331 -0.232 0 C-N-CA 119.531 -0.868 . . . . 0.0 109.889 -176.953 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 153' ' ' TYR . . . . . . . . . . . . . 86.3 m-85 -88.46 -1.0 57.81 Favored 'General case' 0 C--N 1.331 -0.227 0 CA-C-N 116.036 -0.529 . . . . 0.0 110.522 176.768 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 154' ' ' VAL . . . . . 0.442 HG21 ' HB ' ' A' ' 112' ' ' ILE . 73.5 t -85.87 126.36 40.56 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.436 0 CA-C-N 115.861 -0.608 . . . . 0.0 109.793 175.788 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 155' ' ' ARG . . . . . . . . . . . . . 38.7 ttt180 -103.63 140.59 37.36 Favored 'General case' 0 C--N 1.323 -0.585 0 CA-C-N 116.222 -0.445 . . . . 0.0 111.127 -173.421 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 156' ' ' ILE . . . . . 0.408 HG12 ' HG2' ' A' ' 127' ' ' LYS . 1.9 mp -88.32 140.7 30.4 Favored Pre-proline 0 C--N 1.328 -0.346 0 CA-C-N 115.656 -0.702 . . . . 0.0 110.135 177.904 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 157' ' ' PRO . . . . . . . . . . . . . 52.0 Cg_exo -56.98 128.63 30.68 Favored 'Trans proline' 0 N--CA 1.459 -0.541 0 C-N-CA 122.083 1.855 . . . . 0.0 111.818 173.221 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 158' ' ' LYS . . . . . 0.605 ' HB2' HD13 ' A' ' 159' ' ' ILE . 41.8 mttm 68.7 -48.21 0.57 Allowed 'General case' 0 N--CA 1.466 0.347 0 C-N-CA 124.04 0.936 . . . . 0.0 113.424 175.739 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 159' ' ' ILE . . . . . 0.605 HD13 ' HB2' ' A' ' 158' ' ' LYS . 0.4 OUTLIER -88.52 126.31 41.75 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.51 0 CA-C-O 120.937 0.399 . . . . 0.0 111.469 -169.003 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 160' ' ' ALA . . . . . . . . . . . . . . . -135.2 -164.76 1.57 Allowed 'General case' 0 C--N 1.321 -0.642 0 CA-C-N 115.594 -0.73 . . . . 0.0 109.655 176.733 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 161' ' ' LEU . . . . . . . . . . . . . 95.2 mt -96.78 -179.44 4.58 Favored 'General case' 0 C--N 1.321 -0.64 0 N-CA-C 110.324 -0.25 . . . . 0.0 110.324 177.989 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 162' ' ' GLU . . . . . . . . . . . . . 37.2 mt-10 66.67 -171.53 0.19 Allowed 'General case' 0 N--CA 1.463 0.187 0 O-C-N 123.645 0.59 . . . . 0.0 111.28 179.587 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 163' ' ' HIS . . . . . . . . . . . . . 28.0 p80 -107.8 117.52 34.32 Favored 'General case' 0 C--N 1.325 -0.46 0 CA-C-O 121.305 0.574 . . . . 0.0 110.045 176.752 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 164' ' ' HIS . . . . . . . . . . . . . 4.5 m-70 -132.67 -13.92 2.87 Favored 'General case' 0 C--N 1.323 -0.549 0 CA-C-N 115.386 -0.825 . . . . 0.0 110.372 179.005 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 165' ' ' HIS . . . . . 0.402 ' O ' ' HB3' ' A' ' 166' ' ' HIS . 42.9 t60 -131.07 -8.53 3.86 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.33 -0.396 . . . . 0.0 111.133 -176.435 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 166' ' ' HIS . . . . . 0.402 ' HB3' ' O ' ' A' ' 165' ' ' HIS . 19.9 t-80 67.1 49.28 1.12 Allowed 'General case' 0 N--CA 1.468 0.434 0 CA-C-O 121.945 0.878 . . . . 0.0 109.825 -176.509 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 167' ' ' HIS . . . . . . . . . . . . . 57.1 t-80 -156.17 122.45 5.07 Favored 'General case' 0 C--N 1.323 -0.57 0 CA-C-N 115.381 -0.827 . . . . 0.0 109.973 178.706 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 168' ' ' HIS . . . . . . . . . . . . . 5.6 p-80 . . . . . 0 C--O 1.244 0.787 0 CA-C-O 119.01 -0.519 . . . . 0.0 110.671 177.887 . . . . . . . . 0 0 . 1 . 003 nuclear nobuild full ' A' A ' 61' ' ' ARG . . . . . . . . . . . . . 42.0 ttt85 . . . . . 0 N--CA 1.48 1.069 0 N-CA-C 110.69 -0.115 . . . . 0.0 110.69 . . . . . . . . . 0 0 . 1 . 003 nuclear nobuild full ' A' A ' 62' ' ' ASP . . . . . . . . . . . . . 26.6 m-20 46.95 80.07 0.05 Allowed 'General case' 0 N--CA 1.47 0.548 0 CA-C-O 121.457 0.646 . . . . 0.0 112.214 178.736 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 63' ' ' SER . . . . . 0.437 ' HA ' ' HA ' ' A' ' 103' ' ' SER . 32.3 m -92.54 145.05 24.74 Favored 'General case' 0 C--N 1.318 -0.763 0 CA-C-N 115.85 -0.614 . . . . 0.0 110.035 179.008 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 64' ' ' PHE . . . . . 0.411 ' HB3' ' O ' ' A' ' 99' ' ' LEU . 88.6 t80 -60.72 -44.71 96.29 Favored 'General case' 0 C--N 1.326 -0.438 0 CA-C-N 116.366 -0.379 . . . . 0.0 110.812 -177.888 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 65' ' ' GLY . . . . . . . . . . . . . . . -68.47 -23.83 75.15 Favored Glycine 0 N--CA 1.451 -0.365 0 C-N-CA 120.765 -0.731 . . . . 0.0 112.374 179.622 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 66' ' ' ASP . . . . . . . . . . . . . 29.9 t70 -74.64 -47.65 30.82 Favored 'General case' 0 C--N 1.322 -0.598 0 N-CA-C 109.512 -0.551 . . . . 0.0 109.512 177.221 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 67' ' ' TRP . . . . . 0.498 ' HA ' ' HG3' ' A' ' 70' ' ' LYS . 64.3 m95 -65.29 -31.37 72.47 Favored 'General case' 0 C--N 1.33 -0.243 0 CA-C-N 115.91 -0.586 . . . . 0.0 110.906 175.361 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 68' ' ' ALA . . . . . 0.552 ' O ' ' HG ' ' A' ' 72' ' ' LEU . . . -61.93 -41.69 98.25 Favored 'General case' 0 C--N 1.327 -0.403 0 CA-C-N 116.171 -0.468 . . . . 0.0 110.239 174.935 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 69' ' ' GLU . . . . . . . . . . . . . 76.8 tt0 -63.74 -41.44 98.03 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.106 -0.497 . . . . 0.0 109.884 177.2 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 70' ' ' LYS . . . . . 0.498 ' HG3' ' HA ' ' A' ' 67' ' ' TRP . 14.1 mmmt -55.72 -47.29 77.12 Favored 'General case' 0 C--N 1.333 -0.122 0 CA-C-N 115.696 -0.684 . . . . 0.0 109.695 174.919 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 71' ' ' PHE . . . . . . . . . . . . . 91.9 t80 -63.97 -44.54 92.44 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 115.378 -0.828 . . . . 0.0 111.219 179.421 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 72' ' ' LEU . . . . . 0.552 ' HG ' ' O ' ' A' ' 68' ' ' ALA . 96.4 mt -60.36 -49.11 78.88 Favored 'General case' 0 C--N 1.327 -0.405 0 CA-C-O 120.735 0.303 . . . . 0.0 111.05 -178.914 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 73' ' ' LYS . . . . . . . . . . . . . 55.7 tptt -65.26 -37.56 87.6 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-O 121.032 0.444 . . . . 0.0 110.331 179.607 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 74' ' ' SER . . . . . . . . . . . . . 27.3 t -66.11 -41.7 90.23 Favored 'General case' 0 C--N 1.326 -0.436 0 CA-C-N 116.07 -0.514 . . . . 0.0 110.277 177.994 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 75' ' ' LYS . . . . . 0.444 ' HA ' ' HD2' ' A' ' 75' ' ' LYS . 38.7 tptt -72.13 -30.8 65.41 Favored 'General case' 0 N--CA 1.447 -0.622 0 CA-C-O 121.011 0.434 . . . . 0.0 110.687 -177.927 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 76' ' ' GLU . . . . . . . . . . . . . 37.2 tt0 -58.82 -50.14 75.07 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.202 -0.454 . . . . 0.0 109.811 171.591 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 77' ' ' ALA . . . . . . . . . . . . . . . -69.3 -27.34 65.31 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 115.935 -0.575 . . . . 0.0 110.748 178.348 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 78' ' ' ASP . . . . . 0.407 ' HB3' ' O ' ' A' ' 75' ' ' LYS . 24.1 t70 -59.27 -31.15 68.84 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 115.752 -0.658 . . . . 0.0 110.009 175.823 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 79' ' ' GLY . . . . . . . . . . . . . . . 105.17 53.22 0.8 Allowed Glycine 0 N--CA 1.451 -0.319 0 C-N-CA 120.715 -0.755 . . . . 0.0 113.238 172.466 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 80' ' ' VAL . . . . . . . . . . . . . 30.2 m -99.73 161.38 3.26 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.519 0 CA-C-O 120.685 0.279 . . . . 0.0 111.001 178.644 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 81' ' ' SER . . . . . . . . . . . . . 5.5 m -66.09 154.61 39.13 Favored 'General case' 0 C--N 1.325 -0.496 0 CA-C-N 115.767 -0.651 . . . . 0.0 110.379 178.164 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 82' ' ' VAL . . . . . . . . . . . . . 8.7 p -59.78 -40.21 81.93 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.297 0 CA-C-O 120.542 0.21 . . . . 0.0 111.199 -178.433 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 83' ' ' SER . . . . . . . . . . . . . 69.2 m -74.09 -22.29 59.56 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-O 120.662 0.267 . . . . 0.0 110.725 178.59 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 84' ' ' GLN . . . . . . . . . . . . . 50.8 tt0 -71.96 -44.33 63.74 Favored 'General case' 0 N--CA 1.455 -0.189 0 N-CA-C 109.336 -0.616 . . . . 0.0 109.336 178.228 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 85' ' ' LEU . . . . . 0.447 ' HA ' HD22 ' A' ' 85' ' ' LEU . 0.3 OUTLIER -63.4 -36.14 82.75 Favored 'General case' 0 C--N 1.327 -0.409 0 N-CA-C 109.12 -0.696 . . . . 0.0 109.12 175.869 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 86' ' ' ASN . . . . . . . . . . . . . 8.1 m-80 -66.74 -37.52 84.82 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 115.612 -0.722 . . . . 0.0 111.707 178.392 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 87' ' ' SER . . . . . . . . . . . . . 66.6 p -67.1 -29.74 69.57 Favored 'General case' 0 C--N 1.332 -0.189 0 C-N-CA 120.667 -0.413 . . . . 0.0 110.694 178.846 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 88' ' ' TYR . . . . . . . . . . . . . 26.1 m-85 -66.68 -35.63 80.61 Favored 'General case' 0 N--CA 1.454 -0.227 0 N-CA-C 109.755 -0.461 . . . . 0.0 109.755 174.827 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 89' ' ' LYS . . . . . . . . . . . . . 62.9 mttm -63.89 -38.68 91.99 Favored 'General case' 0 CA--C 1.529 0.167 0 CA-C-N 116.063 -0.517 . . . . 0.0 110.113 173.873 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 90' ' ' ASN . . . . . 0.562 ' O ' ' HB3' ' A' ' 94' ' ' ASN . 6.8 m120 -57.88 -35.68 71.33 Favored 'General case' 0 N--CA 1.467 0.389 0 CA-C-N 116.055 -0.521 . . . . 0.0 111.012 177.441 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 91' ' ' TYR . . . . . 0.505 ' CD1' HG12 ' A' ' 129' ' ' ILE . 23.1 m-85 -84.54 -49.14 8.86 Favored 'General case' 0 C--N 1.318 -0.781 0 CA-C-N 116.325 -0.398 . . . . 0.0 111.121 -179.773 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 92' ' ' CYS . . . . . 0.53 ' HA ' ' HB2' ' A' ' 96' ' ' LEU . 50.3 t -70.22 -48.72 55.79 Favored 'General case' 0 C--N 1.323 -0.564 0 N-CA-C 112.236 0.458 . . . . 0.0 112.236 -174.524 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 93' ' ' ARG . . . . . 0.533 ' O ' ' HB3' ' A' ' 97' ' ' SER . 54.7 ttt180 -80.95 -25.13 37.62 Favored 'General case' 0 C--N 1.325 -0.464 0 CA-C-O 120.741 0.305 . . . . 0.0 111.63 -172.669 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 94' ' ' ASN . . . . . 0.562 ' HB3' ' O ' ' A' ' 90' ' ' ASN . 24.0 t-20 -100.18 -61.36 1.38 Allowed 'General case' 0 C--N 1.325 -0.467 0 C-N-CA 120.66 -0.416 . . . . 0.0 111.397 -178.514 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 95' ' ' HIS . . . . . . . . . . . . . 60.5 m80 -85.82 -14.46 45.0 Favored 'General case' 0 C--N 1.326 -0.453 0 N-CA-C 112.494 0.553 . . . . 0.0 112.494 -170.987 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 96' ' ' LEU . . . . . 0.53 ' HB2' ' HA ' ' A' ' 92' ' ' CYS . 93.5 mt -119.61 17.2 12.84 Favored 'General case' 0 C--N 1.321 -0.661 0 CA-C-O 120.796 0.332 . . . . 0.0 110.449 -179.606 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 97' ' ' SER . . . . . 0.536 ' N ' ' HD2' ' A' ' 98' ' ' PRO . 22.2 p -61.88 -42.19 81.13 Favored Pre-proline 0 CA--C 1.543 0.675 0 N-CA-C 113.073 0.768 . . . . 0.0 113.073 -176.251 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 98' ' ' PRO . . . . . 0.536 ' HD2' ' N ' ' A' ' 97' ' ' SER . 36.3 Cg_endo -65.42 -26.09 55.62 Favored 'Trans proline' 0 C--N 1.36 1.137 0 C-N-CA 121.431 1.421 . . . . 0.0 112.037 178.378 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 99' ' ' LEU . . . . . 0.414 HD22 HG23 ' A' ' 107' ' ' ILE . 80.9 mt -89.93 -21.67 22.36 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 115.978 -0.555 . . . . 0.0 110.673 -178.45 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 100' ' ' TYR . . . . . . . . . . . . . 28.1 t80 -55.06 -43.15 73.59 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 115.858 -0.61 . . . . 0.0 110.825 -179.07 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 101' ' ' MET . . . . . . . . . . . . . 23.1 ptt? -94.63 14.12 22.06 Favored 'General case' 0 C--N 1.319 -0.723 0 CA-C-N 115.807 -0.633 . . . . 0.0 111.52 -175.727 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 102' ' ' LYS . . . . . . . . . . . . . 64.6 mttm -108.77 165.99 11.14 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-O 120.962 0.41 . . . . 0.0 110.997 178.092 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 103' ' ' SER . . . . . 0.494 ' O ' ' HG2' ' A' ' 106' ' ' GLU . 3.1 m -79.91 143.06 34.58 Favored 'General case' 0 C--N 1.323 -0.559 0 N-CA-C 108.821 -0.807 . . . . 0.0 108.821 172.138 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 104' ' ' LEU . . . . . . . . . . . . . 1.9 pt? -68.14 -18.92 64.76 Favored 'General case' 0 C--N 1.322 -0.618 0 C-N-CA 120.898 -0.321 . . . . 0.0 111.748 -174.103 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 105' ' ' SER . . . . . . . . . . . . . 16.7 p -87.79 -22.17 24.67 Favored 'General case' 0 C--N 1.327 -0.411 0 N-CA-C 111.813 0.301 . . . . 0.0 111.813 -179.171 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 106' ' ' GLU . . . . . 0.494 ' HG2' ' O ' ' A' ' 103' ' ' SER . 11.5 pt-20 -89.66 -7.63 54.24 Favored 'General case' 0 C--N 1.331 -0.199 0 CA-C-O 120.963 0.411 . . . . 0.0 110.583 -177.633 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 107' ' ' ILE . . . . . 0.474 HG13 ' O ' ' A' ' 103' ' ' SER . 73.4 mt -70.41 135.16 28.73 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.48 0 CA-C-N 115.885 -0.598 . . . . 0.0 110.566 179.826 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 108' ' ' LEU . . . . . 0.451 ' HB2' ' HB2' ' A' ' 111' ' ' ASP . 54.3 mt -97.43 129.52 31.61 Favored Pre-proline 0 C--N 1.325 -0.49 0 CA-C-N 116.175 -0.466 . . . . 0.0 110.776 -176.434 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 109' ' ' PRO . . . . . . . . . . . . . 50.6 Cg_exo -56.95 -38.24 96.45 Favored 'Trans proline' 0 CA--C 1.529 0.274 0 C-N-CA 122.752 2.301 . . . . 0.0 112.032 177.213 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 110' ' ' ALA . . . . . . . . . . . . . . . -70.83 -32.37 69.4 Favored 'General case' 0 C--N 1.332 -0.192 0 CA-C-N 116.204 -0.453 . . . . 0.0 110.776 178.751 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 111' ' ' ASP . . . . . 0.451 ' HB2' ' HB2' ' A' ' 108' ' ' LEU . 36.6 t70 -64.93 -45.72 84.62 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.079 -0.51 . . . . 0.0 109.925 179.038 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 112' ' ' ILE . . . . . . . . . . . . . 36.4 mt -64.25 -39.37 85.29 Favored 'Isoleucine or valine' 0 C--O 1.234 0.277 0 CA-C-N 115.589 -0.732 . . . . 0.0 110.511 176.823 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 113' ' ' GLN . . . . . . . . . . . . . 6.5 tp-100 -58.3 -44.73 88.66 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 115.774 -0.648 . . . . 0.0 110.791 178.232 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 114' ' ' SER . . . . . . . . . . . . . 53.5 m -62.57 -36.0 81.29 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.667 -0.242 . . . . 0.0 110.911 178.097 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 115' ' ' ILE . . . . . 0.419 HG13 ' O ' ' A' ' 111' ' ' ASP . 72.4 mt -64.86 -48.63 83.53 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.193 0 CA-C-O 120.686 0.279 . . . . 0.0 110.384 177.707 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 116' ' ' ILE . . . . . . . . . . . . . 40.8 mm -61.45 -43.42 96.76 Favored 'Isoleucine or valine' 0 N--CA 1.463 0.209 0 CA-C-N 116.265 -0.425 . . . . 0.0 110.53 177.833 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 117' ' ' ASN . . . . . . . . . . . . . 3.0 t-20 -60.17 -37.0 78.84 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 115.689 -0.687 . . . . 0.0 111.203 179.964 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 118' ' ' GLU . . . . . . . . . . . . . 48.4 mt-10 -93.8 0.76 56.44 Favored 'General case' 0 C--N 1.326 -0.417 0 CA-C-N 116.382 -0.372 . . . . 0.0 111.713 -178.513 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 119' ' ' THR . . . . . . . . . . . . . 94.2 m -88.04 110.02 20.29 Favored 'General case' 0 N--CA 1.447 -0.6 0 N-CA-C 108.067 -1.086 . . . . 0.0 108.067 168.876 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 120' ' ' LYS . . . . . . . . . . . . . 66.4 mttm -107.69 64.98 0.63 Allowed 'General case' 0 C--N 1.322 -0.601 0 CA-C-O 121.919 0.866 . . . . 0.0 110.471 -172.401 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 121' ' ' LEU . . . . . . . . . . . . . 87.5 mt -119.5 -174.19 2.68 Favored 'General case' 0 C--N 1.321 -0.634 0 CA-C-N 114.567 -1.197 . . . . 0.0 109.639 -179.526 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 122' ' ' ALA . . . . . . . . . . . . . . . -61.2 149.3 38.04 Favored 'General case' 0 C--N 1.325 -0.476 0 CA-C-N 116.337 -0.392 . . . . 0.0 111.364 -179.832 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 123' ' ' LYS . . . . . . . . . . . . . 55.5 pttt -56.14 -33.01 64.77 Favored 'General case' 0 C--N 1.327 -0.378 0 CA-C-N 115.802 -0.635 . . . . 0.0 111.217 178.473 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 124' ' ' ASN . . . . . . . . . . . . . 95.0 m-20 -62.18 -39.96 94.44 Favored 'General case' 0 C--N 1.331 -0.219 0 CA-C-N 116.069 -0.514 . . . . 0.0 110.472 177.944 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 125' ' ' THR . . . . . 0.555 ' O ' HG13 ' A' ' 129' ' ' ILE . 8.6 m -68.29 -41.41 81.01 Favored 'General case' 0 C--N 1.326 -0.424 0 CA-C-N 116.031 -0.532 . . . . 0.0 110.489 -179.895 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 126' ' ' LEU . . . . . . . . . . . . . 92.6 mt -59.99 -45.54 92.38 Favored 'General case' 0 C--O 1.235 0.324 0 CA-C-N 116.071 -0.513 . . . . 0.0 110.755 179.691 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 127' ' ' LYS . . . . . . . . . . . . . 98.8 mttt -67.29 -34.83 78.22 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.018 -0.537 . . . . 0.0 110.766 178.844 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 128' ' ' ALA . . . . . . . . . . . . . . . -65.82 -43.65 87.95 Favored 'General case' 0 C--N 1.327 -0.391 0 CA-C-N 116.162 -0.472 . . . . 0.0 111.059 -179.273 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 129' ' ' ILE . . . . . 0.555 HG13 ' O ' ' A' ' 125' ' ' THR . 59.1 mt -61.2 -41.82 90.98 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.185 0 CA-C-O 121.154 0.502 . . . . 0.0 109.795 176.998 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 130' ' ' ARG . . . . . 0.608 HH21 HG11 ' A' ' 154' ' ' VAL . 3.2 tpp180 -64.5 -48.1 76.45 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 115.843 -0.617 . . . . 0.0 110.723 179.032 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 131' ' ' ASN . . . . . . . . . . . . . 0.9 OUTLIER -57.83 -52.67 64.51 Favored 'General case' 0 C--N 1.328 -0.345 0 O-C-N 123.341 0.4 . . . . 0.0 110.899 -179.887 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 132' ' ' THR . . . . . 0.479 ' O ' HG13 ' A' ' 136' ' ' ILE . 33.3 m -54.55 -54.06 46.29 Favored 'General case' 0 C--N 1.327 -0.384 0 CA-C-N 116.098 -0.501 . . . . 0.0 110.94 -179.451 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 133' ' ' ALA . . . . . . . . . . . . . . . -62.9 -39.32 94.14 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 116.284 -0.416 . . . . 0.0 111.932 -176.929 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 134' ' ' SER . . . . . . . . . . . . . 79.4 p -65.46 -32.53 74.19 Favored 'General case' 0 C--O 1.233 0.188 0 CA-C-O 120.55 0.214 . . . . 0.0 111.259 -176.514 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 135' ' ' GLN . . . . . 0.484 ' O ' ' HG2' ' A' ' 138' ' ' ARG . 36.1 mt-30 -79.73 -26.11 40.9 Favored 'General case' 0 N--CA 1.453 -0.306 0 C-N-CA 120.946 -0.302 . . . . 0.0 110.808 -179.919 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 136' ' ' ILE . . . . . 0.479 HG13 ' O ' ' A' ' 132' ' ' THR . 73.5 mt -65.34 -46.59 89.94 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.323 0 N-CA-C 109.823 -0.436 . . . . 0.0 109.823 173.791 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 137' ' ' PHE . . . . . 0.424 ' O ' HG13 ' A' ' 141' ' ' ILE . 53.3 m-85 -64.87 -40.5 95.23 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 116.078 -0.51 . . . . 0.0 111.102 177.33 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 138' ' ' ARG . . . . . 0.484 ' HG2' ' O ' ' A' ' 135' ' ' GLN . 0.2 OUTLIER -67.5 -26.07 66.17 Favored 'General case' 0 CA--C 1.53 0.203 0 CA-C-O 120.805 0.336 . . . . 0.0 110.391 -177.751 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 139' ' ' LEU . . . . . 0.413 ' HA ' ' HG2' ' A' ' 142' ' ' GLU . 62.2 tp -67.65 -34.3 76.67 Favored 'General case' 0 C--N 1.332 -0.195 0 CA-C-O 121.28 0.562 . . . . 0.0 109.561 176.706 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 140' ' ' ALA . . . . . . . . . . . . . . . -74.61 -33.78 62.68 Favored 'General case' 0 C--N 1.325 -0.459 0 CA-C-N 115.907 -0.588 . . . . 0.0 110.081 175.697 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 141' ' ' ILE . . . . . 0.634 ' HA ' ' O ' ' A' ' 146' ' ' ILE . 75.9 mt -62.3 -47.94 90.73 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.28 0 CA-C-N 115.947 -0.569 . . . . 0.0 111.069 176.795 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 142' ' ' GLU . . . . . 0.413 ' HG2' ' HA ' ' A' ' 139' ' ' LEU . 5.3 pt-20 -69.56 -16.55 63.44 Favored 'General case' 0 C--N 1.331 -0.229 0 CA-C-O 120.917 0.389 . . . . 0.0 110.975 -179.52 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 143' ' ' ASN . . . . . . . . . . . . . 18.3 m-80 -98.41 2.9 48.31 Favored 'General case' 0 C--N 1.326 -0.435 0 CA-C-N 116.399 -0.364 . . . . 0.0 110.485 175.68 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 144' ' ' ARG . . . . . 0.434 HH11 ' HD2' ' A' ' 144' ' ' ARG . 25.6 mtm180 63.43 20.55 12.31 Favored 'General case' 0 N--CA 1.464 0.271 0 CA-C-N 115.649 -0.705 . . . . 0.0 112.146 175.663 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 145' ' ' ALA . . . . . . . . . . . . . . . -75.12 -37.58 61.38 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-O 121.367 0.604 . . . . 0.0 109.418 176.421 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 146' ' ' ILE . . . . . 0.634 ' O ' ' HA ' ' A' ' 141' ' ' ILE . 13.7 tt -146.85 137.9 18.17 Favored 'Isoleucine or valine' 0 N--CA 1.449 -0.513 0 CA-C-N 115.254 -0.885 . . . . 0.0 108.823 175.192 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 147' ' ' ASP . . . . . . . . . . . . . 7.9 p-10 -106.04 19.71 20.1 Favored 'General case' 0 C--N 1.321 -0.639 0 CA-C-O 121.19 0.519 . . . . 0.0 110.188 -178.947 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 148' ' ' PHE . . . . . 0.497 ' H ' HG12 ' A' ' 146' ' ' ILE . 70.6 t80 -132.12 123.35 26.96 Favored 'General case' 0 C--N 1.32 -0.689 0 CA-C-N 115.353 -0.84 . . . . 0.0 109.846 -175.058 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 149' ' ' ASN . . . . . 0.528 ' HB2' HD11 ' A' ' 141' ' ' ILE . 31.5 t-20 -107.58 98.12 22.79 Favored Pre-proline 0 C--N 1.325 -0.494 0 N-CA-C 110.058 -0.349 . . . . 0.0 110.058 -179.656 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 150' ' ' PRO . . . . . . . . . . . . . 55.2 Cg_endo -70.44 -13.89 33.41 Favored 'Trans proline' 0 C--N 1.344 0.338 0 C-N-CA 122.765 2.31 . . . . 0.0 112.661 -176.51 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 151' ' ' ALA . . . . . . . . . . . . . . . -71.24 -20.02 62.29 Favored 'General case' 0 C--N 1.326 -0.414 0 CA-C-N 116.206 -0.452 . . . . 0.0 110.987 -179.374 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 152' ' ' ASP . . . . . . . . . . . . . 31.0 t70 -71.99 -21.74 61.53 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-O 121.186 0.517 . . . . 0.0 110.902 -179.82 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 153' ' ' TYR . . . . . . . . . . . . . 99.2 m-85 -92.58 1.73 57.1 Favored 'General case' 0 C--N 1.324 -0.532 0 CA-C-N 115.893 -0.594 . . . . 0.0 110.81 -177.962 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 154' ' ' VAL . . . . . 0.608 HG11 HH21 ' A' ' 130' ' ' ARG . 60.6 t -88.11 106.52 16.56 Favored 'Isoleucine or valine' 0 N--CA 1.448 -0.529 0 N-CA-C 109.529 -0.545 . . . . 0.0 109.529 175.949 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 155' ' ' ARG . . . . . . . . . . . . . 12.0 tpp180 -77.01 121.6 23.75 Favored 'General case' 0 C--N 1.32 -0.675 0 CA-C-N 115.853 -0.612 . . . . 0.0 109.891 -178.982 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 156' ' ' ILE . . . . . . . . . . . . . 48.5 mm -90.0 120.2 69.31 Favored Pre-proline 0 C--N 1.325 -0.499 0 CA-C-N 116.272 -0.422 . . . . 0.0 110.213 179.932 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 157' ' ' PRO . . . . . . . . . . . . . 55.5 Cg_endo -70.32 138.18 35.47 Favored 'Trans proline' 0 N--CA 1.461 -0.402 0 C-N-CA 122.349 2.033 . . . . 0.0 111.819 178.372 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 158' ' ' LYS . . . . . . . . . . . . . 33.6 mtmt -103.44 4.91 36.64 Favored 'General case' 0 C--N 1.321 -0.651 0 CA-C-O 121.111 0.481 . . . . 0.0 110.799 -179.796 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 159' ' ' ILE . . . . . . . . . . . . . 2.7 mp 72.54 -60.29 0.28 Allowed 'Isoleucine or valine' 0 N--CA 1.463 0.208 0 CA-C-N 114.907 -1.042 . . . . 0.0 112.229 171.359 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 160' ' ' ALA . . . . . . . . . . . . . . . -131.36 175.08 9.44 Favored 'General case' 0 C--N 1.317 -0.84 0 N-CA-C 111.616 0.228 . . . . 0.0 111.616 -170.883 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 161' ' ' LEU . . . . . . . . . . . . . 89.2 mt 60.9 36.17 18.98 Favored 'General case' 0 C--O 1.234 0.263 0 O-C-N 123.791 0.682 . . . . 0.0 110.563 -177.031 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 162' ' ' GLU . . . . . . . . . . . . . 12.5 pt-20 -67.89 167.95 12.62 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 115.541 -0.754 . . . . 0.0 110.241 179.159 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 163' ' ' HIS . . . . . . . . . . . . . 9.2 t-160 -119.29 51.66 1.13 Allowed 'General case' 0 C--N 1.323 -0.562 0 C-N-CA 120.695 -0.402 . . . . 0.0 110.23 -176.276 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 164' ' ' HIS . . . . . . . . . . . . . 0.9 OUTLIER 166.41 60.8 0.0 OUTLIER 'General case' 0 N--CA 1.471 0.608 0 O-C-N 124.353 1.033 . . . . 0.0 109.752 177.958 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 165' ' ' HIS . . . . . . . . . . . . . 70.0 t60 -73.49 -45.98 50.79 Favored 'General case' 0 C--N 1.327 -0.413 0 C-N-CA 120.561 -0.456 . . . . 0.0 110.63 -174.995 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 166' ' ' HIS . . . . . . . . . . . . . 1.9 p-80 -85.37 114.6 22.56 Favored 'General case' 0 C--N 1.325 -0.496 0 CA-C-O 121.221 0.534 . . . . 0.0 109.822 173.103 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 167' ' ' HIS . . . . . . . . . . . . . 4.5 p-80 -155.15 157.9 38.13 Favored 'General case' 0 C--N 1.324 -0.522 0 CA-C-N 116.263 -0.426 . . . . 0.0 111.442 -173.27 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 168' ' ' HIS . . . . . . . . . . . . . 24.5 m80 . . . . . 0 C--O 1.246 0.885 0 CA-C-O 118.561 -0.733 . . . . 0.0 109.491 170.678 . . . . . . . . 0 0 . 1 . 004 nuclear nobuild full ' A' A ' 61' ' ' ARG . . . . . . . . . . . . . 18.2 mtt180 . . . . . 0 N--CA 1.48 1.062 0 CA-C-O 120.807 0.336 . . . . 0.0 111.148 . . . . . . . . . 0 0 . 1 . 004 nuclear nobuild full ' A' A ' 62' ' ' ASP . . . . . . . . . . . . . 19.6 m-20 -79.69 -176.03 5.15 Favored 'General case' 0 C--O 1.235 0.327 0 CA-C-O 121.708 0.766 . . . . 0.0 112.6 -171.07 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 63' ' ' SER . . . . . . . . . . . . . 36.5 t -116.89 150.32 38.66 Favored 'General case' 0 C--N 1.324 -0.508 0 CA-C-N 114.774 -1.103 . . . . 0.0 109.744 179.224 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 64' ' ' PHE . . . . . 0.453 ' HB3' ' O ' ' A' ' 99' ' ' LEU . 87.4 t80 -59.07 -38.61 79.85 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-N 116.207 -0.451 . . . . 0.0 110.357 179.753 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 65' ' ' GLY . . . . . . . . . . . . . . . -65.38 -32.32 83.21 Favored Glycine 0 N--CA 1.45 -0.38 0 C-N-CA 120.91 -0.662 . . . . 0.0 112.745 179.99 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 66' ' ' ASP . . . . . . . . . . . . . 20.3 t70 -68.33 -41.45 80.78 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-O 121.043 0.449 . . . . 0.0 110.154 -179.645 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 67' ' ' TRP . . . . . . . . . . . . . 80.4 m95 -74.84 -31.56 61.69 Favored 'General case' 0 C--N 1.327 -0.399 0 CA-C-N 116.027 -0.533 . . . . 0.0 110.979 178.061 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 68' ' ' ALA . . . . . . . . . . . . . . . -62.07 -41.66 98.39 Favored 'General case' 0 C--N 1.33 -0.243 0 N-CA-C 109.874 -0.417 . . . . 0.0 109.874 174.342 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 69' ' ' GLU . . . . . . . . . . . . . 3.3 tm-20 -54.32 -51.09 65.79 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 115.607 -0.724 . . . . 0.0 110.246 175.034 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 70' ' ' LYS . . . . . . . . . . . . . 48.3 mttp -72.81 -25.44 61.14 Favored 'General case' 0 C--N 1.324 -0.531 0 CA-C-N 115.904 -0.589 . . . . 0.0 111.828 -176.688 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 71' ' ' PHE . . . . . . . . . . . . . 69.5 t80 -70.36 -49.38 49.78 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-O 120.876 0.37 . . . . 0.0 110.29 175.337 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 72' ' ' LEU . . . . . 0.442 HD13 ' HA ' ' A' ' 72' ' ' LEU . 4.0 mm? -65.42 -34.71 78.93 Favored 'General case' 0 C--N 1.326 -0.446 0 CA-C-O 120.882 0.373 . . . . 0.0 110.222 177.065 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 73' ' ' LYS . . . . . . . . . . . . . 3.9 tppp? -64.05 -45.9 86.77 Favored 'General case' 0 C--N 1.325 -0.469 0 CA-C-N 115.84 -0.618 . . . . 0.0 110.513 178.43 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 74' ' ' SER . . . . . 0.435 ' O ' ' HB2' ' A' ' 78' ' ' ASP . 13.1 p -70.33 -27.73 64.6 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 116.333 -0.394 . . . . 0.0 111.037 -179.023 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 75' ' ' LYS . . . . . 0.467 ' HA ' ' HD3' ' A' ' 75' ' ' LYS . 67.9 mmtt -74.83 -34.18 62.28 Favored 'General case' 0 C--O 1.236 0.346 0 CA-C-O 120.929 0.395 . . . . 0.0 110.842 174.462 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 76' ' ' GLU . . . . . . . . . . . . . 7.5 tp10 -63.06 -41.54 99.49 Favored 'General case' 0 C--N 1.324 -0.526 0 CA-C-O 121.369 0.604 . . . . 0.0 109.608 173.842 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 77' ' ' ALA . . . . . . . . . . . . . . . -81.18 -10.09 59.69 Favored 'General case' 0 C--N 1.327 -0.404 0 CA-C-N 115.755 -0.657 . . . . 0.0 110.92 177.033 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 78' ' ' ASP . . . . . 0.435 ' HB2' ' O ' ' A' ' 74' ' ' SER . 17.9 t70 -77.23 -49.48 15.0 Favored 'General case' 0 C--N 1.327 -0.4 0 CA-C-N 115.999 -0.546 . . . . 0.0 110.101 178.824 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 79' ' ' GLY . . . . . . . . . . . . . . . 121.43 25.54 2.17 Favored Glycine 0 N--CA 1.449 -0.489 0 C-N-CA 120.573 -0.822 . . . . 0.0 113.052 177.227 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 80' ' ' VAL . . . . . . . . . . . . . 15.9 m -67.67 157.39 6.24 Favored 'Isoleucine or valine' 0 C--O 1.234 0.262 0 CA-C-N 117.088 0.444 . . . . 0.0 110.559 176.734 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 81' ' ' SER . . . . . . . . . . . . . 28.7 t -58.67 138.39 57.02 Favored 'General case' 0 N--CA 1.451 -0.418 0 CA-C-N 115.985 -0.552 . . . . 0.0 109.755 174.812 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 82' ' ' VAL . . . . . . . . . . . . . 14.0 p -58.39 -34.07 49.49 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.583 0 CA-C-O 120.732 0.301 . . . . 0.0 110.786 -179.44 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 83' ' ' SER . . . . . . . . . . . . . 23.3 t -69.38 -43.16 74.09 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-O 121.17 0.509 . . . . 0.0 109.861 177.715 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 84' ' ' GLN . . . . . . . . . . . . . 24.6 tp60 -64.58 -37.62 88.17 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 115.757 -0.656 . . . . 0.0 110.085 178.008 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 85' ' ' LEU . . . . . . . . . . . . . 41.1 tp -66.02 -43.07 88.73 Favored 'General case' 0 C--N 1.327 -0.403 0 CA-C-N 115.646 -0.706 . . . . 0.0 110.564 177.781 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 86' ' ' ASN . . . . . . . . . . . . . 12.3 m-80 -59.6 -38.66 81.86 Favored 'General case' 0 N--CA 1.463 0.189 0 CA-C-N 116.452 -0.34 . . . . 0.0 110.405 176.469 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 87' ' ' SER . . . . . . . . . . . . . 33.1 t -60.62 -48.22 82.75 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 115.903 -0.589 . . . . 0.0 110.4 177.341 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 88' ' ' TYR . . . . . . . . . . . . . 21.8 m-85 -61.58 -45.16 95.32 Favored 'General case' 0 C--O 1.234 0.28 0 CA-C-O 120.786 0.327 . . . . 0.0 110.745 178.311 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 89' ' ' LYS . . . . . . . . . . . . . 97.4 mttt -61.27 -39.33 90.0 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 116.127 -0.488 . . . . 0.0 111.066 179.328 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 90' ' ' ASN . . . . . . . . . . . . . 8.7 t30 -65.26 -41.95 93.73 Favored 'General case' 0 C--N 1.327 -0.37 0 CA-C-O 120.762 0.315 . . . . 0.0 110.578 -179.399 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 91' ' ' TYR . . . . . . . . . . . . . 21.4 m-30 -64.63 -43.22 94.42 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.392 -0.367 . . . . 0.0 111.221 179.93 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 92' ' ' CYS . . . . . 0.527 ' HA ' HD12 ' A' ' 96' ' ' LEU . 58.4 m -76.37 -42.89 43.05 Favored 'General case' 0 C--N 1.323 -0.564 0 CA-C-N 116.5 -0.318 . . . . 0.0 111.844 -175.846 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 93' ' ' ARG . . . . . . . . . . . . . 63.8 ttt180 -79.25 -36.4 39.98 Favored 'General case' 0 C--N 1.326 -0.426 0 CA-C-O 120.669 0.271 . . . . 0.0 111.478 -174.46 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 94' ' ' ASN . . . . . . . . . . . . . 4.1 m-20 -101.03 -49.96 3.95 Favored 'General case' 0 C--N 1.328 -0.337 0 N-CA-C 111.997 0.369 . . . . 0.0 111.997 -174.509 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 95' ' ' HIS . . . . . . . . . . . . . 0.6 OUTLIER -82.25 -32.53 29.63 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-O 120.943 0.402 . . . . 0.0 111.248 -174.0 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 96' ' ' LEU . . . . . 0.554 HD21 ' NH2' ' A' ' 130' ' ' ARG . 93.3 mt -98.68 22.48 9.92 Favored 'General case' 0 C--N 1.324 -0.524 0 CA-C-N 116.115 -0.493 . . . . 0.0 110.741 179.746 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 97' ' ' SER . . . . . 0.551 ' OG ' ' HD3' ' A' ' 98' ' ' PRO . 2.5 p -53.86 -45.1 99.01 Favored Pre-proline 0 CA--C 1.544 0.742 0 N-CA-C 113.29 0.848 . . . . 0.0 113.29 -177.98 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 98' ' ' PRO . . . . . 0.551 ' HD3' ' OG ' ' A' ' 97' ' ' SER . 33.8 Cg_exo -60.3 -43.77 32.59 Favored 'Trans proline' 0 C--N 1.361 1.224 0 C-N-CA 121.593 1.528 . . . . 0.0 111.938 178.454 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 99' ' ' LEU . . . . . 0.453 ' O ' ' HB3' ' A' ' 64' ' ' PHE . 61.1 mt -76.29 -32.45 58.78 Favored 'General case' 0 C--N 1.326 -0.456 0 CA-C-N 115.818 -0.628 . . . . 0.0 110.592 -176.399 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 100' ' ' TYR . . . . . . . . . . . . . 42.8 t80 -57.84 -33.22 68.4 Favored 'General case' 0 C--N 1.326 -0.433 0 CA-C-N 115.73 -0.668 . . . . 0.0 110.801 -179.652 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 101' ' ' MET . . . . . . . . . . . . . 65.8 mtt -102.32 14.29 32.35 Favored 'General case' 0 C--N 1.324 -0.508 0 CA-C-N 116.206 -0.452 . . . . 0.0 110.889 -178.244 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 102' ' ' LYS . . . . . 0.437 ' HG3' ' O ' ' A' ' 98' ' ' PRO . 64.6 mttt -99.05 163.14 12.7 Favored 'General case' 0 C--N 1.326 -0.444 0 CA-C-O 121.24 0.543 . . . . 0.0 111.162 179.104 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 103' ' ' SER . . . . . . . . . . . . . 20.3 m -80.3 137.06 36.54 Favored 'General case' 0 N--CA 1.446 -0.662 0 CA-C-N 115.307 -0.86 . . . . 0.0 109.134 173.533 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 104' ' ' LEU . . . . . 0.563 ' HG ' HD12 ' A' ' 146' ' ' ILE . 50.3 tp -55.07 -43.82 74.25 Favored 'General case' 0 C--N 1.327 -0.409 0 N-CA-C 112.65 0.611 . . . . 0.0 112.65 -171.293 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 105' ' ' SER . . . . . . . . . . . . . 15.5 m -84.01 -9.72 58.44 Favored 'General case' 0 C--N 1.321 -0.665 0 N-CA-C 112.702 0.631 . . . . 0.0 112.702 -171.171 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 106' ' ' GLU . . . . . . . . . . . . . 0.2 OUTLIER -86.95 -22.12 25.8 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-O 120.871 0.367 . . . . 0.0 110.229 -177.082 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 107' ' ' ILE . . . . . . . . . . . . . 62.9 mt -60.66 126.25 18.2 Favored 'Isoleucine or valine' 0 C--O 1.236 0.35 0 CA-C-N 115.747 -0.66 . . . . 0.0 111.491 -174.939 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 108' ' ' LEU . . . . . 0.482 ' H ' HD23 ' A' ' 108' ' ' LEU . 1.4 pt? -112.25 149.32 40.81 Favored Pre-proline 0 C--N 1.325 -0.488 0 CA-C-N 115.432 -0.804 . . . . 0.0 110.31 -179.541 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 109' ' ' PRO . . . . . . . . . . . . . 50.9 Cg_exo -55.01 -39.77 89.25 Favored 'Trans proline' 0 C--N 1.344 0.324 0 C-N-CA 122.952 2.435 . . . . 0.0 112.906 179.674 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 110' ' ' ALA . . . . . 0.47 ' HB3' HD12 ' A' ' 108' ' ' LEU . . . -58.85 -38.67 79.28 Favored 'General case' 0 N--CA 1.464 0.243 0 N-CA-C 111.779 0.289 . . . . 0.0 111.779 -178.209 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 111' ' ' ASP . . . . . . . . . . . . . 28.2 t70 -66.49 -45.91 78.05 Favored 'General case' 0 C--N 1.327 -0.379 0 CA-C-O 121.246 0.546 . . . . 0.0 110.155 -178.172 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 112' ' ' ILE . . . . . 0.58 HD12 ' HB2' ' A' ' 150' ' ' PRO . 58.4 mt -65.74 -38.6 82.63 Favored 'Isoleucine or valine' 0 C--O 1.239 0.519 0 CA-C-N 115.564 -0.744 . . . . 0.0 110.581 177.486 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 113' ' ' GLN . . . . . . . . . . . . . 27.1 tp60 -61.91 -40.57 95.93 Favored 'General case' 0 C--N 1.327 -0.384 0 CA-C-N 115.266 -0.879 . . . . 0.0 110.348 179.597 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 114' ' ' SER . . . . . . . . . . . . . 19.0 t -60.18 -43.95 95.45 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 116.088 -0.506 . . . . 0.0 110.152 177.687 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 115' ' ' ILE . . . . . . . . . . . . . 69.0 mt -54.88 -39.52 48.93 Favored 'Isoleucine or valine' 0 CA--C 1.53 0.195 0 CA-C-O 120.8 0.333 . . . . 0.0 110.677 178.491 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 116' ' ' ILE . . . . . 0.503 HG12 HH11 ' A' ' 130' ' ' ARG . 23.3 mm -70.02 -40.0 77.99 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.238 0 CA-C-N 116.425 -0.352 . . . . 0.0 111.332 177.905 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 117' ' ' ASN . . . . . . . . . . . . . 6.4 t30 -67.39 -32.82 73.98 Favored 'General case' 0 C--N 1.324 -0.51 0 CA-C-O 120.948 0.404 . . . . 0.0 110.501 -178.772 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 118' ' ' GLU . . . . . . . . . . . . . 36.9 mt-10 -83.7 -30.61 26.63 Favored 'General case' 0 C--N 1.327 -0.391 0 CA-C-N 115.808 -0.633 . . . . 0.0 111.564 -178.848 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 119' ' ' THR . . . . . . . . . . . . . 97.9 m -83.77 121.06 26.79 Favored 'General case' 0 C--N 1.325 -0.467 0 CA-C-O 120.977 0.417 . . . . 0.0 111.399 -177.584 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 120' ' ' LYS . . . . . . . . . . . . . 74.6 mmtt -109.09 86.11 2.22 Favored 'General case' 0 C--N 1.321 -0.666 0 CA-C-O 121.293 0.568 . . . . 0.0 110.868 176.716 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 121' ' ' LEU . . . . . . . . . . . . . 85.8 mt -120.52 -175.2 2.97 Favored 'General case' 0 C--N 1.319 -0.755 0 CA-C-N 115.235 -0.893 . . . . 0.0 108.841 174.727 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 122' ' ' ALA . . . . . . . . . . . . . . . -58.5 139.42 55.69 Favored 'General case' 0 C--N 1.324 -0.529 0 N-CA-C 109.325 -0.62 . . . . 0.0 109.325 173.871 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 123' ' ' LYS . . . . . . . . . . . . . 91.6 mttt -62.33 -33.04 73.93 Favored 'General case' 0 C--N 1.322 -0.618 0 CA-C-O 121.141 0.495 . . . . 0.0 110.832 -174.432 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 124' ' ' ASN . . . . . . . . . . . . . 42.9 m-80 -65.56 -39.07 91.26 Favored 'General case' 0 C--N 1.325 -0.49 0 CA-C-N 115.666 -0.697 . . . . 0.0 110.312 175.09 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 125' ' ' THR . . . . . 0.475 ' O ' HG13 ' A' ' 129' ' ' ILE . 17.3 m -69.75 -37.39 76.42 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 116.001 -0.545 . . . . 0.0 110.691 179.48 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 126' ' ' LEU . . . . . . . . . . . . . 98.2 mt -56.8 -51.45 68.88 Favored 'General case' 0 C--O 1.237 0.442 0 CA-C-N 116.27 -0.423 . . . . 0.0 110.949 179.364 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 127' ' ' LYS . . . . . 0.56 ' HB3' HG21 ' A' ' 156' ' ' ILE . 12.7 ptmm? -71.29 -21.29 62.1 Favored 'General case' 0 C--N 1.327 -0.41 0 CA-C-N 116.269 -0.423 . . . . 0.0 111.254 179.593 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 128' ' ' ALA . . . . . . . . . . . . . . . -69.08 -43.02 75.4 Favored 'General case' 0 C--N 1.331 -0.222 0 CA-C-O 120.859 0.362 . . . . 0.0 110.654 175.353 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 129' ' ' ILE . . . . . 0.475 HG13 ' O ' ' A' ' 125' ' ' THR . 51.9 mt -66.07 -29.45 46.83 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.235 0 CA-C-O 121.177 0.513 . . . . 0.0 110.03 177.779 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 130' ' ' ARG . . . . . 0.866 ' HE ' ' HA ' ' A' ' 130' ' ' ARG . 0.4 OUTLIER -76.09 -43.31 44.06 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.397 -0.365 . . . . 0.0 110.932 175.69 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 131' ' ' ASN . . . . . 0.576 ' O ' ' HG2' ' A' ' 135' ' ' GLN . 27.2 t-20 -55.86 -51.51 67.29 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-O 120.889 0.376 . . . . 0.0 110.259 177.649 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 132' ' ' THR . . . . . . . . . . . . . 28.5 m -54.81 -48.57 72.61 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 115.569 -0.741 . . . . 0.0 110.966 178.454 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 133' ' ' ALA . . . . . . . . . . . . . . . -63.15 -39.27 94.18 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.122 -0.49 . . . . 0.0 111.04 179.654 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 134' ' ' SER . . . . . . . . . . . . . 11.1 t -63.98 -38.56 91.53 Favored 'General case' 0 C--N 1.327 -0.406 0 CA-C-N 116.372 -0.376 . . . . 0.0 110.429 -179.613 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 135' ' ' GLN . . . . . 0.576 ' HG2' ' O ' ' A' ' 131' ' ' ASN . 78.1 mm-40 -61.04 -37.81 83.92 Favored 'General case' 0 C--N 1.331 -0.229 0 CA-C-O 121.016 0.436 . . . . 0.0 110.198 177.474 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 136' ' ' ILE . . . . . . . . . . . . . 69.9 mt -64.57 -46.62 92.02 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.357 0 CA-C-N 115.71 -0.677 . . . . 0.0 110.683 177.998 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 137' ' ' PHE . . . . . 0.473 ' O ' HG13 ' A' ' 141' ' ' ILE . 53.4 m-85 -61.0 -42.27 98.11 Favored 'General case' 0 N--CA 1.462 0.14 0 CA-C-O 120.908 0.385 . . . . 0.0 110.548 176.192 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 138' ' ' ARG . . . . . 0.522 ' O ' ' HG3' ' A' ' 142' ' ' GLU . 25.9 mtp180 -57.88 -47.11 83.73 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 115.895 -0.593 . . . . 0.0 111.207 177.699 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 139' ' ' LEU . . . . . . . . . . . . . 61.7 tp -56.55 -37.34 70.38 Favored 'General case' 0 C--N 1.327 -0.392 0 CA-C-O 121.28 0.562 . . . . 0.0 110.637 178.67 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 140' ' ' ALA . . . . . 0.518 ' HB1' HD21 ' A' ' 104' ' ' LEU . . . -68.92 -43.09 75.85 Favored 'General case' 0 C--N 1.324 -0.511 0 CA-C-N 115.775 -0.648 . . . . 0.0 110.551 176.955 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 141' ' ' ILE . . . . . 0.473 HG13 ' O ' ' A' ' 137' ' ' PHE . 81.7 mt -60.3 -39.11 79.85 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.254 0 CA-C-N 116.109 -0.496 . . . . 0.0 110.911 177.094 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 142' ' ' GLU . . . . . 0.522 ' HG3' ' O ' ' A' ' 138' ' ' ARG . 42.5 mt-10 -61.5 -32.58 72.61 Favored 'General case' 0 C--N 1.33 -0.243 0 CA-C-N 116.419 -0.355 . . . . 0.0 111.16 179.624 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 143' ' ' ASN . . . . . . . . . . . . . 44.9 m-80 -95.34 6.58 48.63 Favored 'General case' 0 C--N 1.326 -0.42 0 CA-C-N 116.365 -0.38 . . . . 0.0 110.477 178.58 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 144' ' ' ARG . . . . . . . . . . . . . 47.7 mtp85 59.81 30.67 20.23 Favored 'General case' 0 N--CA 1.466 0.333 0 CA-C-N 115.525 -0.761 . . . . 0.0 111.426 179.309 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 145' ' ' ALA . . . . . . . . . . . . . . . -85.5 -9.43 57.43 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 115.897 -0.592 . . . . 0.0 110.237 177.703 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 146' ' ' ILE . . . . . 0.563 HD12 ' HG ' ' A' ' 104' ' ' LEU . 14.8 tt -160.08 150.4 6.0 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.454 0 CA-C-N 115.545 -0.752 . . . . 0.0 109.069 174.992 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 147' ' ' ASP . . . . . . . . . . . . . 21.2 t70 -116.76 19.83 14.28 Favored 'General case' 0 C--N 1.326 -0.447 0 CA-C-O 121.864 0.84 . . . . 0.0 109.469 -177.81 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 148' ' ' PHE . . . . . 0.46 ' H ' HG12 ' A' ' 146' ' ' ILE . 61.4 t80 -141.93 134.26 27.92 Favored 'General case' 0 C--N 1.321 -0.653 0 CA-C-N 115.321 -0.854 . . . . 0.0 109.985 -171.532 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 149' ' ' ASN . . . . . . . . . . . . . 54.7 t-20 -117.19 95.96 48.25 Favored Pre-proline 0 C--N 1.324 -0.539 0 N-CA-C 109.64 -0.504 . . . . 0.0 109.64 176.816 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 150' ' ' PRO . . . . . 0.58 ' HB2' HD12 ' A' ' 112' ' ' ILE . 23.3 Cg_exo -63.54 -32.26 70.26 Favored 'Trans proline' 0 CA--C 1.528 0.191 0 C-N-CA 122.604 2.202 . . . . 0.0 112.324 -177.692 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 151' ' ' ALA . . . . . . . . . . . . . . . -71.91 -20.09 61.83 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.114 -0.494 . . . . 0.0 111.163 -177.073 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 152' ' ' ASP . . . . . . . . . . . . . 31.9 t70 -68.85 -25.48 64.67 Favored 'General case' 0 C--N 1.326 -0.422 0 CA-C-N 116.196 -0.457 . . . . 0.0 110.854 -179.63 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 153' ' ' TYR . . . . . . . . . . . . . 78.8 m-85 -93.5 -7.29 44.74 Favored 'General case' 0 C--N 1.327 -0.373 0 CA-C-N 115.981 -0.554 . . . . 0.0 111.203 -176.857 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 154' ' ' VAL . . . . . . . . . . . . . 99.3 t -76.33 117.31 20.79 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.42 0 CA-C-O 121.033 0.444 . . . . 0.0 111.346 -175.284 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 155' ' ' ARG . . . . . . . . . . . . . 32.7 ptt85 -80.43 144.05 32.94 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 115.882 -0.599 . . . . 0.0 110.112 177.912 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 156' ' ' ILE . . . . . 0.624 HD11 ' HG3' ' A' ' 130' ' ' ARG . 24.3 mm -115.55 131.89 23.41 Favored Pre-proline 0 C--N 1.323 -0.546 0 CA-C-N 116.133 -0.485 . . . . 0.0 110.653 -179.024 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 157' ' ' PRO . . . . . . . . . . . . . 55.7 Cg_endo -71.13 130.07 17.1 Favored 'Trans proline' 0 N--CA 1.459 -0.5 0 C-N-CA 122.186 1.924 . . . . 0.0 111.278 174.068 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 158' ' ' LYS . . . . . . . . . . . . . 22.9 pttm -150.17 25.13 0.81 Allowed 'General case' 0 C--N 1.32 -0.677 0 CA-C-O 121.519 0.676 . . . . 0.0 110.138 -178.348 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 159' ' ' ILE . . . . . . . . . . . . . 60.1 mt -84.12 122.06 37.35 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.467 0 CA-C-N 115.041 -0.981 . . . . 0.0 109.899 -178.216 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 160' ' ' ALA . . . . . . . . . . . . . . . -132.22 148.26 52.45 Favored 'General case' 0 C--N 1.319 -0.724 0 CA-C-N 116.456 -0.338 . . . . 0.0 110.621 -178.583 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 161' ' ' LEU . . . . . . . . . . . . . 81.7 mt -102.03 7.72 41.15 Favored 'General case' 0 C--N 1.324 -0.501 0 CA-C-O 121.701 0.762 . . . . 0.0 109.485 177.801 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 162' ' ' GLU . . . . . . . . . . . . . 4.3 mp0 -93.09 179.8 5.32 Favored 'General case' 0 C--N 1.319 -0.743 0 CA-C-N 114.783 -1.099 . . . . 0.0 109.636 178.338 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 163' ' ' HIS . . . . . . . . . . . . . 8.5 p80 -67.16 93.44 0.3 Allowed 'General case' 0 C--N 1.324 -0.528 0 CA-C-O 121.5 0.667 . . . . 0.0 110.828 175.308 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 164' ' ' HIS . . . . . . . . . . . . . 81.2 t60 -98.78 -0.95 41.6 Favored 'General case' 0 C--N 1.325 -0.469 0 CA-C-N 115.804 -0.635 . . . . 0.0 110.344 -177.07 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 165' ' ' HIS . . . . . . . . . . . . . 62.3 m-70 -86.54 160.18 19.04 Favored 'General case' 0 C--N 1.327 -0.402 0 N-CA-C 109.179 -0.674 . . . . 0.0 109.179 174.759 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 166' ' ' HIS . . . . . . . . . . . . . 9.1 p80 -139.93 169.9 16.85 Favored 'General case' 0 C--N 1.321 -0.632 0 CA-C-O 120.709 0.29 . . . . 0.0 110.401 178.978 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 167' ' ' HIS . . . . . . . . . . . . . 74.0 m-70 -77.99 149.52 34.07 Favored 'General case' 0 C--N 1.322 -0.596 0 CA-C-O 121.438 0.637 . . . . 0.0 111.489 -176.854 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 168' ' ' HIS . . . . . . . . . . . . . 60.2 m-70 . . . . . 0 C--O 1.249 1.034 0 CA-C-O 118.194 -0.907 . . . . 0.0 108.835 174.195 . . . . . . . . 0 0 . 1 . 005 nuclear nobuild full ' A' A ' 61' ' ' ARG . . . . . . . . . . . . . 45.3 ttt180 . . . . . 0 N--CA 1.479 0.981 0 CA-C-O 120.72 0.295 . . . . 0.0 111.014 . . . . . . . . . 0 0 . 1 . 005 nuclear nobuild full ' A' A ' 62' ' ' ASP . . . . . . . . . . . . . 0.0 OUTLIER -91.81 173.85 7.65 Favored 'General case' 0 C--N 1.327 -0.371 0 CA-C-N 116.161 -0.472 . . . . 0.0 110.79 -177.067 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 63' ' ' SER . . . . . . . . . . . . . 93.9 p -106.01 169.53 8.44 Favored 'General case' 0 C--N 1.327 -0.385 0 CA-C-N 116.335 -0.393 . . . . 0.0 110.258 179.197 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 64' ' ' PHE . . . . . 0.474 ' HB2' HD11 ' A' ' 107' ' ' ILE . 64.0 t80 -64.78 -29.91 70.9 Favored 'General case' 0 C--N 1.327 -0.382 0 N-CA-C 109.634 -0.506 . . . . 0.0 109.634 178.587 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 65' ' ' GLY . . . . . . . . . . . . . . . -61.4 -39.37 97.18 Favored Glycine 0 C--N 1.332 0.342 0 CA-C-N 115.885 -0.598 . . . . 0.0 112.133 176.664 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 66' ' ' ASP . . . . . . . . . . . . . 20.5 m-20 -62.57 -51.68 66.39 Favored 'General case' 0 N--CA 1.463 0.187 0 CA-C-O 121.106 0.479 . . . . 0.0 110.162 178.263 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 67' ' ' TRP . . . . . . . . . . . . . 95.7 m95 -68.78 -29.32 67.66 Favored 'General case' 0 C--N 1.326 -0.451 0 CA-C-N 115.577 -0.738 . . . . 0.0 111.937 -177.777 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 68' ' ' ALA . . . . . 0.629 ' HB1' ' SG ' ' A' ' 92' ' ' CYS . . . -61.23 -48.78 79.9 Favored 'General case' 0 C--N 1.324 -0.517 0 CA-C-O 121.086 0.469 . . . . 0.0 110.282 175.725 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 69' ' ' GLU . . . . . . . . . . . . . 5.1 mm-40 -59.71 -44.14 93.82 Favored 'General case' 0 C--N 1.326 -0.416 0 CA-C-N 115.525 -0.761 . . . . 0.0 111.055 176.218 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 70' ' ' LYS . . . . . . . . . . . . . 57.0 mtpt -66.28 -33.97 76.95 Favored 'General case' 0 C--N 1.327 -0.388 0 CA-C-N 115.936 -0.575 . . . . 0.0 110.825 -179.872 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 71' ' ' PHE . . . . . 0.552 ' CE1' ' HB3' ' A' ' 135' ' ' GLN . 65.9 t80 -66.91 -49.35 65.84 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-O 120.843 0.354 . . . . 0.0 110.657 176.683 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 72' ' ' LEU . . . . . 0.456 ' HG ' ' O ' ' A' ' 68' ' ' ALA . 89.9 mt -59.89 -40.58 89.22 Favored 'General case' 0 C--N 1.324 -0.526 0 CA-C-N 116.238 -0.437 . . . . 0.0 110.681 -179.047 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 73' ' ' LYS . . . . . 0.729 ' HA ' ' HG2' ' A' ' 76' ' ' GLU . 28.1 tttp -78.34 -27.0 46.97 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.412 -0.358 . . . . 0.0 111.549 -175.989 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 74' ' ' SER . . . . . . . . . . . . . 22.1 p -75.89 -26.08 56.67 Favored 'General case' 0 C--N 1.321 -0.64 0 C-N-CA 120.197 -0.601 . . . . 0.0 110.226 176.355 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 75' ' ' LYS . . . . . 0.438 ' HG2' ' O ' ' A' ' 71' ' ' PHE . 28.8 mmmt -77.52 -43.25 32.69 Favored 'General case' 0 C--O 1.234 0.251 0 CA-C-N 116.554 -0.293 . . . . 0.0 110.835 177.368 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 76' ' ' GLU . . . . . 0.729 ' HG2' ' HA ' ' A' ' 73' ' ' LYS . 12.2 pt-20 -62.05 -35.39 78.48 Favored 'General case' 0 N--CA 1.462 0.167 0 CA-C-O 120.84 0.353 . . . . 0.0 110.223 176.709 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 77' ' ' ALA . . . . . . . . . . . . . . . -73.8 -32.7 63.88 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.21 -0.45 . . . . 0.0 110.85 176.987 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 78' ' ' ASP . . . . . . . . . . . . . 19.3 t70 -61.68 -54.77 38.26 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.099 -0.5 . . . . 0.0 110.787 178.47 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 79' ' ' GLY . . . . . . . . . . . . . . . 145.89 50.43 0.03 OUTLIER Glycine 0 N--CA 1.45 -0.427 0 C-N-CA 120.275 -0.964 . . . . 0.0 113.068 177.076 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 80' ' ' VAL . . . . . 0.452 HG21 HD23 ' A' ' 85' ' ' LEU . 31.0 m -106.56 155.48 7.34 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.514 0 O-C-N 122.652 -0.322 . . . . 0.0 110.334 177.055 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 81' ' ' SER . . . . . . . . . . . . . 13.0 m -70.73 150.55 45.8 Favored 'General case' 0 C--N 1.32 -0.682 0 CA-C-N 116.137 -0.483 . . . . 0.0 109.789 175.162 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 82' ' ' VAL . . . . . . . . . . . . . 14.1 p -60.75 -35.61 65.37 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.402 0 CA-C-O 120.597 0.237 . . . . 0.0 110.556 179.274 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 83' ' ' SER . . . . . . . . . . . . . 8.5 m -65.29 -37.49 87.31 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-O 121.081 0.467 . . . . 0.0 110.57 177.419 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 84' ' ' GLN . . . . . . . . . . . . . 6.1 tp-100 -68.42 -40.08 81.35 Favored 'General case' 0 C--N 1.332 -0.179 0 CA-C-N 115.971 -0.559 . . . . 0.0 109.609 177.031 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 85' ' ' LEU . . . . . 0.46 ' HA ' HD22 ' A' ' 85' ' ' LEU . 0.7 OUTLIER -65.12 -36.73 85.2 Favored 'General case' 0 C--N 1.327 -0.385 0 CA-C-N 115.59 -0.732 . . . . 0.0 109.486 177.35 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 86' ' ' ASN . . . . . . . . . . . . . 11.6 m120 -57.64 -39.47 77.06 Favored 'General case' 0 CA--C 1.519 -0.221 0 CA-C-N 116.046 -0.524 . . . . 0.0 110.622 175.261 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 87' ' ' SER . . . . . . . . . . . . . 49.0 m -65.23 -46.3 81.17 Favored 'General case' 0 C--N 1.326 -0.42 0 CA-C-N 116.407 -0.36 . . . . 0.0 110.547 178.588 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 88' ' ' TYR . . . . . . . . . . . . . 49.2 m-85 -57.5 -46.45 83.75 Favored 'General case' 0 N--CA 1.463 0.198 0 CA-C-O 121.01 0.433 . . . . 0.0 110.404 175.495 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 89' ' ' LYS . . . . . . . . . . . . . 38.4 ttmt -66.44 -35.6 80.69 Favored 'General case' 0 C--N 1.324 -0.528 0 CA-C-N 115.652 -0.704 . . . . 0.0 110.734 -178.951 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 90' ' ' ASN . . . . . . . . . . . . . 25.9 t-20 -62.29 -47.86 82.46 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-O 120.943 0.401 . . . . 0.0 110.207 178.553 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 91' ' ' TYR . . . . . . . . . . . . . 31.0 m-85 -62.3 -50.94 69.65 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.085 -0.507 . . . . 0.0 110.185 177.361 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 92' ' ' CYS . . . . . 0.629 ' SG ' ' HB1' ' A' ' 68' ' ' ALA . 42.0 t -63.96 -48.56 76.0 Favored 'General case' 0 C--N 1.323 -0.579 0 N-CA-C 112.368 0.507 . . . . 0.0 112.368 -175.262 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 93' ' ' ARG . . . . . . . . . . . . . 72.5 ttt180 -70.93 -38.5 72.91 Favored 'General case' 0 C--N 1.324 -0.504 0 N-CA-C 111.914 0.338 . . . . 0.0 111.914 -173.293 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 94' ' ' ASN . . . . . . . . . . . . . 73.1 m-20 -102.96 -58.12 1.93 Allowed 'General case' 0 C--N 1.324 -0.527 0 C-N-CA 120.912 -0.315 . . . . 0.0 111.718 -172.437 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 95' ' ' HIS . . . . . . . . . . . . . 78.0 m-70 -74.05 -42.7 59.84 Favored 'General case' 0 C--N 1.326 -0.425 0 CA-C-O 120.73 0.3 . . . . 0.0 111.086 -174.572 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 96' ' ' LEU . . . . . 0.568 ' HB2' ' HA ' ' A' ' 92' ' ' CYS . 96.0 mt -93.16 16.88 11.98 Favored 'General case' 0 C--N 1.325 -0.471 0 CA-C-N 116.475 -0.329 . . . . 0.0 110.63 179.414 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 97' ' ' SER . . . . . 0.575 ' N ' ' HD2' ' A' ' 98' ' ' PRO . 18.6 t -54.37 -47.55 97.28 Favored Pre-proline 0 CA--C 1.537 0.476 0 CA-C-N 115.811 -0.632 . . . . 0.0 111.427 178.665 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 98' ' ' PRO . . . . . 0.586 ' O ' ' HG3' ' A' ' 102' ' ' LYS . 10.3 Cg_endo -53.56 -32.38 63.6 Favored 'Trans proline' 0 C--N 1.36 1.143 0 C-N-CA 122.329 2.019 . . . . 0.0 112.758 175.554 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 99' ' ' LEU . . . . . 0.583 HD21 HG12 ' A' ' 112' ' ' ILE . 10.7 mp -81.22 -39.76 24.87 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-O 120.766 0.317 . . . . 0.0 110.865 178.243 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 100' ' ' TYR . . . . . . . . . . . . . 33.4 t80 -54.03 -33.69 57.98 Favored 'General case' 0 C--N 1.331 -0.225 0 CA-C-N 115.642 -0.708 . . . . 0.0 110.531 179.062 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 101' ' ' MET . . . . . . . . . . . . . 65.0 mtt -91.15 6.41 45.16 Favored 'General case' 0 C--N 1.327 -0.401 0 CA-C-N 115.539 -0.755 . . . . 0.0 111.652 -177.586 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 102' ' ' LYS . . . . . 0.586 ' HG3' ' O ' ' A' ' 98' ' ' PRO . 59.3 mttp -108.92 166.52 10.76 Favored 'General case' 0 C--N 1.326 -0.456 0 CA-C-O 121.555 0.693 . . . . 0.0 111.148 178.942 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 103' ' ' SER . . . . . 0.492 ' O ' HG13 ' A' ' 107' ' ' ILE . 28.6 t -96.93 160.38 14.38 Favored 'General case' 0 C--N 1.32 -0.703 0 CA-C-N 115.199 -0.909 . . . . 0.0 109.312 174.218 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 104' ' ' LEU . . . . . 0.513 ' HB3' HD12 ' A' ' 146' ' ' ILE . 84.9 mt -50.21 -59.57 3.81 Favored 'General case' 0 N--CA 1.468 0.469 0 N-CA-C 113.407 0.891 . . . . 0.0 113.407 -171.087 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 105' ' ' SER . . . . . . . . . . . . . 29.4 t -81.02 -0.47 39.85 Favored 'General case' 0 C--N 1.325 -0.483 0 CA-C-O 121.061 0.457 . . . . 0.0 111.046 -174.115 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 106' ' ' GLU . . . . . . . . . . . . . 3.4 mp0 -99.46 -1.8 37.62 Favored 'General case' 0 C--N 1.325 -0.481 0 CA-C-N 116.131 -0.486 . . . . 0.0 110.702 -175.962 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 107' ' ' ILE . . . . . 0.492 HG13 ' O ' ' A' ' 103' ' ' SER . 76.0 mt -87.13 129.0 39.31 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.455 0 CA-C-N 115.889 -0.596 . . . . 0.0 110.596 179.83 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 108' ' ' LEU . . . . . . . . . . . . . 91.9 mt -97.44 136.63 21.25 Favored Pre-proline 0 C--N 1.321 -0.636 0 CA-C-N 116.093 -0.503 . . . . 0.0 110.206 178.311 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 109' ' ' PRO . . . . . . . . . . . . . 32.5 Cg_exo -59.03 -32.94 98.42 Favored 'Trans proline' 0 CA--C 1.528 0.215 0 C-N-CA 122.738 2.292 . . . . 0.0 111.892 177.06 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 110' ' ' ALA . . . . . . . . . . . . . . . -67.04 -30.72 70.87 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 115.77 -0.65 . . . . 0.0 110.988 178.651 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 111' ' ' ASP . . . . . 0.431 ' O ' HG13 ' A' ' 115' ' ' ILE . 32.5 t70 -65.92 -39.61 90.7 Favored 'General case' 0 C--N 1.331 -0.218 0 N-CA-C 109.448 -0.575 . . . . 0.0 109.448 179.975 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 112' ' ' ILE . . . . . 0.583 HG12 HD21 ' A' ' 99' ' ' LEU . 15.6 mt -68.39 -40.95 83.09 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.308 0 CA-C-N 115.358 -0.837 . . . . 0.0 110.238 177.474 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 113' ' ' GLN . . . . . 0.517 ' HA ' HG23 ' A' ' 154' ' ' VAL . 0.0 OUTLIER -63.14 -40.63 98.13 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 115.911 -0.586 . . . . 0.0 109.988 -179.514 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 114' ' ' SER . . . . . . . . . . . . . 58.2 m -59.59 -41.47 90.36 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 116.358 -0.383 . . . . 0.0 110.862 176.921 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 115' ' ' ILE . . . . . 0.504 HD11 ' HG2' ' A' ' 98' ' ' PRO . 78.1 mt -57.65 -50.38 77.56 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.211 0 CA-C-O 120.81 0.338 . . . . 0.0 110.52 176.547 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 116' ' ' ILE . . . . . 0.404 HG23 ' HB3' ' A' ' 126' ' ' LEU . 49.5 mm -60.56 -43.2 94.0 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.343 0 CA-C-N 115.897 -0.592 . . . . 0.0 111.017 179.784 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 117' ' ' ASN . . . . . . . . . . . . . 55.1 t30 -67.18 -36.55 82.02 Favored 'General case' 0 C--N 1.324 -0.503 0 CA-C-N 115.925 -0.579 . . . . 0.0 111.492 -177.492 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 118' ' ' GLU . . . . . . . . . . . . . 43.2 mt-10 -84.19 -19.89 33.27 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 116.496 -0.32 . . . . 0.0 111.813 -177.43 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 119' ' ' THR . . . . . 0.412 HG23 HD23 ' A' ' 121' ' ' LEU . 96.1 m -70.82 126.29 29.18 Favored 'General case' 0 C--N 1.323 -0.563 0 N-CA-C 109.817 -0.438 . . . . 0.0 109.817 176.202 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 120' ' ' LYS . . . . . . . . . . . . . 21.8 mtpp -102.44 35.75 2.35 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-O 120.862 0.363 . . . . 0.0 111.591 -174.659 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 121' ' ' LEU . . . . . 0.412 HD23 HG23 ' A' ' 119' ' ' THR . 3.9 mm? -100.92 -175.92 3.02 Favored 'General case' 0 C--N 1.323 -0.574 0 CA-C-N 116.215 -0.448 . . . . 0.0 109.919 177.105 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 122' ' ' ALA . . . . . 0.422 ' O ' ' HG ' ' A' ' 126' ' ' LEU . . . -69.65 162.68 27.2 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-O 121.072 0.463 . . . . 0.0 111.67 -177.228 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 123' ' ' LYS . . . . . . . . . . . . . 53.2 mtmt -62.84 -34.2 76.82 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 115.764 -0.653 . . . . 0.0 111.073 -179.043 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 124' ' ' ASN . . . . . 0.743 ' HA ' ' HE3' ' A' ' 127' ' ' LYS . 65.2 t30 -64.4 -39.45 93.88 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-O 121.06 0.457 . . . . 0.0 109.911 176.937 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 125' ' ' THR . . . . . 0.44 ' O ' HG13 ' A' ' 129' ' ' ILE . 3.5 m -65.98 -39.0 89.97 Favored 'General case' 0 C--N 1.327 -0.399 0 CA-C-N 115.665 -0.698 . . . . 0.0 110.29 178.6 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 126' ' ' LEU . . . . . 0.422 ' HG ' ' O ' ' A' ' 122' ' ' ALA . 85.0 mt -62.33 -43.16 99.47 Favored 'General case' 0 C--O 1.234 0.26 0 CA-C-N 115.862 -0.608 . . . . 0.0 110.563 177.151 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 127' ' ' LYS . . . . . 0.743 ' HE3' ' HA ' ' A' ' 124' ' ' ASN . 27.0 mtmt -59.92 -41.35 91.54 Favored 'General case' 0 C--N 1.331 -0.237 0 CA-C-N 116.132 -0.486 . . . . 0.0 110.766 177.328 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 128' ' ' ALA . . . . . . . . . . . . . . . -60.99 -34.78 75.32 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.148 -0.478 . . . . 0.0 111.327 -179.308 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 129' ' ' ILE . . . . . 0.44 HG13 ' O ' ' A' ' 125' ' ' THR . 64.6 mt -65.69 -50.55 70.51 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.304 0 CA-C-N 116.519 -0.31 . . . . 0.0 110.397 178.424 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 130' ' ' ARG . . . . . . . . . . . . . 24.5 ttt180 -60.68 -42.85 97.93 Favored 'General case' 0 N--CA 1.462 0.14 0 CA-C-N 116.455 -0.339 . . . . 0.0 110.336 176.23 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 131' ' ' ASN . . . . . . . . . . . . . 7.7 t30 -55.91 -52.31 64.56 Favored 'General case' 0 C--N 1.327 -0.384 0 CA-C-N 115.816 -0.629 . . . . 0.0 110.519 -179.768 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 132' ' ' THR . . . . . 0.571 ' O ' HG13 ' A' ' 136' ' ' ILE . 37.7 m -57.43 -48.88 77.95 Favored 'General case' 0 C--N 1.326 -0.442 0 CA-C-N 115.714 -0.675 . . . . 0.0 110.814 178.898 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 133' ' ' ALA . . . . . . . . . . . . . . . -63.3 -46.99 84.14 Favored 'General case' 0 C--N 1.331 -0.213 0 CA-C-N 116.109 -0.496 . . . . 0.0 111.601 -177.859 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 134' ' ' SER . . . . . . . . . . . . . 9.5 t -62.98 -38.78 92.53 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-O 120.73 0.3 . . . . 0.0 110.519 -177.596 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 135' ' ' GLN . . . . . 0.552 ' HB3' ' CE1' ' A' ' 71' ' ' PHE . 0.8 OUTLIER -61.73 -39.97 93.44 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.255 -0.43 . . . . 0.0 110.967 176.67 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 136' ' ' ILE . . . . . 0.571 HG13 ' O ' ' A' ' 132' ' ' THR . 66.3 mt -65.7 -48.52 82.11 Favored 'Isoleucine or valine' 0 C--O 1.233 0.213 0 CA-C-N 116.344 -0.389 . . . . 0.0 110.635 178.336 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 137' ' ' PHE . . . . . 0.457 ' O ' HG13 ' A' ' 141' ' ' ILE . 40.6 m-85 -58.19 -43.92 87.81 Favored 'General case' 0 CA--C 1.521 -0.143 0 CA-C-N 116.179 -0.464 . . . . 0.0 110.748 178.321 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 138' ' ' ARG . . . . . 0.595 ' O ' ' HG3' ' A' ' 142' ' ' GLU . 62.3 mtt85 -59.51 -42.3 91.88 Favored 'General case' 0 C--O 1.222 -0.354 0 CA-C-N 116.278 -0.419 . . . . 0.0 111.163 178.673 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 139' ' ' LEU . . . . . . . . . . . . . 57.4 tp -56.95 -41.89 79.1 Favored 'General case' 0 C--N 1.326 -0.456 0 CA-C-O 120.942 0.401 . . . . 0.0 110.398 178.301 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 140' ' ' ALA . . . . . . . . . . . . . . . -66.84 -40.46 87.96 Favored 'General case' 0 C--N 1.327 -0.389 0 CA-C-N 116.144 -0.48 . . . . 0.0 110.475 176.693 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 141' ' ' ILE . . . . . 0.457 HG13 ' O ' ' A' ' 137' ' ' PHE . 80.1 mt -63.3 -40.5 89.28 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.301 0 CA-C-N 116.207 -0.451 . . . . 0.0 110.831 178.428 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 142' ' ' GLU . . . . . 0.595 ' HG3' ' O ' ' A' ' 138' ' ' ARG . 50.2 mt-10 -63.47 -29.99 71.19 Favored 'General case' 0 C--N 1.331 -0.228 0 CA-C-O 120.812 0.339 . . . . 0.0 111.049 179.971 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 143' ' ' ASN . . . . . 0.454 HD22 ' N ' ' A' ' 143' ' ' ASN . 0.9 OUTLIER -92.98 6.18 48.82 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-O 120.95 0.405 . . . . 0.0 110.32 176.927 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 144' ' ' ARG . . . . . 0.409 ' HD3' ' HA ' ' A' ' 144' ' ' ARG . 3.8 mmt180 59.52 28.33 17.7 Favored 'General case' 0 N--CA 1.464 0.26 0 CA-C-N 115.545 -0.752 . . . . 0.0 112.096 179.087 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 145' ' ' ALA . . . . . . . . . . . . . . . -78.51 -31.25 47.56 Favored 'General case' 0 C--N 1.327 -0.395 0 CA-C-O 121.074 0.464 . . . . 0.0 109.965 176.874 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 146' ' ' ILE . . . . . 0.513 HD12 ' HB3' ' A' ' 104' ' ' LEU . 14.8 tt -141.75 142.48 28.37 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.464 0 CA-C-N 115.641 -0.708 . . . . 0.0 109.165 175.503 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 147' ' ' ASP . . . . . . . . . . . . . 33.1 t70 -108.28 25.66 11.37 Favored 'General case' 0 C--N 1.322 -0.626 0 CA-C-O 121.681 0.753 . . . . 0.0 110.394 -175.999 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 148' ' ' PHE . . . . . 0.445 ' H ' HG12 ' A' ' 146' ' ' ILE . 80.7 t80 -148.81 141.96 24.98 Favored 'General case' 0 C--N 1.325 -0.498 0 CA-C-N 115.909 -0.587 . . . . 0.0 110.498 -177.393 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 149' ' ' ASN . . . . . . . . . . . . . 47.3 t-20 -116.73 99.61 52.95 Favored Pre-proline 0 C--N 1.326 -0.427 0 N-CA-C 110.111 -0.329 . . . . 0.0 110.111 177.83 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 150' ' ' PRO . . . . . . . . . . . . . 24.1 Cg_exo -64.54 -21.69 65.68 Favored 'Trans proline' 0 C--N 1.342 0.229 0 C-N-CA 122.892 2.395 . . . . 0.0 112.757 -178.593 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 151' ' ' ALA . . . . . 0.466 ' O ' HG12 ' A' ' 154' ' ' VAL . . . -73.62 -14.35 61.16 Favored 'General case' 0 C--N 1.327 -0.39 0 CA-C-O 120.875 0.369 . . . . 0.0 111.322 -176.719 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 152' ' ' ASP . . . . . . . . . . . . . 24.1 t70 -64.87 -27.89 69.17 Favored 'General case' 0 C--N 1.324 -0.54 0 CA-C-O 121.044 0.45 . . . . 0.0 110.395 178.201 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 153' ' ' TYR . . . . . . . . . . . . . 63.2 m-85 -97.26 0.81 48.78 Favored 'General case' 0 C--N 1.328 -0.343 0 N-CA-C 112.787 0.662 . . . . 0.0 112.787 -175.275 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 154' ' ' VAL . . . . . 0.517 HG23 ' HA ' ' A' ' 113' ' ' GLN . 6.3 p -94.21 106.7 18.39 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.384 0 C-N-CA 119.667 -0.813 . . . . 0.0 110.224 177.146 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 155' ' ' ARG . . . . . . . . . . . . . 18.2 ptt180 -93.04 144.55 25.15 Favored 'General case' 0 C--N 1.322 -0.622 0 CA-C-N 115.666 -0.697 . . . . 0.0 111.015 -177.249 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 156' ' ' ILE . . . . . . . . . . . . . 44.4 mm -89.25 116.82 67.34 Favored Pre-proline 0 C--N 1.323 -0.555 0 CA-C-N 115.655 -0.702 . . . . 0.0 109.803 179.616 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 157' ' ' PRO . . . . . . . . . . . . . 13.0 Cg_exo -70.01 130.75 19.57 Favored 'Trans proline' 0 N--CA 1.464 -0.264 0 C-N-CA 122.613 2.209 . . . . 0.0 111.867 -179.613 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 158' ' ' LYS . . . . . . . . . . . . . 9.9 mtmp? -93.34 67.64 4.11 Favored 'General case' 0 C--N 1.322 -0.629 0 CA-C-N 116.051 -0.522 . . . . 0.0 110.138 179.441 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 159' ' ' ILE . . . . . . . . . . . . . 64.4 mt -89.11 108.45 19.08 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.55 0 CA-C-N 115.651 -0.704 . . . . 0.0 111.198 -178.075 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 160' ' ' ALA . . . . . . . . . . . . . . . -126.27 22.76 7.12 Favored 'General case' 0 C--N 1.325 -0.488 0 CA-C-O 121.817 0.817 . . . . 0.0 109.667 175.883 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 161' ' ' LEU . . . . . . . . . . . . . 67.2 mt -79.58 -36.82 37.57 Favored 'General case' 0 C--N 1.318 -0.799 0 CA-C-N 114.584 -1.189 . . . . 0.0 111.726 -175.172 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 162' ' ' GLU . . . . . . . . . . . . . 0.2 OUTLIER -85.51 -63.4 1.33 Allowed 'General case' 0 C--N 1.327 -0.408 0 CA-C-N 116.415 -0.357 . . . . 0.0 110.526 -176.098 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 163' ' ' HIS . . . . . . . . . . . . . 0.6 OUTLIER -67.11 118.31 10.36 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-O 121.085 0.469 . . . . 0.0 110.871 -178.834 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 164' ' ' HIS . . . . . . . . . . . . . 32.6 m170 -82.12 -162.62 0.57 Allowed 'General case' 0 C--N 1.325 -0.479 0 CA-C-N 115.423 -0.808 . . . . 0.0 110.904 -177.946 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 165' ' ' HIS . . . . . . . . . . . . . 7.1 p80 -68.56 -0.23 4.87 Favored 'General case' 0 N--CA 1.472 0.643 0 N-CA-C 113.286 0.847 . . . . 0.0 113.286 -170.316 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 166' ' ' HIS . . . . . . . . . . . . . 57.8 t-80 -91.25 110.64 21.93 Favored 'General case' 0 C--N 1.325 -0.47 0 O-C-N 121.982 -0.449 . . . . 0.0 109.921 177.182 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 167' ' ' HIS . . . . . . . . . . . . . 65.0 t-80 -104.03 132.97 49.75 Favored 'General case' 0 C--N 1.325 -0.49 0 CA-C-N 116.179 -0.464 . . . . 0.0 110.736 -175.892 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 168' ' ' HIS . . . . . . . . . . . . . 51.5 t-80 . . . . . 0 C--O 1.249 1.032 0 CA-C-O 118.442 -0.789 . . . . 0.0 109.083 173.302 . . . . . . . . 0 0 . 1 . 006 nuclear nobuild full ' A' A ' 61' ' ' ARG . . . . . . . . . . . . . 98.9 mtt180 . . . . . 0 N--CA 1.482 1.146 0 CA-C-O 120.566 0.222 . . . . 0.0 110.418 . . . . . . . . . 0 0 . 1 . 006 nuclear nobuild full ' A' A ' 62' ' ' ASP . . . . . 0.482 ' HB3' ' NE1' ' A' ' 67' ' ' TRP . 6.9 m-20 67.8 88.7 0.11 Allowed 'General case' 0 C--O 1.235 0.297 0 CA-C-N 115.529 -0.76 . . . . 0.0 111.238 178.763 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 63' ' ' SER . . . . . 0.513 ' HA ' ' HA ' ' A' ' 103' ' ' SER . 10.7 p -84.26 160.37 20.77 Favored 'General case' 0 C--N 1.322 -0.608 0 CA-C-N 115.528 -0.76 . . . . 0.0 110.259 177.131 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 64' ' ' PHE . . . . . 0.54 ' HB2' HD11 ' A' ' 107' ' ' ILE . 86.6 t80 -60.99 -34.55 74.96 Favored 'General case' 0 C--N 1.33 -0.249 0 N-CA-C 109.933 -0.395 . . . . 0.0 109.933 179.693 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 65' ' ' GLY . . . . . . . . . . . . . . . -58.5 -44.82 95.19 Favored Glycine 0 N--CA 1.447 -0.6 0 CA-C-N 115.901 -0.59 . . . . 0.0 112.256 176.326 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 66' ' ' ASP . . . . . . . . . . . . . 36.9 t70 -65.08 -40.98 95.42 Favored 'General case' 0 C--N 1.327 -0.393 0 CA-C-O 120.819 0.342 . . . . 0.0 110.324 178.273 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 67' ' ' TRP . . . . . 0.482 ' NE1' ' HB3' ' A' ' 62' ' ' ASP . 87.0 m95 -62.36 -42.02 99.07 Favored 'General case' 0 C--N 1.332 -0.18 0 CA-C-N 116.278 -0.419 . . . . 0.0 110.967 177.011 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 68' ' ' ALA . . . . . 0.519 ' O ' ' HG ' ' A' ' 72' ' ' LEU . . . -59.73 -44.69 93.65 Favored 'General case' 0 C--N 1.327 -0.373 0 CA-C-N 116.287 -0.415 . . . . 0.0 110.669 177.8 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 69' ' ' GLU . . . . . . . . . . . . . 80.6 mt-10 -61.57 -42.85 99.44 Favored 'General case' 0 C--N 1.325 -0.461 0 CA-C-N 116.242 -0.436 . . . . 0.0 111.177 178.51 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 70' ' ' LYS . . . . . . . . . . . . . 43.2 mtmt -69.63 -28.64 66.09 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.272 -0.422 . . . . 0.0 110.731 179.639 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 71' ' ' PHE . . . . . . . . . . . . . 87.8 t80 -74.53 -40.12 61.94 Favored 'General case' 0 C--N 1.325 -0.488 0 CA-C-N 116.07 -0.514 . . . . 0.0 110.216 176.371 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 72' ' ' LEU . . . . . 0.519 ' HG ' ' O ' ' A' ' 68' ' ' ALA . 91.1 mt -65.93 -36.48 83.48 Favored 'General case' 0 C--N 1.327 -0.37 0 CA-C-O 120.883 0.373 . . . . 0.0 110.307 176.773 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 73' ' ' LYS . . . . . . . . . . . . . 39.4 ttmt -63.11 -45.8 90.31 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 115.943 -0.571 . . . . 0.0 110.642 178.472 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 74' ' ' SER . . . . . . . . . . . . . 6.4 p -73.75 -39.8 63.97 Favored 'General case' 0 C--N 1.326 -0.456 0 CA-C-N 115.847 -0.615 . . . . 0.0 111.323 -178.023 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 75' ' ' LYS . . . . . 0.492 ' O ' ' HB3' ' A' ' 78' ' ' ASP . 10.8 tptp -69.61 -21.93 63.54 Favored 'General case' 0 N--CA 1.454 -0.268 0 CA-C-O 120.811 0.338 . . . . 0.0 111.074 179.29 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 76' ' ' GLU . . . . . . . . . . . . . 31.1 tt0 -73.15 -43.5 61.44 Favored 'General case' 0 C--N 1.324 -0.532 0 N-CA-C 109.304 -0.628 . . . . 0.0 109.304 174.183 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 77' ' ' ALA . . . . . . . . . . . . . . . -65.65 -27.18 68.19 Favored 'General case' 0 C--N 1.331 -0.213 0 CA-C-N 115.668 -0.696 . . . . 0.0 110.672 175.714 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 78' ' ' ASP . . . . . 0.492 ' HB3' ' O ' ' A' ' 75' ' ' LYS . 18.5 t0 -51.98 -44.1 63.87 Favored 'General case' 0 C--O 1.235 0.295 0 CA-C-N 115.555 -0.748 . . . . 0.0 109.605 173.712 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 79' ' ' GLY . . . . . . . . . . . . . . . 107.31 29.06 4.65 Favored Glycine 0 N--CA 1.448 -0.521 0 CA-C-N 115.44 -0.8 . . . . 0.0 112.141 -179.315 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 80' ' ' VAL . . . . . . . . . . . . . 33.1 m -69.63 150.35 10.34 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.347 0 CA-C-O 120.956 0.407 . . . . 0.0 110.675 179.758 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 81' ' ' SER . . . . . . . . . . . . . 14.0 m -72.92 168.34 19.16 Favored 'General case' 0 C--N 1.324 -0.518 0 CA-C-N 115.849 -0.614 . . . . 0.0 111.016 -179.383 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 82' ' ' VAL . . . . . . . . . . . . . 48.9 t -57.44 -52.37 57.88 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.187 0 CA-C-N 116.259 -0.428 . . . . 0.0 111.425 -176.523 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 83' ' ' SER . . . . . . . . . . . . . 59.8 m -62.42 -27.6 69.21 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-O 120.891 0.377 . . . . 0.0 111.113 -179.095 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 84' ' ' GLN . . . . . . . . . . . . . 51.5 tp60 -69.18 -54.55 14.25 Favored 'General case' 0 C--N 1.327 -0.396 0 CA-C-N 116.152 -0.476 . . . . 0.0 109.812 -179.74 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 85' ' ' LEU . . . . . . . . . . . . . 31.7 tp -69.17 -30.33 68.53 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.22 -0.446 . . . . 0.0 110.216 179.835 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 86' ' ' ASN . . . . . . . . . . . . . 27.2 t-20 -58.03 -44.65 87.45 Favored 'General case' 0 C--O 1.235 0.3 0 CA-C-N 116.094 -0.503 . . . . 0.0 110.195 176.018 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 87' ' ' SER . . . . . . . . . . . . . 8.7 t -66.83 -39.24 87.58 Favored 'General case' 0 N--CA 1.452 -0.327 0 CA-C-N 115.66 -0.7 . . . . 0.0 110.1 178.821 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 88' ' ' TYR . . . . . . . . . . . . . 30.9 m-85 -59.17 -46.32 88.71 Favored 'General case' 0 C--O 1.231 0.101 0 CA-C-N 116.321 -0.399 . . . . 0.0 111.106 177.053 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 89' ' ' LYS . . . . . . . . . . . . . 88.3 mttt -62.82 -44.38 96.3 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.5 -0.318 . . . . 0.0 110.45 179.09 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 90' ' ' ASN . . . . . . . . . . . . . 27.1 t-20 -57.98 -50.35 73.71 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.095 -0.502 . . . . 0.0 110.913 -179.5 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 91' ' ' TYR . . . . . . . . . . . . . 22.3 m-30 -58.68 -52.1 67.11 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.321 -0.4 . . . . 0.0 110.909 -179.492 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 92' ' ' CYS . . . . . 0.478 ' HA ' ' HB2' ' A' ' 96' ' ' LEU . 61.5 m -67.52 -44.9 77.26 Favored 'General case' 0 C--N 1.325 -0.461 0 CA-C-N 116.173 -0.467 . . . . 0.0 112.117 -173.771 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 93' ' ' ARG . . . . . . . . . . . . . 23.9 mmm-85 -81.08 -28.97 35.07 Favored 'General case' 0 C--N 1.329 -0.318 0 N-CA-C 112.194 0.442 . . . . 0.0 112.194 -173.123 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 94' ' ' ASN . . . . . . . . . . . . . 0.9 OUTLIER -105.54 -61.95 1.42 Allowed 'General case' 0 C--N 1.328 -0.366 0 C-N-CA 120.407 -0.517 . . . . 0.0 112.115 -176.409 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 95' ' ' HIS . . . . . . . . . . . . . 38.9 t-80 -75.84 -26.21 56.95 Favored 'General case' 0 C--N 1.326 -0.416 0 CA-C-O 120.826 0.346 . . . . 0.0 111.148 -172.37 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 96' ' ' LEU . . . . . 0.478 ' HB2' ' HA ' ' A' ' 92' ' ' CYS . 86.7 mt -108.37 14.95 24.4 Favored 'General case' 0 C--N 1.324 -0.504 0 CA-C-N 116.334 -0.394 . . . . 0.0 110.69 -179.793 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 97' ' ' SER . . . . . 0.585 ' N ' ' HD2' ' A' ' 98' ' ' PRO . 8.1 t -57.76 -46.03 99.77 Favored Pre-proline 0 CA--C 1.541 0.632 0 CA-C-N 116.342 -0.39 . . . . 0.0 111.897 -179.249 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 98' ' ' PRO . . . . . 0.585 ' HD2' ' N ' ' A' ' 97' ' ' SER . 10.2 Cg_endo -55.13 -28.19 59.65 Favored 'Trans proline' 0 C--N 1.357 0.992 0 C-N-CA 122.306 2.004 . . . . 0.0 112.591 175.604 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 99' ' ' LEU . . . . . 0.503 HD11 HG12 ' A' ' 112' ' ' ILE . 72.8 mt -89.29 -30.48 18.44 Favored 'General case' 0 C--N 1.326 -0.413 0 CA-C-N 116.251 -0.431 . . . . 0.0 110.219 -179.895 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 100' ' ' TYR . . . . . . . . . . . . . 16.4 t80 -57.11 -39.84 75.88 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 115.473 -0.785 . . . . 0.0 110.577 -179.519 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 101' ' ' MET . . . . . . . . . . . . . 24.7 ttt -76.47 -23.23 53.83 Favored 'General case' 0 C--O 1.233 0.222 0 CA-C-N 115.764 -0.653 . . . . 0.0 110.751 179.706 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 102' ' ' LYS . . . . . . . . . . . . . 50.0 mttm -75.72 146.46 40.1 Favored 'General case' 0 C--N 1.323 -0.573 0 CA-C-O 121.298 0.57 . . . . 0.0 111.63 -177.945 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 103' ' ' SER . . . . . 0.513 ' HA ' ' HA ' ' A' ' 63' ' ' SER . 7.4 m -76.4 160.73 29.29 Favored 'General case' 0 N--CA 1.445 -0.698 0 N-CA-C 108.109 -1.071 . . . . 0.0 108.109 169.788 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 104' ' ' LEU . . . . . 0.556 ' HG ' HD12 ' A' ' 146' ' ' ILE . 18.0 tp -56.5 -33.48 66.03 Favored 'General case' 0 C--N 1.323 -0.568 0 N-CA-C 111.914 0.339 . . . . 0.0 111.914 -174.007 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 105' ' ' SER . . . . . . . . . . . . . 12.1 p -87.77 -2.11 58.4 Favored 'General case' 0 CA--C 1.536 0.437 0 N-CA-C 112.416 0.524 . . . . 0.0 112.416 -177.698 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 106' ' ' GLU . . . . . 0.404 ' HG3' ' HB2' ' A' ' 103' ' ' SER . 43.3 mt-10 -94.41 -6.11 44.82 Favored 'General case' 0 C--O 1.234 0.268 0 CA-C-O 120.93 0.395 . . . . 0.0 111.17 -178.519 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 107' ' ' ILE . . . . . 0.54 HD11 ' HB2' ' A' ' 64' ' ' PHE . 74.8 mt -95.19 120.13 44.19 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.685 0 CA-C-N 116.147 -0.479 . . . . 0.0 111.456 -173.341 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 108' ' ' LEU . . . . . . . . . . . . . 85.7 mt -101.47 152.47 38.02 Favored Pre-proline 0 C--N 1.323 -0.549 0 CA-C-N 115.726 -0.67 . . . . 0.0 109.618 176.744 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 109' ' ' PRO . . . . . . . . . . . . . 18.4 Cg_endo -61.77 -24.39 77.38 Favored 'Trans proline' 0 C--O 1.233 0.235 0 C-N-CA 122.235 1.957 . . . . 0.0 111.516 176.446 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 110' ' ' ALA . . . . . . . . . . . . . . . -69.42 -38.44 77.9 Favored 'General case' 0 N--CA 1.452 -0.354 0 CA-C-N 115.612 -0.722 . . . . 0.0 111.011 179.761 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 111' ' ' ASP . . . . . 0.42 ' O ' HG13 ' A' ' 115' ' ' ILE . 54.6 m-20 -57.7 -52.94 63.37 Favored 'General case' 0 N--CA 1.464 0.228 0 CA-C-O 121.129 0.49 . . . . 0.0 110.437 -179.508 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 112' ' ' ILE . . . . . 0.503 HG12 HD11 ' A' ' 99' ' ' LEU . 28.4 mt -62.58 -47.39 93.16 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.51 0 CA-C-N 115.388 -0.824 . . . . 0.0 111.015 -177.745 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 113' ' ' GLN . . . . . . . . . . . . . 12.2 tm0? -64.97 -40.11 94.5 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.166 -0.47 . . . . 0.0 110.653 -176.2 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 114' ' ' SER . . . . . . . . . . . . . 27.9 t -57.11 -49.47 75.8 Favored 'General case' 0 C--O 1.237 0.438 0 CA-C-O 120.842 0.354 . . . . 0.0 110.477 179.034 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 115' ' ' ILE . . . . . 0.42 HG13 ' O ' ' A' ' 111' ' ' ASP . 60.9 mt -59.4 -49.34 83.89 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.179 0 CA-C-N 115.943 -0.571 . . . . 0.0 109.969 179.015 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 116' ' ' ILE . . . . . 0.47 HG21 HD12 ' A' ' 156' ' ' ILE . 33.4 mm -56.16 -44.29 78.59 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.227 0 CA-C-N 116.033 -0.531 . . . . 0.0 111.024 178.462 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 117' ' ' ASN . . . . . . . . . . . . . 10.1 t30 -55.62 -40.73 72.51 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 115.826 -0.624 . . . . 0.0 112.207 -177.494 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 118' ' ' GLU . . . . . . . . . . . . . 10.9 pt-20 -92.29 -9.22 42.79 Favored 'General case' 0 C--N 1.325 -0.462 0 N-CA-C 112.308 0.484 . . . . 0.0 112.308 -178.572 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 119' ' ' THR . . . . . . . . . . . . . 84.4 m -76.25 132.73 40.04 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-O 120.731 0.301 . . . . 0.0 110.844 178.91 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 120' ' ' LYS . . . . . 0.452 ' HE3' ' HB2' ' A' ' 120' ' ' LYS . 39.3 mtmt -106.91 89.55 3.04 Favored 'General case' 0 C--N 1.328 -0.364 0 N-CA-C 110.247 -0.279 . . . . 0.0 110.247 179.619 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 121' ' ' LEU . . . . . . . . . . . . . 86.8 mt -135.44 173.23 11.95 Favored 'General case' 0 C--N 1.322 -0.598 0 CA-C-N 116.565 -0.289 . . . . 0.0 110.265 178.27 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 122' ' ' ALA . . . . . . . . . . . . . . . -68.4 157.19 36.3 Favored 'General case' 0 C--N 1.327 -0.384 0 CA-C-N 116.359 -0.382 . . . . 0.0 110.543 178.906 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 123' ' ' LYS . . . . . . . . . . . . . 59.2 pttt -57.56 -36.41 71.63 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.2 -0.454 . . . . 0.0 110.83 -179.556 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 124' ' ' ASN . . . . . . . . . . . . . 52.9 t30 -64.82 -46.25 82.76 Favored 'General case' 0 C--N 1.332 -0.161 0 CA-C-N 116.235 -0.439 . . . . 0.0 110.405 177.591 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 125' ' ' THR . . . . . 0.476 ' O ' HG13 ' A' ' 129' ' ' ILE . 2.3 m -66.39 -45.31 80.46 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 115.573 -0.739 . . . . 0.0 111.187 -176.246 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 126' ' ' LEU . . . . . 0.638 ' HB3' HD11 ' A' ' 156' ' ' ILE . 83.8 mt -61.84 -48.01 82.48 Favored 'General case' 0 C--O 1.234 0.246 0 CA-C-N 116.286 -0.415 . . . . 0.0 111.248 -179.144 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 127' ' ' LYS . . . . . . . . . . . . . 98.1 mttt -63.56 -35.11 79.4 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.378 -0.374 . . . . 0.0 110.782 177.81 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 128' ' ' ALA . . . . . . . . . . . . . . . -62.18 -43.28 99.18 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-N 116.57 -0.286 . . . . 0.0 110.969 179.517 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 129' ' ' ILE . . . . . 0.476 HG13 ' O ' ' A' ' 125' ' ' THR . 68.4 mt -61.28 -47.52 93.13 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.33 0 CA-C-O 120.878 0.37 . . . . 0.0 110.499 178.491 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 130' ' ' ARG . . . . . 0.451 ' HD2' ' HB ' ' A' ' 154' ' ' VAL . 9.7 ttt180 -65.31 -45.89 82.52 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.258 -0.428 . . . . 0.0 111.213 -179.666 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 131' ' ' ASN . . . . . . . . . . . . . 92.9 m-20 -63.94 -33.39 75.61 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-O 120.65 0.262 . . . . 0.0 111.094 -179.755 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 132' ' ' THR . . . . . . . . . . . . . 98.0 m -65.53 -45.35 83.81 Favored 'General case' 0 C--N 1.325 -0.493 0 CA-C-O 120.887 0.375 . . . . 0.0 110.331 174.823 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 133' ' ' ALA . . . . . . . . . . . . . . . -64.4 -43.88 93.04 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 115.923 -0.58 . . . . 0.0 111.111 -179.386 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 134' ' ' SER . . . . . 0.534 ' O ' ' HG3' ' A' ' 138' ' ' ARG . 23.6 p -64.3 -35.51 81.1 Favored 'General case' 0 C--N 1.331 -0.196 0 CA-C-N 116.667 -0.242 . . . . 0.0 110.797 -179.373 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 135' ' ' GLN . . . . . . . . . . . . . 13.1 mm100 -59.63 -42.06 91.88 Favored 'General case' 0 C--N 1.331 -0.236 0 CA-C-O 120.803 0.335 . . . . 0.0 110.794 175.034 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 136' ' ' ILE . . . . . . . . . . . . . 69.3 mt -65.07 -42.98 95.89 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.365 0 CA-C-N 115.938 -0.573 . . . . 0.0 110.508 178.045 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 137' ' ' PHE . . . . . 0.437 ' O ' HG13 ' A' ' 141' ' ' ILE . 35.3 m-85 -66.92 -37.83 85.06 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.213 -0.449 . . . . 0.0 110.927 178.207 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 138' ' ' ARG . . . . . 0.534 ' HG3' ' O ' ' A' ' 134' ' ' SER . 54.1 mtp180 -59.32 -43.33 92.69 Favored 'General case' 0 CA--C 1.517 -0.324 0 N-CA-C 110.022 -0.362 . . . . 0.0 110.022 174.92 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 139' ' ' LEU . . . . . . . . . . . . . 49.9 tp -58.87 -41.18 86.47 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 115.75 -0.659 . . . . 0.0 110.075 178.205 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 140' ' ' ALA . . . . . 0.466 ' HB1' HD21 ' A' ' 104' ' ' LEU . . . -64.99 -41.63 95.23 Favored 'General case' 0 C--N 1.327 -0.391 0 CA-C-N 116.086 -0.506 . . . . 0.0 110.62 177.16 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 141' ' ' ILE . . . . . 0.437 HG13 ' O ' ' A' ' 137' ' ' PHE . 74.7 mt -61.81 -46.11 97.23 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.374 0 CA-C-N 116.14 -0.482 . . . . 0.0 110.902 176.299 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 142' ' ' GLU . . . . . . . . . . . . . 44.5 mt-10 -60.61 -36.77 79.41 Favored 'General case' 0 N--CA 1.465 0.282 0 CA-C-O 120.79 0.329 . . . . 0.0 111.012 178.548 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 143' ' ' ASN . . . . . . . . . . . . . 40.4 m-80 -88.23 10.44 19.56 Favored 'General case' 0 C--N 1.331 -0.225 0 CA-C-N 116.154 -0.475 . . . . 0.0 110.719 178.934 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 144' ' ' ARG . . . . . . . . . . . . . 61.6 mtt-85 64.23 21.71 12.61 Favored 'General case' 0 N--CA 1.466 0.334 0 CA-C-N 115.621 -0.718 . . . . 0.0 112.389 171.246 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 145' ' ' ALA . . . . . . . . . . . . . . . -85.26 -27.6 25.91 Favored 'General case' 0 C--N 1.323 -0.552 0 CA-C-O 120.806 0.336 . . . . 0.0 111.595 -176.678 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 146' ' ' ILE . . . . . 0.556 HD12 ' HG ' ' A' ' 104' ' ' LEU . 13.8 tt -143.88 149.58 17.72 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.536 0 CA-C-O 120.906 0.384 . . . . 0.0 110.452 -179.79 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 147' ' ' ASP . . . . . . . . . . . . . 0.9 OUTLIER -114.92 25.03 11.24 Favored 'General case' 0 C--N 1.325 -0.46 0 CA-C-O 121.254 0.549 . . . . 0.0 110.249 179.524 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 148' ' ' PHE . . . . . 0.441 ' H ' HG12 ' A' ' 146' ' ' ILE . 60.1 t80 -144.29 134.01 23.67 Favored 'General case' 0 C--N 1.323 -0.582 0 CA-C-N 115.581 -0.736 . . . . 0.0 109.589 -174.434 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 149' ' ' ASN . . . . . . . . . . . . . 53.6 t-20 -115.19 95.66 43.05 Favored Pre-proline 0 C--N 1.324 -0.525 0 N-CA-C 109.987 -0.375 . . . . 0.0 109.987 178.5 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 150' ' ' PRO . . . . . . . . . . . . . 32.9 Cg_exo -58.62 -33.18 98.01 Favored 'Trans proline' 0 C--N 1.342 0.225 0 C-N-CA 122.937 2.425 . . . . 0.0 112.769 -178.575 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 151' ' ' ALA . . . . . 0.507 ' HA ' HG23 ' A' ' 154' ' ' VAL . . . -73.38 -20.73 60.69 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 116.442 -0.345 . . . . 0.0 111.502 -176.327 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 152' ' ' ASP . . . . . . . . . . . . . 29.9 t70 -70.15 -23.72 63.05 Favored 'General case' 0 C--N 1.325 -0.5 0 CA-C-O 121.123 0.487 . . . . 0.0 110.62 178.942 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 153' ' ' TYR . . . . . . . . . . . . . 77.0 m-85 -96.59 -2.88 43.97 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.114 -0.493 . . . . 0.0 110.763 -178.571 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 154' ' ' VAL . . . . . 0.507 HG23 ' HA ' ' A' ' 151' ' ' ALA . 61.0 t -77.64 117.66 23.15 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.391 0 CA-C-N 116.384 -0.371 . . . . 0.0 110.374 179.19 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 155' ' ' ARG . . . . . . . . . . . . . 51.1 mtp85 -92.12 141.9 28.09 Favored 'General case' 0 C--N 1.318 -0.802 0 CA-C-O 120.972 0.415 . . . . 0.0 110.514 176.32 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 156' ' ' ILE . . . . . 0.638 HD11 ' HB3' ' A' ' 126' ' ' LEU . 2.9 tp -106.97 129.31 24.55 Favored Pre-proline 0 C--N 1.318 -0.789 0 CA-C-N 115.456 -0.793 . . . . 0.0 109.609 -176.889 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 157' ' ' PRO . . . . . . . . . . . . . 86.1 Cg_endo -89.51 140.79 3.78 Favored 'Trans proline' 0 N--CA 1.454 -0.8 0 C-N-CA 122.631 2.221 . . . . 0.0 113.08 -179.426 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 158' ' ' LYS . . . . . . . . . . . . . 39.8 mtmt -105.77 3.05 28.41 Favored 'General case' 0 C--N 1.327 -0.398 0 N-CA-C 109.156 -0.683 . . . . 0.0 109.156 171.817 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 159' ' ' ILE . . . . . . . . . . . . . 66.6 mt -82.06 94.78 2.89 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.446 0 CA-C-N 115.296 -0.865 . . . . 0.0 111.134 -172.707 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 160' ' ' ALA . . . . . . . . . . . . . . . -89.11 170.87 10.26 Favored 'General case' 0 C--N 1.319 -0.719 0 CA-C-N 115.555 -0.748 . . . . 0.0 109.288 172.379 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 161' ' ' LEU . . . . . 0.598 HD21 ' HB3' ' A' ' 167' ' ' HIS . 5.6 mp -66.44 109.63 2.81 Favored 'General case' 0 C--N 1.322 -0.617 0 CA-C-O 120.995 0.426 . . . . 0.0 110.601 -176.484 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 162' ' ' GLU . . . . . . . . . . . . . 42.7 tt0 -70.45 -51.59 28.22 Favored 'General case' 0 C--N 1.325 -0.482 0 CA-C-N 115.84 -0.618 . . . . 0.0 109.993 179.214 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 163' ' ' HIS . . . . . . . . . . . . . 15.0 m-70 -85.62 173.55 10.07 Favored 'General case' 0 C--N 1.323 -0.579 0 CA-C-N 115.901 -0.59 . . . . 0.0 110.513 177.923 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 164' ' ' HIS . . . . . . . . . . . . . 41.8 m-70 -100.52 154.28 18.68 Favored 'General case' 0 C--N 1.322 -0.627 0 CA-C-N 116.069 -0.514 . . . . 0.0 110.715 -176.95 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 165' ' ' HIS . . . . . . . . . . . . . 90.6 m-70 47.79 79.34 0.07 Allowed 'General case' 0 N--CA 1.467 0.392 0 O-C-N 124.066 0.854 . . . . 0.0 112.732 173.756 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 166' ' ' HIS . . . . . . . . . . . . . 28.5 m80 -141.23 -41.01 0.38 Allowed 'General case' 0 C--N 1.319 -0.742 0 CA-C-N 115.448 -0.796 . . . . 0.0 109.355 174.564 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 167' ' ' HIS . . . . . 0.598 ' HB3' HD21 ' A' ' 161' ' ' LEU . 33.2 t60 -123.27 85.35 2.41 Favored 'General case' 0 C--N 1.32 -0.678 0 N-CA-C 107.438 -1.319 . . . . 0.0 107.438 172.236 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 168' ' ' HIS . . . . . 0.442 ' HB2' ' O ' ' A' ' 167' ' ' HIS . 5.9 m80 . . . . . 0 C--O 1.249 1.037 0 O-C-N 123.911 0.757 . . . . 0.0 109.865 -166.541 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 61' ' ' ARG . . . . . . . . . . . . . 23.6 mtm180 . . . . . 0 N--CA 1.477 0.903 0 N-CA-C 109.517 -0.549 . . . . 0.0 109.517 . . . . . . . . . 0 0 . 1 . 007 nuclear nobuild full ' A' A ' 62' ' ' ASP . . . . . 0.413 ' HB2' ' HE1' ' A' ' 67' ' ' TRP . 30.8 m-20 -77.14 -176.92 4.26 Favored 'General case' 0 C--N 1.326 -0.452 0 CA-C-O 121.185 0.517 . . . . 0.0 110.849 -179.192 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 63' ' ' SER . . . . . 0.6 ' HA ' ' HA ' ' A' ' 103' ' ' SER . 47.0 m -114.71 159.68 20.26 Favored 'General case' 0 N--CA 1.444 -0.77 0 CA-C-N 115.824 -0.625 . . . . 0.0 110.54 -178.825 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 64' ' ' PHE . . . . . 0.517 ' HB2' HD11 ' A' ' 107' ' ' ILE . 80.6 t80 -58.47 -34.4 70.84 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 115.865 -0.607 . . . . 0.0 111.145 -176.171 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 65' ' ' GLY . . . . . . . . . . . . . . . -61.68 -40.78 99.23 Favored Glycine 0 N--CA 1.453 -0.224 0 C-N-CA 120.898 -0.668 . . . . 0.0 112.636 179.901 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 66' ' ' ASP . . . . . . . . . . . . . 24.7 t70 -61.11 -52.16 66.08 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-O 120.936 0.398 . . . . 0.0 110.163 177.635 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 67' ' ' TRP . . . . . 0.413 ' HE1' ' HB2' ' A' ' 62' ' ' ASP . 98.7 m95 -65.51 -34.47 78.33 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-N 115.58 -0.737 . . . . 0.0 111.403 -179.204 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 68' ' ' ALA . . . . . 0.592 ' O ' ' HG ' ' A' ' 72' ' ' LEU . . . -61.96 -50.85 70.46 Favored 'General case' 0 C--N 1.327 -0.377 0 CA-C-O 120.665 0.269 . . . . 0.0 110.827 178.598 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 69' ' ' GLU . . . . . . . . . . . . . 33.3 tt0 -69.87 -34.37 73.48 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-O 120.769 0.319 . . . . 0.0 110.213 -179.791 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 70' ' ' LYS . . . . . . . . . . . . . 48.9 tttm -61.72 -42.93 99.6 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-O 121.298 0.57 . . . . 0.0 109.556 176.264 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 71' ' ' PHE . . . . . . . . . . . . . 71.4 t80 -64.31 -45.15 89.17 Favored 'General case' 0 C--N 1.326 -0.423 0 CA-C-N 115.244 -0.889 . . . . 0.0 111.056 176.82 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 72' ' ' LEU . . . . . 0.592 ' HG ' ' O ' ' A' ' 68' ' ' ALA . 89.2 mt -61.44 -42.41 98.72 Favored 'General case' 0 C--N 1.327 -0.396 0 CA-C-O 121.017 0.436 . . . . 0.0 110.38 178.706 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 73' ' ' LYS . . . . . 0.511 ' HD2' ' HA ' ' A' ' 73' ' ' LYS . 18.2 tptt -70.0 -38.22 75.91 Favored 'General case' 0 C--N 1.326 -0.434 0 CA-C-N 115.842 -0.617 . . . . 0.0 111.15 -176.023 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 74' ' ' SER . . . . . . . . . . . . . 8.1 p -70.06 -32.4 70.48 Favored 'General case' 0 C--N 1.327 -0.376 0 C-N-CA 121.077 -0.249 . . . . 0.0 110.877 179.987 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 75' ' ' LYS . . . . . . . . . . . . . 30.8 mmtp -73.09 -37.28 66.81 Favored 'General case' 0 C--O 1.234 0.273 0 CA-C-O 120.775 0.322 . . . . 0.0 110.478 174.634 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 76' ' ' GLU . . . . . . . . . . . . . 42.0 tt0 -61.84 -46.12 90.83 Favored 'General case' 0 C--N 1.327 -0.379 0 CA-C-N 116.053 -0.521 . . . . 0.0 110.251 177.474 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 77' ' ' ALA . . . . . . . . . . . . . . . -70.54 -33.41 71.12 Favored 'General case' 0 C--N 1.325 -0.466 0 CA-C-N 115.816 -0.629 . . . . 0.0 111.072 177.644 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 78' ' ' ASP . . . . . . . . . . . . . 20.1 t70 -57.9 -47.05 83.95 Favored 'General case' 0 CA--C 1.518 -0.286 0 CA-C-N 116.142 -0.481 . . . . 0.0 110.431 177.449 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 79' ' ' GLY . . . . . . . . . . . . . . . 114.98 41.17 0.85 Allowed Glycine 0 N--CA 1.443 -0.835 0 C-N-CA 120.436 -0.887 . . . . 0.0 112.966 176.288 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 80' ' ' VAL . . . . . . . . . . . . . 29.0 m -77.33 157.53 5.29 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.442 0 N-CA-C 110.137 -0.319 . . . . 0.0 110.137 174.649 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 81' ' ' SER . . . . . . . . . . . . . 18.4 m -62.07 150.3 38.7 Favored 'General case' 0 C--N 1.324 -0.534 0 N-CA-C 110.239 -0.282 . . . . 0.0 110.239 177.925 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 82' ' ' VAL . . . . . . . . . . . . . 55.4 t -58.97 -42.82 87.24 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.495 0 CA-C-N 116.356 -0.384 . . . . 0.0 110.453 -177.348 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 83' ' ' SER . . . . . . . . . . . . . 13.4 m -59.44 -39.19 82.76 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 116.311 -0.404 . . . . 0.0 111.131 179.054 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 84' ' ' GLN . . . . . . . . . . . . . 7.7 tp-100 -63.32 -45.03 93.2 Favored 'General case' 0 C--O 1.234 0.274 0 CA-C-O 121.107 0.48 . . . . 0.0 110.298 177.407 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 85' ' ' LEU . . . . . . . . . . . . . 46.8 tp -67.88 -36.18 79.79 Favored 'General case' 0 C--N 1.327 -0.408 0 CA-C-N 115.936 -0.575 . . . . 0.0 110.428 179.455 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 86' ' ' ASN . . . . . . . . . . . . . 11.8 m120 -60.83 -47.2 87.45 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.233 -0.44 . . . . 0.0 110.563 178.215 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 87' ' ' SER . . . . . . . . . . . . . 3.5 p -63.36 -36.32 83.3 Favored 'General case' 0 CA--C 1.531 0.243 0 C-N-CA 121.038 -0.265 . . . . 0.0 111.319 179.396 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 88' ' ' TYR . . . . . . . . . . . . . 6.6 m-85 -59.62 -54.49 45.86 Favored 'General case' 0 C--O 1.233 0.232 0 CA-C-O 121.707 0.765 . . . . 0.0 110.167 174.236 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 89' ' ' LYS . . . . . 0.403 ' HE3' ' HB2' ' A' ' 89' ' ' LYS . 34.6 ttmt -65.59 -32.97 74.84 Favored 'General case' 0 C--N 1.325 -0.467 0 CA-C-N 114.597 -1.183 . . . . 0.0 110.88 -175.741 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 90' ' ' ASN . . . . . . . . . . . . . 27.6 t-20 -64.43 -52.18 59.41 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 116.02 -0.536 . . . . 0.0 111.324 179.708 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 91' ' ' TYR . . . . . . . . . . . . . 22.3 m-85 -61.06 -39.72 90.91 Favored 'General case' 0 C--O 1.234 0.259 0 CA-C-O 121.033 0.444 . . . . 0.0 110.233 179.756 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 92' ' ' CYS . . . . . 0.614 ' HA ' ' HB2' ' A' ' 96' ' ' LEU . 42.7 t -64.63 -49.57 70.56 Favored 'General case' 0 C--N 1.325 -0.474 0 CA-C-N 115.31 -0.859 . . . . 0.0 111.094 -178.09 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 93' ' ' ARG . . . . . . . . . . . . . 28.9 mmt180 -73.09 -6.56 46.47 Favored 'General case' 0 C--N 1.328 -0.35 0 N-CA-C 112.94 0.718 . . . . 0.0 112.94 -175.099 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 94' ' ' ASN . . . . . . . . . . . . . 52.7 m-80 -118.9 -64.66 1.25 Allowed 'General case' 0 C--N 1.327 -0.403 0 C-N-CA 119.537 -0.865 . . . . 0.0 112.721 -179.402 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 95' ' ' HIS . . . . . . . . . . . . . 82.7 m-70 -88.98 -20.49 24.39 Favored 'General case' 0 C--N 1.325 -0.469 0 N-CA-C 112.617 0.599 . . . . 0.0 112.617 -173.838 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 96' ' ' LEU . . . . . 0.614 ' HB2' ' HA ' ' A' ' 92' ' ' CYS . 83.4 mt -99.05 7.14 46.22 Favored 'General case' 0 C--N 1.325 -0.463 0 C-N-CA 120.946 -0.302 . . . . 0.0 111.065 -178.751 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 97' ' ' SER . . . . . 0.545 ' N ' ' HD2' ' A' ' 98' ' ' PRO . 50.2 m -57.63 -49.26 94.78 Favored Pre-proline 0 CA--C 1.537 0.453 0 CA-C-N 116.383 -0.371 . . . . 0.0 111.896 178.907 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 98' ' ' PRO . . . . . 0.545 ' HD2' ' N ' ' A' ' 97' ' ' SER . 9.5 Cg_endo -53.9 -40.07 82.13 Favored 'Trans proline' 0 C--N 1.358 1.037 0 C-N-CA 122.047 1.831 . . . . 0.0 112.458 176.727 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 99' ' ' LEU . . . . . 0.558 HD23 ' HD2' ' A' ' 102' ' ' LYS . 90.6 mt -75.28 -29.53 60.16 Favored 'General case' 0 C--N 1.332 -0.188 0 CA-C-N 116.255 -0.43 . . . . 0.0 111.107 -178.736 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 100' ' ' TYR . . . . . . . . . . . . . 23.4 t80 -55.74 -29.82 60.19 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 115.759 -0.655 . . . . 0.0 111.701 -174.318 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 101' ' ' MET . . . . . . . . . . . . . 65.2 mtt -106.77 10.75 30.72 Favored 'General case' 0 C--N 1.326 -0.44 0 CA-C-O 120.663 0.268 . . . . 0.0 111.571 -178.16 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 102' ' ' LYS . . . . . 0.558 ' HD2' HD23 ' A' ' 99' ' ' LEU . 68.3 mttm -97.03 134.41 40.42 Favored 'General case' 0 C--N 1.326 -0.424 0 N-CA-C 110.217 -0.29 . . . . 0.0 110.217 177.628 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 103' ' ' SER . . . . . 0.6 ' HA ' ' HA ' ' A' ' 63' ' ' SER . 68.0 m -73.52 152.28 40.72 Favored 'General case' 0 C--N 1.323 -0.568 0 N-CA-C 109.298 -0.631 . . . . 0.0 109.298 172.823 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 104' ' ' LEU . . . . . 0.442 ' HA ' HD12 ' A' ' 107' ' ' ILE . 82.2 mt -53.51 -35.9 61.16 Favored 'General case' 0 C--N 1.33 -0.276 0 N-CA-C 112.265 0.469 . . . . 0.0 112.265 -174.64 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 105' ' ' SER . . . . . . . . . . . . . 2.7 p -79.55 -6.81 57.79 Favored 'General case' 0 C--N 1.325 -0.474 0 N-CA-C 111.95 0.352 . . . . 0.0 111.95 -177.748 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 106' ' ' GLU . . . . . 0.532 ' OE1' ' HB2' ' A' ' 103' ' ' SER . 1.9 mp0 -112.21 7.21 19.4 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-O 120.746 0.308 . . . . 0.0 110.974 178.704 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 107' ' ' ILE . . . . . 0.517 HD11 ' HB2' ' A' ' 64' ' ' PHE . 81.8 mt -88.99 117.02 31.54 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.46 0 CA-C-O 121.106 0.479 . . . . 0.0 110.464 179.553 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 108' ' ' LEU . . . . . . . . . . . . . 85.6 mt -95.25 134.34 24.69 Favored Pre-proline 0 C--N 1.322 -0.609 0 CA-C-N 115.877 -0.601 . . . . 0.0 110.273 -179.868 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 109' ' ' PRO . . . . . . . . . . . . . 40.1 Cg_exo -58.79 -34.4 98.98 Favored 'Trans proline' 0 C--N 1.343 0.264 0 C-N-CA 122.643 2.229 . . . . 0.0 111.735 176.771 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 110' ' ' ALA . . . . . . . . . . . . . . . -70.64 -23.4 62.53 Favored 'General case' 0 C--N 1.33 -0.243 0 CA-C-N 115.624 -0.716 . . . . 0.0 111.106 178.702 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 111' ' ' ASP . . . . . 0.537 ' OD2' ' HE3' ' A' ' 102' ' ' LYS . 31.1 t70 -71.86 -42.97 66.25 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-O 121.181 0.515 . . . . 0.0 109.631 -179.932 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 112' ' ' ILE . . . . . 0.471 HD12 ' HB2' ' A' ' 150' ' ' PRO . 37.4 mt -67.89 -39.7 82.21 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.437 0 CA-C-N 115.69 -0.686 . . . . 0.0 110.186 176.689 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 113' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -59.86 -47.19 86.76 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 115.607 -0.724 . . . . 0.0 110.055 179.081 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 114' ' ' SER . . . . . . . . . . . . . 13.1 p -65.91 -27.56 68.28 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 116.261 -0.427 . . . . 0.0 111.148 -179.261 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 115' ' ' ILE . . . . . 0.519 HG13 ' O ' ' A' ' 111' ' ' ASP . 76.7 mt -61.19 -43.33 96.19 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.231 0 CA-C-O 121.198 0.523 . . . . 0.0 110.399 173.515 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 116' ' ' ILE . . . . . . . . . . . . . 50.7 mm -63.18 -33.35 60.42 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.599 0 CA-C-O 121.22 0.534 . . . . 0.0 110.17 177.228 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 117' ' ' ASN . . . . . . . . . . . . . 0.2 OUTLIER -75.56 -29.18 59.27 Favored 'General case' 0 C--N 1.326 -0.429 0 CA-C-N 115.799 -0.637 . . . . 0.0 110.77 -179.151 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 118' ' ' GLU . . . . . 0.488 ' HG3' ' HA ' ' A' ' 115' ' ' ILE . 3.1 pp20? -87.81 -8.99 55.19 Favored 'General case' 0 C--N 1.33 -0.245 0 C-N-CA 120.599 -0.441 . . . . 0.0 110.887 179.587 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 119' ' ' THR . . . . . . . . . . . . . 34.6 m -80.83 117.77 21.77 Favored 'General case' 0 N--CA 1.449 -0.5 0 N-CA-C 109.472 -0.566 . . . . 0.0 109.472 174.307 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 120' ' ' LYS . . . . . . . . . . . . . 67.3 mttm -98.29 32.14 2.57 Favored 'General case' 0 C--N 1.324 -0.534 0 CA-C-O 121.37 0.605 . . . . 0.0 110.77 -175.734 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 121' ' ' LEU . . . . . 0.414 HD23 HG21 ' A' ' 125' ' ' THR . 10.8 mp -100.86 -175.57 2.92 Favored 'General case' 0 C--N 1.322 -0.619 0 CA-C-N 115.642 -0.708 . . . . 0.0 110.266 178.998 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 122' ' ' ALA . . . . . 0.533 ' O ' ' HG ' ' A' ' 126' ' ' LEU . . . -75.03 164.56 26.41 Favored 'General case' 0 C--N 1.325 -0.495 0 CA-C-O 121.142 0.496 . . . . 0.0 111.888 -175.462 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 123' ' ' LYS . . . . . . . . . . . . . 64.6 tttp -59.86 -42.16 93.06 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 115.28 -0.873 . . . . 0.0 111.879 -175.784 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 124' ' ' ASN . . . . . . . . . . . . . 26.8 p-10 -63.29 -34.3 77.39 Favored 'General case' 0 C--N 1.326 -0.436 0 CA-C-O 120.822 0.344 . . . . 0.0 110.988 179.947 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 125' ' ' THR . . . . . 0.414 HG21 HD23 ' A' ' 121' ' ' LEU . 17.2 m -73.1 -38.02 66.51 Favored 'General case' 0 C--N 1.326 -0.428 0 CA-C-O 120.794 0.33 . . . . 0.0 110.358 177.989 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 126' ' ' LEU . . . . . 0.533 ' HG ' ' O ' ' A' ' 122' ' ' ALA . 89.5 mt -58.96 -49.01 79.49 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-O 121.146 0.498 . . . . 0.0 110.686 178.556 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 127' ' ' LYS . . . . . 0.534 ' HA ' ' HB3' ' A' ' 130' ' ' ARG . 16.4 ptmt -74.91 -20.25 59.79 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-N 116.072 -0.513 . . . . 0.0 110.93 -177.089 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 128' ' ' ALA . . . . . . . . . . . . . . . -66.57 -41.76 88.08 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-O 120.757 0.313 . . . . 0.0 110.62 174.822 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 129' ' ' ILE . . . . . . . . . . . . . 46.9 mt -64.86 -40.28 88.53 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.24 0 N-CA-C 109.192 -0.67 . . . . 0.0 109.192 175.057 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 130' ' ' ARG . . . . . 0.534 ' HB3' ' HA ' ' A' ' 127' ' ' LYS . 13.5 tpt85 -55.02 -45.41 75.16 Favored 'General case' 0 CA--C 1.533 0.314 0 CA-C-N 115.13 -0.941 . . . . 0.0 111.092 173.427 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 131' ' ' ASN . . . . . . . . . . . . . 12.9 m-80 -66.84 -47.04 73.2 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.366 -0.379 . . . . 0.0 111.251 178.637 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 132' ' ' THR . . . . . . . . . . . . . 40.3 m -57.9 -53.18 61.1 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.28 -0.418 . . . . 0.0 111.201 -178.786 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 133' ' ' ALA . . . . . . . . . . . . . . . -60.67 -36.25 78.27 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.234 -0.439 . . . . 0.0 111.034 -178.82 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 134' ' ' SER . . . . . 0.519 ' O ' ' HG3' ' A' ' 138' ' ' ARG . 39.0 t -60.31 -50.0 75.38 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.252 -0.431 . . . . 0.0 110.798 179.925 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 135' ' ' GLN . . . . . . . . . . . . . 75.4 mt-30 -59.47 -37.28 77.78 Favored 'General case' 0 C--N 1.331 -0.216 0 CA-C-N 116.384 -0.371 . . . . 0.0 110.832 -177.993 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 136' ' ' ILE . . . . . . . . . . . . . 71.0 mt -64.55 -47.35 89.49 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.386 0 CA-C-N 116.034 -0.53 . . . . 0.0 110.769 178.879 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 137' ' ' PHE . . . . . 0.459 ' O ' HG13 ' A' ' 141' ' ' ILE . 41.7 m-85 -65.98 -35.08 79.6 Favored 'General case' 0 C--N 1.331 -0.224 0 CA-C-N 116.544 -0.298 . . . . 0.0 111.41 179.543 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 138' ' ' ARG . . . . . 0.519 ' HG3' ' O ' ' A' ' 134' ' ' SER . 45.0 mtp-105 -61.9 -38.84 89.87 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-O 120.888 0.375 . . . . 0.0 110.492 178.157 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 139' ' ' LEU . . . . . . . . . . . . . 50.2 tp -60.55 -36.88 79.54 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-N 115.878 -0.601 . . . . 0.0 110.355 178.072 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 140' ' ' ALA . . . . . . . . . . . . . . . -69.6 -37.75 77.03 Favored 'General case' 0 C--N 1.327 -0.37 0 CA-C-N 115.961 -0.563 . . . . 0.0 110.365 177.353 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 141' ' ' ILE . . . . . 0.459 HG13 ' O ' ' A' ' 137' ' ' PHE . 70.2 mt -63.26 -44.46 99.21 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.277 0 CA-C-N 116.061 -0.518 . . . . 0.0 110.403 175.955 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 142' ' ' GLU . . . . . . . . . . . . . 51.8 mt-10 -62.14 -27.99 69.33 Favored 'General case' 0 C--N 1.331 -0.224 0 CA-C-N 116.129 -0.487 . . . . 0.0 111.59 178.632 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 143' ' ' ASN . . . . . 0.514 ' C ' ' HD2' ' A' ' 144' ' ' ARG . 34.9 m-80 -97.26 21.18 10.33 Favored 'General case' 0 C--N 1.324 -0.511 0 CA-C-N 116.143 -0.481 . . . . 0.0 110.783 178.439 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 144' ' ' ARG . . . . . 0.514 ' HD2' ' C ' ' A' ' 143' ' ' ASN . 0.0 OUTLIER 38.48 39.18 0.29 Allowed 'General case' 0 N--CA 1.472 0.648 0 C-N-CA 124.347 1.059 . . . . 0.0 112.496 -177.497 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 145' ' ' ALA . . . . . . . . . . . . . . . -88.33 -32.88 18.2 Favored 'General case' 0 C--N 1.325 -0.466 0 CA-C-N 115.808 -0.633 . . . . 0.0 109.613 176.983 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 146' ' ' ILE . . . . . 0.511 HG12 ' H ' ' A' ' 148' ' ' PHE . 16.6 tt -149.47 133.56 8.69 Favored 'Isoleucine or valine' 0 N--CA 1.449 -0.514 0 CA-C-N 115.283 -0.871 . . . . 0.0 109.439 177.506 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 147' ' ' ASP . . . . . . . . . . . . . 35.2 t70 -102.56 24.18 10.83 Favored 'General case' 0 C--N 1.325 -0.496 0 CA-C-O 122.09 0.948 . . . . 0.0 109.484 179.636 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 148' ' ' PHE . . . . . 0.511 ' H ' HG12 ' A' ' 146' ' ' ILE . 68.7 t80 -132.7 133.26 43.31 Favored 'General case' 0 C--N 1.319 -0.718 0 CA-C-N 114.927 -1.033 . . . . 0.0 109.64 -174.312 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 149' ' ' ASN . . . . . . . . . . . . . 18.5 t-20 -116.16 99.57 52.78 Favored Pre-proline 0 C--N 1.323 -0.571 0 N-CA-C 110.283 -0.266 . . . . 0.0 110.283 -179.84 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 150' ' ' PRO . . . . . 0.471 ' HB2' HD12 ' A' ' 112' ' ' ILE . 22.0 Cg_exo -65.67 -26.08 53.75 Favored 'Trans proline' 0 C--O 1.23 0.124 0 C-N-CA 122.68 2.253 . . . . 0.0 112.283 -178.818 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 151' ' ' ALA . . . . . . . . . . . . . . . -69.92 -20.89 63.33 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 115.995 -0.548 . . . . 0.0 111.333 -177.469 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 152' ' ' ASP . . . . . . . . . . . . . 25.2 t70 -64.15 -29.79 70.89 Favored 'General case' 0 C--O 1.234 0.253 0 CA-C-N 116.122 -0.49 . . . . 0.0 110.863 179.807 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 153' ' ' TYR . . . . . . . . . . . . . 78.7 m-85 -87.73 -5.19 58.78 Favored 'General case' 0 C--N 1.327 -0.383 0 CA-C-N 115.709 -0.678 . . . . 0.0 111.17 -176.175 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 154' ' ' VAL . . . . . . . . . . . . . 66.0 t -79.5 107.42 11.91 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.445 0 CA-C-O 120.929 0.395 . . . . 0.0 110.214 -179.399 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 155' ' ' ARG . . . . . . . . . . . . . 89.4 mtt180 -91.09 133.75 35.08 Favored 'General case' 0 C--N 1.323 -0.585 0 CA-C-N 116.104 -0.498 . . . . 0.0 110.54 -178.432 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 156' ' ' ILE . . . . . . . . . . . . . 50.6 mm -91.94 116.49 66.56 Favored Pre-proline 0 C--N 1.325 -0.495 0 CA-C-N 116.114 -0.494 . . . . 0.0 110.491 -176.951 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 157' ' ' PRO . . . . . . . . . . . . . 31.9 Cg_endo -64.0 159.11 44.01 Favored 'Trans proline' 0 C--O 1.235 0.355 0 C-N-CA 122.97 2.447 . . . . 0.0 113.219 -175.86 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 158' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -126.14 -7.13 6.54 Favored 'General case' 0 C--N 1.326 -0.427 0 CA-C-N 115.448 -0.797 . . . . 0.0 109.761 179.002 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 159' ' ' ILE . . . . . . . . . . . . . 4.4 mp -123.74 141.56 43.56 Favored 'Isoleucine or valine' 0 N--CA 1.438 -1.025 0 N-CA-C 108.326 -0.99 . . . . 0.0 108.326 -170.39 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 160' ' ' ALA . . . . . . . . . . . . . . . -58.44 114.96 2.69 Favored 'General case' 0 C--N 1.305 -1.331 0 CA-C-N 115.582 -0.736 . . . . 0.0 110.642 175.226 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 161' ' ' LEU . . . . . . . . . . . . . 80.7 mt -90.79 -137.34 0.14 Allowed 'General case' 0 C--N 1.322 -0.59 0 CA-C-N 115.792 -0.64 . . . . 0.0 109.846 -177.627 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 162' ' ' GLU . . . . . . . . . . . . . 28.4 mt-10 73.17 11.97 4.99 Favored 'General case' 0 C--O 1.234 0.268 0 CA-C-O 121.095 0.474 . . . . 0.0 111.053 175.202 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 163' ' ' HIS . . . . . . . . . . . . . 51.9 t-80 -94.78 96.86 9.64 Favored 'General case' 0 C--N 1.323 -0.546 0 N-CA-C 108.42 -0.956 . . . . 0.0 108.42 174.837 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 164' ' ' HIS . . . . . . . . . . . . . 25.8 t60 -100.7 98.65 9.17 Favored 'General case' 0 C--N 1.321 -0.662 0 CA-C-N 115.954 -0.566 . . . . 0.0 111.527 -169.224 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 165' ' ' HIS . . . . . 0.414 ' O ' ' HB2' ' A' ' 166' ' ' HIS . 21.3 t60 66.72 -85.15 0.03 OUTLIER 'General case' 0 N--CA 1.468 0.433 0 O-C-N 123.691 0.62 . . . . 0.0 111.328 175.379 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 166' ' ' HIS . . . . . 0.414 ' HB2' ' O ' ' A' ' 165' ' ' HIS . 23.6 t-80 167.05 111.1 0.01 OUTLIER 'General case' 0 C--N 1.325 -0.499 0 N-CA-C 107.561 -1.274 . . . . 0.0 107.561 -175.525 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 167' ' ' HIS . . . . . . . . . . . . . 1.3 t-80 -71.79 105.61 3.83 Favored 'General case' 0 C--N 1.322 -0.61 0 CA-C-O 120.981 0.42 . . . . 0.0 111.187 -172.311 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 168' ' ' HIS . . . . . . . . . . . . . 46.2 t-80 . . . . . 0 C--N 1.318 -0.78 0 CA-C-O 118.218 -0.896 . . . . 0.0 109.154 176.694 . . . . . . . . 0 0 . 1 . 008 nuclear nobuild full ' A' A ' 61' ' ' ARG . . . . . . . . . . . . . 85.9 mtt180 . . . . . 0 N--CA 1.481 1.108 0 CA-C-O 121.196 0.522 . . . . 0.0 109.796 . . . . . . . . . 0 0 . 1 . 008 nuclear nobuild full ' A' A ' 62' ' ' ASP . . . . . . . . . . . . . 2.5 p-10 -69.83 128.58 36.9 Favored 'General case' 0 C--N 1.325 -0.472 0 CA-C-N 115.49 -0.777 . . . . 0.0 110.87 178.535 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 63' ' ' SER . . . . . . . . . . . . . 72.4 p -110.64 -179.14 3.67 Favored 'General case' 0 C--N 1.317 -0.814 0 CA-C-N 115.627 -0.715 . . . . 0.0 109.565 176.975 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 64' ' ' PHE . . . . . 0.491 ' HB2' HD11 ' A' ' 107' ' ' ILE . 87.1 t80 -60.25 -35.71 76.12 Favored 'General case' 0 C--N 1.329 -0.299 0 N-CA-C 109.896 -0.409 . . . . 0.0 109.896 176.642 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 65' ' ' GLY . . . . . . . . . . . . . . . -62.01 -39.32 97.42 Favored Glycine 0 N--CA 1.452 -0.267 0 C-N-CA 121.13 -0.557 . . . . 0.0 112.106 176.964 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 66' ' ' ASP . . . . . 0.401 ' O ' ' HG3' ' A' ' 70' ' ' LYS . 8.6 m-20 -63.39 -52.08 63.14 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-O 120.908 0.385 . . . . 0.0 110.445 177.958 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 67' ' ' TRP . . . . . . . . . . . . . 95.9 m95 -67.19 -35.3 79.33 Favored 'General case' 0 C--N 1.326 -0.433 0 CA-C-N 115.921 -0.582 . . . . 0.0 111.37 -178.011 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 68' ' ' ALA . . . . . 0.671 ' O ' ' HG ' ' A' ' 72' ' ' LEU . . . -61.07 -51.09 70.62 Favored 'General case' 0 C--N 1.326 -0.449 0 N-CA-C 110.065 -0.346 . . . . 0.0 110.065 175.806 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 69' ' ' GLU . . . . . . . . . . . . . 11.9 tp10 -61.29 -37.86 84.72 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.099 -0.5 . . . . 0.0 110.665 -179.379 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 70' ' ' LYS . . . . . 0.401 ' HG3' ' O ' ' A' ' 66' ' ' ASP . 57.2 mtpt -66.57 -45.8 78.11 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.465 -0.334 . . . . 0.0 110.79 176.956 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 71' ' ' PHE . . . . . . . . . . . . . 89.9 t80 -61.77 -42.29 98.79 Favored 'General case' 0 C--N 1.327 -0.381 0 CA-C-N 116.241 -0.436 . . . . 0.0 110.384 179.215 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 72' ' ' LEU . . . . . 0.671 ' HG ' ' O ' ' A' ' 68' ' ' ALA . 91.7 mt -62.82 -44.23 96.7 Favored 'General case' 0 C--N 1.326 -0.439 0 CA-C-N 115.978 -0.555 . . . . 0.0 110.751 178.335 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 73' ' ' LYS . . . . . . . . . . . . . 22.7 tptp -65.67 -37.16 85.72 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-O 121.137 0.494 . . . . 0.0 110.057 179.794 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 74' ' ' SER . . . . . . . . . . . . . 9.8 t -65.44 -44.57 86.88 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 115.688 -0.687 . . . . 0.0 110.183 177.766 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 75' ' ' LYS . . . . . . . . . . . . . 20.6 mmtt -68.17 -31.55 71.18 Favored 'General case' 0 C--N 1.331 -0.204 0 CA-C-N 116.371 -0.377 . . . . 0.0 110.983 178.796 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 76' ' ' GLU . . . . . . . . . . . . . 38.9 tt0 -57.64 -49.13 77.47 Favored 'General case' 0 C--N 1.324 -0.51 0 CA-C-N 115.92 -0.582 . . . . 0.0 110.097 174.947 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 77' ' ' ALA . . . . . . . . . . . . . . . -74.69 -29.13 61.11 Favored 'General case' 0 C--N 1.327 -0.382 0 CA-C-N 115.705 -0.68 . . . . 0.0 111.34 178.824 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 78' ' ' ASP . . . . . . . . . . . . . 19.8 t70 -55.34 -45.45 76.42 Favored 'General case' 0 N--CA 1.465 0.32 0 CA-C-N 116.098 -0.501 . . . . 0.0 110.564 177.058 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 79' ' ' GLY . . . . . . . . . . . . . . . 128.41 62.46 0.12 Allowed Glycine 0 N--CA 1.446 -0.697 0 C-N-CA 120.679 -0.772 . . . . 0.0 112.308 176.906 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 80' ' ' VAL . . . . . . . . . . . . . 34.4 m -115.66 155.17 17.02 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.589 0 CA-C-O 120.677 0.275 . . . . 0.0 110.562 177.403 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 81' ' ' SER . . . . . . . . . . . . . 31.0 t -65.06 153.75 39.82 Favored 'General case' 0 C--N 1.324 -0.532 0 CA-C-N 115.817 -0.629 . . . . 0.0 110.261 175.818 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 82' ' ' VAL . . . . . . . . . . . . . 10.2 p -60.03 -36.83 69.79 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.318 0 CA-C-O 120.818 0.342 . . . . 0.0 110.325 177.453 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 83' ' ' SER . . . . . . . . . . . . . 34.2 t -69.43 -34.48 74.51 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-O 121.185 0.517 . . . . 0.0 109.973 178.254 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 84' ' ' GLN . . . . . . . . . . . . . 8.0 tp-100 -65.97 -40.63 91.41 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 115.825 -0.625 . . . . 0.0 109.852 178.23 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 85' ' ' LEU . . . . . 0.42 HD11 ' HB3' ' A' ' 72' ' ' LEU . 54.4 tp -70.41 -43.65 69.53 Favored 'General case' 0 C--N 1.326 -0.42 0 CA-C-N 115.987 -0.551 . . . . 0.0 110.831 178.229 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 86' ' ' ASN . . . . . . . . . . . . . 97.3 m-20 -60.45 -44.34 95.96 Favored 'General case' 0 C--N 1.332 -0.16 0 CA-C-N 116.437 -0.347 . . . . 0.0 110.922 179.498 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 87' ' ' SER . . . . . . . . . . . . . 8.4 p -61.58 -38.2 86.66 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.669 -0.241 . . . . 0.0 110.798 -179.735 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 88' ' ' TYR . . . . . 0.408 ' HA ' ' CD2' ' A' ' 91' ' ' TYR . 18.0 m-30 -57.89 -46.05 85.5 Favored 'General case' 0 C--O 1.231 0.1 0 CA-C-O 120.983 0.421 . . . . 0.0 110.32 173.81 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 89' ' ' LYS . . . . . 0.593 ' HA ' ' SG ' ' A' ' 92' ' ' CYS . 60.0 mttm -63.24 -38.1 89.85 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 115.681 -0.69 . . . . 0.0 110.872 179.264 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 90' ' ' ASN . . . . . . . . . . . . . 9.4 m120 -60.02 -32.49 70.94 Favored 'General case' 0 C--N 1.327 -0.401 0 CA-C-O 120.753 0.311 . . . . 0.0 111.085 177.408 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 91' ' ' TYR . . . . . 0.408 ' CD2' ' HA ' ' A' ' 88' ' ' TYR . 21.1 m-85 -70.38 -52.6 21.27 Favored 'General case' 0 C--O 1.235 0.327 0 CA-C-O 120.735 0.302 . . . . 0.0 110.619 178.17 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 92' ' ' CYS . . . . . 0.704 ' HA ' ' HB2' ' A' ' 96' ' ' LEU . 21.2 p -75.79 -39.18 57.4 Favored 'General case' 0 C--N 1.33 -0.253 0 N-CA-C 112.256 0.465 . . . . 0.0 112.256 -172.903 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 93' ' ' ARG . . . . . . . . . . . . . 43.8 ttt-85 -69.87 -47.92 60.72 Favored 'General case' 0 C--N 1.324 -0.51 0 CA-C-O 120.866 0.365 . . . . 0.0 111.502 -176.902 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 94' ' ' ASN . . . . . . . . . . . . . 17.7 m120 -87.54 -57.63 2.88 Favored 'General case' 0 C--N 1.325 -0.469 0 N-CA-C 112.205 0.446 . . . . 0.0 112.205 -173.282 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 95' ' ' HIS . . . . . . . . . . . . . 8.5 m80 -86.46 -40.57 15.19 Favored 'General case' 0 C--N 1.327 -0.389 0 N-CA-C 113.263 0.838 . . . . 0.0 113.263 -173.292 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 96' ' ' LEU . . . . . 0.704 ' HB2' ' HA ' ' A' ' 92' ' ' CYS . 76.6 mt -87.0 21.45 2.3 Favored 'General case' 0 C--N 1.325 -0.459 0 C-N-CA 120.704 -0.398 . . . . 0.0 110.69 -179.276 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 97' ' ' SER . . . . . 0.565 ' OG ' ' HD3' ' A' ' 98' ' ' PRO . 1.8 p -55.65 -45.29 99.9 Favored Pre-proline 0 CA--C 1.54 0.56 0 N-CA-C 113.003 0.742 . . . . 0.0 113.003 -179.006 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 98' ' ' PRO . . . . . 0.565 ' HD3' ' OG ' ' A' ' 97' ' ' SER . 32.2 Cg_exo -58.28 -38.23 91.75 Favored 'Trans proline' 0 C--N 1.36 1.18 0 C-N-CA 121.581 1.521 . . . . 0.0 111.688 177.488 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 99' ' ' LEU . . . . . 0.576 HD22 HG23 ' A' ' 107' ' ' ILE . 34.9 mt -77.44 -34.34 54.57 Favored 'General case' 0 C--N 1.325 -0.459 0 CA-C-N 115.809 -0.632 . . . . 0.0 110.34 -178.055 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 100' ' ' TYR . . . . . . . . . . . . . 5.7 t80 -55.5 -30.55 60.86 Favored 'General case' 0 C--N 1.326 -0.436 0 CA-C-N 115.279 -0.873 . . . . 0.0 111.226 -175.922 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 101' ' ' MET . . . . . . . . . . . . . 21.6 mmt -100.69 4.2 42.99 Favored 'General case' 0 C--N 1.326 -0.438 0 CA-C-N 116.346 -0.388 . . . . 0.0 111.403 -177.044 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 102' ' ' LYS . . . . . 0.487 ' HG3' ' O ' ' A' ' 98' ' ' PRO . 99.0 mttt -107.39 160.88 15.3 Favored 'General case' 0 C--N 1.325 -0.49 0 CA-C-O 121.055 0.455 . . . . 0.0 111.193 -178.309 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 103' ' ' SER . . . . . 0.408 ' O ' HG13 ' A' ' 107' ' ' ILE . 27.9 t -88.55 162.51 16.35 Favored 'General case' 0 C--N 1.325 -0.48 0 CA-C-N 115.862 -0.608 . . . . 0.0 109.998 176.531 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 104' ' ' LEU . . . . . 0.412 ' HB3' HD12 ' A' ' 146' ' ' ILE . 67.0 mt -61.61 -29.72 70.23 Favored 'General case' 0 C--N 1.326 -0.421 0 CA-C-N 116.039 -0.528 . . . . 0.0 111.81 -174.646 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 105' ' ' SER . . . . . . . . . . . . . 19.9 p -84.84 -15.86 43.31 Favored 'General case' 0 C--N 1.325 -0.462 0 CA-C-N 116.38 -0.373 . . . . 0.0 111.332 -178.318 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 106' ' ' GLU . . . . . . . . . . . . . 47.5 mt-10 -94.97 -24.23 17.04 Favored 'General case' 0 C--N 1.327 -0.393 0 CA-C-O 121.09 0.471 . . . . 0.0 110.719 -176.319 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 107' ' ' ILE . . . . . 0.576 HG23 HD22 ' A' ' 99' ' ' LEU . 82.4 mt -71.2 113.97 8.55 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.58 0 CA-C-N 115.624 -0.716 . . . . 0.0 110.695 -179.917 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 108' ' ' LEU . . . . . . . . . . . . . 88.5 mt -96.49 147.74 33.41 Favored Pre-proline 0 C--N 1.321 -0.646 0 CA-C-N 115.573 -0.739 . . . . 0.0 110.434 -179.985 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 109' ' ' PRO . . . . . 0.745 ' HB3' ' HB3' ' A' ' 153' ' ' TYR . 15.8 Cg_endo -58.55 -35.73 98.28 Favored 'Trans proline' 0 C--N 1.343 0.24 0 C-N-CA 122.653 2.236 . . . . 0.0 112.068 178.514 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 110' ' ' ALA . . . . . . . . . . . . . . . -68.51 -31.45 70.71 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 116.041 -0.527 . . . . 0.0 110.892 179.829 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 111' ' ' ASP . . . . . . . . . . . . . 24.6 t70 -68.9 -46.98 66.96 Favored 'General case' 0 C--N 1.327 -0.396 0 CA-C-O 121.22 0.533 . . . . 0.0 109.631 179.534 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 112' ' ' ILE . . . . . . . . . . . . . 30.7 mt -62.34 -41.17 90.6 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.291 0 CA-C-N 115.633 -0.712 . . . . 0.0 109.926 175.505 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 113' ' ' GLN . . . . . . . . . . . . . 24.3 tp60 -57.09 -42.8 81.42 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-N 115.524 -0.762 . . . . 0.0 110.207 178.002 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 114' ' ' SER . . . . . . . . . . . . . 36.5 m -59.19 -38.79 80.71 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 115.971 -0.559 . . . . 0.0 110.778 179.342 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 115' ' ' ILE . . . . . . . . . . . . . 73.3 mt -64.08 -47.99 87.83 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.358 0 CA-C-N 116.238 -0.437 . . . . 0.0 110.759 176.938 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 116' ' ' ILE . . . . . . . . . . . . . 48.1 mm -59.99 -41.72 87.13 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.442 0 CA-C-O 121.001 0.429 . . . . 0.0 110.79 179.78 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 117' ' ' ASN . . . . . . . . . . . . . 9.2 m-20 -65.82 -38.96 90.32 Favored 'General case' 0 C--N 1.327 -0.408 0 CA-C-N 115.707 -0.679 . . . . 0.0 112.111 -177.321 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 118' ' ' GLU . . . . . . . . . . . . . 10.8 pt-20 -80.74 -22.09 40.55 Favored 'General case' 0 C--O 1.234 0.285 0 C-N-CA 120.973 -0.291 . . . . 0.0 111.649 -176.454 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 119' ' ' THR . . . . . 0.469 HG22 ' H ' ' A' ' 121' ' ' LEU . 86.9 m -68.0 112.76 5.18 Favored 'General case' 0 C--N 1.325 -0.459 0 CA-C-O 121.137 0.494 . . . . 0.0 110.788 -177.95 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 120' ' ' LYS . . . . . . . . . . . . . 21.5 ptmt -91.08 26.46 2.14 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 115.896 -0.593 . . . . 0.0 111.263 -177.236 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 121' ' ' LEU . . . . . 0.469 ' H ' HG22 ' A' ' 119' ' ' THR . 85.7 mt -90.28 173.4 8.16 Favored 'General case' 0 C--N 1.32 -0.712 0 N-CA-C 109.571 -0.529 . . . . 0.0 109.571 179.307 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 122' ' ' ALA . . . . . . . . . . . . . . . -61.29 151.25 32.44 Favored 'General case' 0 C--N 1.326 -0.439 0 CA-C-O 120.78 0.324 . . . . 0.0 111.125 -178.015 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 123' ' ' LYS . . . . . . . . . . . . . 85.9 tttt -57.26 -36.5 71.07 Favored 'General case' 0 C--N 1.327 -0.41 0 CA-C-N 115.999 -0.546 . . . . 0.0 111.215 -178.932 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 124' ' ' ASN . . . . . . . . . . . . . 31.3 p30 -64.87 -25.21 67.8 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-O 121.084 0.468 . . . . 0.0 111.092 177.38 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 125' ' ' THR . . . . . 0.453 ' O ' HG13 ' A' ' 129' ' ' ILE . 16.6 m -81.92 -36.99 27.48 Favored 'General case' 0 N--CA 1.45 -0.464 0 CA-C-N 116.061 -0.518 . . . . 0.0 109.814 178.681 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 126' ' ' LEU . . . . . . . . . . . . . 94.2 mt -58.79 -45.89 88.82 Favored 'General case' 0 C--N 1.33 -0.246 0 CA-C-N 116.002 -0.545 . . . . 0.0 109.622 174.083 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 127' ' ' LYS . . . . . . . . . . . . . 50.1 mttm -62.16 -35.08 77.72 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-N 115.382 -0.827 . . . . 0.0 111.219 176.785 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 128' ' ' ALA . . . . . . . . . . . . . . . -65.72 -47.8 74.11 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.367 -0.379 . . . . 0.0 110.806 178.554 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 129' ' ' ILE . . . . . 0.453 HG13 ' O ' ' A' ' 125' ' ' THR . 58.3 mt -62.02 -45.68 98.17 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.226 0 CA-C-N 116.289 -0.414 . . . . 0.0 109.92 178.032 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 130' ' ' ARG . . . . . . . . . . . . . 8.9 tpt85 -55.95 -54.27 46.74 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-N 115.512 -0.767 . . . . 0.0 111.19 177.057 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 131' ' ' ASN . . . . . . . . . . . . . 8.8 t30 -57.71 -47.41 82.47 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 116.478 -0.328 . . . . 0.0 111.289 -177.312 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 132' ' ' THR . . . . . 0.478 ' O ' HG13 ' A' ' 136' ' ' ILE . 30.8 m -57.77 -51.79 68.12 Favored 'General case' 0 C--N 1.324 -0.517 0 CA-C-N 115.971 -0.559 . . . . 0.0 110.855 -178.993 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 133' ' ' ALA . . . . . . . . . . . . . . . -61.96 -41.07 97.59 Favored 'General case' 0 C--N 1.331 -0.206 0 CA-C-N 116.183 -0.462 . . . . 0.0 111.103 -179.96 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 134' ' ' SER . . . . . 0.621 ' O ' ' HG3' ' A' ' 138' ' ' ARG . 50.0 m -58.24 -49.59 76.55 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.022 -0.536 . . . . 0.0 111.284 -178.327 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 135' ' ' GLN . . . . . . . . . . . . . 22.0 mt-30 -66.62 -32.25 73.46 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.517 -0.31 . . . . 0.0 111.205 -177.162 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 136' ' ' ILE . . . . . 0.478 HG13 ' O ' ' A' ' 132' ' ' THR . 82.9 mt -61.57 -47.11 94.89 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.231 0 CA-C-O 120.799 0.333 . . . . 0.0 110.518 177.155 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 137' ' ' PHE . . . . . 0.436 ' HZ ' HG21 ' A' ' 107' ' ' ILE . 54.3 m-85 -64.99 -39.74 93.93 Favored 'General case' 0 C--N 1.327 -0.401 0 CA-C-N 116.325 -0.398 . . . . 0.0 111.432 178.53 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 138' ' ' ARG . . . . . 0.621 ' HG3' ' O ' ' A' ' 134' ' ' SER . 41.0 mtp180 -67.67 -31.25 71.09 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-O 120.779 0.323 . . . . 0.0 110.409 -179.761 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 139' ' ' LEU . . . . . . . . . . . . . 60.8 tp -62.8 -40.73 98.27 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-O 121.245 0.545 . . . . 0.0 109.852 174.994 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 140' ' ' ALA . . . . . . . . . . . . . . . -64.34 -35.28 80.36 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-N 115.652 -0.704 . . . . 0.0 110.682 177.637 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 141' ' ' ILE . . . . . 0.544 ' HA ' ' O ' ' A' ' 146' ' ' ILE . 70.4 mt -63.3 -44.04 98.92 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.224 0 CA-C-O 120.858 0.361 . . . . 0.0 110.462 175.126 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 142' ' ' GLU . . . . . . . . . . . . . 19.1 mm-40 -67.57 -25.47 65.8 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.148 -0.478 . . . . 0.0 111.538 179.796 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 143' ' ' ASN . . . . . 0.449 HD22 ' N ' ' A' ' 143' ' ' ASN . 0.9 OUTLIER -94.12 5.04 52.99 Favored 'General case' 0 C--N 1.323 -0.58 0 CA-C-N 116.278 -0.419 . . . . 0.0 110.446 176.423 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 144' ' ' ARG . . . . . . . . . . . . . 57.5 mtp85 64.62 25.22 13.1 Favored 'General case' 0 N--CA 1.465 0.313 0 CA-C-N 115.517 -0.765 . . . . 0.0 112.787 174.001 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 145' ' ' ALA . . . . . . . . . . . . . . . -83.43 -27.52 29.48 Favored 'General case' 0 C--N 1.325 -0.46 0 CA-C-O 121.294 0.569 . . . . 0.0 109.993 176.384 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 146' ' ' ILE . . . . . 0.544 ' O ' ' HA ' ' A' ' 141' ' ' ILE . 18.1 tt -145.91 154.56 13.05 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.461 0 CA-C-N 115.653 -0.703 . . . . 0.0 109.185 178.728 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 147' ' ' ASP . . . . . . . . . . . . . 4.9 p-10 -103.44 -5.2 23.11 Favored 'General case' 0 N--CA 1.467 0.393 0 N-CA-C 111.963 0.357 . . . . 0.0 111.963 -174.455 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 148' ' ' PHE . . . . . 0.423 ' H ' HG12 ' A' ' 146' ' ' ILE . 76.2 t80 -155.66 145.23 21.11 Favored 'General case' 0 C--N 1.324 -0.513 0 N-CA-C 110.166 -0.309 . . . . 0.0 110.166 -176.7 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 149' ' ' ASN . . . . . 0.415 ' HA ' ' HD2' ' A' ' 150' ' ' PRO . 20.0 p-10 -107.28 112.27 62.87 Favored Pre-proline 0 C--N 1.323 -0.563 0 CA-C-O 121.053 0.454 . . . . 0.0 110.943 178.99 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 150' ' ' PRO . . . . . 0.415 ' HD2' ' HA ' ' A' ' 149' ' ' ASN . 35.6 Cg_endo -65.34 -11.0 28.17 Favored 'Trans proline' 0 N--CA 1.473 0.323 0 C-N-CA 122.969 2.446 . . . . 0.0 112.291 179.31 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 151' ' ' ALA . . . . . . . . . . . . . . . -67.5 -31.85 72.26 Favored 'General case' 0 C--N 1.327 -0.387 0 CA-C-N 115.968 -0.56 . . . . 0.0 110.775 178.088 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 152' ' ' ASP . . . . . . . . . . . . . 25.9 t70 -72.91 -15.77 61.57 Favored 'General case' 0 N--CA 1.464 0.262 0 CA-C-O 121.589 0.709 . . . . 0.0 110.04 179.594 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 153' ' ' TYR . . . . . 0.745 ' HB3' ' HB3' ' A' ' 109' ' ' PRO . 3.1 t80 -84.26 -20.82 31.56 Favored 'General case' 0 C--N 1.325 -0.48 0 CA-C-N 115.234 -0.894 . . . . 0.0 109.458 179.444 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 154' ' ' VAL . . . . . . . . . . . . . 59.1 t -72.85 129.54 35.92 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.423 0 CA-C-N 115.726 -0.67 . . . . 0.0 110.812 -178.768 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 155' ' ' ARG . . . . . 0.406 ' HE ' ' HB2' ' A' ' 155' ' ' ARG . 59.2 mtm180 -86.6 146.99 26.12 Favored 'General case' 0 C--N 1.324 -0.538 0 CA-C-N 116.218 -0.446 . . . . 0.0 110.675 -178.3 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 156' ' ' ILE . . . . . . . . . . . . . 37.8 mm -108.36 113.49 60.27 Favored Pre-proline 0 C--N 1.317 -0.823 0 CA-C-N 115.669 -0.696 . . . . 0.0 109.517 172.754 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 157' ' ' PRO . . . . . . . . . . . . . 51.1 Cg_exo -54.47 130.35 39.58 Favored 'Trans proline' 0 C--N 1.344 0.325 0 C-N-CA 122.542 2.162 . . . . 0.0 111.62 -179.982 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 158' ' ' LYS . . . . . . . . . . . . . 51.2 mttp -94.25 -47.89 6.42 Favored 'General case' 0 C--N 1.319 -0.742 0 CA-C-N 115.906 -0.588 . . . . 0.0 109.42 -176.434 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 159' ' ' ILE . . . . . . . . . . . . . 51.8 mm 71.48 -59.22 0.28 Allowed 'Isoleucine or valine' 0 N--CA 1.465 0.309 0 O-C-N 124.223 0.952 . . . . 0.0 111.883 173.887 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 160' ' ' ALA . . . . . . . . . . . . . . . -70.47 107.09 3.67 Favored 'General case' 0 C--N 1.323 -0.55 0 CA-C-N 116.433 -0.349 . . . . 0.0 111.021 -178.239 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 161' ' ' LEU . . . . . . . . . . . . . 69.1 mt 60.11 31.7 20.67 Favored 'General case' 0 C--O 1.233 0.229 0 CA-C-N 115.718 -0.674 . . . . 0.0 111.102 178.715 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 162' ' ' GLU . . . . . . . . . . . . . 32.8 tt0 -77.6 91.26 3.98 Favored 'General case' 0 C--N 1.324 -0.514 0 N-CA-C 109.744 -0.465 . . . . 0.0 109.744 178.418 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 163' ' ' HIS . . . . . . . . . . . . . 97.1 m-70 -92.75 126.58 37.9 Favored 'General case' 0 C--N 1.322 -0.6 0 CA-C-N 116.219 -0.446 . . . . 0.0 110.07 -178.374 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 164' ' ' HIS . . . . . . . . . . . . . 36.0 m80 -88.31 -51.25 5.85 Favored 'General case' 0 C--N 1.322 -0.598 0 N-CA-C 109.533 -0.543 . . . . 0.0 109.533 -179.895 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 165' ' ' HIS . . . . . . . . . . . . . 48.8 t-80 65.67 8.87 5.49 Favored 'General case' 0 N--CA 1.471 0.597 0 N-CA-C 112.445 0.535 . . . . 0.0 112.445 166.787 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 166' ' ' HIS . . . . . . . . . . . . . 66.4 m80 59.6 88.87 0.07 Allowed 'General case' 0 C--O 1.234 0.279 0 CA-C-O 121.506 0.67 . . . . 0.0 110.337 -172.324 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 167' ' ' HIS . . . . . . . . . . . . . 27.1 t-80 -80.15 118.47 21.87 Favored 'General case' 0 C--N 1.321 -0.65 0 CA-C-N 115.237 -0.892 . . . . 0.0 111.063 -175.822 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 168' ' ' HIS . . . . . . . . . . . . . 64.3 m-70 . . . . . 0 C--O 1.245 0.823 0 CA-C-O 118.305 -0.855 . . . . 0.0 110.172 177.493 . . . . . . . . 0 0 . 1 . 009 nuclear nobuild full ' A' A ' 61' ' ' ARG . . . . . . . . . . . . . 87.9 mtt180 . . . . . 0 N--CA 1.478 0.962 0 N-CA-C 109.802 -0.444 . . . . 0.0 109.802 . . . . . . . . . 0 0 . 1 . 009 nuclear nobuild full ' A' A ' 62' ' ' ASP . . . . . 0.815 ' HA ' ' HE1' ' A' ' 67' ' ' TRP . 37.0 m-20 65.6 22.48 11.72 Favored 'General case' 0 N--CA 1.47 0.531 0 CA-C-N 115.94 -0.573 . . . . 0.0 110.916 -179.934 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 63' ' ' SER . . . . . 0.55 ' HA ' ' HA ' ' A' ' 103' ' ' SER . 1.3 m -95.43 152.25 18.57 Favored 'General case' 0 C--N 1.32 -0.695 0 N-CA-C 109.366 -0.605 . . . . 0.0 109.366 179.772 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 64' ' ' PHE . . . . . 0.583 ' HB2' HD11 ' A' ' 107' ' ' ILE . 56.0 t80 -63.44 -44.58 94.15 Favored 'General case' 0 C--N 1.324 -0.504 0 C-N-CA 120.959 -0.297 . . . . 0.0 110.434 -179.319 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 65' ' ' GLY . . . . . . . . . . . . . . . -65.35 -29.76 76.02 Favored Glycine 0 C--N 1.331 0.289 0 C-N-CA 120.845 -0.693 . . . . 0.0 112.062 177.654 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 66' ' ' ASP . . . . . . . . . . . . . 12.2 t0 -65.89 -54.16 30.21 Favored 'General case' 0 C--O 1.24 0.579 0 CA-C-O 121.475 0.655 . . . . 0.0 110.209 177.91 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 67' ' ' TRP . . . . . 0.815 ' HE1' ' HA ' ' A' ' 62' ' ' ASP . 96.3 m95 -70.62 -23.78 62.61 Favored 'General case' 0 C--N 1.325 -0.463 0 CA-C-N 115.802 -0.635 . . . . 0.0 110.91 178.162 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 68' ' ' ALA . . . . . . . . . . . . . . . -62.61 -48.81 77.77 Favored 'General case' 0 C--O 1.225 -0.208 0 CA-C-N 116.406 -0.361 . . . . 0.0 110.671 176.419 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 69' ' ' GLU . . . . . . . . . . . . . 43.6 tt0 -59.05 -44.57 91.82 Favored 'General case' 0 C--O 1.234 0.281 0 C-N-CA 120.856 -0.338 . . . . 0.0 110.114 177.382 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 70' ' ' LYS . . . . . . . . . . . . . 24.5 ttmm -58.91 -43.02 91.0 Favored 'General case' 0 CA--C 1.535 0.399 0 CA-C-N 116.105 -0.498 . . . . 0.0 110.955 179.151 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 71' ' ' PHE . . . . . . . . . . . . . 82.3 t80 -72.11 -44.56 62.99 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-O 120.88 0.371 . . . . 0.0 111.332 -179.626 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 72' ' ' LEU . . . . . 0.505 HD23 ' HG2' ' A' ' 89' ' ' LYS . 7.3 mp -61.38 -39.44 90.67 Favored 'General case' 0 C--N 1.325 -0.472 0 CA-C-N 116.332 -0.395 . . . . 0.0 111.32 -178.297 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 73' ' ' LYS . . . . . 0.486 ' O ' ' HB3' ' A' ' 76' ' ' GLU . 57.3 tttp -77.21 -33.32 56.27 Favored 'General case' 0 C--N 1.326 -0.429 0 C-N-CA 120.644 -0.422 . . . . 0.0 111.416 -178.403 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 74' ' ' SER . . . . . . . . . . . . . 12.3 p -68.76 -29.34 67.71 Favored 'General case' 0 C--N 1.324 -0.513 0 C-N-CA 120.268 -0.573 . . . . 0.0 109.847 176.679 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 75' ' ' LYS . . . . . 0.517 ' O ' HG22 ' A' ' 80' ' ' VAL . 43.3 mmtt -77.39 -34.73 54.84 Favored 'General case' 0 C--N 1.331 -0.217 0 CA-C-N 116.267 -0.424 . . . . 0.0 110.529 173.14 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 76' ' ' GLU . . . . . 0.486 ' HB3' ' O ' ' A' ' 73' ' ' LYS . 34.6 tt0 -51.75 -47.61 64.03 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 116.018 -0.537 . . . . 0.0 110.057 172.444 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 77' ' ' ALA . . . . . . . . . . . . . . . -84.56 -12.65 53.71 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 115.677 -0.692 . . . . 0.0 111.751 178.847 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 78' ' ' ASP . . . . . . . . . . . . . 29.5 t70 -65.99 -35.85 81.7 Favored 'General case' 0 N--CA 1.467 0.386 0 CA-C-O 120.876 0.369 . . . . 0.0 110.473 178.773 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 79' ' ' GLY . . . . . . . . . . . . . . . 133.76 2.07 3.61 Favored Glycine 0 N--CA 1.447 -0.567 0 C-N-CA 120.073 -1.06 . . . . 0.0 113.447 176.047 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 80' ' ' VAL . . . . . 0.517 HG22 ' O ' ' A' ' 75' ' ' LYS . 28.4 m -70.15 136.96 25.0 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.339 0 CA-C-N 117.324 0.562 . . . . 0.0 110.377 179.499 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 81' ' ' SER . . . . . . . . . . . . . 23.3 t -72.62 164.7 26.07 Favored 'General case' 0 C--N 1.322 -0.607 0 CA-C-O 121.147 0.498 . . . . 0.0 110.224 179.947 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 82' ' ' VAL . . . . . . . . . . . . . 28.8 m -57.08 -29.69 32.35 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.609 0 CA-C-N 115.305 -0.861 . . . . 0.0 111.7 -177.177 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 83' ' ' SER . . . . . . . . . . . . . 5.9 p -62.71 -48.01 81.13 Favored 'General case' 0 C--N 1.326 -0.432 0 CA-C-O 121.173 0.511 . . . . 0.0 110.701 177.337 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 84' ' ' GLN . . . . . . . . . . . . . 6.8 tp-100 -73.83 -37.13 64.94 Favored 'General case' 0 C--N 1.325 -0.484 0 CA-C-N 115.793 -0.64 . . . . 0.0 110.074 -179.954 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 85' ' ' LEU . . . . . . . . . . . . . 43.5 tp -62.49 -44.79 95.54 Favored 'General case' 0 C--N 1.326 -0.442 0 CA-C-N 115.836 -0.62 . . . . 0.0 110.655 178.734 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 86' ' ' ASN . . . . . . . . . . . . . 83.5 m-20 -61.52 -37.02 82.18 Favored 'General case' 0 CA--C 1.519 -0.214 0 CA-C-N 116.487 -0.324 . . . . 0.0 110.377 176.265 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 87' ' ' SER . . . . . . . . . . . . . 27.2 t -56.1 -49.34 74.14 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 116.176 -0.466 . . . . 0.0 110.284 178.753 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 88' ' ' TYR . . . . . . . . . . . . . 32.3 m-85 -58.47 -41.28 84.85 Favored 'General case' 0 C--O 1.233 0.188 0 CA-C-O 120.87 0.366 . . . . 0.0 110.895 178.908 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 89' ' ' LYS . . . . . 0.566 ' HA ' ' SG ' ' A' ' 92' ' ' CYS . 85.1 mttt -70.76 -31.65 68.53 Favored 'General case' 0 C--N 1.327 -0.386 0 CA-C-N 116.197 -0.456 . . . . 0.0 111.294 -177.675 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 90' ' ' ASN . . . . . . . . . . . . . 27.6 m-80 -64.55 -36.17 83.36 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-O 120.97 0.414 . . . . 0.0 110.384 175.61 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 91' ' ' TYR . . . . . . . . . . . . . 42.4 m-85 -67.01 -48.9 66.97 Favored 'General case' 0 C--N 1.326 -0.415 0 CA-C-N 116.279 -0.419 . . . . 0.0 111.306 179.43 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 92' ' ' CYS . . . . . 0.611 ' HA ' ' HB2' ' A' ' 96' ' ' LEU . 26.1 p -72.56 -32.99 66.49 Favored 'General case' 0 C--N 1.331 -0.238 0 N-CA-C 111.849 0.315 . . . . 0.0 111.849 -175.63 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 93' ' ' ARG . . . . . . . . . . . . . 99.7 mtt180 -78.53 -38.99 39.23 Favored 'General case' 0 C--N 1.328 -0.365 0 N-CA-C 112.022 0.378 . . . . 0.0 112.022 -178.358 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 94' ' ' ASN . . . . . . . . . . . . . 17.4 m120 -99.62 -60.4 1.54 Allowed 'General case' 0 C--N 1.327 -0.384 0 N-CA-C 112.539 0.57 . . . . 0.0 112.539 -175.19 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 95' ' ' HIS . . . . . . . . . . . . . 6.1 m80 -78.79 -47.73 16.17 Favored 'General case' 0 C--N 1.325 -0.463 0 N-CA-C 112.502 0.556 . . . . 0.0 112.502 -172.4 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 96' ' ' LEU . . . . . 0.611 ' HB2' ' HA ' ' A' ' 92' ' ' CYS . 86.6 mt -91.59 21.53 4.6 Favored 'General case' 0 C--N 1.32 -0.698 0 CA-C-N 116.718 -0.219 . . . . 0.0 111.188 -175.386 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 97' ' ' SER . . . . . 0.525 ' N ' ' HD2' ' A' ' 98' ' ' PRO . 3.1 p -59.94 -43.22 94.06 Favored Pre-proline 0 CA--C 1.544 0.739 0 N-CA-C 112.667 0.617 . . . . 0.0 112.667 -179.719 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 98' ' ' PRO . . . . . 0.525 ' HD2' ' N ' ' A' ' 97' ' ' SER . 22.9 Cg_endo -63.41 -32.03 71.97 Favored 'Trans proline' 0 C--N 1.362 1.241 0 C-N-CA 121.59 1.527 . . . . 0.0 112.195 175.951 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 99' ' ' LEU . . . . . 0.65 ' HA ' ' HD2' ' A' ' 102' ' ' LYS . 10.8 mp -80.1 -31.45 39.2 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.407 -0.36 . . . . 0.0 110.51 179.682 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 100' ' ' TYR . . . . . . . . . . . . . 36.1 t80 -54.39 -34.63 61.66 Favored 'General case' 0 C--N 1.327 -0.374 0 CA-C-N 115.673 -0.694 . . . . 0.0 111.193 -178.258 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 101' ' ' MET . . . . . . . . . . . . . 22.5 mmt -91.83 -4.29 55.04 Favored 'General case' 0 C--N 1.331 -0.228 0 CA-C-N 115.791 -0.64 . . . . 0.0 111.06 -176.661 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 102' ' ' LYS . . . . . 0.65 ' HD2' ' HA ' ' A' ' 99' ' ' LEU . 51.8 mttm -87.93 150.01 23.73 Favored 'General case' 0 C--N 1.323 -0.566 0 CA-C-N 116.132 -0.485 . . . . 0.0 110.71 179.662 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 103' ' ' SER . . . . . 0.55 ' HA ' ' HA ' ' A' ' 63' ' ' SER . 8.7 m -82.52 162.98 21.83 Favored 'General case' 0 C--N 1.322 -0.597 0 N-CA-C 107.972 -1.121 . . . . 0.0 107.972 167.622 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 104' ' ' LEU . . . . . . . . . . . . . 95.2 mt -52.54 -39.31 61.28 Favored 'General case' 0 C--N 1.324 -0.535 0 N-CA-C 111.983 0.364 . . . . 0.0 111.983 -177.53 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 105' ' ' SER . . . . . . . . . . . . . 9.0 m -83.65 0.24 47.76 Favored 'General case' 0 C--N 1.326 -0.446 0 N-CA-C 111.933 0.345 . . . . 0.0 111.933 -177.641 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 106' ' ' GLU . . . . . . . . . . . . . 44.9 mt-10 -102.92 -3.24 26.44 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-O 121.026 0.441 . . . . 0.0 110.253 178.4 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 107' ' ' ILE . . . . . 0.606 HG21 ' HZ ' ' A' ' 137' ' ' PHE . 62.0 mt -94.13 112.57 27.15 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.645 0 CA-C-N 115.998 -0.547 . . . . 0.0 110.5 -177.741 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 108' ' ' LEU . . . . . . . . . . . . . 64.5 mt -96.09 146.15 30.81 Favored Pre-proline 0 C--N 1.318 -0.769 0 CA-C-N 115.887 -0.597 . . . . 0.0 110.004 179.856 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 109' ' ' PRO . . . . . . . . . . . . . 42.0 Cg_exo -57.91 -28.39 82.56 Favored 'Trans proline' 0 N--CA 1.464 -0.245 0 C-N-CA 122.317 2.011 . . . . 0.0 111.33 175.437 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 110' ' ' ALA . . . . . . . . . . . . . . . -65.6 -34.73 78.92 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-N 115.724 -0.671 . . . . 0.0 110.983 177.083 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 111' ' ' ASP . . . . . 0.455 ' O ' HG13 ' A' ' 115' ' ' ILE . 70.6 m-20 -61.6 -46.24 90.68 Favored 'General case' 0 CA--C 1.516 -0.354 0 CA-C-O 121.027 0.441 . . . . 0.0 109.814 178.864 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 112' ' ' ILE . . . . . 0.542 ' O ' HG12 ' A' ' 116' ' ' ILE . 46.0 mt -69.73 -45.16 78.3 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.585 0 CA-C-N 115.892 -0.595 . . . . 0.0 110.293 179.67 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 113' ' ' GLN . . . . . . . . . . . . . 7.0 tp-100 -57.81 -43.45 85.71 Favored 'General case' 0 C--N 1.332 -0.18 0 CA-C-N 116.374 -0.376 . . . . 0.0 111.143 179.721 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 114' ' ' SER . . . . . 0.504 ' O ' ' HG2' ' A' ' 118' ' ' GLU . 13.5 p -66.33 -37.56 85.64 Favored 'General case' 0 C--N 1.327 -0.399 0 C-N-CA 120.903 -0.319 . . . . 0.0 110.814 -179.906 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 115' ' ' ILE . . . . . 0.455 HG13 ' O ' ' A' ' 111' ' ' ASP . 69.0 mt -63.47 -41.92 94.39 Favored 'Isoleucine or valine' 0 N--CA 1.465 0.288 0 CA-C-O 120.731 0.301 . . . . 0.0 110.548 176.184 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 116' ' ' ILE . . . . . 0.542 HG12 ' O ' ' A' ' 112' ' ' ILE . 50.0 mm -65.01 -26.33 39.76 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.323 0 CA-C-O 121.307 0.575 . . . . 0.0 110.439 178.005 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 117' ' ' ASN . . . . . . . . . . . . . 8.8 t30 -86.63 -37.17 18.31 Favored 'General case' 0 C--N 1.325 -0.499 0 CA-C-N 115.759 -0.655 . . . . 0.0 111.435 -179.916 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 118' ' ' GLU . . . . . 0.504 ' HG2' ' O ' ' A' ' 114' ' ' SER . 33.9 mm-40 -79.78 -29.21 40.31 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-N 116.514 -0.312 . . . . 0.0 111.388 -176.212 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 119' ' ' THR . . . . . 0.492 ' HB ' HD21 ' A' ' 126' ' ' LEU . 62.0 m -76.03 111.31 11.3 Favored 'General case' 0 C--N 1.323 -0.573 0 CA-C-O 121.415 0.626 . . . . 0.0 109.752 176.83 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 120' ' ' LYS . . . . . . . . . . . . . 45.4 mtmt -96.11 31.59 2.13 Favored 'General case' 0 C--N 1.322 -0.599 0 CA-C-N 115.499 -0.773 . . . . 0.0 110.766 -174.157 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 121' ' ' LEU . . . . . 0.428 HD13 HG23 ' A' ' 119' ' ' THR . 11.2 mp -90.09 -174.93 4.39 Favored 'General case' 0 C--N 1.321 -0.641 0 CA-C-N 115.296 -0.865 . . . . 0.0 110.235 178.11 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 122' ' ' ALA . . . . . . . . . . . . . . . -62.33 152.62 33.31 Favored 'General case' 0 C--N 1.326 -0.439 0 CA-C-N 115.955 -0.566 . . . . 0.0 111.581 -177.301 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 123' ' ' LYS . . . . . 0.78 ' HE3' ' HA ' ' A' ' 123' ' ' LYS . 1.0 OUTLIER -56.88 -39.65 74.75 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 115.508 -0.769 . . . . 0.0 110.791 -177.784 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 124' ' ' ASN . . . . . . . . . . . . . 17.7 m120 -55.85 -47.33 77.47 Favored 'General case' 0 C--N 1.331 -0.217 0 CA-C-N 116.056 -0.52 . . . . 0.0 111.156 179.594 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 125' ' ' THR . . . . . 0.56 ' O ' HG13 ' A' ' 129' ' ' ILE . 19.0 m -59.41 -44.94 92.75 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.054 -0.521 . . . . 0.0 110.715 -178.955 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 126' ' ' LEU . . . . . 0.492 HD21 ' HB ' ' A' ' 119' ' ' THR . 97.5 mt -61.53 -41.68 97.7 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 115.932 -0.576 . . . . 0.0 111.033 179.553 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 127' ' ' LYS . . . . . 0.458 ' HG3' ' O ' ' A' ' 123' ' ' LYS . 51.5 mtpt -66.35 -37.53 85.53 Favored 'General case' 0 C--N 1.326 -0.437 0 CA-C-N 115.872 -0.604 . . . . 0.0 110.359 179.626 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 128' ' ' ALA . . . . . . . . . . . . . . . -67.3 -36.14 80.91 Favored 'General case' 0 C--N 1.326 -0.428 0 CA-C-N 116.055 -0.52 . . . . 0.0 111.149 179.442 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 129' ' ' ILE . . . . . 0.56 HG13 ' O ' ' A' ' 125' ' ' THR . 80.2 mt -58.86 -51.96 66.04 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.277 0 CA-C-O 120.851 0.358 . . . . 0.0 110.432 177.355 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 130' ' ' ARG . . . . . 0.408 HH11 ' HD3' ' A' ' 130' ' ' ARG . 39.8 ttt-85 -62.94 -44.07 97.07 Favored 'General case' 0 C--N 1.331 -0.203 0 CA-C-N 116.045 -0.525 . . . . 0.0 110.602 178.606 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 131' ' ' ASN . . . . . . . . . . . . . 47.5 t30 -57.5 -47.0 83.1 Favored 'General case' 0 N--CA 1.465 0.278 0 CA-C-N 116.111 -0.495 . . . . 0.0 111.277 -179.297 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 132' ' ' THR . . . . . . . . . . . . . 34.6 m -61.31 -49.17 78.11 Favored 'General case' 0 C--N 1.326 -0.413 0 CA-C-N 116.34 -0.391 . . . . 0.0 110.816 -179.748 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 133' ' ' ALA . . . . . . . . . . . . . . . -62.75 -41.72 99.34 Favored 'General case' 0 C--N 1.331 -0.211 0 CA-C-N 116.274 -0.421 . . . . 0.0 111.126 -179.173 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 134' ' ' SER . . . . . . . . . . . . . 32.7 t -60.04 -42.41 94.39 Favored 'General case' 0 C--N 1.327 -0.402 0 CA-C-N 116.182 -0.463 . . . . 0.0 110.993 -178.189 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 135' ' ' GLN . . . . . . . . . . . . . 49.8 mt-30 -65.13 -35.68 81.89 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-N 116.382 -0.372 . . . . 0.0 110.709 179.953 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 136' ' ' ILE . . . . . . . . . . . . . 74.4 mt -65.32 -44.37 94.8 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.272 0 CA-C-N 116.338 -0.392 . . . . 0.0 110.44 177.143 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 137' ' ' PHE . . . . . 0.606 ' HZ ' HG21 ' A' ' 107' ' ' ILE . 50.1 m-85 -62.02 -39.47 92.38 Favored 'General case' 0 N--CA 1.461 0.119 0 CA-C-N 116.3 -0.409 . . . . 0.0 110.675 177.243 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 138' ' ' ARG . . . . . 0.599 ' O ' ' HG2' ' A' ' 142' ' ' GLU . 73.9 mtp180 -58.64 -44.8 90.16 Favored 'General case' 0 C--N 1.33 -0.242 0 CA-C-N 116.395 -0.366 . . . . 0.0 110.768 177.645 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 139' ' ' LEU . . . . . . . . . . . . . 53.9 tp -59.13 -36.93 76.05 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-O 121.061 0.457 . . . . 0.0 110.686 179.232 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 140' ' ' ALA . . . . . . . . . . . . . . . -67.97 -41.0 83.06 Favored 'General case' 0 C--N 1.326 -0.417 0 CA-C-N 116.096 -0.502 . . . . 0.0 110.515 176.792 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 141' ' ' ILE . . . . . 0.57 ' HA ' ' O ' ' A' ' 146' ' ' ILE . 72.2 mt -61.12 -44.33 98.09 Favored 'Isoleucine or valine' 0 C--O 1.234 0.239 0 CA-C-N 116.254 -0.43 . . . . 0.0 110.482 176.482 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 142' ' ' GLU . . . . . 0.599 ' HG2' ' O ' ' A' ' 138' ' ' ARG . 24.8 mm-40 -54.57 -43.99 72.54 Favored 'General case' 0 C--N 1.33 -0.241 0 CA-C-N 115.993 -0.549 . . . . 0.0 110.862 178.458 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 143' ' ' ASN . . . . . . . . . . . . . 42.5 m-80 -90.0 14.05 13.22 Favored 'General case' 0 C--N 1.325 -0.496 0 CA-C-N 115.695 -0.684 . . . . 0.0 111.558 -176.718 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 144' ' ' ARG . . . . . . . . . . . . . 92.6 mtt180 61.98 32.14 17.82 Favored 'General case' 0 N--CA 1.467 0.419 0 N-CA-C 112.144 0.424 . . . . 0.0 112.144 174.367 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 145' ' ' ALA . . . . . . . . . . . . . . . -89.8 -29.95 18.3 Favored 'General case' 0 C--N 1.324 -0.513 0 CA-C-O 121.219 0.533 . . . . 0.0 110.416 177.047 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 146' ' ' ILE . . . . . 0.57 ' O ' ' HA ' ' A' ' 141' ' ' ILE . 16.4 tt -147.32 155.94 10.58 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.69 0 N-CA-C 108.457 -0.942 . . . . 0.0 108.457 177.941 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 147' ' ' ASP . . . . . . . . . . . . . 16.9 t70 -122.34 18.72 10.61 Favored 'General case' 0 C--N 1.323 -0.57 0 CA-C-O 121.122 0.486 . . . . 0.0 111.569 -176.446 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 148' ' ' PHE . . . . . 0.428 ' H ' HG12 ' A' ' 146' ' ' ILE . 49.7 p90 -149.29 154.77 39.51 Favored 'General case' 0 C--N 1.321 -0.635 0 N-CA-C 110.147 -0.316 . . . . 0.0 110.147 176.797 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 149' ' ' ASN . . . . . . . . . . . . . 57.3 t-20 -118.72 96.84 50.42 Favored Pre-proline 0 C--N 1.324 -0.51 0 CA-C-N 116.271 -0.422 . . . . 0.0 110.427 -176.696 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 150' ' ' PRO . . . . . . . . . . . . . 31.9 Cg_exo -59.33 -33.63 97.72 Favored 'Trans proline' 0 C--N 1.342 0.188 0 C-N-CA 122.897 2.398 . . . . 0.0 111.939 179.312 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 151' ' ' ALA . . . . . 0.402 ' HA ' HG23 ' A' ' 154' ' ' VAL . . . -69.37 -32.06 70.86 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.12 -0.491 . . . . 0.0 110.68 -179.555 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 152' ' ' ASP . . . . . . . . . . . . . 30.6 t70 -70.84 -22.72 62.28 Favored 'General case' 0 C--N 1.326 -0.421 0 CA-C-O 121.226 0.536 . . . . 0.0 109.91 178.624 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 153' ' ' TYR . . . . . . . . . . . . . 75.5 t80 -82.85 -16.08 49.05 Favored 'General case' 0 C--N 1.324 -0.512 0 CA-C-N 115.518 -0.765 . . . . 0.0 110.213 -179.04 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 154' ' ' VAL . . . . . 0.402 HG23 ' HA ' ' A' ' 151' ' ' ALA . 24.2 t -68.98 132.44 33.04 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.304 0 CA-C-N 116.25 -0.432 . . . . 0.0 110.298 176.145 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 155' ' ' ARG . . . . . . . . . . . . . 17.3 tpp180 -109.41 119.49 39.62 Favored 'General case' 0 C--N 1.318 -0.79 0 N-CA-C 109.816 -0.438 . . . . 0.0 109.816 173.897 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 156' ' ' ILE . . . . . . . . . . . . . 33.1 mm -66.02 124.48 87.87 Favored Pre-proline 0 C--N 1.327 -0.396 0 CA-C-N 115.658 -0.701 . . . . 0.0 109.731 174.121 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 157' ' ' PRO . . . . . . . . . . . . . 14.7 Cg_exo -69.67 144.7 55.38 Favored 'Trans proline' 0 N--CA 1.455 -0.748 0 C-N-CA 121.92 1.747 . . . . 0.0 110.91 173.41 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 158' ' ' LYS . . . . . . . . . . . . . 75.5 mttt 76.29 -43.5 0.47 Allowed 'General case' 0 N--CA 1.467 0.41 0 C-N-CA 123.72 0.808 . . . . 0.0 111.398 176.821 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 159' ' ' ILE . . . . . . . . . . . . . 4.3 mp 69.97 -56.26 0.28 Allowed 'Isoleucine or valine' 0 N--CA 1.47 0.549 0 C-N-CA 123.463 0.705 . . . . 0.0 112.326 174.117 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 160' ' ' ALA . . . . . . . . . . . . . . . -77.09 164.66 25.5 Favored 'General case' 0 C--N 1.326 -0.43 0 CA-C-O 121.32 0.581 . . . . 0.0 111.979 -174.114 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 161' ' ' LEU . . . . . . . . . . . . . 1.2 pp -118.41 15.25 13.85 Favored 'General case' 0 C--N 1.327 -0.398 0 CA-C-N 115.468 -0.787 . . . . 0.0 111.23 -178.925 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 162' ' ' GLU . . . . . . . . . . . . . 34.5 tt0 -85.04 106.02 16.22 Favored 'General case' 0 C--N 1.327 -0.393 0 CA-C-O 120.988 0.423 . . . . 0.0 110.069 179.408 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 163' ' ' HIS . . . . . . . . . . . . . 57.0 t-80 -107.92 109.87 21.48 Favored 'General case' 0 C--N 1.322 -0.604 0 CA-C-O 121.078 0.466 . . . . 0.0 110.914 -179.041 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 164' ' ' HIS . . . . . . . . . . . . . 31.5 t-80 -125.77 -67.3 0.89 Allowed 'General case' 0 C--N 1.321 -0.635 0 N-CA-C 108.591 -0.892 . . . . 0.0 108.591 170.943 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 165' ' ' HIS . . . . . . . . . . . . . 5.1 t60 69.34 144.66 0.05 Allowed 'General case' 0 CA--C 1.531 0.249 0 O-C-N 124.269 0.981 . . . . 0.0 110.896 174.516 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 166' ' ' HIS . . . . . . . . . . . . . 53.4 t-80 -96.7 70.3 2.54 Favored 'General case' 0 C--N 1.322 -0.6 0 C-N-CA 120.224 -0.59 . . . . 0.0 110.833 -179.023 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 167' ' ' HIS . . . . . . . . . . . . . 11.5 m170 -144.33 77.99 1.56 Allowed 'General case' 0 C--N 1.324 -0.521 0 CA-C-N 115.772 -0.649 . . . . 0.0 109.31 170.395 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 168' ' ' HIS . . . . . . . . . . . . . 0.5 OUTLIER . . . . . 0 C--O 1.244 0.814 0 CA-C-N 114.823 -1.08 . . . . 0.0 108.908 -178.883 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 61' ' ' ARG . . . . . . . . . . . . . 48.1 mtt180 . . . . . 0 N--CA 1.481 1.1 0 N-CA-C 109.772 -0.455 . . . . 0.0 109.772 . . . . . . . . . 0 0 . 1 . 010 nuclear nobuild full ' A' A ' 62' ' ' ASP . . . . . . . . . . . . . 0.7 OUTLIER -150.32 155.03 38.88 Favored 'General case' 0 C--N 1.322 -0.62 0 CA-C-O 121.502 0.668 . . . . 0.0 111.481 -178.518 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 63' ' ' SER . . . . . . . . . . . . . 29.1 t -118.69 161.21 20.47 Favored 'General case' 0 C--N 1.322 -0.603 0 CA-C-N 115.063 -0.971 . . . . 0.0 109.703 -177.658 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 64' ' ' PHE . . . . . 0.533 ' HB2' HD11 ' A' ' 107' ' ' ILE . 73.4 t80 -60.11 -30.04 69.0 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-O 120.76 0.314 . . . . 0.0 110.427 179.194 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 65' ' ' GLY . . . . . 0.461 ' HA2' ' CD1' ' A' ' 100' ' ' TYR . . . -61.11 -41.04 99.34 Favored Glycine 0 N--CA 1.449 -0.472 0 C-N-CA 121.08 -0.581 . . . . 0.0 112.217 176.675 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 66' ' ' ASP . . . . . 0.509 ' O ' ' HG2' ' A' ' 70' ' ' LYS . 33.9 t70 -66.69 -42.58 86.23 Favored 'General case' 0 C--N 1.325 -0.463 0 N-CA-C 109.767 -0.457 . . . . 0.0 109.767 178.185 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 67' ' ' TRP . . . . . . . . . . . . . 93.8 m95 -67.72 -27.82 67.13 Favored 'General case' 0 C--N 1.331 -0.23 0 CA-C-N 115.827 -0.624 . . . . 0.0 111.54 -179.961 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 68' ' ' ALA . . . . . 0.49 ' O ' ' HG ' ' A' ' 72' ' ' LEU . . . -62.22 -49.55 75.3 Favored 'General case' 0 C--N 1.328 -0.355 0 N-CA-C 109.779 -0.452 . . . . 0.0 109.779 174.291 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 69' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER -61.83 -37.64 85.19 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.087 -0.506 . . . . 0.0 110.65 175.262 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 70' ' ' LYS . . . . . 0.509 ' HG2' ' O ' ' A' ' 66' ' ' ASP . 27.0 mmmt -57.58 -52.09 66.83 Favored 'General case' 0 N--CA 1.464 0.254 0 CA-C-N 116.356 -0.384 . . . . 0.0 110.47 176.364 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 71' ' ' PHE . . . . . . . . . . . . . 92.0 t80 -62.12 -40.3 95.44 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 115.998 -0.546 . . . . 0.0 110.829 -179.669 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 72' ' ' LEU . . . . . 0.49 ' HG ' ' O ' ' A' ' 68' ' ' ALA . 79.5 mt -61.74 -51.65 67.48 Favored 'General case' 0 C--N 1.326 -0.456 0 CA-C-N 116.223 -0.444 . . . . 0.0 111.097 179.496 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 73' ' ' LYS . . . . . 0.454 ' HA ' ' HB3' ' A' ' 76' ' ' GLU . 55.0 tttp -71.44 -24.06 61.95 Favored 'General case' 0 C--N 1.326 -0.441 0 C-N-CA 120.216 -0.594 . . . . 0.0 110.59 -179.165 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 74' ' ' SER . . . . . . . . . . . . . 33.5 t -60.26 -45.47 93.19 Favored 'General case' 0 C--N 1.328 -0.358 0 N-CA-C 109.795 -0.446 . . . . 0.0 109.795 173.745 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 75' ' ' LYS . . . . . . . . . . . . . 27.5 mmtm -76.11 -30.35 58.2 Favored 'General case' 0 C--N 1.327 -0.399 0 CA-C-N 116.384 -0.371 . . . . 0.0 110.855 177.605 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 76' ' ' GLU . . . . . 0.454 ' HB3' ' HA ' ' A' ' 73' ' ' LYS . 2.7 tm-20 -58.08 -53.43 58.38 Favored 'General case' 0 C--N 1.327 -0.379 0 CA-C-N 116.092 -0.504 . . . . 0.0 109.722 173.969 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 77' ' ' ALA . . . . . . . . . . . . . . . -71.33 -27.04 63.09 Favored 'General case' 0 C--N 1.325 -0.473 0 CA-C-N 115.721 -0.672 . . . . 0.0 111.229 179.322 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 78' ' ' ASP . . . . . . . . . . . . . 17.4 t70 -64.08 -49.09 73.62 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.114 -0.494 . . . . 0.0 110.528 178.117 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 79' ' ' GLY . . . . . . . . . . . . . . . 131.32 55.15 0.09 OUTLIER Glycine 0 N--CA 1.448 -0.555 0 C-N-CA 120.633 -0.794 . . . . 0.0 112.975 177.084 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 80' ' ' VAL . . . . . 0.631 HG23 ' HG ' ' A' ' 85' ' ' LEU . 22.8 m -112.16 168.91 4.69 Favored 'Isoleucine or valine' 0 C--O 1.237 0.431 0 O-C-N 122.462 -0.434 . . . . 0.0 110.732 175.328 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 81' ' ' SER . . . . . . . . . . . . . 74.9 p -83.08 169.31 16.03 Favored 'General case' 0 C--N 1.322 -0.612 0 CA-C-N 115.929 -0.578 . . . . 0.0 110.944 -178.721 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 82' ' ' VAL . . . . . . . . . . . . . 94.3 t -64.33 -37.83 80.98 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.431 0 N-CA-C 109.379 -0.601 . . . . 0.0 109.379 173.817 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 83' ' ' SER . . . . . . . . . . . . . 13.6 t -60.38 -47.65 85.13 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 115.758 -0.655 . . . . 0.0 110.536 178.657 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 84' ' ' GLN . . . . . 0.412 ' HG3' ' CE2' ' A' ' 88' ' ' TYR . 6.7 tp-100 -63.71 -45.1 91.51 Favored 'General case' 0 C--N 1.332 -0.157 0 CA-C-N 116.369 -0.378 . . . . 0.0 110.396 179.704 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 85' ' ' LEU . . . . . 0.631 ' HG ' HG23 ' A' ' 80' ' ' VAL . 19.1 mt -62.46 -36.07 81.28 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.225 -0.443 . . . . 0.0 111.266 177.418 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 86' ' ' ASN . . . . . . . . . . . . . 53.7 t30 -72.77 -29.95 63.72 Favored 'General case' 0 C--N 1.322 -0.621 0 CA-C-N 115.837 -0.62 . . . . 0.0 109.856 -177.9 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 87' ' ' SER . . . . . 0.413 ' O ' ' HD1' ' A' ' 91' ' ' TYR . 42.4 t -64.27 -49.94 69.87 Favored 'General case' 0 N--CA 1.452 -0.363 0 CA-C-N 115.655 -0.702 . . . . 0.0 109.682 172.877 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 88' ' ' TYR . . . . . 0.412 ' CE2' ' HG3' ' A' ' 84' ' ' GLN . 25.7 m-85 -59.86 -38.72 82.95 Favored 'General case' 0 C--N 1.331 -0.234 0 CA-C-N 116.208 -0.451 . . . . 0.0 111.265 179.733 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 89' ' ' LYS . . . . . 0.467 ' HG3' ' O ' ' A' ' 85' ' ' LEU . 64.6 mttp -57.92 -44.58 86.94 Favored 'General case' 0 C--N 1.333 -0.115 0 CA-C-O 120.801 0.334 . . . . 0.0 110.89 177.625 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 90' ' ' ASN . . . . . . . . . . . . . 20.7 t-20 -64.49 -42.9 95.57 Favored 'General case' 0 C--N 1.325 -0.487 0 CA-C-N 116.038 -0.528 . . . . 0.0 111.048 -177.295 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 91' ' ' TYR . . . . . 0.413 ' HD1' ' O ' ' A' ' 87' ' ' SER . 11.8 m-85 -66.54 -46.65 75.41 Favored 'General case' 0 C--N 1.324 -0.524 0 N-CA-C 111.719 0.266 . . . . 0.0 111.719 -177.926 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 92' ' ' CYS . . . . . 0.499 ' HA ' HD12 ' A' ' 96' ' ' LEU . 24.5 p -75.98 -25.68 56.04 Favored 'General case' 0 C--N 1.327 -0.391 0 N-CA-C 111.883 0.327 . . . . 0.0 111.883 -175.122 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 93' ' ' ARG . . . . . 0.409 ' HB2' ' O ' ' A' ' 89' ' ' LYS . 51.3 mtt85 -98.12 -31.87 11.89 Favored 'General case' 0 C--N 1.325 -0.494 0 N-CA-C 112.912 0.708 . . . . 0.0 112.912 -176.116 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 94' ' ' ASN . . . . . . . . . . . . . 16.7 m120 -95.31 -45.26 7.22 Favored 'General case' 0 C--N 1.325 -0.469 0 C-N-CA 120.581 -0.448 . . . . 0.0 111.608 -179.285 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 95' ' ' HIS . . . . . . . . . . . . . 77.4 m-70 -84.96 -44.46 13.09 Favored 'General case' 0 C--N 1.327 -0.39 0 CA-C-O 120.881 0.372 . . . . 0.0 110.501 -177.611 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 96' ' ' LEU . . . . . 0.499 HD12 ' HA ' ' A' ' 92' ' ' CYS . 79.8 mt -91.72 26.8 2.24 Favored 'General case' 0 C--N 1.324 -0.534 0 CA-C-N 116.107 -0.497 . . . . 0.0 110.061 179.854 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 97' ' ' SER . . . . . 0.585 ' OG ' ' HD3' ' A' ' 98' ' ' PRO . 1.4 p -54.43 -48.04 95.97 Favored Pre-proline 0 CA--C 1.542 0.657 0 N-CA-C 113.276 0.843 . . . . 0.0 113.276 -176.841 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 98' ' ' PRO . . . . . 0.585 ' HD3' ' OG ' ' A' ' 97' ' ' SER . 13.1 Cg_exo -69.18 -13.96 37.07 Favored 'Trans proline' 0 C--N 1.356 0.934 0 C-N-CA 121.873 1.715 . . . . 0.0 112.233 -178.837 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 99' ' ' LEU . . . . . 0.482 HD12 HD22 ' A' ' 96' ' ' LEU . 61.2 mt -95.02 -30.84 13.89 Favored 'General case' 0 C--N 1.324 -0.516 0 CA-C-N 116.353 -0.385 . . . . 0.0 110.418 -178.519 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 100' ' ' TYR . . . . . 0.461 ' CD1' ' HA2' ' A' ' 65' ' ' GLY . 84.4 t80 -56.5 -32.77 65.35 Favored 'General case' 0 C--N 1.331 -0.203 0 CA-C-N 115.855 -0.612 . . . . 0.0 111.716 -176.458 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 101' ' ' MET . . . . . . . . . . . . . 25.6 ttt -98.92 1.19 45.41 Favored 'General case' 0 C--N 1.323 -0.575 0 CA-C-O 120.871 0.367 . . . . 0.0 111.406 -176.051 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 102' ' ' LYS . . . . . 0.477 ' HG3' ' O ' ' A' ' 98' ' ' PRO . 77.8 mttt -90.42 145.65 24.76 Favored 'General case' 0 C--N 1.322 -0.595 0 CA-C-O 121.482 0.658 . . . . 0.0 111.813 -178.561 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 103' ' ' SER . . . . . 0.426 ' O ' HG13 ' A' ' 107' ' ' ILE . 44.8 t -66.88 145.02 55.91 Favored 'General case' 0 C--N 1.323 -0.576 0 CA-C-N 115.236 -0.893 . . . . 0.0 109.183 173.0 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 104' ' ' LEU . . . . . . . . . . . . . 41.9 tp -56.85 -51.19 69.98 Favored 'General case' 0 C--N 1.328 -0.353 0 N-CA-C 112.536 0.569 . . . . 0.0 112.536 -170.043 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 105' ' ' SER . . . . . . . . . . . . . 4.8 m -74.29 -11.35 60.24 Favored 'General case' 0 C--N 1.327 -0.382 0 CA-C-O 121.001 0.429 . . . . 0.0 111.388 -175.966 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 106' ' ' GLU . . . . . . . . . . . . . 2.1 mp0 -96.84 5.64 50.17 Favored 'General case' 0 C--N 1.326 -0.416 0 CA-C-N 116.071 -0.513 . . . . 0.0 111.434 -174.688 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 107' ' ' ILE . . . . . 0.533 HD11 ' HB2' ' A' ' 64' ' ' PHE . 70.2 mt -89.57 137.6 21.02 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.455 0 CA-C-O 120.992 0.425 . . . . 0.0 111.0 -179.695 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 108' ' ' LEU . . . . . 0.44 ' N ' HD22 ' A' ' 108' ' ' LEU . 2.1 mm? -108.66 148.32 37.51 Favored Pre-proline 0 C--N 1.325 -0.482 0 CA-C-N 115.777 -0.647 . . . . 0.0 110.294 -179.863 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 109' ' ' PRO . . . . . . . . . . . . . 27.5 Cg_endo -63.59 -22.52 70.44 Favored 'Trans proline' 0 C--N 1.343 0.239 0 C-N-CA 122.182 1.921 . . . . 0.0 111.031 174.296 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 110' ' ' ALA . . . . . . . . . . . . . . . -63.76 -41.81 97.92 Favored 'General case' 0 N--CA 1.454 -0.255 0 CA-C-N 115.464 -0.789 . . . . 0.0 111.16 -179.641 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 111' ' ' ASP . . . . . 0.483 ' O ' HG13 ' A' ' 115' ' ' ILE . 20.2 m-20 -58.33 -44.43 88.68 Favored 'General case' 0 N--CA 1.465 0.288 0 CA-C-O 121.189 0.519 . . . . 0.0 110.897 178.837 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 112' ' ' ILE . . . . . 0.581 HG21 HH22 ' A' ' 130' ' ' ARG . 12.7 mt -72.09 -33.89 48.49 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.59 0 CA-C-N 115.863 -0.608 . . . . 0.0 110.652 -176.373 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 113' ' ' GLN . . . . . . . . . . . . . 25.1 tp60 -64.92 -40.55 95.23 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 115.996 -0.547 . . . . 0.0 110.626 -179.619 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 114' ' ' SER . . . . . . . . . . . . . 6.8 p -72.52 -36.13 68.26 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 116.46 -0.336 . . . . 0.0 110.935 179.616 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 115' ' ' ILE . . . . . 0.483 HG13 ' O ' ' A' ' 111' ' ' ASP . 77.5 mt -56.4 -46.78 82.1 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.158 0 CA-C-O 120.896 0.379 . . . . 0.0 110.292 175.729 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 116' ' ' ILE . . . . . . . . . . . . . 49.1 mm -67.22 -35.59 74.47 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.316 0 CA-C-N 116.094 -0.503 . . . . 0.0 110.686 178.661 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 117' ' ' ASN . . . . . . . . . . . . . 50.8 t30 -66.05 -40.93 91.34 Favored 'General case' 0 C--N 1.327 -0.398 0 CA-C-N 116.158 -0.473 . . . . 0.0 111.171 -179.735 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 118' ' ' GLU . . . . . . . . . . . . . 43.0 mt-10 -84.91 -19.3 32.47 Favored 'General case' 0 C--N 1.326 -0.444 0 CA-C-N 116.169 -0.468 . . . . 0.0 111.787 -176.605 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 119' ' ' THR . . . . . . . . . . . . . 69.6 m -84.04 112.94 20.65 Favored 'General case' 0 C--N 1.326 -0.444 0 CA-C-O 121.209 0.528 . . . . 0.0 109.763 175.042 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 120' ' ' LYS . . . . . 0.405 ' HB3' ' HE2' ' A' ' 120' ' ' LYS . 11.4 ptpt -110.34 86.29 2.28 Favored 'General case' 0 C--N 1.32 -0.696 0 CA-C-O 121.817 0.818 . . . . 0.0 110.887 -177.614 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 121' ' ' LEU . . . . . . . . . . . . . 96.0 mt -133.16 -175.04 3.66 Favored 'General case' 0 C--N 1.322 -0.622 0 CA-C-N 114.65 -1.159 . . . . 0.0 109.122 179.29 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 122' ' ' ALA . . . . . . . . . . . . . . . -58.52 145.58 38.55 Favored 'General case' 0 C--N 1.326 -0.419 0 O-C-N 123.123 0.264 . . . . 0.0 110.644 178.009 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 123' ' ' LYS . . . . . . . . . . . . . 21.4 ptmt -60.75 -33.93 73.67 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.662 -0.244 . . . . 0.0 111.537 -175.563 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 124' ' ' ASN . . . . . . . . . . . . . 1.9 p-10 -68.66 -27.15 65.74 Favored 'General case' 0 N--CA 1.463 0.208 0 CA-C-O 121.127 0.489 . . . . 0.0 110.036 178.925 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 125' ' ' THR . . . . . 0.402 ' O ' HG13 ' A' ' 129' ' ' ILE . 20.7 m -78.22 -34.63 49.19 Favored 'General case' 0 N--CA 1.452 -0.356 0 CA-C-N 115.932 -0.576 . . . . 0.0 109.828 178.877 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 126' ' ' LEU . . . . . . . . . . . . . 91.8 mt -67.42 -38.14 84.15 Favored 'General case' 0 C--N 1.327 -0.407 0 CA-C-N 115.809 -0.632 . . . . 0.0 109.879 175.723 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 127' ' ' LYS . . . . . 0.572 ' HG2' HG21 ' A' ' 156' ' ' ILE . 50.2 mtpt -70.4 -26.61 63.77 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.009 -0.541 . . . . 0.0 110.706 176.184 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 128' ' ' ALA . . . . . . . . . . . . . . . -67.09 -41.19 86.73 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-O 120.845 0.355 . . . . 0.0 110.132 174.97 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 129' ' ' ILE . . . . . 0.402 HG13 ' O ' ' A' ' 125' ' ' THR . 62.6 mt -65.29 -43.33 95.15 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.289 0 CA-C-N 116.017 -0.538 . . . . 0.0 109.791 175.628 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 130' ' ' ARG . . . . . 0.672 ' HA ' ' CZ ' ' A' ' 130' ' ' ARG . 0.5 OUTLIER -58.39 -49.92 75.53 Favored 'General case' 0 C--N 1.331 -0.229 0 CA-C-N 115.562 -0.745 . . . . 0.0 110.435 176.721 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 131' ' ' ASN . . . . . . . . . . . . . 5.4 t30 -55.96 -55.86 27.6 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 115.677 -0.692 . . . . 0.0 111.233 178.041 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 132' ' ' THR . . . . . 0.498 ' O ' HG13 ' A' ' 136' ' ' ILE . 37.3 m -56.12 -53.56 55.62 Favored 'General case' 0 C--N 1.327 -0.373 0 CA-C-N 116.055 -0.52 . . . . 0.0 111.488 -175.16 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 133' ' ' ALA . . . . . . . . . . . . . . . -63.2 -37.57 87.74 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.52 -0.309 . . . . 0.0 111.133 -177.858 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 134' ' ' SER . . . . . 0.469 ' O ' ' HG3' ' A' ' 138' ' ' ARG . 8.3 t -66.26 -44.3 84.02 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.433 -0.349 . . . . 0.0 110.512 -177.486 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 135' ' ' GLN . . . . . . . . . . . . . 44.5 mt-30 -62.93 -33.53 75.53 Favored 'General case' 0 C--O 1.233 0.199 0 CA-C-O 120.669 0.271 . . . . 0.0 110.914 -179.078 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 136' ' ' ILE . . . . . 0.498 HG13 ' O ' ' A' ' 132' ' ' THR . 66.3 mt -63.61 -48.44 86.75 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.218 0 CA-C-N 116.347 -0.388 . . . . 0.0 110.696 176.95 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 137' ' ' PHE . . . . . 0.419 ' O ' HG13 ' A' ' 141' ' ' ILE . 56.4 m-85 -66.25 -37.53 85.71 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-N 116.635 -0.257 . . . . 0.0 110.879 178.579 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 138' ' ' ARG . . . . . 0.469 ' HG3' ' O ' ' A' ' 134' ' ' SER . 41.4 mtp-105 -60.03 -40.3 88.85 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-N 116.449 -0.342 . . . . 0.0 110.454 176.871 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 139' ' ' LEU . . . . . . . . . . . . . 62.1 tp -62.73 -38.56 90.97 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 115.947 -0.569 . . . . 0.0 110.225 177.35 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 140' ' ' ALA . . . . . . . . . . . . . . . -63.94 -41.55 97.58 Favored 'General case' 0 C--N 1.326 -0.427 0 CA-C-N 115.942 -0.572 . . . . 0.0 110.522 176.408 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 141' ' ' ILE . . . . . 0.419 HG13 ' O ' ' A' ' 137' ' ' PHE . 58.9 mt -63.62 -39.04 83.88 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.267 0 CA-C-N 116.565 -0.289 . . . . 0.0 111.021 174.76 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 142' ' ' GLU . . . . . 0.449 ' HG3' ' O ' ' A' ' 138' ' ' ARG . 48.8 mt-10 -60.87 -39.29 88.65 Favored 'General case' 0 N--CA 1.462 0.157 0 CA-C-O 120.858 0.361 . . . . 0.0 110.626 177.169 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 143' ' ' ASN . . . . . 0.44 HD22 ' N ' ' A' ' 143' ' ' ASN . 0.9 OUTLIER -84.87 0.94 49.25 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.204 -0.453 . . . . 0.0 110.189 177.074 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 144' ' ' ARG . . . . . . . . . . . . . 99.5 mtt180 55.15 44.7 27.41 Favored 'General case' 0 C--O 1.232 0.139 0 CA-C-N 115.341 -0.845 . . . . 0.0 111.713 179.222 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 145' ' ' ALA . . . . . . . . . . . . . . . -88.21 -55.59 3.68 Favored 'General case' 0 C--N 1.327 -0.4 0 CA-C-N 115.44 -0.8 . . . . 0.0 109.632 173.897 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 146' ' ' ILE . . . . . 0.446 HG12 ' H ' ' A' ' 148' ' ' PHE . 18.3 tt -104.85 147.49 10.68 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.44 0 N-CA-C 109.359 -0.608 . . . . 0.0 109.359 175.966 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 147' ' ' ASP . . . . . . . . . . . . . 27.2 t70 -87.7 -6.3 58.28 Favored 'General case' 0 C--N 1.324 -0.52 0 CA-C-N 116.4 -0.364 . . . . 0.0 111.891 -172.593 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 148' ' ' PHE . . . . . 0.446 ' H ' HG12 ' A' ' 146' ' ' ILE . 33.0 p90 -155.33 168.7 26.23 Favored 'General case' 0 C--N 1.325 -0.458 0 CA-C-O 120.885 0.374 . . . . 0.0 111.023 -174.003 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 149' ' ' ASN . . . . . . . . . . . . . 29.6 t30 -115.15 102.16 54.63 Favored Pre-proline 0 C--N 1.324 -0.527 0 CA-C-N 115.857 -0.611 . . . . 0.0 110.163 178.303 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 150' ' ' PRO . . . . . . . . . . . . . 40.7 Cg_endo -68.04 -17.96 46.0 Favored 'Trans proline' 0 C--N 1.343 0.254 0 C-N-CA 122.787 2.324 . . . . 0.0 112.48 -178.367 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 151' ' ' ALA . . . . . 0.462 ' HB1' HH21 ' A' ' 130' ' ' ARG . . . -71.54 -20.35 62.04 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 116.269 -0.423 . . . . 0.0 110.942 -179.453 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 152' ' ' ASP . . . . . . . . . . . . . 36.7 t70 -72.92 -15.39 61.58 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 115.821 -0.627 . . . . 0.0 110.822 -178.301 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 153' ' ' TYR . . . . . . . . . . . . . 88.4 m-85 -92.21 2.51 56.56 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.061 -0.518 . . . . 0.0 111.255 -177.922 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 154' ' ' VAL . . . . . . . . . . . . . 81.1 t -90.99 121.86 41.8 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.449 0 CA-C-O 120.752 0.31 . . . . 0.0 111.107 -177.505 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 155' ' ' ARG . . . . . . . . . . . . . 12.4 ttm180 -80.97 134.12 35.64 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 116.155 -0.475 . . . . 0.0 110.03 177.865 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 156' ' ' ILE . . . . . 0.572 HG21 ' HG2' ' A' ' 127' ' ' LYS . 46.1 mm -105.95 130.26 23.28 Favored Pre-proline 0 C--N 1.325 -0.484 0 CA-C-N 116.174 -0.466 . . . . 0.0 109.765 176.613 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 157' ' ' PRO . . . . . . . . . . . . . 18.4 Cg_endo -60.33 130.72 35.13 Favored 'Trans proline' 0 C--N 1.344 0.335 0 C-N-CA 122.343 2.029 . . . . 0.0 111.912 179.323 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 158' ' ' LYS . . . . . . . . . . . . . 93.5 mttt -102.46 -12.27 17.96 Favored 'General case' 0 C--N 1.322 -0.605 0 CA-C-N 115.851 -0.613 . . . . 0.0 111.031 -174.858 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 159' ' ' ILE . . . . . 0.424 HD12 ' N ' ' A' ' 159' ' ' ILE . 4.3 mp -110.49 103.04 14.84 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.489 0 CA-C-N 116.19 -0.459 . . . . 0.0 110.051 -178.53 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 160' ' ' ALA . . . . . . . . . . . . . . . -148.66 115.64 6.06 Favored 'General case' 0 C--N 1.324 -0.543 0 CA-C-N 116.551 -0.295 . . . . 0.0 111.031 -179.575 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 161' ' ' LEU . . . . . . . . . . . . . 93.3 mt 63.7 -157.12 0.32 Allowed 'General case' 0 C--O 1.234 0.259 0 CA-C-N 115.724 -0.671 . . . . 0.0 111.149 175.345 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 162' ' ' GLU . . . . . . . . . . . . . 10.1 pt-20 -79.31 149.32 31.8 Favored 'General case' 0 C--N 1.326 -0.446 0 CA-C-O 121.118 0.485 . . . . 0.0 111.063 -179.901 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 163' ' ' HIS . . . . . . . . . . . . . 6.1 p80 -112.09 63.67 0.62 Allowed 'General case' 0 C--N 1.32 -0.687 0 CA-C-O 121.798 0.809 . . . . 0.0 109.54 177.788 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 164' ' ' HIS . . . . . . . . . . . . . 17.6 t-160 -87.44 17.42 4.52 Favored 'General case' 0 C--N 1.326 -0.426 0 CA-C-N 114.919 -1.037 . . . . 0.0 110.658 -174.687 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 165' ' ' HIS . . . . . . . . . . . . . 94.5 m-70 -135.79 133.74 38.21 Favored 'General case' 0 C--N 1.322 -0.622 0 CA-C-N 116.114 -0.494 . . . . 0.0 109.924 177.832 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 166' ' ' HIS . . . . . . . . . . . . . 26.8 p80 -159.15 148.52 18.64 Favored 'General case' 0 C--N 1.326 -0.423 0 N-CA-C 110.16 -0.311 . . . . 0.0 110.16 176.751 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 167' ' ' HIS . . . . . . . . . . . . . 6.4 p80 -82.36 171.78 13.81 Favored 'General case' 0 C--N 1.323 -0.552 0 N-CA-C 110.13 -0.322 . . . . 0.0 110.13 177.72 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 168' ' ' HIS . . . . . . . . . . . . . 4.1 t-160 . . . . . 0 C--O 1.242 0.695 0 CA-C-O 118.573 -0.727 . . . . 0.0 109.09 174.074 . . . . . . . . 0 0 . 1 . 011 nuclear nobuild full ' A' A ' 61' ' ' ARG . . . . . 0.409 HH11 ' HD3' ' A' ' 61' ' ' ARG . 1.3 ptm180 . . . . . 0 N--CA 1.481 1.105 0 CA-C-O 120.918 0.389 . . . . 0.0 111.094 . . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 62' ' ' ASP . . . . . . . . . . . . . 5.4 p-10 -177.92 149.84 0.6 Allowed 'General case' 0 C--O 1.233 0.188 0 CA-C-N 116.259 -0.428 . . . . 0.0 110.914 -177.673 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 63' ' ' SER . . . . . 0.511 ' HA ' ' HA ' ' A' ' 103' ' ' SER . 97.7 p -119.64 158.78 25.71 Favored 'General case' 0 C--N 1.326 -0.436 0 N-CA-C 109.556 -0.535 . . . . 0.0 109.556 169.54 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 64' ' ' PHE . . . . . . . . . . . . . 82.4 t80 -62.02 -28.74 69.79 Favored 'General case' 0 C--N 1.324 -0.542 0 CA-C-O 120.994 0.426 . . . . 0.0 109.987 178.021 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 65' ' ' GLY . . . . . . . . . . . . . . . -63.8 -37.57 94.87 Favored Glycine 0 N--CA 1.449 -0.497 0 CA-C-N 115.941 -0.572 . . . . 0.0 112.144 176.711 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 66' ' ' ASP . . . . . . . . . . . . . 56.1 m-20 -65.31 -43.77 90.02 Favored 'General case' 0 C--O 1.234 0.243 0 CA-C-O 120.958 0.408 . . . . 0.0 109.957 178.308 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 67' ' ' TRP . . . . . . . . . . . . . 99.4 m95 -69.6 -36.74 76.5 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 115.787 -0.642 . . . . 0.0 111.059 178.371 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 68' ' ' ALA . . . . . 0.469 ' O ' ' HG ' ' A' ' 72' ' ' LEU . . . -59.13 -43.4 92.0 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-O 120.868 0.366 . . . . 0.0 110.544 176.998 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 69' ' ' GLU . . . . . 0.466 ' O ' ' HG2' ' A' ' 73' ' ' LYS . 36.6 tt0 -62.4 -44.77 95.66 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.229 -0.442 . . . . 0.0 110.166 175.506 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 70' ' ' LYS . . . . . 0.455 ' HG2' HD21 ' A' ' 139' ' ' LEU . 64.2 tttp -59.42 -39.99 85.27 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 115.886 -0.597 . . . . 0.0 110.66 -179.963 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 71' ' ' PHE . . . . . . . . . . . . . 68.7 t80 -63.62 -44.42 93.98 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.207 -0.451 . . . . 0.0 110.142 176.619 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 72' ' ' LEU . . . . . 0.469 ' HG ' ' O ' ' A' ' 68' ' ' ALA . 82.8 mt -64.62 -36.65 84.92 Favored 'General case' 0 C--N 1.325 -0.486 0 CA-C-N 116.177 -0.465 . . . . 0.0 110.982 -179.913 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 73' ' ' LYS . . . . . 0.466 ' HG2' ' O ' ' A' ' 69' ' ' GLU . 33.3 mmtp -70.6 -40.84 72.97 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-O 120.681 0.277 . . . . 0.0 111.268 -179.912 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 74' ' ' SER . . . . . . . . . . . . . 8.1 p -71.97 -34.56 69.05 Favored 'General case' 0 C--N 1.324 -0.535 0 CA-C-O 120.829 0.347 . . . . 0.0 110.513 179.169 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 75' ' ' LYS . . . . . 0.52 ' HE3' HG11 ' A' ' 80' ' ' VAL . 46.1 tptt -74.02 -30.24 62.34 Favored 'General case' 0 N--CA 1.444 -0.752 0 CA-C-O 120.928 0.394 . . . . 0.0 110.065 177.087 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 76' ' ' GLU . . . . . . . . . . . . . 33.9 tt0 -59.48 -50.24 74.69 Favored 'General case' 0 C--N 1.327 -0.403 0 CA-C-O 121.183 0.516 . . . . 0.0 109.628 171.291 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 77' ' ' ALA . . . . . . . . . . . . . . . -72.69 -10.96 60.41 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-N 115.332 -0.849 . . . . 0.0 111.06 179.131 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 78' ' ' ASP . . . . . 0.504 ' HB3' ' O ' ' A' ' 75' ' ' LYS . 27.9 t70 -73.54 -15.83 61.29 Favored 'General case' 0 C--N 1.326 -0.439 0 CA-C-N 115.844 -0.616 . . . . 0.0 109.983 175.649 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 79' ' ' GLY . . . . . . . . . . . . . . . 91.87 60.42 1.27 Allowed Glycine 0 N--CA 1.446 -0.655 0 CA-C-N 115.762 -0.654 . . . . 0.0 112.06 177.354 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 80' ' ' VAL . . . . . 0.52 HG11 ' HE3' ' A' ' 75' ' ' LYS . 34.9 m -115.79 152.42 17.47 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.433 0 CA-C-O 120.87 0.367 . . . . 0.0 110.74 178.76 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 81' ' ' SER . . . . . . . . . . . . . 31.2 t -64.45 153.01 40.09 Favored 'General case' 0 C--N 1.322 -0.627 0 CA-C-N 115.732 -0.667 . . . . 0.0 109.829 175.668 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 82' ' ' VAL . . . . . . . . . . . . . 59.2 t -62.56 -43.53 98.51 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.336 0 CA-C-O 120.874 0.369 . . . . 0.0 110.575 -179.203 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 83' ' ' SER . . . . . . . . . . . . . 18.0 t -64.48 -30.71 71.74 Favored 'General case' 0 C--N 1.326 -0.428 0 CA-C-N 116.135 -0.484 . . . . 0.0 110.421 177.509 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 84' ' ' GLN . . . . . . . . . . . . . 47.9 tp60 -71.86 -38.79 70.01 Favored 'General case' 0 C--N 1.332 -0.187 0 CA-C-N 116.076 -0.511 . . . . 0.0 109.738 176.961 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 85' ' ' LEU . . . . . 0.405 ' HA ' ' HD2' ' A' ' 88' ' ' TYR . 40.1 tp -66.56 -38.76 87.77 Favored 'General case' 0 C--N 1.327 -0.389 0 CA-C-N 115.878 -0.601 . . . . 0.0 110.217 176.226 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 86' ' ' ASN . . . . . . . . . . . . . 86.0 m-20 -64.47 -26.87 68.63 Favored 'General case' 0 C--O 1.233 0.201 0 CA-C-N 116.129 -0.487 . . . . 0.0 110.716 176.382 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 87' ' ' SER . . . . . . . . . . . . . 13.0 t -65.71 -48.54 71.65 Favored 'General case' 0 C--N 1.324 -0.501 0 N-CA-C 109.711 -0.477 . . . . 0.0 109.711 175.771 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 88' ' ' TYR . . . . . 0.405 ' HD2' ' HA ' ' A' ' 85' ' ' LEU . 77.7 m-85 -62.45 -35.5 79.49 Favored 'General case' 0 N--CA 1.464 0.25 0 CA-C-O 121.084 0.468 . . . . 0.0 110.38 175.638 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 89' ' ' LYS . . . . . . . . . . . . . 39.1 ttmt -61.2 -37.17 82.01 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-N 115.709 -0.678 . . . . 0.0 110.154 178.809 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 90' ' ' ASN . . . . . 0.484 ' O ' ' HB3' ' A' ' 94' ' ' ASN . 26.6 t-20 -65.49 -39.2 91.63 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 115.79 -0.641 . . . . 0.0 110.414 177.66 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 91' ' ' TYR . . . . . . . . . . . . . 56.5 m-85 -63.91 -59.75 4.13 Favored 'General case' 0 C--N 1.327 -0.409 0 CA-C-N 116.363 -0.38 . . . . 0.0 110.879 176.96 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 92' ' ' CYS . . . . . 0.508 ' HA ' HD12 ' A' ' 96' ' ' LEU . 58.3 m -63.55 -46.71 84.71 Favored 'General case' 0 C--N 1.326 -0.456 0 N-CA-C 112.594 0.59 . . . . 0.0 112.594 -173.485 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 93' ' ' ARG . . . . . . . . . . . . . 40.8 ttm180 -86.13 -39.98 16.15 Favored 'General case' 0 C--N 1.327 -0.405 0 N-CA-C 112.355 0.502 . . . . 0.0 112.355 -172.71 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 94' ' ' ASN . . . . . 0.484 ' HB3' ' O ' ' A' ' 90' ' ' ASN . 49.8 t30 -92.78 -52.81 4.44 Favored 'General case' 0 C--N 1.328 -0.368 0 C-N-CA 120.726 -0.39 . . . . 0.0 111.842 -173.876 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 95' ' ' HIS . . . . . . . . . . . . . 8.8 m80 -77.71 -36.17 51.27 Favored 'General case' 0 C--N 1.326 -0.427 0 C-N-CA 120.789 -0.364 . . . . 0.0 111.57 -176.204 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 96' ' ' LEU . . . . . 0.508 HD12 ' HA ' ' A' ' 92' ' ' CYS . 84.3 mt -98.16 27.05 4.83 Favored 'General case' 0 C--N 1.321 -0.65 0 CA-C-N 116.441 -0.345 . . . . 0.0 110.37 178.678 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 97' ' ' SER . . . . . 0.512 ' N ' ' HD2' ' A' ' 98' ' ' PRO . 1.8 p -53.01 -46.72 97.47 Favored Pre-proline 0 CA--C 1.543 0.686 0 N-CA-C 113.444 0.905 . . . . 0.0 113.444 -175.884 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 98' ' ' PRO . . . . . 0.512 ' HD2' ' N ' ' A' ' 97' ' ' SER . 18.3 Cg_endo -60.43 -34.24 93.32 Favored 'Trans proline' 0 C--N 1.359 1.091 0 C-N-CA 121.771 1.647 . . . . 0.0 112.106 178.301 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 99' ' ' LEU . . . . . 0.539 HD22 HG23 ' A' ' 107' ' ' ILE . 41.1 mt -83.81 -28.78 27.85 Favored 'General case' 0 C--N 1.325 -0.475 0 CA-C-O 121.071 0.462 . . . . 0.0 110.366 -177.668 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 100' ' ' TYR . . . . . . . . . . . . . 44.1 t80 -59.38 -25.79 64.55 Favored 'General case' 0 C--N 1.325 -0.497 0 CA-C-N 115.218 -0.901 . . . . 0.0 111.603 -176.802 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 101' ' ' MET . . . . . . . . . . . . . 22.5 ptp -104.17 5.18 34.76 Favored 'General case' 0 C--N 1.327 -0.385 0 CA-C-N 116.347 -0.388 . . . . 0.0 111.24 -178.867 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 102' ' ' LYS . . . . . 0.539 ' HB3' ' HB3' ' A' ' 106' ' ' GLU . 64.0 mttm -105.43 166.96 10.06 Favored 'General case' 0 C--N 1.324 -0.501 0 CA-C-N 116.55 -0.295 . . . . 0.0 110.521 -179.561 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 103' ' ' SER . . . . . 0.511 ' HA ' ' HA ' ' A' ' 63' ' ' SER . 50.9 p -94.97 170.8 9.17 Favored 'General case' 0 C--N 1.32 -0.688 0 N-CA-C 109.613 -0.514 . . . . 0.0 109.613 173.806 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 104' ' ' LEU . . . . . . . . . . . . . 96.5 mt -58.69 -31.04 67.86 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-O 120.747 0.308 . . . . 0.0 111.028 179.222 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 105' ' ' SER . . . . . . . . . . . . . 14.0 m -86.91 -20.99 26.57 Favored 'General case' 0 C--N 1.327 -0.391 0 CA-C-N 116.344 -0.389 . . . . 0.0 111.112 -179.109 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 106' ' ' GLU . . . . . 0.539 ' HB3' ' HB3' ' A' ' 102' ' ' LYS . 0.6 OUTLIER -83.04 -25.23 32.31 Favored 'General case' 0 C--N 1.326 -0.433 0 CA-C-O 121.219 0.533 . . . . 0.0 110.443 -176.901 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' A' A ' 107' ' ' ILE . . . . . 0.539 HG23 HD22 ' A' ' 99' ' ' LEU . 78.9 mt -70.84 127.11 32.36 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.571 0 CA-C-N 115.929 -0.578 . . . . 0.0 111.329 -179.004 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 108' ' ' LEU . . . . . 0.422 ' HA ' ' HD3' ' A' ' 109' ' ' PRO . 93.5 mt -100.44 137.89 20.05 Favored Pre-proline 0 C--N 1.326 -0.452 0 CA-C-N 115.691 -0.686 . . . . 0.0 110.457 176.669 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 109' ' ' PRO . . . . . 0.422 ' HD3' ' HA ' ' A' ' 108' ' ' LEU . 44.2 Cg_exo -56.62 -44.04 49.32 Favored 'Trans proline' 0 CA--C 1.53 0.315 0 C-N-CA 122.709 2.273 . . . . 0.0 112.528 178.97 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 110' ' ' ALA . . . . . . . . . . . . . . . -65.78 -27.99 68.69 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-O 120.818 0.342 . . . . 0.0 111.469 -178.502 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 111' ' ' ASP . . . . . 0.539 ' O ' HG13 ' A' ' 115' ' ' ILE . 10.3 t70 -68.68 -39.82 80.37 Favored 'General case' 0 C--N 1.325 -0.486 0 CA-C-O 121.383 0.611 . . . . 0.0 109.703 179.996 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 112' ' ' ILE . . . . . 0.521 ' HB ' HG21 ' A' ' 154' ' ' VAL . 40.5 mt -67.62 -38.25 80.14 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.39 0 CA-C-N 115.583 -0.735 . . . . 0.0 109.829 175.178 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 113' ' ' GLN . . . . . 0.434 ' HA ' HG13 ' A' ' 154' ' ' VAL . 25.2 tp60 -62.88 -41.23 99.33 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-N 115.466 -0.788 . . . . 0.0 110.794 -179.012 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 114' ' ' SER . . . . . 0.415 ' HA ' ' HB3' ' A' ' 117' ' ' ASN . 41.3 p -70.1 -30.66 67.93 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.761 -0.2 . . . . 0.0 111.024 -179.516 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 115' ' ' ILE . . . . . 0.539 HG13 ' O ' ' A' ' 111' ' ' ASP . 83.6 mt -56.55 -55.32 20.03 Favored 'Isoleucine or valine' 0 N--CA 1.463 0.193 0 CA-C-O 120.951 0.405 . . . . 0.0 110.045 174.442 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 116' ' ' ILE . . . . . 0.422 HG23 ' HB3' ' A' ' 126' ' ' LEU . 45.2 mm -64.71 -30.04 49.12 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.378 0 CA-C-N 115.815 -0.63 . . . . 0.0 110.432 179.569 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 117' ' ' ASN . . . . . 0.415 ' HB3' ' HA ' ' A' ' 114' ' ' SER . 8.1 t30 -66.37 -43.25 86.49 Favored 'General case' 0 C--N 1.324 -0.505 0 CA-C-N 115.564 -0.744 . . . . 0.0 111.524 -178.587 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 118' ' ' GLU . . . . . . . . . . . . . 39.3 mt-10 -91.61 -30.46 16.35 Favored 'General case' 0 C--N 1.327 -0.39 0 N-CA-C 112.41 0.522 . . . . 0.0 112.41 -175.897 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 119' ' ' THR . . . . . . . . . . . . . 63.4 m -64.99 111.9 3.07 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-O 120.96 0.409 . . . . 0.0 110.356 -178.68 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 120' ' ' LYS . . . . . . . . . . . . . 91.2 mttt -92.93 79.58 4.63 Favored 'General case' 0 C--N 1.326 -0.42 0 CA-C-O 121.309 0.576 . . . . 0.0 110.734 -176.896 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 121' ' ' LEU . . . . . . . . . . . . . 76.5 mt -126.97 -175.66 3.48 Favored 'General case' 0 C--N 1.321 -0.658 0 CA-C-N 115.5 -0.773 . . . . 0.0 109.612 177.559 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 122' ' ' ALA . . . . . . . . . . . . . . . -65.53 152.28 44.42 Favored 'General case' 0 C--N 1.325 -0.495 0 CA-C-N 116.497 -0.319 . . . . 0.0 110.328 178.812 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 123' ' ' LYS . . . . . . . . . . . . . 0.4 OUTLIER -63.56 -35.66 81.22 Favored 'General case' 0 C--N 1.325 -0.491 0 CA-C-N 116.273 -0.421 . . . . 0.0 110.238 -176.043 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 124' ' ' ASN . . . . . 0.783 ' HA ' ' HE3' ' A' ' 127' ' ' LYS . 11.6 t30 -69.61 -35.69 75.5 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 116.176 -0.465 . . . . 0.0 110.246 177.979 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 125' ' ' THR . . . . . 0.545 ' O ' HG13 ' A' ' 129' ' ' ILE . 8.6 m -65.43 -44.25 87.92 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.226 -0.443 . . . . 0.0 110.274 177.015 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 126' ' ' LEU . . . . . 0.422 ' HB3' HG23 ' A' ' 116' ' ' ILE . 98.6 mt -61.55 -43.27 99.16 Favored 'General case' 0 C--N 1.33 -0.246 0 CA-C-N 115.911 -0.586 . . . . 0.0 110.57 178.665 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 127' ' ' LYS . . . . . 0.783 ' HE3' ' HA ' ' A' ' 124' ' ' ASN . 44.9 mtmt -60.87 -40.06 91.53 Favored 'General case' 0 C--N 1.331 -0.219 0 CA-C-N 116.118 -0.492 . . . . 0.0 110.519 175.824 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 128' ' ' ALA . . . . . . . . . . . . . . . -64.47 -34.38 78.06 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 116.086 -0.506 . . . . 0.0 110.995 179.48 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 129' ' ' ILE . . . . . 0.545 HG13 ' O ' ' A' ' 125' ' ' THR . 71.3 mt -63.26 -53.42 46.04 Favored 'Isoleucine or valine' 0 C--O 1.234 0.244 0 CA-C-N 116.565 -0.289 . . . . 0.0 110.347 177.196 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 130' ' ' ARG . . . . . . . . . . . . . 40.4 ttp180 -62.85 -40.69 98.23 Favored 'General case' 0 CA--C 1.521 -0.154 0 CA-C-O 120.793 0.33 . . . . 0.0 110.126 178.455 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 131' ' ' ASN . . . . . 0.632 ' O ' ' HG2' ' A' ' 135' ' ' GLN . 7.5 t30 -54.98 -55.91 25.55 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-N 115.777 -0.647 . . . . 0.0 110.832 178.538 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 132' ' ' THR . . . . . 0.465 ' O ' HG13 ' A' ' 136' ' ' ILE . 32.0 m -57.04 -45.6 83.04 Favored 'General case' 0 C--N 1.326 -0.433 0 CA-C-N 116.295 -0.412 . . . . 0.0 110.79 -178.705 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 133' ' ' ALA . . . . . . . . . . . . . . . -63.34 -48.67 77.03 Favored 'General case' 0 C--N 1.332 -0.193 0 CA-C-N 116.325 -0.398 . . . . 0.0 111.56 179.796 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 134' ' ' SER . . . . . 0.585 ' O ' ' HG3' ' A' ' 138' ' ' ARG . 26.9 p -66.53 -32.0 73.08 Favored 'General case' 0 C--N 1.327 -0.39 0 CA-C-N 116.633 -0.258 . . . . 0.0 111.27 -177.108 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 135' ' ' GLN . . . . . 0.632 ' HG2' ' O ' ' A' ' 131' ' ' ASN . 11.0 mm100 -65.53 -38.24 89.08 Favored 'General case' 0 C--N 1.331 -0.205 0 C-N-CA 120.967 -0.293 . . . . 0.0 110.36 176.777 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 136' ' ' ILE . . . . . 0.465 HG13 ' O ' ' A' ' 132' ' ' THR . 76.3 mt -64.0 -39.9 87.11 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.262 0 CA-C-N 116.285 -0.416 . . . . 0.0 109.986 176.699 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 137' ' ' PHE . . . . . 0.523 ' O ' HG13 ' A' ' 141' ' ' ILE . 44.2 m-85 -62.86 -42.89 99.92 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.183 -0.462 . . . . 0.0 110.638 175.435 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 138' ' ' ARG . . . . . 0.585 ' HG3' ' O ' ' A' ' 134' ' ' SER . 42.4 mtt180 -60.84 -38.56 85.91 Favored 'General case' 0 N--CA 1.465 0.283 0 CA-C-O 120.804 0.335 . . . . 0.0 110.537 178.559 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 139' ' ' LEU . . . . . 0.455 HD21 ' HG2' ' A' ' 70' ' ' LYS . 65.5 tp -56.45 -38.65 71.92 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 115.821 -0.627 . . . . 0.0 110.519 177.071 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 140' ' ' ALA . . . . . . . . . . . . . . . -74.87 -33.27 62.07 Favored 'General case' 0 C--N 1.325 -0.47 0 CA-C-N 115.872 -0.604 . . . . 0.0 110.706 177.43 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 141' ' ' ILE . . . . . 0.65 ' HA ' ' O ' ' A' ' 146' ' ' ILE . 73.6 mt -64.35 -43.59 97.12 Favored 'Isoleucine or valine' 0 C--O 1.233 0.228 0 CA-C-N 116.08 -0.509 . . . . 0.0 111.01 177.983 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 142' ' ' GLU . . . . . 0.48 ' HG3' ' O ' ' A' ' 138' ' ' ARG . 48.4 mt-10 -60.69 -39.33 88.08 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.113 -0.494 . . . . 0.0 110.657 178.976 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 143' ' ' ASN . . . . . . . . . . . . . 43.7 m-80 -83.97 3.09 35.77 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 115.782 -0.645 . . . . 0.0 110.622 179.555 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 144' ' ' ARG . . . . . . . . . . . . . 99.5 mtt180 60.87 28.66 18.42 Favored 'General case' 0 C--O 1.234 0.267 0 CA-C-N 115.423 -0.808 . . . . 0.0 111.762 174.014 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 145' ' ' ALA . . . . . . . . . . . . . . . -78.25 -37.77 44.43 Favored 'General case' 0 C--N 1.326 -0.428 0 CA-C-N 115.672 -0.694 . . . . 0.0 109.224 174.276 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 146' ' ' ILE . . . . . 0.65 ' O ' ' HA ' ' A' ' 141' ' ' ILE . 13.8 tt -144.73 140.26 23.47 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.626 0 CA-C-N 115.011 -0.995 . . . . 0.0 108.847 175.961 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 147' ' ' ASP . . . . . . . . . . . . . 31.6 t70 -117.1 46.12 1.74 Allowed 'General case' 0 C--N 1.318 -0.791 0 N-CA-C 108.75 -0.833 . . . . 0.0 108.75 178.53 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 148' ' ' PHE . . . . . . . . . . . . . 70.5 t80 -151.42 123.9 8.39 Favored 'General case' 0 C--N 1.322 -0.603 0 CA-C-N 114.851 -1.068 . . . . 0.0 109.321 -177.105 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 149' ' ' ASN . . . . . . . . . . . . . 49.0 t-20 -110.74 98.12 36.26 Favored Pre-proline 0 C--N 1.321 -0.634 0 N-CA-C 110.119 -0.326 . . . . 0.0 110.119 -179.354 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 150' ' ' PRO . . . . . . . . . . . . . 26.6 Cg_exo -62.37 -33.2 80.64 Favored 'Trans proline' 0 C--O 1.232 0.181 0 C-N-CA 122.689 2.259 . . . . 0.0 111.98 -179.335 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 151' ' ' ALA . . . . . . . . . . . . . . . -73.46 -18.11 61.16 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 115.988 -0.551 . . . . 0.0 111.386 -176.51 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 152' ' ' ASP . . . . . . . . . . . . . 34.6 t70 -72.49 -24.3 61.15 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-O 121.288 0.566 . . . . 0.0 110.234 179.216 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 153' ' ' TYR . . . . . . . . . . . . . 62.5 m-85 -89.91 -4.41 57.54 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-N 115.954 -0.567 . . . . 0.0 110.138 179.916 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 154' ' ' VAL . . . . . 0.521 HG21 ' HB ' ' A' ' 112' ' ' ILE . 60.3 t -89.67 139.11 18.01 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.544 0 CA-C-N 115.531 -0.759 . . . . 0.0 109.495 176.437 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 155' ' ' ARG . . . . . . . . . . . . . 15.9 ptt180 -124.58 155.55 38.9 Favored 'General case' 0 C--N 1.321 -0.648 0 C-N-CA 120.554 -0.458 . . . . 0.0 110.963 179.855 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 156' ' ' ILE . . . . . 0.424 ' HA ' ' HD3' ' A' ' 157' ' ' PRO . 2.4 mp -96.43 116.29 66.07 Favored Pre-proline 0 C--N 1.324 -0.51 0 CA-C-N 115.843 -0.617 . . . . 0.0 109.986 179.734 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 157' ' ' PRO . . . . . 0.424 ' HD3' ' HA ' ' A' ' 156' ' ' ILE . 14.2 Cg_exo -69.32 131.27 21.48 Favored 'Trans proline' 0 N--CA 1.456 -0.685 0 C-N-CA 122.591 2.194 . . . . 0.0 111.181 177.191 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 158' ' ' LYS . . . . . . . . . . . . . 64.5 mttp -80.36 -6.19 57.6 Favored 'General case' 0 C--N 1.325 -0.474 0 CA-C-N 116.513 -0.312 . . . . 0.0 110.334 179.681 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 159' ' ' ILE . . . . . . . . . . . . . 47.3 mm 72.46 -56.46 0.28 Allowed 'Isoleucine or valine' 0 N--CA 1.465 0.302 0 CA-C-N 115.556 -0.747 . . . . 0.0 111.295 -179.79 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 160' ' ' ALA . . . . . . . . . . . . . . . -76.73 84.41 3.35 Favored 'General case' 0 C--N 1.323 -0.582 0 CA-C-O 121.502 0.667 . . . . 0.0 110.761 179.083 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 161' ' ' LEU . . . . . . . . . . . . . 92.7 mt -105.99 -7.74 17.94 Favored 'General case' 0 C--N 1.312 -1.056 0 CA-C-N 114.825 -1.08 . . . . 0.0 109.349 175.854 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 162' ' ' GLU . . . . . . . . . . . . . 41.1 mt-10 66.41 173.38 0.24 Allowed 'General case' 0 C--O 1.236 0.379 0 CA-C-N 114.55 -1.205 . . . . 0.0 111.998 178.188 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 163' ' ' HIS . . . . . . . . . . . . . 32.2 m170 -108.19 128.17 54.48 Favored 'General case' 0 C--N 1.321 -0.634 0 CA-C-N 115.793 -0.64 . . . . 0.0 110.018 178.788 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 164' ' ' HIS . . . . . . . . . . . . . 30.1 m80 -94.7 118.28 31.48 Favored 'General case' 0 C--N 1.322 -0.615 0 CA-C-N 115.954 -0.566 . . . . 0.0 109.959 -176.712 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 165' ' ' HIS . . . . . . . . . . . . . 48.1 m80 -113.66 -54.79 2.58 Favored 'General case' 0 C--N 1.323 -0.58 0 CA-C-O 121.04 0.448 . . . . 0.0 110.257 -176.948 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 166' ' ' HIS . . . . . . . . . . . . . 32.6 m80 -100.92 -157.81 0.63 Allowed 'General case' 0 C--N 1.324 -0.518 0 CA-C-N 115.632 -0.713 . . . . 0.0 109.369 179.143 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 167' ' ' HIS . . . . . . . . . . . . . 33.3 m80 -74.55 78.6 1.96 Allowed 'General case' 0 C--N 1.327 -0.392 0 N-CA-C 109.23 -0.655 . . . . 0.0 109.23 175.31 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 168' ' ' HIS . . . . . . . . . . . . . 58.9 t-80 . . . . . 0 C--O 1.251 1.17 0 CA-C-O 118.29 -0.862 . . . . 0.0 109.202 -177.961 . . . . . . . . 0 0 . 1 . 012 nuclear nobuild full ' A' A ' 61' ' ' ARG . . . . . . . . . . . . . 59.5 mtp180 . . . . . 0 N--CA 1.48 1.025 0 CA-C-O 121.217 0.532 . . . . 0.0 110.801 . . . . . . . . . 0 0 . 1 . 012 nuclear nobuild full ' A' A ' 62' ' ' ASP . . . . . . . . . . . . . 5.2 p-10 -136.59 111.51 8.87 Favored 'General case' 0 C--N 1.321 -0.663 0 N-CA-C 108.593 -0.892 . . . . 0.0 108.593 171.041 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 63' ' ' SER . . . . . 0.596 ' HB2' ' HB2' ' A' ' 66' ' ' ASP . 5.5 m -119.45 149.49 41.78 Favored 'General case' 0 C--N 1.318 -0.803 0 N-CA-C 109.784 -0.451 . . . . 0.0 109.784 -179.448 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 64' ' ' PHE . . . . . 0.491 ' HB2' HD11 ' A' ' 107' ' ' ILE . 80.0 t80 -64.23 -50.37 68.28 Favored 'General case' 0 C--N 1.328 -0.365 0 N-CA-C 109.989 -0.374 . . . . 0.0 109.989 178.588 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 65' ' ' GLY . . . . . . . . . . . . . . . -62.87 -27.67 70.58 Favored Glycine 0 C--N 1.33 0.247 0 C-N-CA 120.816 -0.707 . . . . 0.0 112.193 177.378 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 66' ' ' ASP . . . . . 0.596 ' HB2' ' HB2' ' A' ' 63' ' ' SER . 8.1 t70 -62.68 -53.28 56.88 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-O 121.107 0.479 . . . . 0.0 110.34 177.692 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 67' ' ' TRP . . . . . . . . . . . . . 90.8 m95 -75.22 -27.26 59.47 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 115.788 -0.642 . . . . 0.0 111.256 -179.922 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 68' ' ' ALA . . . . . 0.557 ' O ' ' HG ' ' A' ' 72' ' ' LEU . . . -60.34 -48.54 81.33 Favored 'General case' 0 C--N 1.326 -0.419 0 N-CA-C 110.025 -0.361 . . . . 0.0 110.025 174.995 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 69' ' ' GLU . . . . . . . . . . . . . 17.8 tp10 -56.68 -44.06 81.07 Favored 'General case' 0 C--O 1.233 0.236 0 CA-C-N 115.885 -0.598 . . . . 0.0 110.527 175.358 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 70' ' ' LYS . . . . . . . . . . . . . 59.2 mttp -61.27 -45.1 95.91 Favored 'General case' 0 C--N 1.326 -0.416 0 CA-C-N 116.07 -0.514 . . . . 0.0 110.832 177.597 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 71' ' ' PHE . . . . . . . . . . . . . 69.8 t80 -66.04 -42.79 89.12 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.352 -0.385 . . . . 0.0 111.058 -178.974 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 72' ' ' LEU . . . . . 0.557 ' HG ' ' O ' ' A' ' 68' ' ' ALA . 88.6 mt -63.74 -49.94 71.05 Favored 'General case' 0 C--N 1.326 -0.417 0 CA-C-O 120.857 0.361 . . . . 0.0 110.667 179.805 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 73' ' ' LYS . . . . . . . . . . . . . 5.7 ttpm? -69.32 -32.32 71.36 Favored 'General case' 0 C--N 1.323 -0.548 0 CA-C-N 116.173 -0.467 . . . . 0.0 111.406 -175.653 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 74' ' ' SER . . . . . . . . . . . . . 37.9 p -71.04 -32.25 68.94 Favored 'General case' 0 C--N 1.328 -0.327 0 C-N-CA 120.628 -0.429 . . . . 0.0 110.216 175.955 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 75' ' ' LYS . . . . . 0.402 ' O ' HG22 ' A' ' 80' ' ' VAL . 39.5 mmtt -70.59 -35.92 73.27 Favored 'General case' 0 C--O 1.233 0.203 0 CA-C-O 120.801 0.334 . . . . 0.0 110.687 174.082 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 76' ' ' GLU . . . . . . . . . . . . . 33.9 tt0 -56.22 -44.8 79.9 Favored 'General case' 0 C--N 1.327 -0.403 0 CA-C-N 116.011 -0.54 . . . . 0.0 110.175 176.083 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 77' ' ' ALA . . . . . . . . . . . . . . . -80.96 -24.1 38.32 Favored 'General case' 0 C--N 1.326 -0.423 0 CA-C-N 115.818 -0.628 . . . . 0.0 111.276 177.417 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 78' ' ' ASP . . . . . . . . . . . . . 15.6 t70 -57.35 -54.6 45.03 Favored 'General case' 0 N--CA 1.466 0.343 0 CA-C-N 116.108 -0.496 . . . . 0.0 110.735 179.192 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 79' ' ' GLY . . . . . . . . . . . . . . . 146.52 56.37 0.02 OUTLIER Glycine 0 N--CA 1.443 -0.884 0 C-N-CA 120.335 -0.936 . . . . 0.0 112.656 178.2 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 80' ' ' VAL . . . . . 0.619 ' HB ' ' HB2' ' A' ' 84' ' ' GLN . 32.9 m -121.2 148.88 24.27 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.642 0 CA-C-O 120.763 0.316 . . . . 0.0 110.223 176.67 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 81' ' ' SER . . . . . . . . . . . . . 13.1 p -81.94 172.78 12.88 Favored 'General case' 0 C--N 1.319 -0.733 0 CA-C-N 116.146 -0.479 . . . . 0.0 110.076 176.789 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 82' ' ' VAL . . . . . . . . . . . . . 7.9 p -58.7 -40.08 78.38 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.47 0 CA-C-N 116.49 -0.323 . . . . 0.0 111.463 -176.178 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 83' ' ' SER . . . . . . . . . . . . . 13.7 t -62.86 -33.43 75.25 Favored 'General case' 0 C--N 1.331 -0.206 0 CA-C-O 120.623 0.249 . . . . 0.0 110.734 -178.631 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 84' ' ' GLN . . . . . 0.619 ' HB2' ' HB ' ' A' ' 80' ' ' VAL . 17.1 mm100 -68.35 -57.49 5.83 Favored 'General case' 0 C--N 1.332 -0.191 0 N-CA-C 109.896 -0.409 . . . . 0.0 109.896 177.464 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 85' ' ' LEU . . . . . 0.49 HD21 ' O ' ' A' ' 72' ' ' LEU . 0.2 OUTLIER -58.93 -39.87 82.86 Favored 'General case' 0 C--N 1.325 -0.462 0 CA-C-N 116.051 -0.522 . . . . 0.0 110.507 -176.618 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' A' A ' 86' ' ' ASN . . . . . . . . . . . . . 62.7 t30 -63.83 -35.67 81.38 Favored 'General case' 0 C--N 1.326 -0.453 0 CA-C-N 115.865 -0.607 . . . . 0.0 110.832 -179.486 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 87' ' ' SER . . . . . . . . . . . . . 75.9 p -78.55 -36.85 44.08 Favored 'General case' 0 CA--C 1.531 0.239 0 C-N-CA 121.033 -0.267 . . . . 0.0 111.143 178.448 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 88' ' ' TYR . . . . . . . . . . . . . 29.8 m-85 -56.6 -47.69 79.05 Favored 'General case' 0 N--CA 1.463 0.182 0 CA-C-O 121.381 0.61 . . . . 0.0 109.728 173.791 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 89' ' ' LYS . . . . . 0.434 ' HB2' ' HE2' ' A' ' 89' ' ' LYS . 21.9 ttmm -64.64 -41.81 95.9 Favored 'General case' 0 C--N 1.327 -0.392 0 CA-C-N 115.173 -0.921 . . . . 0.0 110.554 178.859 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 90' ' ' ASN . . . . . . . . . . . . . 20.3 t30 -53.41 -50.02 66.04 Favored 'General case' 0 C--O 1.237 0.427 0 CA-C-O 120.945 0.402 . . . . 0.0 111.094 177.831 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 91' ' ' TYR . . . . . 0.423 ' O ' ' HB2' ' A' ' 95' ' ' HIS . 34.0 m-85 -60.39 -48.97 79.46 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.335 -0.393 . . . . 0.0 111.112 179.599 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 92' ' ' CYS . . . . . 0.554 ' HA ' ' HB2' ' A' ' 96' ' ' LEU . 51.2 t -71.14 -24.99 62.37 Favored 'General case' 0 C--N 1.324 -0.532 0 CA-C-O 120.878 0.37 . . . . 0.0 111.609 -176.299 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 93' ' ' ARG . . . . . 0.413 ' O ' ' HB3' ' A' ' 97' ' ' SER . 37.5 ttt180 -77.31 -52.24 9.52 Favored 'General case' 0 C--N 1.324 -0.512 0 CA-C-N 116.371 -0.377 . . . . 0.0 111.844 -174.951 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 94' ' ' ASN . . . . . . . . . . . . . 3.5 t-20 -103.65 -36.45 7.9 Favored 'General case' 0 C--N 1.33 -0.269 0 C-N-CA 120.937 -0.305 . . . . 0.0 111.812 -175.211 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 95' ' ' HIS . . . . . 0.423 ' HB2' ' O ' ' A' ' 91' ' ' TYR . 42.6 m80 -85.71 -21.14 28.44 Favored 'General case' 0 C--N 1.322 -0.605 0 C-N-CA 120.688 -0.405 . . . . 0.0 111.344 -175.544 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 96' ' ' LEU . . . . . 0.554 ' HB2' ' HA ' ' A' ' 92' ' ' CYS . 89.7 mt -117.66 24.52 11.02 Favored 'General case' 0 C--N 1.324 -0.511 0 CA-C-O 121.124 0.487 . . . . 0.0 110.173 177.123 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 97' ' ' SER . . . . . 0.587 ' OG ' ' HD3' ' A' ' 98' ' ' PRO . 8.1 p -61.16 -43.12 89.37 Favored Pre-proline 0 CA--C 1.541 0.63 0 N-CA-C 113.272 0.841 . . . . 0.0 113.272 -177.548 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 98' ' ' PRO . . . . . 0.587 ' HD3' ' OG ' ' A' ' 97' ' ' SER . 17.5 Cg_exo -66.9 -15.06 46.02 Favored 'Trans proline' 0 C--N 1.361 1.208 0 C-N-CA 121.711 1.607 . . . . 0.0 112.028 -179.924 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 99' ' ' LEU . . . . . 0.405 HD12 HD22 ' A' ' 96' ' ' LEU . 49.9 mt -98.33 -33.69 10.97 Favored 'General case' 0 C--N 1.324 -0.501 0 CA-C-N 115.942 -0.572 . . . . 0.0 110.575 -178.835 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 100' ' ' TYR . . . . . . . . . . . . . 45.0 t80 -53.94 -43.44 69.81 Favored 'General case' 0 N--CA 1.465 0.279 0 CA-C-N 115.931 -0.577 . . . . 0.0 111.956 -175.434 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 101' ' ' MET . . . . . . . . . . . . . 0.7 OUTLIER -80.18 -16.13 55.51 Favored 'General case' 0 C--N 1.328 -0.335 0 N-CA-C 112.175 0.435 . . . . 0.0 112.175 -176.601 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 102' ' ' LYS . . . . . . . . . . . . . 95.4 mttt -88.95 153.64 20.87 Favored 'General case' 0 C--N 1.325 -0.5 0 CA-C-O 121.204 0.526 . . . . 0.0 110.975 -176.731 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 103' ' ' SER . . . . . 0.603 ' HB2' ' CG ' ' A' ' 106' ' ' GLU . 3.1 m -69.69 148.09 49.71 Favored 'General case' 0 C--N 1.324 -0.521 0 CA-C-N 115.651 -0.704 . . . . 0.0 109.174 175.003 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 104' ' ' LEU . . . . . . . . . . . . . 25.1 tp -59.87 -55.37 34.99 Favored 'General case' 0 C--N 1.323 -0.548 0 CA-C-O 120.803 0.335 . . . . 0.0 111.582 -171.466 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 105' ' ' SER . . . . . . . . . . . . . 34.4 t -73.09 -11.87 60.7 Favored 'General case' 0 C--N 1.325 -0.465 0 CA-C-N 116.212 -0.449 . . . . 0.0 111.45 -176.741 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 106' ' ' GLU . . . . . 0.603 ' CG ' ' HB2' ' A' ' 103' ' ' SER . 6.6 mm-40 -88.29 -15.55 35.48 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-O 120.686 0.279 . . . . 0.0 110.657 -178.465 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 107' ' ' ILE . . . . . 0.531 HG13 ' O ' ' A' ' 103' ' ' SER . 81.5 mt -69.78 129.27 34.05 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.376 0 CA-C-N 116.246 -0.433 . . . . 0.0 110.691 -179.49 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 108' ' ' LEU . . . . . . . . . . . . . 65.6 mt -88.3 146.01 37.04 Favored Pre-proline 0 C--N 1.322 -0.618 0 CA-C-N 115.916 -0.583 . . . . 0.0 109.871 178.267 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 109' ' ' PRO . . . . . . . . . . . . . 52.6 Cg_exo -55.38 -31.05 75.79 Favored 'Trans proline' 0 N--CA 1.463 -0.318 0 C-N-CA 122.184 1.923 . . . . 0.0 111.123 173.387 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 110' ' ' ALA . . . . . . . . . . . . . . . -60.98 -37.93 84.21 Favored 'General case' 0 N--CA 1.453 -0.287 0 CA-C-N 115.342 -0.844 . . . . 0.0 111.434 178.319 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 111' ' ' ASP . . . . . 0.432 ' O ' HG13 ' A' ' 115' ' ' ILE . 5.9 m-20 -58.46 -56.58 20.24 Favored 'General case' 0 N--CA 1.466 0.329 0 CA-C-O 120.9 0.381 . . . . 0.0 110.999 -179.247 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 112' ' ' ILE . . . . . . . . . . . . . 18.6 mt -65.43 -43.35 94.66 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.514 0 CA-C-N 115.578 -0.737 . . . . 0.0 110.684 -176.332 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 113' ' ' GLN . . . . . 0.473 ' HA ' HG13 ' A' ' 154' ' ' VAL . 24.7 tp60 -61.96 -40.95 97.32 Favored 'General case' 0 C--N 1.332 -0.195 0 CA-C-N 116.227 -0.442 . . . . 0.0 110.524 -179.927 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 114' ' ' SER . . . . . 0.429 ' O ' ' HG2' ' A' ' 118' ' ' GLU . 48.3 t -59.42 -46.22 89.33 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.088 -0.505 . . . . 0.0 110.492 178.194 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 115' ' ' ILE . . . . . 0.432 HG13 ' O ' ' A' ' 111' ' ' ASP . 79.2 mt -58.87 -57.63 10.37 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.224 0 CA-C-N 116.162 -0.472 . . . . 0.0 110.683 179.812 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 116' ' ' ILE . . . . . . . . . . . . . 47.3 mm -57.86 -38.48 66.22 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.371 0 CA-C-N 116.196 -0.456 . . . . 0.0 111.55 -177.51 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 117' ' ' ASN . . . . . . . . . . . . . 7.8 t30 -65.93 -38.32 88.35 Favored 'General case' 0 C--N 1.327 -0.384 0 CA-C-N 116.457 -0.338 . . . . 0.0 111.707 -175.452 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 118' ' ' GLU . . . . . 0.429 ' HG2' ' O ' ' A' ' 114' ' ' SER . 11.0 pt-20 -96.43 -12.41 24.28 Favored 'General case' 0 C--N 1.33 -0.279 0 N-CA-C 112.239 0.459 . . . . 0.0 112.239 -176.255 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 119' ' ' THR . . . . . . . . . . . . . 90.3 m -68.95 113.7 6.59 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-O 121.259 0.552 . . . . 0.0 110.103 177.98 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 120' ' ' LYS . . . . . . . . . . . . . 47.9 mttp -93.8 81.28 4.22 Favored 'General case' 0 C--N 1.322 -0.618 0 CA-C-N 115.726 -0.67 . . . . 0.0 110.429 -174.924 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 121' ' ' LEU . . . . . . . . . . . . . 85.2 mt -133.86 -175.48 3.85 Favored 'General case' 0 C--N 1.325 -0.499 0 CA-C-N 115.308 -0.86 . . . . 0.0 109.695 179.825 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 122' ' ' ALA . . . . . . . . . . . . . . . -71.78 158.3 36.36 Favored 'General case' 0 C--N 1.325 -0.489 0 CA-C-O 120.83 0.348 . . . . 0.0 111.097 -179.045 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 123' ' ' LYS . . . . . . . . . . . . . 54.9 mtpt -60.04 -40.2 88.54 Favored 'General case' 0 C--N 1.33 -0.244 0 CA-C-N 115.858 -0.61 . . . . 0.0 111.3 -176.08 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 124' ' ' ASN . . . . . . . . . . . . . 20.4 p-10 -73.36 -30.52 63.36 Favored 'General case' 0 C--N 1.326 -0.442 0 CA-C-N 116.077 -0.51 . . . . 0.0 110.726 -179.76 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 125' ' ' THR . . . . . 0.403 ' O ' HG13 ' A' ' 129' ' ' ILE . 8.0 m -70.5 -41.17 73.02 Favored 'General case' 0 C--N 1.323 -0.578 0 CA-C-N 116.326 -0.397 . . . . 0.0 110.623 178.982 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 126' ' ' LEU . . . . . . . . . . . . . 91.1 mt -61.74 -44.02 97.71 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 116.105 -0.498 . . . . 0.0 110.675 178.348 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 127' ' ' LYS . . . . . 0.629 ' HG2' HG13 ' A' ' 156' ' ' ILE . 87.8 mttt -64.45 -39.0 92.99 Favored 'General case' 0 C--N 1.331 -0.213 0 CA-C-N 116.126 -0.488 . . . . 0.0 111.005 178.985 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 128' ' ' ALA . . . . . . . . . . . . . . . -58.32 -44.41 88.62 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.276 -0.42 . . . . 0.0 110.895 -179.874 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 129' ' ' ILE . . . . . 0.403 HG13 ' O ' ' A' ' 125' ' ' THR . 65.2 mt -61.97 -47.81 91.45 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.37 0 CA-C-N 115.86 -0.609 . . . . 0.0 110.446 179.024 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 130' ' ' ARG . . . . . 0.415 HH11 ' HD2' ' A' ' 130' ' ' ARG . 10.4 ttp180 -64.95 -43.82 91.46 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 115.864 -0.607 . . . . 0.0 110.952 -178.188 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 131' ' ' ASN . . . . . . . . . . . . . 9.9 t30 -62.12 -44.56 96.38 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.421 -0.354 . . . . 0.0 111.084 -179.317 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 132' ' ' THR . . . . . 0.485 ' O ' HG13 ' A' ' 136' ' ' ILE . 35.8 m -58.17 -48.22 80.98 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.268 -0.424 . . . . 0.0 110.292 178.844 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 133' ' ' ALA . . . . . . . . . . . . . . . -65.1 -38.83 91.98 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.131 -0.486 . . . . 0.0 110.991 178.905 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 134' ' ' SER . . . . . 0.443 ' HA ' ' HB3' ' A' ' 151' ' ' ALA . 18.5 t -61.76 -41.92 98.31 Favored 'General case' 0 C--N 1.327 -0.393 0 CA-C-N 116.048 -0.524 . . . . 0.0 110.622 -179.199 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 135' ' ' GLN . . . . . . . . . . . . . 49.7 mt-30 -66.8 -31.0 71.35 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 116.544 -0.298 . . . . 0.0 111.322 178.101 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 136' ' ' ILE . . . . . 0.485 HG13 ' O ' ' A' ' 132' ' ' THR . 76.1 mt -65.95 -50.93 66.44 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.225 0 CA-C-O 120.807 0.337 . . . . 0.0 110.202 176.761 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 137' ' ' PHE . . . . . 0.491 ' O ' HG13 ' A' ' 141' ' ' ILE . 66.0 m-85 -62.7 -37.46 86.57 Favored 'General case' 0 C--N 1.331 -0.213 0 CA-C-N 116.279 -0.418 . . . . 0.0 110.539 176.431 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 138' ' ' ARG . . . . . . . . . . . . . 26.5 ttp85 -60.1 -44.28 94.94 Favored 'General case' 0 N--CA 1.45 -0.469 0 CA-C-N 116.11 -0.496 . . . . 0.0 110.549 178.88 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 139' ' ' LEU . . . . . . . . . . . . . 65.9 tp -60.29 -34.92 74.44 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 115.678 -0.692 . . . . 0.0 110.562 177.87 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 140' ' ' ALA . . . . . 0.481 ' HB1' ' HB3' ' A' ' 145' ' ' ALA . . . -72.62 -34.65 67.48 Favored 'General case' 0 C--N 1.323 -0.579 0 CA-C-N 115.975 -0.557 . . . . 0.0 110.868 178.512 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 141' ' ' ILE . . . . . 0.562 ' HA ' ' O ' ' A' ' 146' ' ' ILE . 81.7 mt -60.31 -49.96 82.18 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.235 0 CA-C-N 116.708 -0.224 . . . . 0.0 111.281 176.982 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 142' ' ' GLU . . . . . . . . . . . . . 14.9 pt-20 -70.08 -18.78 63.28 Favored 'General case' 0 N--CA 1.464 0.252 0 CA-C-O 120.943 0.402 . . . . 0.0 111.298 -179.216 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 143' ' ' ASN . . . . . . . . . . . . . 20.8 m-80 -97.74 6.22 48.18 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.37 -0.377 . . . . 0.0 110.515 175.32 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 144' ' ' ARG . . . . . . . . . . . . . 44.7 mtt180 60.1 32.45 20.97 Favored 'General case' 0 N--CA 1.464 0.26 0 CA-C-N 115.65 -0.705 . . . . 0.0 112.037 173.966 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 145' ' ' ALA . . . . . 0.481 ' HB3' ' HB1' ' A' ' 140' ' ' ALA . . . -88.4 -32.09 18.51 Favored 'General case' 0 C--N 1.324 -0.524 0 CA-C-O 121.073 0.463 . . . . 0.0 109.754 175.009 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 146' ' ' ILE . . . . . 0.562 ' O ' ' HA ' ' A' ' 141' ' ' ILE . 16.5 tt -143.11 144.5 23.81 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.444 0 CA-C-N 115.32 -0.854 . . . . 0.0 108.882 176.293 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 147' ' ' ASP . . . . . . . . . . . . . 34.6 t70 -96.89 -0.45 47.67 Favored 'General case' 0 C--N 1.323 -0.551 0 CA-C-O 120.953 0.406 . . . . 0.0 111.887 -172.823 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 148' ' ' PHE . . . . . 0.453 ' H ' HG12 ' A' ' 146' ' ' ILE . 46.7 p90 -144.43 163.28 34.27 Favored 'General case' 0 C--N 1.324 -0.52 0 O-C-N 122.026 -0.421 . . . . 0.0 111.07 -175.949 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 149' ' ' ASN . . . . . 0.505 ' HB2' HD11 ' A' ' 141' ' ' ILE . 47.1 t-20 -120.67 89.84 45.36 Favored Pre-proline 0 C--N 1.328 -0.365 0 CA-C-N 116.24 -0.436 . . . . 0.0 110.394 -177.492 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 150' ' ' PRO . . . . . . . . . . . . . 35.9 Cg_endo -66.15 -22.08 54.69 Favored 'Trans proline' 0 C--N 1.343 0.246 0 C-N-CA 122.59 2.193 . . . . 0.0 112.173 -178.223 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 151' ' ' ALA . . . . . 0.443 ' HB3' ' HA ' ' A' ' 134' ' ' SER . . . -70.75 -30.66 67.22 Favored 'General case' 0 C--N 1.327 -0.399 0 CA-C-N 116.269 -0.423 . . . . 0.0 110.553 179.694 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 152' ' ' ASP . . . . . . . . . . . . . 9.3 t70 -77.81 -15.29 59.19 Favored 'General case' 0 C--N 1.329 -0.306 0 N-CA-C 109.195 -0.669 . . . . 0.0 109.195 178.561 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 153' ' ' TYR . . . . . . . . . . . . . 73.3 t80 -83.18 -16.44 46.58 Favored 'General case' 0 C--N 1.327 -0.411 0 CA-C-N 115.656 -0.702 . . . . 0.0 109.453 177.396 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 154' ' ' VAL . . . . . 0.473 HG13 ' HA ' ' A' ' 113' ' ' GLN . 63.2 t -71.83 136.26 26.13 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.422 0 CA-C-N 115.724 -0.671 . . . . 0.0 110.006 177.474 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 155' ' ' ARG . . . . . 0.424 HH11 ' HD2' ' A' ' 155' ' ' ARG . 40.4 mtt180 -98.43 141.43 31.31 Favored 'General case' 0 C--N 1.322 -0.627 0 CA-C-N 115.838 -0.619 . . . . 0.0 111.167 -177.535 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 156' ' ' ILE . . . . . 0.629 HG13 ' HG2' ' A' ' 127' ' ' LYS . 46.8 mm -98.22 107.27 40.51 Favored Pre-proline 0 C--N 1.321 -0.672 0 N-CA-C 108.593 -0.891 . . . . 0.0 108.593 170.922 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 157' ' ' PRO . . . . . . . . . . . . . 58.8 Cg_endo -75.19 129.39 12.13 Favored 'Trans proline' 0 N--CA 1.451 -0.976 0 C-N-CA 121.281 1.321 . . . . 0.0 113.288 -173.754 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 158' ' ' LYS . . . . . . . . . . . . . 12.4 ptmm? -127.36 19.97 6.82 Favored 'General case' 0 C--N 1.319 -0.73 0 N-CA-C 107.179 -1.415 . . . . 0.0 107.179 171.054 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 159' ' ' ILE . . . . . . . . . . . . . 0.2 OUTLIER -105.62 -22.94 4.64 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.588 0 CA-C-N 112.959 -1.928 . . . . 0.0 110.18 -175.057 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 160' ' ' ALA . . . . . . . . . . . . . . . -78.5 -173.29 3.28 Favored 'General case' 0 C--N 1.326 -0.449 0 CA-C-N 115.549 -0.751 . . . . 0.0 111.475 -175.326 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 161' ' ' LEU . . . . . . . . . . . . . 92.0 mt -56.99 122.43 12.28 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 115.756 -0.657 . . . . 0.0 110.468 176.724 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 162' ' ' GLU . . . . . . . . . . . . . 46.2 mt-10 -81.42 169.87 16.66 Favored 'General case' 0 C--N 1.325 -0.499 0 CA-C-O 121.271 0.558 . . . . 0.0 111.043 -179.93 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 163' ' ' HIS . . . . . . . . . . . . . 26.4 p80 -70.92 168.17 17.5 Favored 'General case' 0 C--N 1.326 -0.428 0 CA-C-N 115.425 -0.807 . . . . 0.0 111.833 -176.131 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 164' ' ' HIS . . . . . 0.57 ' O ' ' HB2' ' A' ' 165' ' ' HIS . 6.3 p80 -55.91 136.32 51.69 Favored 'General case' 0 C--O 1.235 0.317 0 CA-C-N 115.789 -0.641 . . . . 0.0 109.469 170.897 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 165' ' ' HIS . . . . . 0.57 ' HB2' ' O ' ' A' ' 164' ' ' HIS . 20.3 m170 79.62 138.73 0.07 Allowed 'General case' 0 N--CA 1.47 0.567 0 O-C-N 124.223 0.952 . . . . 0.0 110.055 -172.537 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 166' ' ' HIS . . . . . . . . . . . . . 35.8 t-80 72.24 93.02 0.08 Allowed 'General case' 0 C--N 1.329 -0.314 0 O-C-N 124.1 0.875 . . . . 0.0 110.109 -172.403 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 167' ' ' HIS . . . . . . . . . . . . . 78.1 m-70 -89.99 120.55 31.3 Favored 'General case' 0 C--N 1.323 -0.556 0 CA-C-N 115.692 -0.685 . . . . 0.0 110.113 179.649 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 168' ' ' HIS . . . . . . . . . . . . . 17.0 t-80 . . . . . 0 C--O 1.246 0.92 0 CA-C-O 118.477 -0.773 . . . . 0.0 109.614 -176.303 . . . . . . . . 0 0 . 1 . 013 nuclear nobuild full ' A' A ' 61' ' ' ARG . . . . . . . . . . . . . 36.8 ttm180 . . . . . 0 N--CA 1.478 0.939 0 N-CA-C 109.83 -0.433 . . . . 0.0 109.83 . . . . . . . . . 0 0 . 1 . 013 nuclear nobuild full ' A' A ' 62' ' ' ASP . . . . . . . . . . . . . 8.3 m-20 -112.62 -175.92 2.79 Favored 'General case' 0 C--N 1.324 -0.517 0 CA-C-N 116.062 -0.517 . . . . 0.0 110.803 -177.643 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 63' ' ' SER . . . . . 0.599 ' HA ' ' HA ' ' A' ' 103' ' ' SER . 18.7 m -93.89 158.4 15.66 Favored 'General case' 0 C--O 1.242 0.693 0 CA-C-N 115.824 -0.625 . . . . 0.0 111.177 -177.461 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 64' ' ' PHE . . . . . 0.433 ' HB2' HD11 ' A' ' 107' ' ' ILE . 79.5 t80 -60.01 -37.18 78.97 Favored 'General case' 0 C--N 1.325 -0.484 0 CA-C-N 115.206 -0.906 . . . . 0.0 110.32 179.479 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 65' ' ' GLY . . . . . . . . . . . . . . . -58.19 -40.83 94.33 Favored Glycine 0 N--CA 1.451 -0.305 0 C-N-CA 121.145 -0.55 . . . . 0.0 112.692 177.606 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 66' ' ' ASP . . . . . . . . . . . . . 7.3 m-20 -59.9 -53.2 60.62 Favored 'General case' 0 C--O 1.236 0.357 0 CA-C-O 121.375 0.607 . . . . 0.0 110.756 179.04 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 67' ' ' TRP . . . . . 0.424 ' CE3' ' HD3' ' A' ' 70' ' ' LYS . 87.4 m95 -76.91 -23.25 52.52 Favored 'General case' 0 C--N 1.325 -0.494 0 CA-C-N 115.614 -0.721 . . . . 0.0 111.955 -175.804 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 68' ' ' ALA . . . . . 0.597 ' O ' ' HG ' ' A' ' 72' ' ' LEU . . . -63.51 -48.59 76.95 Favored 'General case' 0 C--N 1.325 -0.473 0 CA-C-O 120.837 0.351 . . . . 0.0 110.573 175.969 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 69' ' ' GLU . . . . . 0.515 ' HA ' HD12 ' A' ' 72' ' ' LEU . 26.4 mt-10 -74.2 -22.12 59.52 Favored 'General case' 0 C--N 1.327 -0.375 0 CA-C-N 116.469 -0.332 . . . . 0.0 110.939 -179.965 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 70' ' ' LYS . . . . . 0.424 ' HD3' ' CE3' ' A' ' 67' ' ' TRP . 60.9 tttp -68.19 -41.81 80.87 Favored 'General case' 0 C--N 1.326 -0.43 0 N-CA-C 109.568 -0.53 . . . . 0.0 109.568 172.637 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 71' ' ' PHE . . . . . . . . . . . . . 61.9 t80 -61.61 -44.09 97.65 Favored 'General case' 0 N--CA 1.454 -0.251 0 CA-C-N 116.038 -0.528 . . . . 0.0 109.935 174.2 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 72' ' ' LEU . . . . . 0.597 ' HG ' ' O ' ' A' ' 68' ' ' ALA . 87.3 mt -56.87 -43.96 81.74 Favored 'General case' 0 C--N 1.327 -0.38 0 CA-C-N 116.162 -0.472 . . . . 0.0 110.361 176.802 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 73' ' ' LYS . . . . . . . . . . . . . 24.8 ttmm -64.49 -37.08 86.29 Favored 'General case' 0 C--N 1.326 -0.422 0 CA-C-N 115.763 -0.653 . . . . 0.0 111.207 -179.358 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 74' ' ' SER . . . . . . . . . . . . . 96.8 p -68.89 -34.13 74.92 Favored 'General case' 0 C--O 1.226 -0.181 0 C-N-CA 120.588 -0.445 . . . . 0.0 110.458 179.288 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 75' ' ' LYS . . . . . 0.659 ' HE2' ' HA ' ' A' ' 75' ' ' LYS . 11.3 mmpt? -70.04 -39.47 75.72 Favored 'General case' 0 C--O 1.233 0.189 0 CA-C-O 121.117 0.484 . . . . 0.0 109.989 175.589 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 76' ' ' GLU . . . . . . . . . . . . . 33.2 tt0 -57.17 -46.05 83.13 Favored 'General case' 0 C--N 1.324 -0.517 0 CA-C-N 115.222 -0.899 . . . . 0.0 110.867 177.394 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 77' ' ' ALA . . . . . . . . . . . . . . . -80.31 -20.07 45.15 Favored 'General case' 0 C--N 1.323 -0.567 0 CA-C-N 115.762 -0.654 . . . . 0.0 111.518 179.638 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 78' ' ' ASP . . . . . . . . . . . . . 20.6 t70 -68.22 -53.22 26.3 Favored 'General case' 0 C--N 1.327 -0.384 0 CA-C-O 121.003 0.43 . . . . 0.0 110.604 -179.894 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 79' ' ' GLY . . . . . . . . . . . . . . . 137.51 65.77 0.05 OUTLIER Glycine 0 N--CA 1.447 -0.595 0 C-N-CA 120.518 -0.848 . . . . 0.0 112.42 179.539 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 80' ' ' VAL . . . . . . . . . . . . . 35.0 m -121.69 150.19 24.94 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.558 0 CA-C-O 120.737 0.303 . . . . 0.0 110.407 177.253 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 81' ' ' SER . . . . . . . . . . . . . 45.9 t -76.09 168.57 19.8 Favored 'General case' 0 C--N 1.324 -0.501 0 CA-C-N 116.398 -0.365 . . . . 0.0 110.252 179.02 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 82' ' ' VAL . . . . . . . . . . . . . 67.4 t -56.87 -51.07 72.54 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.215 0 CA-C-N 116.381 -0.372 . . . . 0.0 110.782 -178.657 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 83' ' ' SER . . . . . . . . . . . . . 14.9 m -59.73 -28.07 67.03 Favored 'General case' 0 C--N 1.327 -0.381 0 CA-C-N 116.361 -0.381 . . . . 0.0 111.358 -178.912 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 84' ' ' GLN . . . . . . . . . . . . . 6.5 tp-100 -80.48 -48.18 13.19 Favored 'General case' 0 C--N 1.327 -0.38 0 CA-C-O 120.824 0.345 . . . . 0.0 110.458 -179.328 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 85' ' ' LEU . . . . . . . . . . . . . 51.2 tp -64.55 -42.36 95.75 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-O 121.105 0.479 . . . . 0.0 110.229 178.738 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 86' ' ' ASN . . . . . . . . . . . . . 50.2 t30 -63.42 -33.9 76.56 Favored 'General case' 0 C--N 1.325 -0.457 0 CA-C-N 115.626 -0.715 . . . . 0.0 110.062 177.627 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 87' ' ' SER . . . . . . . . . . . . . 9.1 t -63.31 -45.19 92.46 Favored 'General case' 0 C--N 1.329 -0.283 0 N-CA-C 109.634 -0.506 . . . . 0.0 109.634 175.7 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 88' ' ' TYR . . . . . . . . . . . . . 18.5 m-85 -58.88 -43.61 90.96 Favored 'General case' 0 C--O 1.234 0.289 0 CA-C-N 116.465 -0.334 . . . . 0.0 110.531 176.708 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 89' ' ' LYS . . . . . 0.591 ' HG2' HD13 ' A' ' 72' ' ' LEU . 67.5 mttm -60.59 -42.35 96.57 Favored 'General case' 0 C--N 1.332 -0.163 0 CA-C-N 116.138 -0.483 . . . . 0.0 110.398 176.983 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 90' ' ' ASN . . . . . . . . . . . . . 26.3 t30 -56.95 -44.84 82.98 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.002 -0.545 . . . . 0.0 111.17 178.144 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 91' ' ' TYR . . . . . . . . . . . . . 63.3 m-85 -63.52 -49.2 74.47 Favored 'General case' 0 C--N 1.325 -0.458 0 C-N-CA 120.891 -0.323 . . . . 0.0 111.094 179.384 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 92' ' ' CYS . . . . . 0.471 ' HA ' HD12 ' A' ' 96' ' ' LEU . 58.6 m -65.88 -42.54 90.21 Favored 'General case' 0 C--N 1.326 -0.443 0 CA-C-O 121.064 0.459 . . . . 0.0 111.574 -177.308 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 93' ' ' ARG . . . . . . . . . . . . . 10.0 ttt180 -82.35 -51.06 8.24 Favored 'General case' 0 C--N 1.323 -0.553 0 N-CA-C 112.434 0.531 . . . . 0.0 112.434 -174.353 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 94' ' ' ASN . . . . . . . . . . . . . 31.9 t30 -89.53 -40.5 12.6 Favored 'General case' 0 C--N 1.325 -0.475 0 N-CA-C 112.121 0.415 . . . . 0.0 112.121 -172.04 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 95' ' ' HIS . . . . . . . . . . . . . 82.4 m-70 -85.46 -34.38 21.66 Favored 'General case' 0 C--N 1.322 -0.629 0 O-C-N 122.056 -0.402 . . . . 0.0 111.435 -176.755 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 96' ' ' LEU . . . . . 0.472 HD22 HD22 ' A' ' 99' ' ' LEU . 86.9 mt -106.46 27.07 9.13 Favored 'General case' 0 C--N 1.323 -0.574 0 CA-C-N 116.374 -0.376 . . . . 0.0 111.164 -176.647 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 97' ' ' SER . . . . . 0.444 ' N ' ' HD2' ' A' ' 98' ' ' PRO . 15.3 m -46.92 -53.05 29.04 Favored Pre-proline 0 CA--C 1.541 0.608 0 N-CA-C 112.715 0.635 . . . . 0.0 112.715 -178.985 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 98' ' ' PRO . . . . . 0.444 ' HD2' ' N ' ' A' ' 97' ' ' SER . 38.0 Cg_endo -66.44 -20.82 54.24 Favored 'Trans proline' 0 C--N 1.356 0.954 0 C-N-CA 121.936 1.757 . . . . 0.0 113.285 -178.185 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 99' ' ' LEU . . . . . 0.571 HD21 HG12 ' A' ' 112' ' ' ILE . 11.2 mp -88.89 -27.79 20.76 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-O 120.903 0.383 . . . . 0.0 110.476 -179.559 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 100' ' ' TYR . . . . . . . . . . . . . 5.9 t80 -57.76 -31.75 66.8 Favored 'General case' 0 C--N 1.325 -0.472 0 CA-C-N 115.541 -0.754 . . . . 0.0 111.394 -174.962 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 101' ' ' MET . . . . . . . . . . . . . 66.3 mtt -102.17 14.05 33.01 Favored 'General case' 0 C--N 1.327 -0.394 0 CA-C-N 116.217 -0.447 . . . . 0.0 111.334 -178.447 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 102' ' ' LYS . . . . . . . . . . . . . 96.5 mttt -103.26 151.11 23.05 Favored 'General case' 0 C--N 1.326 -0.422 0 N-CA-C 110.136 -0.32 . . . . 0.0 110.136 176.825 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 103' ' ' SER . . . . . 0.599 ' HA ' ' HA ' ' A' ' 63' ' ' SER . 46.6 t -75.85 161.41 29.02 Favored 'General case' 0 C--N 1.322 -0.588 0 N-CA-C 109.084 -0.71 . . . . 0.0 109.084 171.296 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 104' ' ' LEU . . . . . 0.42 ' HB3' HD12 ' A' ' 146' ' ' ILE . 90.3 mt -58.91 -28.93 66.66 Favored 'General case' 0 C--N 1.323 -0.56 0 CA-C-O 121.041 0.448 . . . . 0.0 110.613 179.208 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 105' ' ' SER . . . . . . . . . . . . . 26.4 t -87.97 -7.57 56.91 Favored 'General case' 0 CA--C 1.534 0.357 0 CA-C-N 115.98 -0.555 . . . . 0.0 111.472 -179.269 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 106' ' ' GLU . . . . . 0.528 ' HG3' ' HB3' ' A' ' 103' ' ' SER . 45.2 mt-10 -96.67 -6.38 36.68 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-O 120.792 0.33 . . . . 0.0 111.049 -177.553 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 107' ' ' ILE . . . . . 0.433 HD11 ' HB2' ' A' ' 64' ' ' PHE . 72.4 mt -93.89 122.23 45.2 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.594 0 CA-C-O 120.972 0.415 . . . . 0.0 110.778 -176.963 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 108' ' ' LEU . . . . . 0.428 ' HB2' ' HB2' ' A' ' 111' ' ' ASP . 86.4 mt -96.72 143.79 26.72 Favored Pre-proline 0 C--N 1.326 -0.445 0 CA-C-N 115.944 -0.571 . . . . 0.0 110.641 -178.88 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 109' ' ' PRO . . . . . 0.603 ' HB3' ' HB2' ' A' ' 153' ' ' TYR . 50.2 Cg_exo -55.31 -45.33 40.95 Favored 'Trans proline' 0 CA--C 1.531 0.374 0 C-N-CA 122.81 2.34 . . . . 0.0 112.378 176.823 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 110' ' ' ALA . . . . . . . . . . . . . . . -69.34 -25.11 64.04 Favored 'General case' 0 C--N 1.332 -0.186 0 CA-C-N 116.497 -0.32 . . . . 0.0 111.134 -179.46 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 111' ' ' ASP . . . . . 0.428 ' HB2' ' HB2' ' A' ' 108' ' ' LEU . 38.2 t70 -65.99 -45.14 82.7 Favored 'General case' 0 C--N 1.326 -0.437 0 CA-C-O 121.131 0.491 . . . . 0.0 109.785 179.309 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 112' ' ' ILE . . . . . 0.571 HG12 HD21 ' A' ' 99' ' ' LEU . 19.2 mt -69.14 -39.95 79.98 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.295 0 CA-C-N 115.752 -0.658 . . . . 0.0 110.071 176.557 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 113' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -58.18 -43.22 87.4 Favored 'General case' 0 C--N 1.331 -0.215 0 CA-C-N 115.892 -0.595 . . . . 0.0 109.89 178.877 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 114' ' ' SER . . . . . . . . . . . . . 40.8 t -56.12 -50.25 71.63 Favored 'General case' 0 C--N 1.331 -0.231 0 CA-C-N 116.039 -0.528 . . . . 0.0 110.226 177.052 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 115' ' ' ILE . . . . . . . . . . . . . 67.1 mt -58.15 -44.44 87.59 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.193 0 CA-C-N 116.372 -0.376 . . . . 0.0 111.002 179.309 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 116' ' ' ILE . . . . . 0.411 HG12 ' O ' ' A' ' 112' ' ' ILE . 47.3 mm -62.81 -41.35 92.17 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.326 0 CA-C-O 120.821 0.343 . . . . 0.0 111.1 -179.93 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 117' ' ' ASN . . . . . . . . . . . . . 8.4 t30 -69.98 -33.67 72.37 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-N 116.391 -0.368 . . . . 0.0 111.165 -179.251 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 118' ' ' GLU . . . . . . . . . . . . . 28.3 mm-40 -80.1 -21.94 42.74 Favored 'General case' 0 C--N 1.327 -0.396 0 CA-C-N 116.251 -0.431 . . . . 0.0 110.846 179.48 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 119' ' ' THR . . . . . . . . . . . . . 61.7 m -78.38 111.04 13.98 Favored 'General case' 0 N--CA 1.448 -0.526 0 N-CA-C 108.937 -0.764 . . . . 0.0 108.937 173.897 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 120' ' ' LYS . . . . . 0.456 ' C ' HD12 ' A' ' 121' ' ' LEU . 96.2 mttt -111.61 78.22 1.1 Allowed 'General case' 0 C--N 1.32 -0.693 0 CA-C-O 121.992 0.901 . . . . 0.0 110.993 -173.001 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 121' ' ' LEU . . . . . 0.458 HD22 HG21 ' A' ' 125' ' ' THR . 8.0 mp -131.61 -174.44 3.41 Favored 'General case' 0 C--N 1.326 -0.426 0 CA-C-N 114.093 -1.412 . . . . 0.0 108.825 178.462 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 122' ' ' ALA . . . . . . . . . . . . . . . -59.88 148.54 34.49 Favored 'General case' 0 C--N 1.326 -0.431 0 CA-C-O 120.611 0.243 . . . . 0.0 110.568 177.296 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 123' ' ' LYS . . . . . . . . . . . . . 56.0 mtmt -60.79 -29.46 69.46 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-N 116.332 -0.395 . . . . 0.0 111.241 -176.719 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 124' ' ' ASN . . . . . . . . . . . . . 0.2 OUTLIER -59.93 -37.97 81.02 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.193 -0.458 . . . . 0.0 109.882 176.959 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 125' ' ' THR . . . . . 0.458 HG21 HD22 ' A' ' 121' ' ' LEU . 17.7 m -71.82 -39.63 69.67 Favored 'General case' 0 C--N 1.327 -0.394 0 CA-C-N 115.921 -0.582 . . . . 0.0 110.361 179.512 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 126' ' ' LEU . . . . . . . . . . . . . 93.3 mt -61.72 -40.91 96.73 Favored 'General case' 0 C--N 1.327 -0.383 0 CA-C-N 116.051 -0.522 . . . . 0.0 110.345 177.802 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 127' ' ' LYS . . . . . . . . . . . . . 90.6 mttt -66.18 -31.83 72.9 Favored 'General case' 0 C--N 1.327 -0.377 0 CA-C-N 116.025 -0.534 . . . . 0.0 111.399 177.961 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 128' ' ' ALA . . . . . . . . . . . . . . . -62.25 -43.96 97.64 Favored 'General case' 0 C--N 1.325 -0.457 0 CA-C-O 120.766 0.317 . . . . 0.0 110.602 178.923 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 129' ' ' ILE . . . . . . . . . . . . . 35.4 mt -67.16 -43.67 88.37 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.313 0 CA-C-N 116.145 -0.479 . . . . 0.0 109.736 177.264 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 130' ' ' ARG . . . . . 0.588 ' HB2' HD11 ' A' ' 156' ' ' ILE . 16.4 tpt85 -55.8 -51.74 66.39 Favored 'General case' 0 C--N 1.331 -0.219 0 CA-C-N 115.35 -0.841 . . . . 0.0 111.005 178.159 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 131' ' ' ASN . . . . . . . . . . . . . 14.4 m-80 -58.59 -54.41 47.42 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.202 -0.454 . . . . 0.0 111.109 179.986 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 132' ' ' THR . . . . . 0.419 ' O ' HG13 ' A' ' 136' ' ' ILE . 33.6 m -52.9 -50.7 63.38 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-N 116.136 -0.483 . . . . 0.0 111.255 -178.519 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 133' ' ' ALA . . . . . . . . . . . . . . . -61.45 -48.46 81.06 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.301 -0.409 . . . . 0.0 111.39 -178.266 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 134' ' ' SER . . . . . 0.498 ' O ' ' HG2' ' A' ' 138' ' ' ARG . 52.9 p -62.44 -36.35 82.15 Favored 'General case' 0 C--N 1.331 -0.214 0 CA-C-N 116.569 -0.287 . . . . 0.0 111.157 -177.918 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 135' ' ' GLN . . . . . 0.436 ' HA ' ' HG2' ' A' ' 138' ' ' ARG . 14.7 mm100 -66.37 -36.26 82.43 Favored 'General case' 0 C--N 1.333 -0.138 0 CA-C-N 116.576 -0.284 . . . . 0.0 111.266 -178.723 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 136' ' ' ILE . . . . . 0.419 HG13 ' O ' ' A' ' 132' ' ' THR . 79.5 mt -66.75 -45.68 87.42 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.505 0 CA-C-O 120.786 0.327 . . . . 0.0 110.73 179.624 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 137' ' ' PHE . . . . . 0.477 ' O ' HG13 ' A' ' 141' ' ' ILE . 58.5 m-85 -67.47 -45.21 76.6 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.373 -0.376 . . . . 0.0 111.566 -178.962 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 138' ' ' ARG . . . . . 0.498 ' HG2' ' O ' ' A' ' 134' ' ' SER . 13.3 ptm180 -65.17 -33.02 75.02 Favored 'General case' 0 N--CA 1.463 0.19 0 C-N-CA 120.796 -0.362 . . . . 0.0 110.77 -179.327 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 139' ' ' LEU . . . . . . . . . . . . . 54.6 tp -63.93 -41.19 97.71 Favored 'General case' 0 C--N 1.33 -0.239 0 CA-C-O 121.014 0.435 . . . . 0.0 109.901 176.608 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 140' ' ' ALA . . . . . . . . . . . . . . . -64.62 -37.67 88.37 Favored 'General case' 0 C--N 1.326 -0.42 0 CA-C-N 116.033 -0.531 . . . . 0.0 110.499 176.629 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 141' ' ' ILE . . . . . 0.477 HG13 ' O ' ' A' ' 137' ' ' PHE . 78.4 mt -63.7 -42.86 97.43 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.299 0 CA-C-N 116.22 -0.445 . . . . 0.0 110.469 177.138 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 142' ' ' GLU . . . . . 0.459 ' HG3' ' O ' ' A' ' 138' ' ' ARG . 43.5 mt-10 -69.07 -8.9 49.44 Favored 'General case' 0 N--CA 1.463 0.219 0 CA-C-N 116.248 -0.433 . . . . 0.0 111.558 179.758 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 143' ' ' ASN . . . . . . . . . . . . . 43.2 m-80 -114.38 14.52 17.95 Favored 'General case' 0 C--N 1.327 -0.378 0 CA-C-N 116.656 -0.247 . . . . 0.0 111.425 177.617 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 144' ' ' ARG . . . . . . . . . . . . . 99.4 mtt180 62.12 26.24 15.76 Favored 'General case' 0 N--CA 1.471 0.59 0 O-C-N 123.434 0.459 . . . . 0.0 112.063 176.738 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 145' ' ' ALA . . . . . . . . . . . . . . . -90.48 -23.52 20.94 Favored 'General case' 0 C--N 1.324 -0.537 0 CA-C-O 120.823 0.344 . . . . 0.0 110.924 -179.35 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 146' ' ' ILE . . . . . 0.466 ' O ' ' HA ' ' A' ' 141' ' ' ILE . 13.3 tt -159.95 157.62 2.83 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.596 0 N-CA-C 109.231 -0.655 . . . . 0.0 109.231 178.131 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 147' ' ' ASP . . . . . . . . . . . . . 31.2 t70 -126.62 27.54 6.08 Favored 'General case' 0 C--N 1.322 -0.598 0 CA-C-O 121.849 0.833 . . . . 0.0 110.188 -179.436 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 148' ' ' PHE . . . . . 0.437 ' H ' HG12 ' A' ' 146' ' ' ILE . 78.2 t80 -141.26 132.73 26.85 Favored 'General case' 0 C--N 1.319 -0.732 0 CA-C-N 115.579 -0.737 . . . . 0.0 109.589 -179.906 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 149' ' ' ASN . . . . . . . . . . . . . 48.6 t-20 -114.93 92.6 31.14 Favored Pre-proline 0 C--N 1.322 -0.607 0 CA-C-N 116.488 -0.324 . . . . 0.0 110.322 -179.657 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 150' ' ' PRO . . . . . . . . . . . . . 23.7 Cg_exo -64.71 -27.9 60.21 Favored 'Trans proline' 0 C--N 1.344 0.297 0 C-N-CA 122.803 2.335 . . . . 0.0 112.243 -178.714 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 151' ' ' ALA . . . . . 0.424 ' HA ' HG23 ' A' ' 154' ' ' VAL . . . -73.5 -21.32 60.44 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.087 -0.506 . . . . 0.0 111.219 -177.063 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 152' ' ' ASP . . . . . . . . . . . . . 3.9 t70 -76.58 -17.08 59.4 Favored 'General case' 0 C--N 1.326 -0.455 0 CA-C-O 121.357 0.599 . . . . 0.0 109.865 -179.877 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 153' ' ' TYR . . . . . 0.603 ' HB2' ' HB3' ' A' ' 109' ' ' PRO . 47.3 m-85 -93.45 2.45 56.47 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-N 115.737 -0.665 . . . . 0.0 110.799 179.133 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 154' ' ' VAL . . . . . 0.424 HG23 ' HA ' ' A' ' 151' ' ' ALA . 98.6 t -83.31 115.92 26.53 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.485 0 CA-C-N 116.299 -0.41 . . . . 0.0 110.639 -178.92 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 155' ' ' ARG . . . . . . . . . . . . . 39.8 ttm-85 -77.88 132.94 38.18 Favored 'General case' 0 C--N 1.322 -0.626 0 CA-C-N 115.802 -0.635 . . . . 0.0 110.526 179.406 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 156' ' ' ILE . . . . . 0.588 HD11 ' HB2' ' A' ' 130' ' ' ARG . 45.1 mm -96.85 120.7 61.2 Favored Pre-proline 0 C--N 1.322 -0.59 0 N-CA-C 109.458 -0.571 . . . . 0.0 109.458 174.729 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 157' ' ' PRO . . . . . 0.437 ' HD3' ' HA ' ' A' ' 156' ' ' ILE . 35.7 Cg_exo -59.82 132.51 45.57 Favored 'Trans proline' 0 N--CA 1.463 -0.313 0 C-N-CA 122.655 2.237 . . . . 0.0 112.588 -178.034 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 158' ' ' LYS . . . . . . . . . . . . . 63.1 mttm -92.13 18.79 7.59 Favored 'General case' 0 C--N 1.325 -0.478 0 CA-C-O 121.605 0.717 . . . . 0.0 109.084 175.855 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 159' ' ' ILE . . . . . . . . . . . . . 63.9 mt -79.98 107.68 12.64 Favored 'Isoleucine or valine' 0 N--CA 1.446 -0.644 0 CA-C-N 114.881 -1.054 . . . . 0.0 110.57 -173.955 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 160' ' ' ALA . . . . . . . . . . . . . . . -98.01 146.35 25.61 Favored 'General case' 0 C--N 1.314 -0.941 0 CA-C-N 115.789 -0.641 . . . . 0.0 109.572 174.619 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 161' ' ' LEU . . . . . . . . . . . . . 90.1 mt -85.07 13.22 6.4 Favored 'General case' 0 C--N 1.322 -0.614 0 CA-C-N 116.344 -0.389 . . . . 0.0 110.647 -177.815 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 162' ' ' GLU . . . . . 0.47 ' HG3' ' H ' ' A' ' 163' ' ' HIS . 7.8 tp10 64.92 -176.03 0.17 Allowed 'General case' 0 C--O 1.235 0.328 0 O-C-N 123.816 0.698 . . . . 0.0 110.057 178.411 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 163' ' ' HIS . . . . . 0.47 ' H ' ' HG3' ' A' ' 162' ' ' GLU . 74.5 m80 -80.19 54.62 2.0 Allowed 'General case' 0 C--N 1.323 -0.574 0 CA-C-O 120.904 0.383 . . . . 0.0 110.046 178.518 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 164' ' ' HIS . . . . . . . . . . . . . 29.7 t60 -82.52 -51.92 7.34 Favored 'General case' 0 C--N 1.325 -0.475 0 N-CA-C 109.419 -0.585 . . . . 0.0 109.419 179.346 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 165' ' ' HIS . . . . . . . . . . . . . 1.7 t-80 -129.35 127.03 40.22 Favored 'General case' 0 C--N 1.325 -0.472 0 N-CA-C 109.357 -0.608 . . . . 0.0 109.357 173.916 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 166' ' ' HIS . . . . . 0.469 ' CD2' ' HB3' ' A' ' 168' ' ' HIS . 82.0 t60 -85.38 98.84 10.79 Favored 'General case' 0 C--N 1.321 -0.651 0 CA-C-O 121.09 0.472 . . . . 0.0 111.706 -172.577 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 167' ' ' HIS . . . . . . . . . . . . . 72.4 t60 -77.85 110.08 12.42 Favored 'General case' 0 C--N 1.322 -0.596 0 N-CA-C 109.233 -0.654 . . . . 0.0 109.233 171.666 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 168' ' ' HIS . . . . . 0.469 ' HB3' ' CD2' ' A' ' 166' ' ' HIS . 7.4 p80 . . . . . 0 C--O 1.244 0.775 0 CA-C-O 118.081 -0.962 . . . . 0.0 110.075 -177.665 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 61' ' ' ARG . . . . . . . . . . . . . 13.4 ttm180 . . . . . 0 N--CA 1.481 1.098 0 N-CA-C 110.083 -0.34 . . . . 0.0 110.083 . . . . . . . . . 0 0 . 1 . 014 nuclear nobuild full ' A' A ' 62' ' ' ASP . . . . . . . . . . . . . 5.8 m-20 -134.63 26.0 3.71 Favored 'General case' 0 CA--C 1.516 -0.328 0 N-CA-C 109.264 -0.643 . . . . 0.0 109.264 175.297 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 63' ' ' SER . . . . . 0.563 ' HA ' ' HA ' ' A' ' 103' ' ' SER . 87.5 p -79.69 163.22 24.7 Favored 'General case' 0 C--N 1.321 -0.655 0 CA-C-N 115.974 -0.557 . . . . 0.0 110.428 -176.055 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 64' ' ' PHE . . . . . 0.585 ' HB2' HD11 ' A' ' 107' ' ' ILE . 64.9 t80 -60.84 -31.82 71.24 Favored 'General case' 0 C--N 1.323 -0.573 0 N-CA-C 109.229 -0.656 . . . . 0.0 109.229 175.647 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 65' ' ' GLY . . . . . . . . . . . . . . . -61.03 -32.67 81.13 Favored Glycine 0 N--CA 1.451 -0.363 0 CA-C-N 115.969 -0.56 . . . . 0.0 112.505 176.934 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 66' ' ' ASP . . . . . . . . . . . . . 24.9 m-20 -68.9 -55.3 11.48 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-O 121.208 0.527 . . . . 0.0 110.18 177.195 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 67' ' ' TRP . . . . . . . . . . . . . 99.4 m95 -68.18 -32.32 72.48 Favored 'General case' 0 C--N 1.326 -0.431 0 CA-C-N 115.705 -0.68 . . . . 0.0 111.869 -176.813 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 68' ' ' ALA . . . . . 0.61 ' O ' ' HG ' ' A' ' 72' ' ' LEU . . . -64.21 -47.43 79.77 Favored 'General case' 0 C--N 1.326 -0.432 0 N-CA-C 110.17 -0.308 . . . . 0.0 110.17 176.706 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 69' ' ' GLU . . . . . . . . . . . . . 7.5 tp10 -63.3 -40.08 96.35 Favored 'General case' 0 C--N 1.329 -0.297 0 N-CA-C 109.497 -0.557 . . . . 0.0 109.497 177.838 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 70' ' ' LYS . . . . . . . . . . . . . 10.7 tppt? -56.12 -49.6 73.43 Favored 'General case' 0 C--N 1.331 -0.223 0 CA-C-N 115.622 -0.717 . . . . 0.0 110.36 174.519 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 71' ' ' PHE . . . . . . . . . . . . . 80.3 t80 -64.71 -46.68 81.29 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 116.123 -0.49 . . . . 0.0 111.477 -179.08 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 72' ' ' LEU . . . . . 0.61 ' HG ' ' O ' ' A' ' 68' ' ' ALA . 85.7 mt -61.02 -43.63 98.61 Favored 'General case' 0 C--N 1.327 -0.396 0 CA-C-O 121.01 0.433 . . . . 0.0 110.422 179.776 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 73' ' ' LYS . . . . . . . . . . . . . 58.3 tttm -67.43 -26.53 66.46 Favored 'General case' 0 C--N 1.326 -0.42 0 CA-C-O 121.192 0.52 . . . . 0.0 110.155 179.015 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 74' ' ' SER . . . . . . . . . . . . . 60.7 m -68.39 -37.8 80.73 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 116.122 -0.49 . . . . 0.0 110.01 174.716 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 75' ' ' LYS . . . . . . . . . . . . . 71.4 mmtt -69.67 -34.03 73.4 Favored 'General case' 0 C--O 1.233 0.19 0 CA-C-N 116.346 -0.388 . . . . 0.0 110.892 177.575 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 76' ' ' GLU . . . . . . . . . . . . . 6.8 tp10 -54.27 -49.55 69.31 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-O 121.095 0.474 . . . . 0.0 109.847 173.591 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 77' ' ' ALA . . . . . . . . . . . . . . . -80.26 -16.66 54.21 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 115.961 -0.563 . . . . 0.0 111.325 179.781 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 78' ' ' ASP . . . . . . . . . . . . . 19.9 t70 -69.57 -34.38 74.08 Favored 'General case' 0 N--CA 1.464 0.24 0 CA-C-O 121.016 0.436 . . . . 0.0 110.196 -179.15 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 79' ' ' GLY . . . . . . . . . . . . . . . 108.09 37.16 2.2 Favored Glycine 0 N--CA 1.449 -0.5 0 C-N-CA 120.497 -0.859 . . . . 0.0 113.375 174.159 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 80' ' ' VAL . . . . . 0.508 ' HB ' ' HB2' ' A' ' 84' ' ' GLN . 17.7 m -88.51 155.73 3.15 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.503 0 CA-C-N 116.973 0.387 . . . . 0.0 110.431 175.511 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 81' ' ' SER . . . . . . . . . . . . . 19.5 m -66.44 159.12 27.76 Favored 'General case' 0 C--N 1.325 -0.49 0 N-CA-C 109.943 -0.391 . . . . 0.0 109.943 177.402 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 82' ' ' VAL . . . . . . . . . . . . . 61.2 t -56.75 -36.71 50.12 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.27 0 CA-C-O 120.905 0.383 . . . . 0.0 110.538 -178.966 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 83' ' ' SER . . . . . . . . . . . . . 14.4 m -57.27 -42.09 80.94 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 115.962 -0.563 . . . . 0.0 110.969 177.352 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 84' ' ' GLN . . . . . 0.508 ' HB2' ' HB ' ' A' ' 80' ' ' VAL . 75.9 mm-40 -64.88 -56.61 12.36 Favored 'General case' 0 CA--C 1.518 -0.269 0 CA-C-N 116.718 -0.219 . . . . 0.0 110.44 -179.951 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 85' ' ' LEU . . . . . . . . . . . . . 53.7 tp -57.82 -39.13 76.9 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.131 -0.486 . . . . 0.0 110.866 -177.657 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 86' ' ' ASN . . . . . . . . . . . . . 24.4 t-20 -61.14 -47.65 85.26 Favored 'General case' 0 C--N 1.327 -0.37 0 CA-C-N 115.864 -0.607 . . . . 0.0 110.074 177.215 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 87' ' ' SER . . . . . . . . . . . . . 49.7 m -64.78 -42.01 95.41 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-N 116.384 -0.371 . . . . 0.0 111.101 179.051 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 88' ' ' TYR . . . . . . . . . . . . . 29.4 m-85 -57.53 -48.68 78.62 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-O 120.976 0.417 . . . . 0.0 110.835 178.683 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 89' ' ' LYS . . . . . . . . . . . . . 22.0 ttmm -72.36 -32.35 66.39 Favored 'General case' 0 C--N 1.326 -0.415 0 CA-C-N 116.131 -0.486 . . . . 0.0 110.82 179.599 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 90' ' ' ASN . . . . . . . . . . . . . 62.0 t30 -66.46 -46.4 76.51 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-O 121.124 0.488 . . . . 0.0 110.447 178.739 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 91' ' ' TYR . . . . . 0.412 ' HD2' HG12 ' A' ' 129' ' ' ILE . 5.1 m-85 -62.42 -37.99 87.96 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.043 -0.526 . . . . 0.0 110.442 177.813 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 92' ' ' CYS . . . . . 0.558 ' HA ' ' HB2' ' A' ' 96' ' ' LEU . 53.2 t -67.59 -36.73 81.45 Favored 'General case' 0 C--N 1.327 -0.412 0 CA-C-N 115.929 -0.578 . . . . 0.0 110.723 177.966 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 93' ' ' ARG . . . . . 0.5 ' O ' ' HB3' ' A' ' 97' ' ' SER . 39.3 ttt180 -71.51 -44.97 63.69 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-O 121.029 0.442 . . . . 0.0 110.815 179.758 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 94' ' ' ASN . . . . . . . . . . . . . 95.1 m-20 -81.19 -61.2 2.02 Favored 'General case' 0 C--N 1.325 -0.499 0 N-CA-C 112.219 0.452 . . . . 0.0 112.219 -175.414 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 95' ' ' HIS . . . . . . . . . . . . . 95.0 m-70 -85.52 -40.34 16.44 Favored 'General case' 0 C--N 1.327 -0.385 0 CA-C-O 120.704 0.288 . . . . 0.0 111.697 -170.272 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 96' ' ' LEU . . . . . 0.558 ' HB2' ' HA ' ' A' ' 92' ' ' CYS . 74.9 mt -91.87 16.99 9.78 Favored 'General case' 0 C--N 1.325 -0.48 0 CA-C-N 116.622 -0.263 . . . . 0.0 111.279 -174.074 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 97' ' ' SER . . . . . 0.586 ' OG ' ' HD3' ' A' ' 98' ' ' PRO . 3.5 p -61.16 -45.7 95.79 Favored Pre-proline 0 CA--C 1.544 0.741 0 N-CA-C 113.123 0.786 . . . . 0.0 113.123 -177.661 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 98' ' ' PRO . . . . . 0.586 ' HD3' ' OG ' ' A' ' 97' ' ' SER . 21.9 Cg_exo -63.6 -33.66 66.56 Favored 'Trans proline' 0 C--N 1.361 1.211 0 C-N-CA 121.657 1.572 . . . . 0.0 111.622 179.133 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 99' ' ' LEU . . . . . 0.451 ' O ' ' HB3' ' A' ' 64' ' ' PHE . 40.4 mt -74.27 -40.22 62.47 Favored 'General case' 0 C--N 1.323 -0.572 0 CA-C-N 115.523 -0.762 . . . . 0.0 109.759 179.849 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 100' ' ' TYR . . . . . . . . . . . . . 36.0 t80 -51.71 -40.89 60.97 Favored 'General case' 0 C--N 1.33 -0.248 0 CA-C-N 115.235 -0.893 . . . . 0.0 111.394 -178.3 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 101' ' ' MET . . . . . . . . . . . . . 24.8 mmt -91.34 11.56 23.3 Favored 'General case' 0 C--N 1.326 -0.425 0 CA-C-N 116.325 -0.398 . . . . 0.0 112.047 -177.13 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 102' ' ' LYS . . . . . . . . . . . . . 66.0 mttt -105.8 150.33 25.65 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-O 120.862 0.363 . . . . 0.0 110.916 176.807 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 103' ' ' SER . . . . . 0.563 ' HA ' ' HA ' ' A' ' 63' ' ' SER . 24.1 t -72.93 150.33 42.64 Favored 'General case' 0 C--N 1.324 -0.526 0 N-CA-C 109.224 -0.658 . . . . 0.0 109.224 171.816 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 104' ' ' LEU . . . . . . . . . . . . . 26.2 tp -56.69 -29.48 62.42 Favored 'General case' 0 C--N 1.324 -0.543 0 CA-C-O 120.933 0.397 . . . . 0.0 112.045 -175.399 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 105' ' ' SER . . . . . . . . . . . . . 40.3 t -83.65 -22.34 32.18 Favored 'General case' 0 C--N 1.326 -0.415 0 N-CA-C 112.211 0.448 . . . . 0.0 112.211 -175.545 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 106' ' ' GLU . . . . . . . . . . . . . 12.1 pt-20 -97.94 6.08 48.13 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-O 120.817 0.341 . . . . 0.0 111.22 -174.298 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 107' ' ' ILE . . . . . 0.594 HG21 ' HZ ' ' A' ' 137' ' ' PHE . 63.4 mt -83.5 121.5 36.34 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.575 0 CA-C-N 116.296 -0.411 . . . . 0.0 110.1 178.93 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 108' ' ' LEU . . . . . . . . . . . . . 84.8 mt -103.44 151.16 38.6 Favored Pre-proline 0 C--N 1.32 -0.698 0 CA-C-N 116.062 -0.517 . . . . 0.0 110.073 179.991 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 109' ' ' PRO . . . . . . . . . . . . . 31.3 Cg_exo -59.88 -27.9 85.97 Favored 'Trans proline' 0 C--N 1.343 0.266 0 C-N-CA 122.27 1.98 . . . . 0.0 111.042 174.47 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 110' ' ' ALA . . . . . . . . . . . . . . . -61.66 -41.14 97.12 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 115.244 -0.889 . . . . 0.0 111.003 178.576 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 111' ' ' ASP . . . . . . . . . . . . . 33.3 m-20 -52.9 -58.41 7.03 Favored 'General case' 0 C--O 1.236 0.351 0 CA-C-O 121.423 0.63 . . . . 0.0 110.547 178.842 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 112' ' ' ILE . . . . . 0.449 HG12 HD11 ' A' ' 99' ' ' LEU . 21.4 mt -66.23 -40.59 87.32 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.557 0 CA-C-N 114.871 -1.059 . . . . 0.0 111.141 -174.651 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 113' ' ' GLN . . . . . . . . . . . . . 17.3 tm0? -65.01 -39.43 93.43 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.404 -0.362 . . . . 0.0 110.401 -178.29 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 114' ' ' SER . . . . . . . . . . . . . 50.0 m -60.57 -38.29 84.08 Favored 'General case' 0 C--O 1.233 0.226 0 CA-C-O 121.041 0.448 . . . . 0.0 110.485 178.039 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 115' ' ' ILE . . . . . . . . . . . . . 78.3 mt -60.12 -46.14 94.84 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.239 0 CA-C-N 115.938 -0.573 . . . . 0.0 110.432 176.592 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 116' ' ' ILE . . . . . . . . . . . . . 51.2 mm -60.33 -37.06 72.72 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.277 0 CA-C-N 115.992 -0.549 . . . . 0.0 111.043 -179.984 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 117' ' ' ASN . . . . . . . . . . . . . 93.6 m-20 -60.79 -44.49 96.75 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.492 -0.322 . . . . 0.0 111.169 179.124 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 118' ' ' GLU . . . . . . . . . . . . . 48.9 mt-10 -80.95 -18.25 47.68 Favored 'General case' 0 C--N 1.327 -0.377 0 CA-C-N 116.292 -0.413 . . . . 0.0 111.506 -176.982 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 119' ' ' THR . . . . . 0.403 ' CG2' HD13 ' A' ' 121' ' ' LEU . 29.2 m -90.86 111.8 23.37 Favored 'General case' 0 C--N 1.324 -0.539 0 CA-C-O 121.054 0.454 . . . . 0.0 110.48 -178.807 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 120' ' ' LYS . . . . . 0.448 ' C ' HD12 ' A' ' 121' ' ' LEU . 48.7 mtpt -106.82 86.9 2.4 Favored 'General case' 0 C--N 1.327 -0.4 0 CA-C-O 120.991 0.424 . . . . 0.0 110.828 -178.491 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 121' ' ' LEU . . . . . 0.448 HD12 ' C ' ' A' ' 120' ' ' LYS . 7.8 mp -132.75 -174.87 3.59 Favored 'General case' 0 C--N 1.323 -0.554 0 CA-C-N 115.547 -0.751 . . . . 0.0 109.622 177.62 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 122' ' ' ALA . . . . . . . . . . . . . . . -65.37 152.69 43.25 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-O 120.629 0.252 . . . . 0.0 111.247 178.927 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 123' ' ' LYS . . . . . 0.468 ' HB2' ' NZ ' ' A' ' 123' ' ' LYS . 9.5 mtmp? -55.85 -43.17 76.79 Favored 'General case' 0 C--N 1.331 -0.235 0 CA-C-N 115.998 -0.546 . . . . 0.0 110.735 -178.428 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 124' ' ' ASN . . . . . . . . . . . . . 3.2 m-20 -61.19 -37.81 84.28 Favored 'General case' 0 C--N 1.327 -0.408 0 CA-C-N 115.362 -0.836 . . . . 0.0 110.774 -178.124 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 125' ' ' THR . . . . . 0.44 ' O ' HG13 ' A' ' 129' ' ' ILE . 10.8 m -69.96 -41.58 74.32 Favored 'General case' 0 C--N 1.325 -0.457 0 CA-C-N 116.201 -0.454 . . . . 0.0 110.532 178.64 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 126' ' ' LEU . . . . . . . . . . . . . 92.5 mt -61.96 -43.68 98.34 Favored 'General case' 0 C--O 1.235 0.292 0 CA-C-N 116.08 -0.509 . . . . 0.0 110.741 179.184 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 127' ' ' LYS . . . . . . . . . . . . . 52.3 mtpt -68.93 -30.99 69.56 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.27 -0.423 . . . . 0.0 110.756 179.133 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 128' ' ' ALA . . . . . . . . . . . . . . . -64.11 -45.74 87.29 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.321 -0.4 . . . . 0.0 110.57 176.94 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 129' ' ' ILE . . . . . 0.44 HG13 ' O ' ' A' ' 125' ' ' THR . 70.1 mt -59.25 -50.25 80.48 Favored 'Isoleucine or valine' 0 C--O 1.235 0.319 0 CA-C-N 116.103 -0.499 . . . . 0.0 110.414 177.865 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 130' ' ' ARG . . . . . . . . . . . . . 45.7 ttt-85 -61.88 -40.97 97.23 Favored 'General case' 0 C--N 1.327 -0.384 0 CA-C-N 115.758 -0.656 . . . . 0.0 111.039 179.427 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 131' ' ' ASN . . . . . . . . . . . . . 63.8 t30 -62.8 -44.81 95.18 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-O 120.648 0.261 . . . . 0.0 110.45 -179.314 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 132' ' ' THR . . . . . 0.481 ' O ' HG13 ' A' ' 136' ' ' ILE . 39.2 m -55.1 -52.7 62.43 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 115.774 -0.648 . . . . 0.0 110.482 178.695 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 133' ' ' ALA . . . . . . . . . . . . . . . -65.45 -38.98 91.47 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.219 -0.446 . . . . 0.0 110.803 179.098 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 134' ' ' SER . . . . . . . . . . . . . 26.9 t -60.28 -43.23 96.4 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 115.964 -0.562 . . . . 0.0 110.84 -179.45 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 135' ' ' GLN . . . . . 0.463 HE21 ' HB3' ' A' ' 135' ' ' GLN . 9.1 mt-30 -67.55 -30.66 70.35 Favored 'General case' 0 C--N 1.33 -0.28 0 C-N-CA 121.133 -0.227 . . . . 0.0 110.791 179.178 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 136' ' ' ILE . . . . . 0.481 HG13 ' O ' ' A' ' 132' ' ' THR . 86.8 mt -65.13 -45.21 94.8 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.333 0 CA-C-N 116.346 -0.388 . . . . 0.0 110.203 175.959 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 137' ' ' PHE . . . . . 0.594 ' HZ ' HG21 ' A' ' 107' ' ' ILE . 60.0 m-85 -65.35 -44.98 85.98 Favored 'General case' 0 C--N 1.331 -0.208 0 CA-C-N 116.292 -0.413 . . . . 0.0 110.353 175.603 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 138' ' ' ARG . . . . . 0.46 ' O ' ' HG3' ' A' ' 142' ' ' GLU . 29.0 mtp180 -55.39 -41.19 72.31 Favored 'General case' 0 C--O 1.223 -0.31 0 CA-C-N 116.029 -0.532 . . . . 0.0 111.092 177.053 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 139' ' ' LEU . . . . . . . . . . . . . 29.4 tp -59.36 -43.09 92.87 Favored 'General case' 0 C--N 1.321 -0.645 0 CA-C-N 115.999 -0.546 . . . . 0.0 110.525 179.829 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 140' ' ' ALA . . . . . . . . . . . . . . . -68.0 -31.47 71.19 Favored 'General case' 0 C--N 1.331 -0.217 0 CA-C-N 116.348 -0.387 . . . . 0.0 110.255 176.443 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 141' ' ' ILE . . . . . 0.659 ' HA ' ' O ' ' A' ' 146' ' ' ILE . 79.7 mt -66.54 -45.93 87.59 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.236 0 CA-C-N 116.275 -0.42 . . . . 0.0 110.465 175.585 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 142' ' ' GLU . . . . . 0.46 ' HG3' ' O ' ' A' ' 138' ' ' ARG . 43.3 mt-10 -67.73 -21.65 65.28 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-O 121.021 0.439 . . . . 0.0 110.774 -179.843 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 143' ' ' ASN . . . . . 0.435 HD22 ' N ' ' A' ' 143' ' ' ASN . 0.9 OUTLIER -94.83 1.42 55.37 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.138 -0.483 . . . . 0.0 110.643 175.991 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' A' A ' 144' ' ' ARG . . . . . 0.414 HH11 ' HD2' ' A' ' 144' ' ' ARG . 29.3 mtp85 59.58 36.91 22.82 Favored 'General case' 0 N--CA 1.465 0.304 0 CA-C-N 115.721 -0.672 . . . . 0.0 112.444 178.37 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 145' ' ' ALA . . . . . . . . . . . . . . . -90.4 -24.68 20.71 Favored 'General case' 0 C--N 1.323 -0.556 0 CA-C-O 121.547 0.689 . . . . 0.0 109.455 173.413 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 146' ' ' ILE . . . . . 0.659 ' O ' ' HA ' ' A' ' 141' ' ' ILE . 11.4 tt -156.84 157.96 3.48 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.569 0 N-CA-C 108.007 -1.108 . . . . 0.0 108.007 177.567 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 147' ' ' ASP . . . . . . . . . . . . . 7.3 p-10 -123.83 21.81 9.04 Favored 'General case' 0 C--N 1.322 -0.604 0 CA-C-O 121.1 0.476 . . . . 0.0 110.862 179.628 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 148' ' ' PHE . . . . . 0.477 ' H ' HG12 ' A' ' 146' ' ' ILE . 73.7 m-85 -121.6 151.06 40.81 Favored 'General case' 0 C--N 1.326 -0.433 0 CA-C-N 115.877 -0.601 . . . . 0.0 109.986 178.537 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 149' ' ' ASN . . . . . . . . . . . . . 53.7 t-20 -124.6 87.77 54.17 Favored Pre-proline 0 C--N 1.321 -0.658 0 N-CA-C 109.682 -0.488 . . . . 0.0 109.682 173.552 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 150' ' ' PRO . . . . . . . . . . . . . 77.6 Cg_exo -52.18 -34.64 59.72 Favored 'Trans proline' 0 C--N 1.344 0.329 0 C-N-CA 122.958 2.439 . . . . 0.0 112.925 177.408 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 151' ' ' ALA . . . . . . . . . . . . . . . -71.39 -26.06 62.62 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.321 -0.399 . . . . 0.0 110.982 -177.31 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 152' ' ' ASP . . . . . . . . . . . . . 39.0 t70 -74.98 -18.25 60.4 Favored 'General case' 0 C--N 1.325 -0.476 0 CA-C-O 120.815 0.341 . . . . 0.0 110.601 -179.59 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 153' ' ' TYR . . . . . . . . . . . . . 96.3 m-85 -83.81 -11.48 56.99 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.284 -0.416 . . . . 0.0 110.863 179.057 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 154' ' ' VAL . . . . . . . . . . . . . 57.4 t -64.63 123.83 18.25 Favored 'Isoleucine or valine' 0 C--O 1.235 0.336 0 CA-C-O 120.876 0.37 . . . . 0.0 111.364 -177.507 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 155' ' ' ARG . . . . . . . . . . . . . 88.7 mtt180 -73.04 117.72 15.11 Favored 'General case' 0 C--N 1.325 -0.488 0 CA-C-N 115.828 -0.624 . . . . 0.0 110.404 174.603 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 156' ' ' ILE . . . . . . . . . . . . . 37.2 mm -92.47 119.6 67.95 Favored Pre-proline 0 C--N 1.318 -0.778 0 N-CA-C 109.317 -0.623 . . . . 0.0 109.317 173.453 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 157' ' ' PRO . . . . . . . . . . . . . 42.1 Cg_endo -68.21 129.61 19.67 Favored 'Trans proline' 0 N--CA 1.457 -0.637 0 C-N-CA 122.107 1.871 . . . . 0.0 112.237 -178.851 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 158' ' ' LYS . . . . . . . . . . . . . 62.9 mttp -82.08 75.9 8.99 Favored 'General case' 0 C--N 1.321 -0.642 0 N-CA-C 108.573 -0.899 . . . . 0.0 108.573 173.45 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 159' ' ' ILE . . . . . . . . . . . . . 51.1 mm -52.78 102.3 0.04 OUTLIER 'Isoleucine or valine' 0 C--N 1.33 -0.263 0 CA-C-N 114.887 -1.052 . . . . 0.0 111.441 -178.892 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 160' ' ' ALA . . . . . . . . . . . . . . . -117.51 14.69 14.61 Favored 'General case' 0 C--N 1.32 -0.708 0 CA-C-N 115.327 -0.851 . . . . 0.0 109.849 177.509 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 161' ' ' LEU . . . . . . . . . . . . . 86.6 mt -71.24 96.4 1.4 Allowed 'General case' 0 C--N 1.322 -0.629 0 CA-C-N 114.59 -1.186 . . . . 0.0 109.585 177.646 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 162' ' ' GLU . . . . . . . . . . . . . 6.1 tp10 54.72 80.01 0.13 Allowed 'General case' 0 CA--C 1.533 0.313 0 CA-C-N 115.501 -0.772 . . . . 0.0 110.379 -172.241 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 163' ' ' HIS . . . . . . . . . . . . . 37.5 t-80 -131.89 128.45 38.62 Favored 'General case' 0 C--N 1.323 -0.569 0 N-CA-C 108.895 -0.78 . . . . 0.0 108.895 175.558 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 164' ' ' HIS . . . . . . . . . . . . . 34.4 m170 -96.03 -176.35 3.67 Favored 'General case' 0 C--N 1.319 -0.729 0 CA-C-N 116.254 -0.43 . . . . 0.0 111.35 -173.441 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 165' ' ' HIS . . . . . . . . . . . . . 59.4 m170 -64.66 139.48 58.77 Favored 'General case' 0 C--N 1.326 -0.416 0 CA-C-N 115.787 -0.642 . . . . 0.0 110.846 -177.572 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 166' ' ' HIS . . . . . . . . . . . . . 40.6 t-80 -71.24 -53.08 15.6 Favored 'General case' 0 C--N 1.322 -0.613 0 CA-C-N 115.714 -0.676 . . . . 0.0 110.307 178.998 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 167' ' ' HIS . . . . . . . . . . . . . 49.6 t-80 -157.19 145.66 19.55 Favored 'General case' 0 C--N 1.327 -0.38 0 CA-C-N 116.62 -0.264 . . . . 0.0 110.831 179.476 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 168' ' ' HIS . . . . . . . . . . . . . 45.3 t-80 . . . . . 0 C--O 1.25 1.1 0 CA-C-O 118.603 -0.713 . . . . 0.0 109.511 172.787 . . . . . . . . 0 0 . 1 . 015 nuclear nobuild full ' A' A ' 61' ' ' ARG . . . . . . . . . . . . . 18.2 mtm-85 . . . . . 0 N--CA 1.481 1.104 0 CA-C-O 120.489 0.185 . . . . 0.0 110.602 . . . . . . . . . 0 0 . 1 . 015 nuclear nobuild full ' A' A ' 62' ' ' ASP . . . . . . . . . . . . . 26.9 m-20 -94.03 157.84 15.9 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-O 120.626 0.25 . . . . 0.0 110.507 -175.905 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 63' ' ' SER . . . . . . . . . . . . . 36.1 t -84.9 144.37 28.42 Favored 'General case' 0 C--N 1.322 -0.591 0 CA-C-O 120.971 0.415 . . . . 0.0 110.522 178.264 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 64' ' ' PHE . . . . . . . . . . . . . 81.2 t80 -63.74 -30.12 71.26 Favored 'General case' 0 C--N 1.327 -0.411 0 CA-C-N 115.857 -0.61 . . . . 0.0 109.723 177.254 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 65' ' ' GLY . . . . . . . . . . . . . . . -62.93 -36.15 93.03 Favored Glycine 0 N--CA 1.448 -0.559 0 C-N-CA 120.862 -0.685 . . . . 0.0 112.157 178.205 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 66' ' ' ASP . . . . . . . . . . . . . 22.7 t70 -69.6 -43.19 73.27 Favored 'General case' 0 C--N 1.327 -0.398 0 CA-C-O 120.931 0.396 . . . . 0.0 110.371 179.515 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 67' ' ' TRP . . . . . . . . . . . . . 83.8 m95 -72.33 -28.02 62.8 Favored 'General case' 0 C--N 1.325 -0.488 0 CA-C-N 116.153 -0.476 . . . . 0.0 111.392 179.477 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 68' ' ' ALA . . . . . 0.489 ' O ' ' HG ' ' A' ' 72' ' ' LEU . . . -65.82 -44.87 84.28 Favored 'General case' 0 C--N 1.329 -0.302 0 N-CA-C 109.57 -0.53 . . . . 0.0 109.57 173.312 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 69' ' ' GLU . . . . . . . . . . . . . 10.3 tp10 -59.46 -46.39 88.92 Favored 'General case' 0 C--O 1.234 0.244 0 CA-C-N 115.605 -0.725 . . . . 0.0 109.998 175.17 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 70' ' ' LYS . . . . . . . . . . . . . 54.7 mttp -63.35 -34.54 77.94 Favored 'General case' 0 C--N 1.331 -0.228 0 CA-C-N 115.793 -0.639 . . . . 0.0 111.645 178.663 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 71' ' ' PHE . . . . . . . . . . . . . 62.7 t80 -67.17 -43.72 81.53 Favored 'General case' 0 C--N 1.326 -0.421 0 CA-C-O 120.887 0.375 . . . . 0.0 110.578 178.809 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 72' ' ' LEU . . . . . 0.489 ' HG ' ' O ' ' A' ' 68' ' ' ALA . 85.7 mt -62.21 -44.21 97.1 Favored 'General case' 0 C--N 1.324 -0.543 0 CA-C-N 116.111 -0.495 . . . . 0.0 110.397 178.355 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 73' ' ' LYS . . . . . . . . . . . . . 35.6 mttp -72.55 -36.37 68.24 Favored 'General case' 0 C--N 1.327 -0.377 0 CA-C-N 116.001 -0.545 . . . . 0.0 112.233 -178.695 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 74' ' ' SER . . . . . . . . . . . . . 35.1 p -66.27 -34.37 77.84 Favored 'General case' 0 C--N 1.328 -0.336 0 C-N-CA 120.725 -0.39 . . . . 0.0 110.31 178.022 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 75' ' ' LYS . . . . . 0.43 ' HD3' ' HA ' ' A' ' 75' ' ' LYS . 25.8 mmtp -75.07 -32.88 61.6 Favored 'General case' 0 C--N 1.332 -0.187 0 CA-C-O 120.894 0.378 . . . . 0.0 110.903 174.958 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 76' ' ' GLU . . . . . . . . . . . . . 43.1 tt0 -63.46 -38.94 93.06 Favored 'General case' 0 C--N 1.323 -0.56 0 CA-C-O 121.219 0.533 . . . . 0.0 110.098 175.198 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 77' ' ' ALA . . . . . . . . . . . . . . . -76.4 -28.99 56.92 Favored 'General case' 0 C--N 1.325 -0.487 0 CA-C-N 115.841 -0.618 . . . . 0.0 110.741 174.578 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 78' ' ' ASP . . . . . 0.407 ' HB3' ' HA ' ' A' ' 75' ' ' LYS . 16.4 t70 -65.37 -46.3 80.7 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 115.898 -0.592 . . . . 0.0 110.357 178.056 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 79' ' ' GLY . . . . . . . . . . . . . . . 121.77 58.28 0.22 Allowed Glycine 0 N--CA 1.445 -0.714 0 C-N-CA 120.858 -0.687 . . . . 0.0 112.378 177.827 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 80' ' ' VAL . . . . . . . . . . . . . 29.8 m -100.65 141.36 17.59 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.5 0 CA-C-O 120.714 0.292 . . . . 0.0 110.533 177.492 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 81' ' ' SER . . . . . . . . . . . . . 32.0 m -57.56 156.17 8.6 Favored 'General case' 0 C--N 1.326 -0.438 0 CA-C-N 115.815 -0.629 . . . . 0.0 110.932 178.645 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 82' ' ' VAL . . . . . . . . . . . . . 7.1 p -58.2 -44.59 88.13 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.281 0 CA-C-N 116.651 -0.249 . . . . 0.0 111.504 -175.506 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 83' ' ' SER . . . . . . . . . . . . . 22.3 m -66.01 -33.13 75.11 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-O 120.771 0.32 . . . . 0.0 110.258 179.041 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 84' ' ' GLN . . . . . . . . . . . . . 52.6 tp60 -68.47 -39.17 81.5 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 115.798 -0.637 . . . . 0.0 110.26 -179.177 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 85' ' ' LEU . . . . . . . . . . . . . 49.1 tp -68.24 -33.49 74.48 Favored 'General case' 0 C--N 1.325 -0.483 0 CA-C-N 116.12 -0.491 . . . . 0.0 110.2 177.166 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 86' ' ' ASN . . . . . . . . . . . . . 90.5 m-20 -76.76 -30.64 56.61 Favored 'General case' 0 C--N 1.327 -0.4 0 CA-C-N 116.111 -0.495 . . . . 0.0 111.144 -179.791 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 87' ' ' SER . . . . . . . . . . . . . 2.9 p -69.75 -38.89 76.96 Favored 'General case' 0 N--CA 1.453 -0.28 0 C-N-CA 120.535 -0.466 . . . . 0.0 109.959 175.25 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 88' ' ' TYR . . . . . . . . . . . . . 16.3 m-85 -60.5 -43.06 97.43 Favored 'General case' 0 C--O 1.232 0.183 0 N-CA-C 109.491 -0.559 . . . . 0.0 109.491 171.32 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 89' ' ' LYS . . . . . 0.428 ' HD3' HD13 ' A' ' 72' ' ' LEU . 1.5 tppp? -54.81 -43.87 73.3 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 115.01 -0.996 . . . . 0.0 110.004 177.392 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 90' ' ' ASN . . . . . . . . . . . . . 48.1 t30 -63.94 -57.18 10.53 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 115.07 -0.968 . . . . 0.0 111.307 -178.571 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 91' ' ' TYR . . . . . . . . . . . . . 31.3 m-85 -54.48 -45.42 73.19 Favored 'General case' 0 C--O 1.235 0.33 0 CA-C-O 120.614 0.245 . . . . 0.0 111.551 -176.411 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 92' ' ' CYS . . . . . . . . . . . . . 62.1 m -68.13 -42.35 80.32 Favored 'General case' 0 C--N 1.326 -0.416 0 N-CA-C 112.518 0.562 . . . . 0.0 112.518 -175.235 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 93' ' ' ARG . . . . . 0.435 ' O ' ' HB3' ' A' ' 97' ' ' SER . 52.0 ttt180 -94.89 -24.85 16.83 Favored 'General case' 0 C--N 1.326 -0.419 0 C-N-CA 120.158 -0.617 . . . . 0.0 112.133 -172.698 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 94' ' ' ASN . . . . . . . . . . . . . 49.8 t-20 -85.79 -61.64 1.71 Allowed 'General case' 0 C--N 1.324 -0.521 0 C-N-CA 120.816 -0.354 . . . . 0.0 110.709 -178.159 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 95' ' ' HIS . . . . . . . . . . . . . 14.3 m80 -86.94 -40.73 14.54 Favored 'General case' 0 C--N 1.326 -0.415 0 N-CA-C 112.387 0.514 . . . . 0.0 112.387 -176.558 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 96' ' ' LEU . . . . . 0.513 HD22 HD12 ' A' ' 99' ' ' LEU . 89.7 mt -88.31 20.91 3.05 Favored 'General case' 0 C--N 1.327 -0.393 0 CA-C-O 120.828 0.346 . . . . 0.0 111.141 -177.037 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 97' ' ' SER . . . . . 0.527 ' N ' ' HD2' ' A' ' 98' ' ' PRO . 1.6 p -58.51 -45.55 99.66 Favored Pre-proline 0 CA--C 1.543 0.681 0 N-CA-C 112.925 0.713 . . . . 0.0 112.925 -177.901 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 98' ' ' PRO . . . . . 0.527 ' HD2' ' N ' ' A' ' 97' ' ' SER . 18.1 Cg_endo -61.28 -34.44 87.9 Favored 'Trans proline' 0 C--N 1.361 1.186 0 C-N-CA 121.623 1.549 . . . . 0.0 112.215 178.091 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 99' ' ' LEU . . . . . 0.513 HD12 HD22 ' A' ' 96' ' ' LEU . 80.6 mt -74.1 -33.37 63.6 Favored 'General case' 0 C--N 1.326 -0.42 0 CA-C-O 120.968 0.413 . . . . 0.0 110.451 -179.288 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 100' ' ' TYR . . . . . . . . . . . . . 38.2 t80 -60.14 -26.29 66.16 Favored 'General case' 0 CA--C 1.532 0.272 0 CA-C-N 115.688 -0.687 . . . . 0.0 110.301 178.551 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 101' ' ' MET . . . . . . . . . . . . . 55.0 mtt -96.54 6.92 47.74 Favored 'General case' 0 C--O 1.236 0.361 0 CA-C-N 115.666 -0.697 . . . . 0.0 111.005 -178.439 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 102' ' ' LYS . . . . . 0.528 ' HE3' HG12 ' A' ' 107' ' ' ILE . 27.3 mtpp -109.15 166.7 10.65 Favored 'General case' 0 C--N 1.324 -0.518 0 CA-C-N 116.172 -0.467 . . . . 0.0 110.984 -179.068 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 103' ' ' SER . . . . . 0.584 ' HB3' ' HG2' ' A' ' 106' ' ' GLU . 20.0 t -94.13 149.12 21.53 Favored 'General case' 0 N--CA 1.449 -0.495 0 N-CA-C 108.743 -0.836 . . . . 0.0 108.743 176.796 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 104' ' ' LEU . . . . . 0.515 HD21 ' HB1' ' A' ' 140' ' ' ALA . 35.9 tp -52.54 -52.3 55.44 Favored 'General case' 0 C--N 1.322 -0.615 0 N-CA-C 112.78 0.659 . . . . 0.0 112.78 -170.147 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 105' ' ' SER . . . . . . . . . . . . . 38.4 m -82.91 -7.36 59.67 Favored 'General case' 0 C--N 1.322 -0.61 0 N-CA-C 112.905 0.706 . . . . 0.0 112.905 -172.828 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 106' ' ' GLU . . . . . 0.584 ' HG2' ' HB3' ' A' ' 103' ' ' SER . 1.1 pp20? -106.48 15.42 25.95 Favored 'General case' 0 C--O 1.233 0.196 0 CA-C-O 121.233 0.54 . . . . 0.0 111.19 -178.899 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 107' ' ' ILE . . . . . 0.528 HG12 ' HE3' ' A' ' 102' ' ' LYS . 80.0 mt -88.14 134.57 27.69 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.56 0 CA-C-N 115.866 -0.606 . . . . 0.0 109.664 173.061 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 108' ' ' LEU . . . . . . . . . . . . . 97.9 mt -105.21 150.21 38.58 Favored Pre-proline 0 C--N 1.327 -0.413 0 CA-C-N 116.465 -0.334 . . . . 0.0 110.479 178.505 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 109' ' ' PRO . . . . . . . . . . . . . 36.5 Cg_exo -60.88 -26.27 82.8 Favored 'Trans proline' 0 C--N 1.343 0.275 0 C-N-CA 122.491 2.127 . . . . 0.0 111.257 175.136 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 110' ' ' ALA . . . . . . . . . . . . . . . -64.77 -38.94 92.69 Favored 'General case' 0 C--N 1.331 -0.227 0 CA-C-N 115.495 -0.775 . . . . 0.0 110.958 178.786 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 111' ' ' ASP . . . . . . . . . . . . . 41.5 m-20 -61.88 -49.66 75.35 Favored 'General case' 0 CA--C 1.52 -0.209 0 CA-C-O 121.074 0.464 . . . . 0.0 109.935 177.759 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 112' ' ' ILE . . . . . 0.44 ' O ' HG12 ' A' ' 116' ' ' ILE . 39.2 mt -62.31 -43.46 98.08 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.249 0 CA-C-N 115.556 -0.747 . . . . 0.0 110.871 -179.193 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 113' ' ' GLN . . . . . . . . . . . . . 7.8 tp-100 -61.34 -38.61 87.56 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.364 -0.38 . . . . 0.0 110.642 178.908 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 114' ' ' SER . . . . . . . . . . . . . 48.2 m -62.72 -41.32 99.1 Favored 'General case' 0 C--N 1.326 -0.42 0 CA-C-N 116.137 -0.483 . . . . 0.0 110.253 177.14 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 115' ' ' ILE . . . . . 0.433 HD11 ' HG2' ' A' ' 98' ' ' PRO . 74.4 mt -62.53 -44.2 99.1 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.214 0 CA-C-N 116.338 -0.392 . . . . 0.0 110.454 176.982 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 116' ' ' ILE . . . . . 0.44 HG12 ' O ' ' A' ' 112' ' ' ILE . 45.4 mm -58.96 -46.88 91.24 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.337 0 CA-C-N 116.034 -0.53 . . . . 0.0 110.915 178.717 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 117' ' ' ASN . . . . . . . . . . . . . 28.7 t-20 -75.07 -23.16 58.0 Favored 'General case' 0 C--N 1.326 -0.442 0 CA-C-N 116.388 -0.369 . . . . 0.0 111.227 -178.189 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 118' ' ' GLU . . . . . . . . . . . . . 7.6 mm-40 -79.7 -20.71 45.9 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-O 120.755 0.312 . . . . 0.0 110.42 175.075 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 119' ' ' THR . . . . . . . . . . . . . 80.9 m -73.48 112.9 10.0 Favored 'General case' 0 N--CA 1.449 -0.488 0 N-CA-C 109.661 -0.496 . . . . 0.0 109.661 175.456 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 120' ' ' LYS . . . . . . . . . . . . . 6.5 ptmt -93.55 26.55 2.98 Favored 'General case' 0 C--N 1.321 -0.639 0 CA-C-N 115.863 -0.608 . . . . 0.0 111.364 -174.846 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 121' ' ' LEU . . . . . . . . . . . . . 3.8 mm? -95.95 -175.82 3.52 Favored 'General case' 0 C--N 1.327 -0.398 0 CA-C-N 115.763 -0.653 . . . . 0.0 110.374 178.879 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 122' ' ' ALA . . . . . 0.406 ' O ' ' HG ' ' A' ' 126' ' ' LEU . . . -87.58 174.03 8.71 Favored 'General case' 0 C--N 1.327 -0.391 0 N-CA-C 112.38 0.511 . . . . 0.0 112.38 -173.521 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 123' ' ' LYS . . . . . . . . . . . . . 14.4 tttm -48.24 -48.22 35.38 Favored 'General case' 0 N--CA 1.467 0.382 0 CA-C-N 115.198 -0.91 . . . . 0.0 113.037 -178.122 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 124' ' ' ASN . . . . . . . . . . . . . 7.1 m-20 -63.52 -40.78 97.94 Favored 'General case' 0 C--N 1.326 -0.418 0 CA-C-O 120.533 0.206 . . . . 0.0 111.354 -176.204 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 125' ' ' THR . . . . . . . . . . . . . 13.3 m -66.77 -39.59 87.92 Favored 'General case' 0 C--N 1.325 -0.46 0 CA-C-O 120.739 0.304 . . . . 0.0 110.739 179.071 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 126' ' ' LEU . . . . . 0.406 ' HG ' ' O ' ' A' ' 122' ' ' ALA . 94.1 mt -59.93 -45.81 91.39 Favored 'General case' 0 N--CA 1.462 0.165 0 CA-C-O 121.197 0.522 . . . . 0.0 110.644 179.239 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 127' ' ' LYS . . . . . . . . . . . . . 58.0 mttm -71.08 -29.68 65.61 Favored 'General case' 0 C--N 1.326 -0.453 0 CA-C-N 115.712 -0.677 . . . . 0.0 111.274 -178.926 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 128' ' ' ALA . . . . . . . . . . . . . . . -62.48 -47.06 85.64 Favored 'General case' 0 C--N 1.326 -0.444 0 CA-C-N 116.223 -0.444 . . . . 0.0 110.322 175.753 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 129' ' ' ILE . . . . . . . . . . . . . 57.9 mt -65.15 -41.07 90.82 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.332 0 CA-C-N 116.112 -0.494 . . . . 0.0 110.021 176.734 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 130' ' ' ARG . . . . . 0.767 HH12 ' HB1' ' A' ' 151' ' ' ALA . 3.8 tpm_? -57.08 -56.21 24.75 Favored 'General case' 0 C--N 1.33 -0.24 0 CA-C-N 115.57 -0.741 . . . . 0.0 111.102 178.796 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 131' ' ' ASN . . . . . 0.498 ' O ' ' HG2' ' A' ' 135' ' ' GLN . 58.1 t30 -59.22 -46.5 88.3 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.359 -0.382 . . . . 0.0 110.822 -178.174 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 132' ' ' THR . . . . . 0.422 ' O ' HG13 ' A' ' 136' ' ' ILE . 61.0 m -56.67 -53.58 56.0 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.314 -0.403 . . . . 0.0 111.224 -179.312 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 133' ' ' ALA . . . . . . . . . . . . . . . -62.48 -34.7 77.35 Favored 'General case' 0 C--N 1.331 -0.217 0 CA-C-O 121.093 0.473 . . . . 0.0 110.965 -179.808 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 134' ' ' SER . . . . . . . . . . . . . 14.0 t -63.27 -46.58 86.16 Favored 'General case' 0 C--N 1.327 -0.374 0 CA-C-N 115.891 -0.595 . . . . 0.0 110.198 179.534 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 135' ' ' GLN . . . . . 0.498 ' HG2' ' O ' ' A' ' 131' ' ' ASN . 82.6 mm-40 -60.2 -39.73 87.59 Favored 'General case' 0 C--N 1.332 -0.175 0 CA-C-N 116.19 -0.459 . . . . 0.0 111.246 -178.952 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 136' ' ' ILE . . . . . 0.422 HG13 ' O ' ' A' ' 132' ' ' THR . 62.8 mt -59.16 -49.73 82.32 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.253 0 CA-C-N 116.343 -0.39 . . . . 0.0 110.733 -179.881 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 137' ' ' PHE . . . . . 0.562 ' O ' HG13 ' A' ' 141' ' ' ILE . 52.8 m-85 -63.29 -41.69 98.99 Favored 'General case' 0 C--N 1.331 -0.217 0 CA-C-N 116.344 -0.389 . . . . 0.0 110.764 177.625 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 138' ' ' ARG . . . . . 0.453 ' O ' ' HG2' ' A' ' 142' ' ' GLU . 72.9 mtp180 -59.79 -42.98 94.58 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.067 -0.515 . . . . 0.0 111.137 179.571 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 139' ' ' LEU . . . . . . . . . . . . . 50.3 tp -60.21 -39.0 85.06 Favored 'General case' 0 C--N 1.325 -0.481 0 CA-C-N 116.091 -0.504 . . . . 0.0 110.685 178.069 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 140' ' ' ALA . . . . . 0.515 ' HB1' HD21 ' A' ' 104' ' ' LEU . . . -67.57 -39.73 84.88 Favored 'General case' 0 C--N 1.326 -0.434 0 CA-C-N 116.193 -0.458 . . . . 0.0 110.668 178.014 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 141' ' ' ILE . . . . . 0.562 HG13 ' O ' ' A' ' 137' ' ' PHE . 66.5 mt -62.96 -39.42 85.06 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.27 0 CA-C-N 116.064 -0.517 . . . . 0.0 110.662 177.007 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 142' ' ' GLU . . . . . 0.453 ' HG2' ' O ' ' A' ' 138' ' ' ARG . 35.8 mm-40 -54.5 -45.07 73.19 Favored 'General case' 0 N--CA 1.463 0.196 0 CA-C-O 121.161 0.505 . . . . 0.0 111.053 177.521 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 143' ' ' ASN . . . . . . . . . . . . . 41.0 m-80 -85.78 6.55 27.5 Favored 'General case' 0 C--N 1.327 -0.409 0 CA-C-N 115.683 -0.69 . . . . 0.0 110.676 -178.34 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 144' ' ' ARG . . . . . 0.4 HH11 ' HD2' ' A' ' 144' ' ' ARG . 41.1 mtp85 58.02 28.09 15.77 Favored 'General case' 0 N--CA 1.465 0.315 0 CA-C-N 115.706 -0.679 . . . . 0.0 112.106 179.54 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 145' ' ' ALA . . . . . . . . . . . . . . . -76.53 -23.01 53.63 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-O 121.739 0.78 . . . . 0.0 109.496 174.663 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 146' ' ' ILE . . . . . 0.549 ' O ' ' HA ' ' A' ' 141' ' ' ILE . 14.6 tt -149.77 144.01 17.77 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.713 0 CA-C-N 114.772 -1.103 . . . . 0.0 108.169 173.578 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 147' ' ' ASP . . . . . . . . . . . . . 30.4 t70 -116.55 27.3 9.28 Favored 'General case' 0 C--N 1.319 -0.755 0 CA-C-O 122.117 0.961 . . . . 0.0 109.158 -179.233 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 148' ' ' PHE . . . . . 0.484 ' H ' HG12 ' A' ' 146' ' ' ILE . 69.8 t80 -137.39 136.97 38.35 Favored 'General case' 0 C--N 1.318 -0.786 0 CA-C-N 114.603 -1.18 . . . . 0.0 109.032 -175.755 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 149' ' ' ASN . . . . . . . . . . . . . 3.8 t-20 -120.19 90.06 44.11 Favored Pre-proline 0 C--N 1.322 -0.616 0 C-N-CA 120.89 -0.324 . . . . 0.0 110.74 -177.318 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 150' ' ' PRO . . . . . . . . . . . . . 21.7 Cg_exo -64.45 -22.85 65.32 Favored 'Trans proline' 0 C--N 1.345 0.35 0 C-N-CA 122.559 2.173 . . . . 0.0 111.108 178.542 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 151' ' ' ALA . . . . . 0.767 ' HB1' HH12 ' A' ' 130' ' ' ARG . . . -66.11 -27.45 68.06 Favored 'General case' 0 N--CA 1.45 -0.428 0 CA-C-N 115.062 -0.972 . . . . 0.0 111.514 -177.819 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 152' ' ' ASP . . . . . . . . . . . . . 14.6 t70 -71.69 -25.35 62.07 Favored 'General case' 0 C--N 1.327 -0.401 0 CA-C-O 121.07 0.462 . . . . 0.0 110.498 -177.354 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 153' ' ' TYR . . . . . . . . . . . . . 92.4 m-85 -87.41 0.15 55.93 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 115.893 -0.594 . . . . 0.0 110.977 -178.464 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 154' ' ' VAL . . . . . . . . . . . . . 55.9 t -88.34 107.24 17.38 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.416 0 N-CA-C 109.967 -0.383 . . . . 0.0 109.967 178.822 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 155' ' ' ARG . . . . . . . . . . . . . 10.4 tpt180 -89.49 130.44 35.83 Favored 'General case' 0 C--N 1.323 -0.554 0 CA-C-N 116.0 -0.545 . . . . 0.0 110.892 -177.374 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 156' ' ' ILE . . . . . . . . . . . . . 48.0 mm -96.81 115.61 65.76 Favored Pre-proline 0 C--N 1.323 -0.545 0 CA-C-N 116.116 -0.493 . . . . 0.0 110.052 175.021 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 157' ' ' PRO . . . . . . . . . . . . . 93.9 Cg_endo -83.86 142.7 10.2 Favored 'Trans proline' 0 N--CA 1.458 -0.57 0 C-N-CA 122.708 2.272 . . . . 0.0 112.318 176.933 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 158' ' ' LYS . . . . . 0.539 ' O ' ' HB ' ' A' ' 159' ' ' ILE . 41.2 mttp -86.84 20.96 2.39 Favored 'General case' 0 C--N 1.326 -0.445 0 CA-C-N 116.345 -0.389 . . . . 0.0 110.453 179.394 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 159' ' ' ILE . . . . . 0.539 ' HB ' ' O ' ' A' ' 158' ' ' LYS . 1.9 mp 76.24 -29.72 0.01 OUTLIER 'Isoleucine or valine' 0 CA--C 1.538 0.487 0 CA-C-N 115.924 -0.58 . . . . 0.0 110.819 -177.594 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 160' ' ' ALA . . . . . 0.416 ' H ' ' C ' ' A' ' 158' ' ' LYS . . . -72.9 166.94 22.02 Favored 'General case' 0 C--N 1.327 -0.4 0 CA-C-O 121.033 0.444 . . . . 0.0 111.17 178.511 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 161' ' ' LEU . . . . . . . . . . . . . 95.1 mt -83.73 53.82 2.68 Favored 'General case' 0 C--N 1.326 -0.44 0 CA-C-N 116.211 -0.45 . . . . 0.0 111.328 -178.058 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 162' ' ' GLU . . . . . . . . . . . . . 27.1 mt-10 -54.33 -43.11 70.94 Favored 'General case' 0 N--CA 1.464 0.261 0 CA-C-O 121.699 0.762 . . . . 0.0 110.16 177.642 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 163' ' ' HIS . . . . . . . . . . . . . 5.9 p80 -129.72 97.23 4.45 Favored 'General case' 0 C--N 1.32 -0.716 0 CA-C-N 114.771 -1.104 . . . . 0.0 109.721 179.153 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 164' ' ' HIS . . . . . . . . . . . . . 8.4 p-80 -93.73 79.22 4.23 Favored 'General case' 0 C--N 1.321 -0.667 0 CA-C-O 121.828 0.823 . . . . 0.0 109.631 178.338 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 165' ' ' HIS . . . . . . . . . . . . . 49.2 t-80 -161.35 78.23 0.57 Allowed 'General case' 0 C--N 1.321 -0.646 0 CA-C-N 114.471 -1.24 . . . . 0.0 108.408 -177.494 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 166' ' ' HIS . . . . . . . . . . . . . 47.4 t-80 -91.36 72.93 6.13 Favored 'General case' 0 C--N 1.324 -0.526 0 CA-C-N 116.18 -0.464 . . . . 0.0 111.497 -172.064 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 167' ' ' HIS . . . . . . . . . . . . . 3.1 m-70 -157.1 139.39 14.66 Favored 'General case' 0 C--N 1.324 -0.536 0 CA-C-N 116.074 -0.512 . . . . 0.0 110.699 173.269 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 168' ' ' HIS . . . . . . . . . . . . . 53.3 t60 . . . . . 0 C--O 1.247 0.972 0 CA-C-O 118.284 -0.865 . . . . 0.0 109.601 176.618 . . . . . . . . 0 0 . 1 . 016 nuclear nobuild full ' A' A ' 61' ' ' ARG . . . . . . . . . . . . . 77.7 mtp180 . . . . . 0 N--CA 1.483 1.184 0 CA-C-O 120.985 0.422 . . . . 0.0 110.295 . . . . . . . . . 0 0 . 1 . 016 nuclear nobuild full ' A' A ' 62' ' ' ASP . . . . . . . . . . . . . 2.4 m-20 -96.32 133.41 40.73 Favored 'General case' 0 C--N 1.324 -0.536 0 CA-C-N 116.07 -0.514 . . . . 0.0 111.088 -171.8 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 63' ' ' SER . . . . . . . . . . . . . 19.4 m -81.78 167.39 19.13 Favored 'General case' 0 C--N 1.325 -0.474 0 CA-C-N 115.862 -0.608 . . . . 0.0 110.152 177.018 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 64' ' ' PHE . . . . . . . . . . . . . 77.8 t80 -59.04 -33.01 70.27 Favored 'General case' 0 N--CA 1.464 0.236 0 CA-C-O 120.68 0.276 . . . . 0.0 110.578 -177.491 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 65' ' ' GLY . . . . . . . . . . . . . . . -57.87 -41.21 94.03 Favored Glycine 0 N--CA 1.448 -0.559 0 C-N-CA 120.856 -0.688 . . . . 0.0 112.366 176.495 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 66' ' ' ASP . . . . . 0.59 ' O ' ' HG3' ' A' ' 70' ' ' LYS . 6.8 t0 -72.66 -41.27 65.61 Favored 'General case' 0 C--N 1.327 -0.392 0 N-CA-C 109.618 -0.512 . . . . 0.0 109.618 179.78 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 67' ' ' TRP . . . . . . . . . . . . . 97.6 m95 -59.71 -38.33 81.32 Favored 'General case' 0 N--CA 1.464 0.268 0 CA-C-N 116.344 -0.389 . . . . 0.0 110.751 177.184 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 68' ' ' ALA . . . . . . . . . . . . . . . -61.23 -44.5 97.16 Favored 'General case' 0 C--N 1.326 -0.435 0 CA-C-N 116.293 -0.412 . . . . 0.0 110.081 176.314 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 69' ' ' GLU . . . . . . . . . . . . . 28.7 tt0 -62.26 -41.17 98.21 Favored 'General case' 0 CA--C 1.53 0.175 0 CA-C-N 116.116 -0.493 . . . . 0.0 110.024 176.943 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 70' ' ' LYS . . . . . 0.59 ' HG3' ' O ' ' A' ' 66' ' ' ASP . 51.8 mttm -57.34 -44.31 84.16 Favored 'General case' 0 C--O 1.232 0.158 0 CA-C-N 116.354 -0.385 . . . . 0.0 110.587 177.711 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 71' ' ' PHE . . . . . . . . . . . . . 89.2 t80 -60.4 -52.52 64.89 Favored 'General case' 0 C--N 1.331 -0.22 0 CA-C-N 115.905 -0.589 . . . . 0.0 110.63 -179.709 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 72' ' ' LEU . . . . . 0.468 HD12 HD13 ' A' ' 85' ' ' LEU . 4.2 mm? -59.65 -47.4 85.77 Favored 'General case' 0 C--N 1.331 -0.231 0 CA-C-N 116.292 -0.413 . . . . 0.0 110.755 178.856 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 73' ' ' LYS . . . . . 0.444 ' HB2' ' HE3' ' A' ' 73' ' ' LYS . 36.0 ttmt -56.43 -46.64 80.16 Favored 'General case' 0 C--N 1.325 -0.469 0 CA-C-N 115.556 -0.747 . . . . 0.0 110.547 179.774 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 74' ' ' SER . . . . . . . . . . . . . 42.0 m -68.15 -43.79 77.46 Favored 'General case' 0 C--N 1.327 -0.395 0 CA-C-N 115.778 -0.646 . . . . 0.0 111.186 -179.69 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 75' ' ' LYS . . . . . 0.453 ' O ' HG22 ' A' ' 80' ' ' VAL . 3.6 mmtm -69.18 -32.5 71.85 Favored 'General case' 0 C--N 1.331 -0.215 0 CA-C-N 116.701 -0.227 . . . . 0.0 111.423 -177.64 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 76' ' ' GLU . . . . . . . . . . . . . 39.3 tt0 -58.27 -50.68 72.74 Favored 'General case' 0 C--N 1.327 -0.413 0 CA-C-O 121.009 0.433 . . . . 0.0 109.978 173.975 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 77' ' ' ALA . . . . . . . . . . . . . . . -75.45 -10.06 59.12 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 115.689 -0.687 . . . . 0.0 111.108 179.137 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 78' ' ' ASP . . . . . . . . . . . . . 34.5 t70 -76.13 -11.81 60.0 Favored 'General case' 0 C--N 1.324 -0.502 0 CA-C-N 115.727 -0.67 . . . . 0.0 110.885 -177.925 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 79' ' ' GLY . . . . . . . . . . . . . . . 103.55 33.99 3.99 Favored Glycine 0 N--CA 1.451 -0.366 0 C-N-CA 120.632 -0.794 . . . . 0.0 113.332 174.012 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 80' ' ' VAL . . . . . 0.453 HG22 ' O ' ' A' ' 75' ' ' LYS . 31.4 m -101.09 159.53 3.93 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.411 0 CA-C-N 116.935 0.368 . . . . 0.0 110.549 176.653 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 81' ' ' SER . . . . . . . . . . . . . 7.1 p -81.78 174.95 10.84 Favored 'General case' 0 C--N 1.324 -0.54 0 CA-C-N 116.164 -0.471 . . . . 0.0 110.868 179.195 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 82' ' ' VAL . . . . . . . . . . . . . 61.0 t -68.29 -41.66 83.9 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.397 0 CA-C-N 116.341 -0.391 . . . . 0.0 110.615 -177.707 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 83' ' ' SER . . . . . . . . . . . . . 53.0 p -58.9 -39.19 80.74 Favored 'General case' 0 C--N 1.332 -0.188 0 CA-C-O 121.248 0.547 . . . . 0.0 110.507 177.964 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 84' ' ' GLN . . . . . . . . . . . . . 6.5 tp-100 -66.52 -47.98 71.21 Favored 'General case' 0 C--N 1.325 -0.465 0 CA-C-N 115.65 -0.705 . . . . 0.0 110.146 177.822 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 85' ' ' LEU . . . . . 0.468 HD13 HD12 ' A' ' 72' ' ' LEU . 0.6 OUTLIER -62.47 -43.43 98.84 Favored 'General case' 0 C--N 1.326 -0.432 0 CA-C-N 115.599 -0.728 . . . . 0.0 110.559 -178.364 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild full ' A' A ' 86' ' ' ASN . . . . . . . . . . . . . 11.8 m120 -61.44 -38.85 88.68 Favored 'General case' 0 N--CA 1.465 0.297 0 CA-C-O 120.689 0.28 . . . . 0.0 111.005 179.409 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 87' ' ' SER . . . . . . . . . . . . . 49.6 m -60.2 -44.38 95.16 Favored 'General case' 0 C--N 1.327 -0.378 0 CA-C-N 116.32 -0.4 . . . . 0.0 110.772 -179.707 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 88' ' ' TYR . . . . . 0.441 ' HB2' HD11 ' A' ' 72' ' ' LEU . 25.8 m-85 -62.56 -37.97 88.23 Favored 'General case' 0 C--N 1.331 -0.235 0 CA-C-N 116.452 -0.34 . . . . 0.0 110.495 177.706 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 89' ' ' LYS . . . . . 0.62 ' HA ' ' SG ' ' A' ' 92' ' ' CYS . 56.3 mtpt -66.09 -36.74 83.99 Favored 'General case' 0 C--N 1.331 -0.226 0 CA-C-N 116.201 -0.454 . . . . 0.0 110.589 178.522 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 90' ' ' ASN . . . . . 0.507 ' O ' ' HB2' ' A' ' 94' ' ' ASN . 27.3 t-20 -60.98 -33.34 73.07 Favored 'General case' 0 C--N 1.327 -0.382 0 CA-C-O 121.347 0.594 . . . . 0.0 110.375 176.234 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 91' ' ' TYR . . . . . . . . . . . . . 24.1 m-85 -72.18 -50.58 26.57 Favored 'General case' 0 C--N 1.322 -0.616 0 CA-C-N 116.064 -0.516 . . . . 0.0 110.841 178.783 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 92' ' ' CYS . . . . . 0.62 ' SG ' ' HA ' ' A' ' 89' ' ' LYS . 24.9 p -76.81 -40.82 46.73 Favored 'General case' 0 C--N 1.328 -0.331 0 N-CA-C 112.226 0.454 . . . . 0.0 112.226 -174.593 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 93' ' ' ARG . . . . . . . . . . . . . 35.6 ttt180 -78.17 -52.75 8.23 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-O 120.812 0.339 . . . . 0.0 111.834 -176.68 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 94' ' ' ASN . . . . . 0.507 ' HB2' ' O ' ' A' ' 90' ' ' ASN . 3.9 m-20 -77.88 -50.21 12.7 Favored 'General case' 0 C--N 1.324 -0.508 0 CA-C-O 120.976 0.417 . . . . 0.0 111.161 -173.266 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 95' ' ' HIS . . . . . . . . . . . . . 76.0 m80 -86.9 -54.12 4.52 Favored 'General case' 0 C--N 1.323 -0.564 0 CA-C-N 116.193 -0.458 . . . . 0.0 112.101 -173.827 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 96' ' ' LEU . . . . . 0.559 ' HB2' ' HA ' ' A' ' 92' ' ' CYS . 81.8 mt -87.54 26.81 1.2 Allowed 'General case' 0 C--N 1.326 -0.415 0 N-CA-C 111.789 0.292 . . . . 0.0 111.789 -173.471 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 97' ' ' SER . . . . . 0.534 ' N ' ' HD2' ' A' ' 98' ' ' PRO . 0.0 OUTLIER -56.66 -48.05 97.91 Favored Pre-proline 0 CA--C 1.54 0.595 0 N-CA-C 112.595 0.591 . . . . 0.0 112.595 -179.16 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild full ' A' A ' 98' ' ' PRO . . . . . 0.534 ' HD2' ' N ' ' A' ' 97' ' ' SER . 15.7 Cg_endo -58.62 -36.54 97.12 Favored 'Trans proline' 0 C--N 1.358 1.037 0 C-N-CA 122.032 1.821 . . . . 0.0 112.336 176.409 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 99' ' ' LEU . . . . . 0.434 HD22 HD22 ' A' ' 96' ' ' LEU . 8.1 mp -70.09 -33.65 72.15 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-N 116.304 -0.407 . . . . 0.0 110.503 -179.342 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 100' ' ' TYR . . . . . . . . . . . . . 62.9 t80 -57.42 -29.79 64.44 Favored 'General case' 0 C--N 1.327 -0.391 0 CA-C-N 115.541 -0.754 . . . . 0.0 110.926 179.272 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 101' ' ' MET . . . . . . . . . . . . . 47.4 ttm -86.6 -18.61 30.99 Favored 'General case' 0 C--N 1.325 -0.468 0 CA-C-N 116.008 -0.542 . . . . 0.0 110.88 -177.344 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 102' ' ' LYS . . . . . . . . . . . . . 89.2 mttt -91.02 165.2 13.66 Favored 'General case' 0 C--N 1.325 -0.495 0 CA-C-O 121.453 0.644 . . . . 0.0 111.944 -174.348 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 103' ' ' SER . . . . . 0.472 ' O ' HG13 ' A' ' 107' ' ' ILE . 18.1 t -95.02 172.2 8.29 Favored 'General case' 0 C--N 1.323 -0.582 0 CA-C-N 115.396 -0.82 . . . . 0.0 109.051 169.336 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 104' ' ' LEU . . . . . . . . . . . . . 89.0 mt -59.07 -43.72 91.8 Favored 'General case' 0 C--N 1.325 -0.458 0 N-CA-C 111.993 0.368 . . . . 0.0 111.993 -174.686 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 105' ' ' SER . . . . . . . . . . . . . 24.1 t -85.04 1.97 45.32 Favored 'General case' 0 C--N 1.326 -0.447 0 CA-C-O 121.099 0.476 . . . . 0.0 110.74 -177.315 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 106' ' ' GLU . . . . . . . . . . . . . 19.7 tp10 -102.36 -14.06 17.07 Favored 'General case' 0 C--N 1.322 -0.63 0 CA-C-O 121.268 0.556 . . . . 0.0 110.531 -178.128 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 107' ' ' ILE . . . . . 0.472 HG13 ' O ' ' A' ' 103' ' ' SER . 68.3 mt -83.81 140.38 16.27 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.45 0 CA-C-N 116.09 -0.504 . . . . 0.0 110.953 -178.626 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 108' ' ' LEU . . . . . . . . . . . . . 76.1 mt -110.81 151.22 42.76 Favored Pre-proline 0 C--N 1.324 -0.513 0 CA-C-N 116.023 -0.535 . . . . 0.0 109.71 178.161 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 109' ' ' PRO . . . . . . . . . . . . . 18.9 Cg_endo -61.08 -26.8 83.43 Favored 'Trans proline' 0 N--CA 1.464 -0.212 0 C-N-CA 121.979 1.786 . . . . 0.0 111.166 174.633 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 110' ' ' ALA . . . . . 0.425 ' HA ' ' HB3' ' A' ' 113' ' ' GLN . . . -71.48 -26.34 62.65 Favored 'General case' 0 N--CA 1.453 -0.288 0 CA-C-N 115.351 -0.841 . . . . 0.0 111.683 -178.78 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 111' ' ' ASP . . . . . 0.466 ' O ' HG13 ' A' ' 115' ' ' ILE . 29.7 m-20 -57.74 -57.15 14.02 Favored 'General case' 0 N--CA 1.463 0.223 0 CA-C-O 121.272 0.558 . . . . 0.0 109.648 176.426 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 112' ' ' ILE . . . . . . . . . . . . . 19.5 mt -67.23 -37.49 79.22 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.538 0 CA-C-N 115.449 -0.796 . . . . 0.0 110.337 -179.162 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 113' ' ' GLN . . . . . 0.425 ' HB3' ' HA ' ' A' ' 110' ' ' ALA . 23.4 tp60 -58.27 -50.12 74.71 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 115.864 -0.607 . . . . 0.0 111.446 179.651 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 114' ' ' SER . . . . . . . . . . . . . 31.6 p -64.7 -35.2 80.27 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 116.335 -0.393 . . . . 0.0 110.956 -177.963 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 115' ' ' ILE . . . . . 0.466 HG13 ' O ' ' A' ' 111' ' ' ASP . 92.7 mt -60.44 -53.3 50.69 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.299 0 CA-C-O 120.694 0.283 . . . . 0.0 110.359 175.979 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 116' ' ' ILE . . . . . . . . . . . . . 47.5 mm -60.16 -41.95 88.47 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.289 0 CA-C-N 116.121 -0.49 . . . . 0.0 110.924 -179.435 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 117' ' ' ASN . . . . . . . . . . . . . 27.9 t-20 -65.49 -32.67 74.41 Favored 'General case' 0 C--N 1.326 -0.447 0 CA-C-N 116.066 -0.515 . . . . 0.0 111.926 -176.896 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 118' ' ' GLU . . . . . . . . . . . . . 21.3 mt-10 -103.17 4.18 36.6 Favored 'General case' 0 C--N 1.329 -0.311 0 N-CA-C 112.176 0.436 . . . . 0.0 112.176 -177.663 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 119' ' ' THR . . . . . . . . . . . . . 96.7 m -97.85 112.06 24.12 Favored 'General case' 0 C--N 1.322 -0.596 0 CA-C-O 121.176 0.512 . . . . 0.0 110.239 173.636 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 120' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -93.86 88.62 5.82 Favored 'General case' 0 C--N 1.325 -0.458 0 CA-C-N 115.943 -0.571 . . . . 0.0 110.362 -177.869 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 121' ' ' LEU . . . . . 0.415 HD13 HG21 ' A' ' 125' ' ' THR . 57.6 mt -138.69 -174.7 3.9 Favored 'General case' 0 C--N 1.32 -0.694 0 CA-C-N 115.392 -0.822 . . . . 0.0 110.025 179.541 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 122' ' ' ALA . . . . . . . . . . . . . . . -64.85 147.39 53.36 Favored 'General case' 0 C--N 1.322 -0.612 0 CA-C-N 116.277 -0.42 . . . . 0.0 110.465 178.439 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 123' ' ' LYS . . . . . 0.51 ' HE3' ' O ' ' A' ' 158' ' ' LYS . 52.6 mttp -55.94 -33.96 65.21 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 115.997 -0.547 . . . . 0.0 111.353 -179.345 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 124' ' ' ASN . . . . . . . . . . . . . 65.5 t30 -64.74 -38.49 91.17 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 115.978 -0.555 . . . . 0.0 110.413 -179.987 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 125' ' ' THR . . . . . 0.475 ' O ' HG13 ' A' ' 129' ' ' ILE . 7.3 m -68.25 -37.52 80.85 Favored 'General case' 0 C--N 1.326 -0.417 0 CA-C-N 115.774 -0.648 . . . . 0.0 110.801 -179.444 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 126' ' ' LEU . . . . . . . . . . . . . 88.5 mt -61.84 -41.8 98.26 Favored 'General case' 0 C--O 1.234 0.289 0 CA-C-O 121.144 0.497 . . . . 0.0 110.221 178.595 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 127' ' ' LYS . . . . . 0.403 ' HG3' ' O ' ' A' ' 123' ' ' LYS . 93.5 mttt -63.49 -44.68 93.66 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 115.663 -0.698 . . . . 0.0 110.201 177.142 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 128' ' ' ALA . . . . . . . . . . . . . . . -57.57 -40.45 78.98 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 115.717 -0.674 . . . . 0.0 111.477 -178.404 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 129' ' ' ILE . . . . . 0.475 HG13 ' O ' ' A' ' 125' ' ' THR . 67.3 mt -62.63 -50.19 80.77 Favored 'Isoleucine or valine' 0 C--O 1.235 0.295 0 CA-C-N 116.478 -0.328 . . . . 0.0 110.687 178.809 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 130' ' ' ARG . . . . . . . . . . . . . 13.7 ttt180 -61.63 -45.68 93.02 Favored 'General case' 0 C--O 1.231 0.107 0 CA-C-N 116.467 -0.333 . . . . 0.0 110.782 178.106 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 131' ' ' ASN . . . . . . . . . . . . . 7.1 m-20 -58.29 -49.54 76.77 Favored 'General case' 0 C--N 1.325 -0.457 0 CA-C-N 116.36 -0.382 . . . . 0.0 111.49 -179.061 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 132' ' ' THR . . . . . 0.484 ' O ' HG13 ' A' ' 136' ' ' ILE . 52.9 m -54.76 -50.72 67.76 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 116.227 -0.442 . . . . 0.0 110.594 178.268 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 133' ' ' ALA . . . . . . . . . . . . . . . -61.06 -40.91 95.46 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.209 -0.451 . . . . 0.0 111.103 179.436 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 134' ' ' SER . . . . . 0.455 ' O ' ' HG3' ' A' ' 138' ' ' ARG . 58.7 m -59.29 -45.57 90.9 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.044 -0.526 . . . . 0.0 111.123 -179.884 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 135' ' ' GLN . . . . . . . . . . . . . 12.3 mm100 -66.0 -34.85 79.04 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.399 -0.364 . . . . 0.0 111.071 -177.716 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 136' ' ' ILE . . . . . 0.484 HG13 ' O ' ' A' ' 132' ' ' THR . 64.3 mt -64.68 -43.81 96.61 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.264 0 CA-C-O 120.843 0.354 . . . . 0.0 110.166 177.219 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 137' ' ' PHE . . . . . 0.531 ' O ' HG13 ' A' ' 141' ' ' ILE . 43.5 m-85 -63.9 -39.86 95.16 Favored 'General case' 0 C--N 1.332 -0.18 0 CA-C-N 116.179 -0.464 . . . . 0.0 110.671 176.346 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 138' ' ' ARG . . . . . 0.455 ' HG3' ' O ' ' A' ' 134' ' ' SER . 79.0 mtt180 -64.0 -36.38 83.8 Favored 'General case' 0 C--N 1.332 -0.185 0 CA-C-O 120.738 0.304 . . . . 0.0 110.634 178.605 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 139' ' ' LEU . . . . . . . . . . . . . 54.8 tp -59.22 -41.52 88.84 Favored 'General case' 0 C--N 1.326 -0.423 0 CA-C-N 116.056 -0.52 . . . . 0.0 110.043 176.13 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 140' ' ' ALA . . . . . . . . . . . . . . . -67.0 -36.3 81.86 Favored 'General case' 0 C--N 1.327 -0.385 0 CA-C-N 116.243 -0.435 . . . . 0.0 110.537 176.715 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 141' ' ' ILE . . . . . 0.604 ' HA ' ' O ' ' A' ' 146' ' ' ILE . 77.3 mt -63.51 -45.58 97.4 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.301 0 CA-C-N 116.083 -0.508 . . . . 0.0 110.582 176.776 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 142' ' ' GLU . . . . . . . . . . . . . 46.4 mt-10 -63.16 -27.66 69.52 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.015 -0.539 . . . . 0.0 111.159 179.534 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 143' ' ' ASN . . . . . . . . . . . . . 35.1 m-80 -95.97 11.85 32.48 Favored 'General case' 0 C--N 1.326 -0.421 0 CA-C-N 116.284 -0.416 . . . . 0.0 110.821 179.43 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 144' ' ' ARG . . . . . . . . . . . . . 81.5 mtm180 60.88 25.24 15.19 Favored 'General case' 0 N--CA 1.469 0.498 0 CA-C-N 115.7 -0.682 . . . . 0.0 112.553 174.589 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 145' ' ' ALA . . . . . . . . . . . . . . . -80.41 -42.35 22.92 Favored 'General case' 0 C--N 1.323 -0.553 0 CA-C-O 121.25 0.548 . . . . 0.0 110.309 177.835 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 146' ' ' ILE . . . . . 0.604 ' O ' ' HA ' ' A' ' 141' ' ' ILE . 13.7 tt -147.13 152.19 13.28 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.542 0 CA-C-N 115.677 -0.692 . . . . 0.0 109.336 179.412 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 147' ' ' ASP . . . . . . . . . . . . . 25.9 t70 -125.83 70.06 1.2 Allowed 'General case' 0 C--N 1.321 -0.634 0 N-CA-C 109.314 -0.625 . . . . 0.0 109.314 175.096 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 148' ' ' PHE . . . . . . . . . . . . . 61.5 t80 -169.48 133.8 1.37 Allowed 'General case' 0 C--N 1.324 -0.535 0 CA-C-N 115.618 -0.719 . . . . 0.0 109.647 -177.905 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 149' ' ' ASN . . . . . 0.417 HD21 ' HA ' ' A' ' 134' ' ' SER . 4.5 t-20 -115.7 96.3 46.06 Favored Pre-proline 0 C--N 1.322 -0.591 0 CA-C-N 116.478 -0.328 . . . . 0.0 110.737 179.369 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 150' ' ' PRO . . . . . . . . . . . . . 17.3 Cg_exo -67.4 -21.47 47.03 Favored 'Trans proline' 0 C--N 1.344 0.311 0 C-N-CA 122.852 2.368 . . . . 0.0 112.07 179.682 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 151' ' ' ALA . . . . . 0.407 ' HA ' HG23 ' A' ' 154' ' ' VAL . . . -72.18 -15.8 61.96 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-N 115.972 -0.558 . . . . 0.0 111.246 -178.582 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 152' ' ' ASP . . . . . . . . . . . . . 25.2 t70 -72.01 -19.56 61.84 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-O 121.212 0.53 . . . . 0.0 110.568 179.997 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 153' ' ' TYR . . . . . . . . . . . . . 97.8 m-85 -93.38 1.52 56.87 Favored 'General case' 0 C--N 1.326 -0.435 0 CA-C-N 115.958 -0.565 . . . . 0.0 111.251 -177.573 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 154' ' ' VAL . . . . . 0.407 HG23 ' HA ' ' A' ' 151' ' ' ALA . 48.8 t -77.2 110.82 13.3 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.373 0 CA-C-N 116.374 -0.376 . . . . 0.0 110.334 179.615 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 155' ' ' ARG . . . . . . . . . . . . . 77.0 mtt-85 -77.22 135.39 38.48 Favored 'General case' 0 C--N 1.321 -0.637 0 CA-C-N 116.181 -0.463 . . . . 0.0 110.273 179.279 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 156' ' ' ILE . . . . . . . . . . . . . 49.8 mm -105.06 104.92 49.48 Favored Pre-proline 0 C--N 1.321 -0.646 0 CA-C-N 115.736 -0.665 . . . . 0.0 109.77 -179.113 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 157' ' ' PRO . . . . . . . . . . . . . 58.2 Cg_endo -73.08 131.69 17.08 Favored 'Trans proline' 0 N--CA 1.461 -0.394 0 C-N-CA 122.412 2.075 . . . . 0.0 112.227 -177.937 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 158' ' ' LYS . . . . . 0.51 ' O ' ' HE3' ' A' ' 123' ' ' LYS . 95.7 mttt -92.25 -48.69 6.56 Favored 'General case' 0 C--N 1.322 -0.625 0 CA-C-N 116.043 -0.526 . . . . 0.0 110.068 179.604 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 159' ' ' ILE . . . . . . . . . . . . . 62.8 mt 69.0 98.74 0.05 OUTLIER 'Isoleucine or valine' 0 N--CA 1.463 0.207 0 CA-C-N 115.769 -0.65 . . . . 0.0 111.486 176.622 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 160' ' ' ALA . . . . . . . . . . . . . . . -111.09 26.82 10.3 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-O 121.581 0.705 . . . . 0.0 110.134 178.687 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 161' ' ' LEU . . . . . 0.406 ' O ' ' HD2' ' A' ' 163' ' ' HIS . 0.6 OUTLIER -152.05 46.03 0.76 Allowed 'General case' 0 C--N 1.317 -0.84 0 CA-C-N 114.762 -1.108 . . . . 0.0 110.401 -177.094 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild full ' A' A ' 162' ' ' GLU . . . . . . . . . . . . . 3.6 mp0 -52.18 113.55 1.06 Allowed 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 115.771 -0.65 . . . . 0.0 112.429 -174.762 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 163' ' ' HIS . . . . . 0.437 ' O ' ' HB3' ' A' ' 164' ' ' HIS . 8.0 p80 -131.48 -169.41 2.18 Favored 'General case' 0 C--N 1.325 -0.467 0 CA-C-N 115.248 -0.887 . . . . 0.0 109.136 176.356 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 164' ' ' HIS . . . . . 0.437 ' HB3' ' O ' ' A' ' 163' ' ' HIS . 74.2 t60 69.06 95.07 0.07 Allowed 'General case' 0 N--CA 1.466 0.351 0 N-CA-C 109.742 -0.466 . . . . 0.0 109.742 -176.816 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 165' ' ' HIS . . . . . . . . . . . . . 39.5 t60 62.13 29.84 17.63 Favored 'General case' 0 N--CA 1.466 0.346 0 CA-C-O 121.587 0.708 . . . . 0.0 109.521 -177.177 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 166' ' ' HIS . . . . . . . . . . . . . 26.7 m80 -129.94 116.76 19.09 Favored 'General case' 0 C--N 1.326 -0.45 0 CA-C-N 116.055 -0.52 . . . . 0.0 111.657 -177.319 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 167' ' ' HIS . . . . . . . . . . . . . 10.2 p80 -97.62 107.0 19.4 Favored 'General case' 0 C--N 1.322 -0.592 0 N-CA-C 108.084 -1.08 . . . . 0.0 108.084 168.111 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 168' ' ' HIS . . . . . . . . . . . . . 35.1 t-80 . . . . . 0 C--O 1.248 1.016 0 CA-C-O 118.563 -0.732 . . . . 0.0 110.417 -174.025 . . . . . . . . 0 0 . 1 . 017 nuclear nobuild full ' A' A ' 61' ' ' ARG . . . . . 0.469 ' NE ' ' HA ' ' A' ' 61' ' ' ARG . 4.1 mmp_? . . . . . 0 N--CA 1.479 0.991 0 N-CA-C 110.171 -0.307 . . . . 0.0 110.171 . . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 62' ' ' ASP . . . . . . . . . . . . . 16.3 m-20 -93.82 147.01 23.47 Favored 'General case' 0 C--N 1.32 -0.716 0 CA-C-O 120.964 0.411 . . . . 0.0 111.033 -176.897 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 63' ' ' SER . . . . . . . . . . . . . 21.9 p -118.8 148.18 43.12 Favored 'General case' 0 C--N 1.321 -0.637 0 CA-C-N 115.971 -0.559 . . . . 0.0 110.077 178.356 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 64' ' ' PHE . . . . . 0.408 ' HB3' ' O ' ' A' ' 99' ' ' LEU . 83.0 t80 -61.84 -42.44 99.04 Favored 'General case' 0 C--N 1.326 -0.445 0 CA-C-N 116.448 -0.342 . . . . 0.0 110.746 -177.055 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 65' ' ' GLY . . . . . . . . . . . . . . . -63.46 -30.64 78.21 Favored Glycine 0 C--N 1.329 0.188 0 C-N-CA 120.898 -0.668 . . . . 0.0 113.019 -178.534 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 66' ' ' ASP . . . . . . . . . . . . . 23.7 t70 -71.31 -45.18 63.64 Favored 'General case' 0 C--N 1.326 -0.434 0 CA-C-O 121.067 0.46 . . . . 0.0 110.574 -179.525 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 67' ' ' TRP . . . . . 0.44 ' HA ' ' HE2' ' A' ' 70' ' ' LYS . 83.2 m95 -74.79 -28.89 60.92 Favored 'General case' 0 C--N 1.325 -0.493 0 CA-C-N 116.285 -0.416 . . . . 0.0 110.942 178.559 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 68' ' ' ALA . . . . . . . . . . . . . . . -64.28 -37.15 86.48 Favored 'General case' 0 C--N 1.331 -0.219 0 CA-C-O 121.008 0.432 . . . . 0.0 110.142 173.971 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 69' ' ' GLU . . . . . . . . . . . . . 43.4 tt0 -59.08 -48.64 80.85 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 115.661 -0.699 . . . . 0.0 109.964 175.661 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 70' ' ' LYS . . . . . 0.44 ' HE2' ' HA ' ' A' ' 67' ' ' TRP . 19.2 mtmm -62.45 -31.63 72.38 Favored 'General case' 0 C--N 1.328 -0.326 0 CA-C-N 115.665 -0.698 . . . . 0.0 111.427 177.428 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 71' ' ' PHE . . . . . 0.417 ' CE2' HG23 ' A' ' 132' ' ' THR . 92.1 t80 -68.14 -45.13 74.44 Favored 'General case' 0 C--O 1.235 0.298 0 CA-C-O 120.578 0.228 . . . . 0.0 111.072 178.78 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 72' ' ' LEU . . . . . . . . . . . . . 8.0 mp -60.07 -42.5 94.69 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-O 121.09 0.471 . . . . 0.0 110.637 177.668 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 73' ' ' LYS . . . . . . . . . . . . . 58.2 mtpt -72.6 -24.6 61.1 Favored 'General case' 0 C--N 1.325 -0.457 0 CA-C-N 115.874 -0.603 . . . . 0.0 110.707 179.207 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 74' ' ' SER . . . . . . . . . . . . . 26.7 t -68.44 -51.32 44.97 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 115.89 -0.596 . . . . 0.0 110.277 177.634 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 75' ' ' LYS . . . . . 0.423 ' O ' HG22 ' A' ' 80' ' ' VAL . 5.2 mptp? -68.42 -27.93 66.62 Favored 'General case' 0 C--O 1.234 0.241 0 CA-C-O 120.865 0.364 . . . . 0.0 110.719 178.741 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 76' ' ' GLU . . . . . . . . . . . . . 36.0 tt0 -56.48 -47.84 78.39 Favored 'General case' 0 C--N 1.324 -0.534 0 CA-C-N 115.803 -0.635 . . . . 0.0 109.772 172.07 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 77' ' ' ALA . . . . . . . . . . . . . . . -75.06 -23.72 58.1 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 115.645 -0.707 . . . . 0.0 111.164 177.904 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 78' ' ' ASP . . . . . . . . . . . . . 20.2 t70 -63.58 -31.61 72.83 Favored 'General case' 0 N--CA 1.464 0.237 0 CA-C-O 121.194 0.521 . . . . 0.0 110.581 178.318 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 79' ' ' GLY . . . . . . . . . . . . . . . 105.14 21.06 9.17 Favored Glycine 0 N--CA 1.446 -0.656 0 C-N-CA 120.636 -0.792 . . . . 0.0 112.795 176.229 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 80' ' ' VAL . . . . . 0.423 HG22 ' O ' ' A' ' 75' ' ' LYS . 25.7 m -71.02 153.5 8.3 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.451 0 CA-C-O 120.838 0.352 . . . . 0.0 110.29 178.986 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 81' ' ' SER . . . . . . . . . . . . . 10.7 p -68.77 160.58 30.16 Favored 'General case' 0 C--N 1.323 -0.573 0 CA-C-N 116.131 -0.486 . . . . 0.0 110.67 179.476 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 82' ' ' VAL . . . . . . . . . . . . . 13.3 p -61.51 -34.35 61.13 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.393 0 CA-C-O 120.735 0.302 . . . . 0.0 110.514 179.6 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 83' ' ' SER . . . . . . . . . . . . . 4.0 p -66.79 -42.29 86.23 Favored 'General case' 0 C--O 1.236 0.387 0 CA-C-O 121.087 0.47 . . . . 0.0 110.282 177.497 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 84' ' ' GLN . . . . . . . . . . . . . 6.3 tp-100 -64.65 -43.87 92.25 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 115.809 -0.632 . . . . 0.0 110.019 176.936 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 85' ' ' LEU . . . . . 0.491 ' O ' ' HG3' ' A' ' 89' ' ' LYS . 52.7 tp -62.68 -45.15 94.12 Favored 'General case' 0 C--N 1.326 -0.431 0 CA-C-N 115.921 -0.581 . . . . 0.0 110.496 178.4 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 86' ' ' ASN . . . . . . . . . . . . . 78.1 m-20 -57.15 -35.49 69.59 Favored 'General case' 0 N--CA 1.464 0.233 0 CA-C-N 116.459 -0.337 . . . . 0.0 110.808 177.325 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 87' ' ' SER . . . . . . . . . . . . . 48.2 m -60.54 -45.36 94.17 Favored 'General case' 0 C--N 1.327 -0.393 0 CA-C-N 116.318 -0.401 . . . . 0.0 110.29 177.827 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 88' ' ' TYR . . . . . . . . . . . . . 54.1 m-85 -66.24 -38.85 88.86 Favored 'General case' 0 C--N 1.331 -0.229 0 CA-C-O 120.926 0.393 . . . . 0.0 110.842 179.126 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 89' ' ' LYS . . . . . 0.491 ' HG3' ' O ' ' A' ' 85' ' ' LEU . 51.7 mtpt -64.29 -40.96 97.02 Favored 'General case' 0 C--N 1.324 -0.504 0 CA-C-N 116.15 -0.477 . . . . 0.0 110.223 178.106 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 90' ' ' ASN . . . . . 0.493 ' O ' ' HB2' ' A' ' 94' ' ' ASN . 0.9 OUTLIER -66.2 -28.89 69.1 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.073 -0.512 . . . . 0.0 110.897 177.617 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild full ' A' A ' 91' ' ' TYR . . . . . . . . . . . . . 19.7 m-85 -71.88 -50.21 31.31 Favored 'General case' 0 C--N 1.323 -0.574 0 N-CA-C 109.905 -0.405 . . . . 0.0 109.905 174.381 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 92' ' ' CYS . . . . . 0.527 ' HA ' ' HB2' ' A' ' 96' ' ' LEU . 40.5 t -67.25 -54.62 19.29 Favored 'General case' 0 C--N 1.325 -0.458 0 CA-C-N 116.093 -0.503 . . . . 0.0 112.324 -176.601 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 93' ' ' ARG . . . . . 0.527 ' O ' ' HB3' ' A' ' 97' ' ' SER . 7.8 mpt_? -71.33 -36.82 71.7 Favored 'General case' 0 C--N 1.328 -0.361 0 N-CA-C 112.542 0.571 . . . . 0.0 112.542 -172.539 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 94' ' ' ASN . . . . . 0.493 ' HB2' ' O ' ' A' ' 90' ' ' ASN . 3.4 m-20 -93.72 -55.94 3.07 Favored 'General case' 0 C--N 1.324 -0.525 0 CA-C-O 120.871 0.367 . . . . 0.0 111.73 -175.412 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 95' ' ' HIS . . . . . . . . . . . . . 79.6 m80 -84.92 -47.18 10.55 Favored 'General case' 0 C--N 1.323 -0.549 0 CA-C-N 116.212 -0.449 . . . . 0.0 111.515 -170.346 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 96' ' ' LEU . . . . . 0.527 ' HB2' ' HA ' ' A' ' 92' ' ' CYS . 88.6 mt -88.62 19.51 3.91 Favored 'General case' 0 C--N 1.324 -0.536 0 CA-C-N 116.388 -0.369 . . . . 0.0 111.035 -178.237 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 97' ' ' SER . . . . . 0.558 ' OG ' ' HD3' ' A' ' 98' ' ' PRO . 12.4 p -60.76 -42.09 85.79 Favored Pre-proline 0 CA--C 1.542 0.664 0 N-CA-C 113.102 0.778 . . . . 0.0 113.102 -177.986 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 98' ' ' PRO . . . . . 0.558 ' HD3' ' OG ' ' A' ' 97' ' ' SER . 17.3 Cg_exo -65.81 -33.57 43.07 Favored 'Trans proline' 0 C--N 1.359 1.079 0 C-N-CA 121.424 1.416 . . . . 0.0 111.737 178.396 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 99' ' ' LEU . . . . . 0.408 ' O ' ' HB3' ' A' ' 64' ' ' PHE . 68.0 mt -79.72 -29.11 40.55 Favored 'General case' 0 C--N 1.327 -0.382 0 CA-C-N 115.742 -0.663 . . . . 0.0 110.679 -177.221 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 100' ' ' TYR . . . . . . . . . . . . . 46.9 t80 -52.79 -40.31 63.09 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 115.775 -0.648 . . . . 0.0 110.916 179.794 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 101' ' ' MET . . . . . . . . . . . . . 21.0 ptp -95.81 14.16 24.23 Favored 'General case' 0 C--N 1.323 -0.567 0 CA-C-N 115.931 -0.577 . . . . 0.0 111.423 -176.51 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 102' ' ' LYS . . . . . 0.505 ' HG3' ' O ' ' A' ' 98' ' ' PRO . 96.7 mttt -104.33 152.88 21.72 Favored 'General case' 0 C--N 1.324 -0.536 0 CA-C-O 121.054 0.454 . . . . 0.0 111.016 178.442 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 103' ' ' SER . . . . . 0.435 ' O ' ' HG2' ' A' ' 106' ' ' GLU . 37.9 t -70.74 146.37 49.88 Favored 'General case' 0 C--N 1.322 -0.615 0 CA-C-N 115.57 -0.741 . . . . 0.0 109.576 176.416 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 104' ' ' LEU . . . . . . . . . . . . . 30.6 tp -60.47 -31.87 70.87 Favored 'General case' 0 C--N 1.323 -0.574 0 CA-C-N 116.21 -0.45 . . . . 0.0 111.038 -176.56 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 105' ' ' SER . . . . . . . . . . . . . 56.3 p -87.89 -17.35 31.59 Favored 'General case' 0 C--N 1.329 -0.319 0 N-CA-C 112.29 0.478 . . . . 0.0 112.29 -176.019 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 106' ' ' GLU . . . . . 0.435 ' HG2' ' O ' ' A' ' 103' ' ' SER . 8.4 pt-20 -89.03 -18.53 27.14 Favored 'General case' 0 N--CA 1.464 0.234 0 C-N-CA 120.755 -0.378 . . . . 0.0 111.289 -174.263 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 107' ' ' ILE . . . . . 0.434 HG13 ' O ' ' A' ' 103' ' ' SER . 66.3 mt -73.0 111.08 6.87 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.467 0 CA-C-O 120.993 0.425 . . . . 0.0 110.961 -176.412 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 108' ' ' LEU . . . . . 0.44 ' HA ' ' HD3' ' A' ' 109' ' ' PRO . 1.7 pp -97.46 145.4 29.61 Favored Pre-proline 0 C--N 1.323 -0.58 0 CA-C-N 115.83 -0.623 . . . . 0.0 110.102 176.951 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 109' ' ' PRO . . . . . 0.442 ' HG3' ' HA ' ' A' ' 150' ' ' PRO . 52.4 Cg_exo -54.96 -33.19 81.83 Favored 'Trans proline' 0 C--N 1.343 0.283 0 C-N-CA 123.438 2.759 . . . . 0.0 113.74 -174.516 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 110' ' ' ALA . . . . . . . . . . . . . . . -59.62 -32.32 70.31 Favored 'General case' 0 C--N 1.331 -0.209 0 CA-C-O 120.697 0.284 . . . . 0.0 111.43 -178.98 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 111' ' ' ASP . . . . . 0.437 ' H ' HD12 ' A' ' 108' ' ' LEU . 38.7 t70 -73.41 -46.82 46.47 Favored 'General case' 0 C--N 1.325 -0.473 0 CA-C-O 121.05 0.453 . . . . 0.0 110.374 -177.159 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 112' ' ' ILE . . . . . . . . . . . . . 27.9 mt -62.01 -39.93 85.49 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.399 0 CA-C-N 115.686 -0.688 . . . . 0.0 110.223 177.992 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 113' ' ' GLN . . . . . 0.42 ' O ' ' HB ' ' A' ' 116' ' ' ILE . 14.6 tm0? -65.54 -35.12 79.92 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 115.889 -0.596 . . . . 0.0 109.857 179.175 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 114' ' ' SER . . . . . 0.471 ' O ' ' HG2' ' A' ' 118' ' ' GLU . 57.5 m -64.74 -38.95 92.74 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.434 -0.348 . . . . 0.0 110.453 177.225 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 115' ' ' ILE . . . . . . . . . . . . . 67.7 mt -62.42 -36.55 75.38 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.337 0 CA-C-O 121.175 0.512 . . . . 0.0 109.951 176.235 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 116' ' ' ILE . . . . . 0.42 ' HB ' ' O ' ' A' ' 113' ' ' GLN . 42.1 mm -61.69 -42.09 92.96 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.338 0 CA-C-N 115.675 -0.693 . . . . 0.0 110.339 175.21 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 117' ' ' ASN . . . . . . . . . . . . . 83.9 m-20 -66.47 -32.02 73.13 Favored 'General case' 0 N--CA 1.466 0.368 0 CA-C-N 116.121 -0.491 . . . . 0.0 110.908 178.627 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 118' ' ' GLU . . . . . 0.471 ' HG2' ' O ' ' A' ' 114' ' ' SER . 65.9 mm-40 -80.63 -17.84 49.98 Favored 'General case' 0 C--N 1.327 -0.383 0 CA-C-N 116.146 -0.479 . . . . 0.0 111.011 -178.306 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 119' ' ' THR . . . . . . . . . . . . . 36.4 m -87.97 113.71 23.88 Favored 'General case' 0 C--N 1.321 -0.638 0 CA-C-N 116.13 -0.486 . . . . 0.0 109.871 178.69 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 120' ' ' LYS . . . . . . . . . . . . . 59.5 pttt -90.53 29.19 1.33 Allowed 'General case' 0 C--N 1.326 -0.424 0 CA-C-N 116.005 -0.543 . . . . 0.0 111.322 -175.294 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 121' ' ' LEU . . . . . 0.541 HD13 HG21 ' A' ' 125' ' ' THR . 95.9 mt -91.92 162.27 14.48 Favored 'General case' 0 C--N 1.32 -0.707 0 CA-C-N 116.167 -0.47 . . . . 0.0 109.999 179.348 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 122' ' ' ALA . . . . . . . . . . . . . . . -64.81 163.22 14.61 Favored 'General case' 0 C--N 1.326 -0.431 0 CA-C-O 120.979 0.419 . . . . 0.0 111.714 -176.967 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 123' ' ' LYS . . . . . 0.501 ' O ' ' HG3' ' A' ' 127' ' ' LYS . 19.7 pttp -55.05 -35.65 64.72 Favored 'General case' 0 C--N 1.331 -0.197 0 CA-C-N 115.624 -0.717 . . . . 0.0 111.897 -177.804 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 124' ' ' ASN . . . . . . . . . . . . . 48.5 t-20 -56.99 -52.14 66.46 Favored 'General case' 0 C--O 1.234 0.249 0 CA-C-O 121.156 0.503 . . . . 0.0 110.16 178.975 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 125' ' ' THR . . . . . 0.541 HG21 HD13 ' A' ' 121' ' ' LEU . 1.3 m -66.77 -37.2 84.12 Favored 'General case' 0 N--CA 1.449 -0.493 0 CA-C-N 115.801 -0.636 . . . . 0.0 110.809 -178.814 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 126' ' ' LEU . . . . . . . . . . . . . 90.9 mt -61.22 -43.52 98.75 Favored 'General case' 0 C--O 1.234 0.28 0 CA-C-N 116.274 -0.421 . . . . 0.0 110.873 178.52 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 127' ' ' LYS . . . . . 0.532 ' HG2' HG21 ' A' ' 156' ' ' ILE . 47.6 mtpt -64.15 -41.53 97.14 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.307 -0.406 . . . . 0.0 110.455 178.21 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 128' ' ' ALA . . . . . . . . . . . . . . . -60.36 -44.09 95.9 Favored 'General case' 0 C--O 1.234 0.246 0 CA-C-N 116.168 -0.469 . . . . 0.0 111.173 179.855 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 129' ' ' ILE . . . . . 0.463 HG13 ' O ' ' A' ' 125' ' ' THR . 77.6 mt -62.54 -45.79 97.96 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.291 0 CA-C-N 116.249 -0.432 . . . . 0.0 110.27 177.728 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 130' ' ' ARG . . . . . 0.543 ' CZ ' ' HA ' ' A' ' 152' ' ' ASP . 0.3 OUTLIER -65.21 -40.59 94.35 Favored 'General case' 0 C--N 1.331 -0.206 0 CA-C-N 116.056 -0.52 . . . . 0.0 110.485 -179.139 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild full ' A' A ' 131' ' ' ASN . . . . . 0.602 ' O ' ' HG2' ' A' ' 135' ' ' GLN . 9.2 m120 -59.67 -52.31 66.08 Favored 'General case' 0 CA--C 1.518 -0.26 0 CA-C-N 116.291 -0.413 . . . . 0.0 110.298 177.25 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 132' ' ' THR . . . . . 0.49 ' O ' HG13 ' A' ' 136' ' ' ILE . 55.1 m -51.7 -49.41 62.49 Favored 'General case' 0 C--N 1.329 -0.316 0 O-C-N 123.678 0.611 . . . . 0.0 110.785 178.74 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 133' ' ' ALA . . . . . . . . . . . . . . . -63.81 -44.15 94.12 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.19 -0.459 . . . . 0.0 111.508 -179.744 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 134' ' ' SER . . . . . . . . . . . . . 34.6 p -66.71 -29.51 69.52 Favored 'General case' 0 C--N 1.33 -0.254 0 C-N-CA 121.168 -0.213 . . . . 0.0 111.463 -177.141 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 135' ' ' GLN . . . . . 0.602 ' HG2' ' O ' ' A' ' 131' ' ' ASN . 11.1 mm100 -73.03 -32.68 65.25 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-O 120.784 0.326 . . . . 0.0 110.237 178.094 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 136' ' ' ILE . . . . . 0.49 HG13 ' O ' ' A' ' 132' ' ' THR . 75.2 mt -64.33 -48.06 86.97 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.21 0 CA-C-N 116.159 -0.473 . . . . 0.0 110.058 176.265 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 137' ' ' PHE . . . . . 0.513 ' O ' HG13 ' A' ' 141' ' ' ILE . 62.5 m-85 -62.38 -40.73 97.4 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.147 -0.479 . . . . 0.0 110.532 176.241 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 138' ' ' ARG . . . . . 0.419 HH11 ' HD2' ' A' ' 138' ' ' ARG . 9.7 mtp180 -57.02 -43.1 81.53 Favored 'General case' 0 CA--C 1.519 -0.247 0 CA-C-N 116.331 -0.395 . . . . 0.0 111.109 176.56 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 139' ' ' LEU . . . . . . . . . . . . . 41.2 tp -60.63 -35.76 76.97 Favored 'General case' 0 C--N 1.326 -0.451 0 CA-C-N 116.004 -0.544 . . . . 0.0 110.34 178.938 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 140' ' ' ALA . . . . . . . . . . . . . . . -72.74 -38.76 67.3 Favored 'General case' 0 C--N 1.324 -0.535 0 CA-C-N 116.12 -0.491 . . . . 0.0 110.652 176.555 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 141' ' ' ILE . . . . . 0.637 ' HA ' ' O ' ' A' ' 146' ' ' ILE . 76.1 mt -64.49 -47.37 89.55 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.272 0 CA-C-N 116.535 -0.302 . . . . 0.0 111.502 179.282 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 142' ' ' GLU . . . . . . . . . . . . . 13.0 pt-20 -67.15 -24.6 65.91 Favored 'General case' 0 C--N 1.33 -0.242 0 CA-C-O 120.787 0.327 . . . . 0.0 111.493 -176.796 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 143' ' ' ASN . . . . . . . . . . . . . 37.8 m-80 -99.11 9.45 43.47 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-O 120.823 0.344 . . . . 0.0 110.408 177.791 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 144' ' ' ARG . . . . . . . . . . . . . 25.9 mtm180 59.47 50.93 6.99 Favored 'General case' 0 N--CA 1.463 0.196 0 CA-C-N 115.53 -0.759 . . . . 0.0 112.707 174.827 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 145' ' ' ALA . . . . . . . . . . . . . . . -101.99 -35.36 8.99 Favored 'General case' 0 C--N 1.323 -0.549 0 CA-C-O 121.446 0.641 . . . . 0.0 109.624 170.384 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 146' ' ' ILE . . . . . 0.637 ' O ' ' HA ' ' A' ' 141' ' ' ILE . 13.5 tt -144.32 158.34 15.25 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.458 0 N-CA-C 108.663 -0.865 . . . . 0.0 108.663 176.322 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 147' ' ' ASP . . . . . . . . . . . . . 7.8 p-10 -121.57 16.72 11.22 Favored 'General case' 0 C--N 1.324 -0.536 0 CA-C-O 121.002 0.429 . . . . 0.0 110.766 -177.992 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 148' ' ' PHE . . . . . 0.465 ' H ' HG12 ' A' ' 146' ' ' ILE . 67.6 t80 -135.55 137.6 42.18 Favored 'General case' 0 C--N 1.324 -0.531 0 CA-C-N 116.012 -0.54 . . . . 0.0 109.757 -176.609 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 149' ' ' ASN . . . . . . . . . . . . . 43.0 t-20 -115.47 89.69 22.92 Favored Pre-proline 0 C--N 1.324 -0.538 0 CA-C-N 116.558 -0.292 . . . . 0.0 110.557 -179.311 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 150' ' ' PRO . . . . . 0.442 ' HA ' ' HG3' ' A' ' 109' ' ' PRO . 28.1 Cg_exo -61.71 -32.12 86.48 Favored 'Trans proline' 0 C--N 1.345 0.382 0 C-N-CA 122.78 2.32 . . . . 0.0 111.861 -179.208 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 151' ' ' ALA . . . . . . . . . . . . . . . -67.53 -30.57 70.27 Favored 'General case' 0 C--N 1.326 -0.445 0 CA-C-N 115.768 -0.651 . . . . 0.0 110.969 -177.932 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 152' ' ' ASP . . . . . 0.543 ' HA ' ' CZ ' ' A' ' 130' ' ' ARG . 33.6 t70 -77.03 -22.3 53.24 Favored 'General case' 0 C--N 1.326 -0.447 0 CA-C-O 121.419 0.628 . . . . 0.0 110.159 179.912 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 153' ' ' TYR . . . . . . . . . . . . . 29.6 t80 -85.14 -1.47 56.92 Favored 'General case' 0 C--N 1.324 -0.519 0 CA-C-N 115.562 -0.744 . . . . 0.0 109.786 178.997 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 154' ' ' VAL . . . . . . . . . . . . . 86.8 t -70.82 118.61 15.7 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.316 0 CA-C-N 115.959 -0.564 . . . . 0.0 109.499 173.412 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 155' ' ' ARG . . . . . . . . . . . . . 28.5 ttt85 -84.68 111.57 19.69 Favored 'General case' 0 C--N 1.319 -0.724 0 CA-C-N 116.115 -0.493 . . . . 0.0 110.355 -176.98 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 156' ' ' ILE . . . . . 0.532 HG21 ' HG2' ' A' ' 127' ' ' LYS . 47.6 mm -89.53 120.64 69.6 Favored Pre-proline 0 C--N 1.324 -0.505 0 CA-C-N 115.604 -0.726 . . . . 0.0 110.109 -178.727 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 157' ' ' PRO . . . . . 0.434 ' HD3' ' HA ' ' A' ' 156' ' ' ILE . 6.5 Cg_exo -73.39 130.49 15.13 Favored 'Trans proline' 0 N--CA 1.453 -0.861 0 C-N-CA 122.298 1.999 . . . . 0.0 111.123 177.376 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 158' ' ' LYS . . . . . . . . . . . . . 28.2 mtpp -94.63 1.51 55.58 Favored 'General case' 0 C--N 1.321 -0.661 0 CA-C-O 121.662 0.744 . . . . 0.0 109.386 177.64 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 159' ' ' ILE . . . . . . . . . . . . . 45.8 mt -81.71 87.14 1.73 Allowed 'Isoleucine or valine' 0 N--CA 1.45 -0.473 0 CA-C-N 114.995 -1.002 . . . . 0.0 110.128 179.766 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 160' ' ' ALA . . . . . . . . . . . . . . . -123.51 24.69 8.51 Favored 'General case' 0 C--N 1.321 -0.667 0 CA-C-N 115.694 -0.684 . . . . 0.0 109.312 177.121 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 161' ' ' LEU . . . . . . . . . . . . . 83.1 mt -54.73 117.47 3.41 Favored 'General case' 0 C--N 1.319 -0.757 0 CA-C-N 114.441 -1.254 . . . . 0.0 111.786 -176.072 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 162' ' ' GLU . . . . . . . . . . . . . 34.3 tt0 -69.82 -51.5 33.06 Favored 'General case' 0 C--N 1.327 -0.382 0 CA-C-N 115.953 -0.567 . . . . 0.0 109.857 175.09 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 163' ' ' HIS . . . . . . . . . . . . . 32.4 m80 -100.42 134.16 43.79 Favored 'General case' 0 C--N 1.324 -0.502 0 CA-C-N 115.594 -0.73 . . . . 0.0 110.073 178.608 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 164' ' ' HIS . . . . . . . . . . . . . 8.1 t60 -71.81 104.12 3.34 Favored 'General case' 0 C--N 1.322 -0.607 0 CA-C-N 116.04 -0.527 . . . . 0.0 109.887 178.206 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 165' ' ' HIS . . . . . 0.554 ' HD2' ' HA ' ' A' ' 168' ' ' HIS . 73.7 t60 -67.01 113.94 5.41 Favored 'General case' 0 C--N 1.323 -0.547 0 N-CA-C 109.111 -0.7 . . . . 0.0 109.111 176.251 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 166' ' ' HIS . . . . . . . . . . . . . 11.0 t60 -41.61 -66.06 0.38 Allowed 'General case' 0 N--CA 1.472 0.671 0 O-C-N 123.943 0.777 . . . . 0.0 111.995 -171.86 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 167' ' ' HIS . . . . . . . . . . . . . 11.0 t60 -115.95 103.81 10.97 Favored 'General case' 0 C--N 1.322 -0.592 0 N-CA-C 109.437 -0.579 . . . . 0.0 109.437 174.156 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 168' ' ' HIS . . . . . 0.554 ' HA ' ' HD2' ' A' ' 165' ' ' HIS . 18.5 p80 . . . . . 0 C--O 1.246 0.877 0 CA-C-O 118.367 -0.825 . . . . 0.0 110.176 179.541 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 61' ' ' ARG . . . . . . . . . . . . . 49.8 mtm180 . . . . . 0 N--CA 1.481 1.079 0 N-CA-C 110.278 -0.267 . . . . 0.0 110.278 . . . . . . . . . 0 0 . 1 . 018 nuclear nobuild full ' A' A ' 62' ' ' ASP . . . . . . . . . . . . . 15.8 m-20 50.31 76.88 0.13 Allowed 'General case' 0 N--CA 1.465 0.292 0 O-C-N 123.796 0.685 . . . . 0.0 111.666 179.295 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 63' ' ' SER . . . . . 0.56 ' HA ' ' HA ' ' A' ' 103' ' ' SER . 7.6 m -80.39 153.28 28.41 Favored 'General case' 0 C--N 1.323 -0.558 0 CA-C-N 116.062 -0.517 . . . . 0.0 109.844 178.628 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 64' ' ' PHE . . . . . 0.539 ' HB2' HD11 ' A' ' 107' ' ' ILE . 84.1 t80 -64.42 -42.52 95.99 Favored 'General case' 0 C--N 1.326 -0.455 0 N-CA-C 109.834 -0.432 . . . . 0.0 109.834 178.639 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 65' ' ' GLY . . . . . . . . . . . . . . . -62.8 -29.43 73.97 Favored Glycine 0 N--CA 1.45 -0.424 0 C-N-CA 120.784 -0.722 . . . . 0.0 112.083 176.137 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 66' ' ' ASP . . . . . . . . . . . . . 20.1 t70 -68.04 -48.13 66.5 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-O 120.837 0.351 . . . . 0.0 110.083 177.386 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 67' ' ' TRP . . . . . . . . . . . . . 52.8 m95 -70.99 -30.49 66.76 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 115.94 -0.573 . . . . 0.0 111.573 178.497 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 68' ' ' ALA . . . . . 0.511 ' O ' ' HG ' ' A' ' 72' ' ' LEU . . . -60.01 -49.34 78.04 Favored 'General case' 0 C--N 1.328 -0.359 0 N-CA-C 109.812 -0.44 . . . . 0.0 109.812 173.813 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 69' ' ' GLU . . . . . . . . . . . . . 5.6 mm-40 -58.19 -41.72 84.54 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 115.976 -0.556 . . . . 0.0 110.843 175.918 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 70' ' ' LYS . . . . . . . . . . . . . 61.6 tttm -62.45 -47.93 81.89 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.3 -0.409 . . . . 0.0 110.219 179.299 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 71' ' ' PHE . . . . . . . . . . . . . 33.7 t80 -59.56 -49.61 77.12 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 115.96 -0.564 . . . . 0.0 110.742 176.955 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 72' ' ' LEU . . . . . 0.511 ' HG ' ' O ' ' A' ' 68' ' ' ALA . 91.6 mt -61.01 -35.74 77.67 Favored 'General case' 0 C--N 1.327 -0.401 0 CA-C-N 116.281 -0.418 . . . . 0.0 111.154 -178.918 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 73' ' ' LYS . . . . . 0.401 ' HD3' ' HA ' ' A' ' 73' ' ' LYS . 61.8 mmtt -72.45 -41.64 65.89 Favored 'General case' 0 C--N 1.327 -0.376 0 C-N-CA 121.234 -0.186 . . . . 0.0 111.379 178.52 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 74' ' ' SER . . . . . . . . . . . . . 12.3 p -68.17 -29.43 68.31 Favored 'General case' 0 C--N 1.327 -0.396 0 CA-C-O 120.956 0.408 . . . . 0.0 110.399 177.139 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 75' ' ' LYS . . . . . . . . . . . . . 45.5 tptt -78.22 -31.43 49.36 Favored 'General case' 0 N--CA 1.446 -0.666 0 CA-C-O 121.085 0.469 . . . . 0.0 110.028 177.154 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 76' ' ' GLU . . . . . . . . . . . . . 37.1 tt0 -63.78 -40.34 96.44 Favored 'General case' 0 C--N 1.326 -0.431 0 CA-C-N 115.768 -0.651 . . . . 0.0 109.863 175.485 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 77' ' ' ALA . . . . . . . . . . . . . . . -80.02 -18.02 51.28 Favored 'General case' 0 C--N 1.327 -0.412 0 CA-C-N 115.891 -0.595 . . . . 0.0 111.123 176.318 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 78' ' ' ASP . . . . . . . . . . . . . 28.5 t70 -68.45 -21.41 64.65 Favored 'General case' 0 N--CA 1.465 0.3 0 CA-C-N 115.913 -0.585 . . . . 0.0 110.538 178.771 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 79' ' ' GLY . . . . . . . . . . . . . . . 102.51 71.26 0.89 Allowed Glycine 0 N--CA 1.447 -0.622 0 C-N-CA 120.734 -0.746 . . . . 0.0 112.276 177.387 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 80' ' ' VAL . . . . . . . . . . . . . 28.0 m -123.87 148.62 27.93 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.5 0 CA-C-O 121.083 0.468 . . . . 0.0 110.763 179.765 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 81' ' ' SER . . . . . . . . . . . . . 14.6 m -75.9 162.46 28.1 Favored 'General case' 0 C--N 1.322 -0.618 0 CA-C-N 115.649 -0.705 . . . . 0.0 109.941 177.093 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 82' ' ' VAL . . . . . . . . . . . . . 57.0 t -58.12 -45.23 88.58 Favored 'Isoleucine or valine' 0 C--O 1.222 -0.375 0 CA-C-N 116.414 -0.357 . . . . 0.0 111.195 -176.566 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 83' ' ' SER . . . . . . . . . . . . . 17.2 t -65.46 -32.65 74.37 Favored 'General case' 0 C--N 1.326 -0.419 0 CA-C-O 120.874 0.368 . . . . 0.0 111.272 -177.955 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 84' ' ' GLN . . . . . . . . . . . . . 8.7 tp-100 -69.85 -42.61 73.33 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-O 121.074 0.464 . . . . 0.0 110.314 179.258 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 85' ' ' LEU . . . . . . . . . . . . . 25.5 tp -75.07 -26.73 59.57 Favored 'General case' 0 C--N 1.321 -0.641 0 CA-C-O 121.282 0.563 . . . . 0.0 109.924 178.556 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 86' ' ' ASN . . . . . . . . . . . . . 26.5 t-20 -64.54 -47.7 77.81 Favored 'General case' 0 C--N 1.325 -0.464 0 CA-C-N 115.314 -0.857 . . . . 0.0 110.454 176.498 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 87' ' ' SER . . . . . . . . . . . . . 11.3 p -65.14 -35.89 82.55 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.295 -0.411 . . . . 0.0 110.623 179.75 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 88' ' ' TYR . . . . . . . . . . . . . 11.5 m-85 -57.99 -43.77 86.78 Favored 'General case' 0 C--O 1.234 0.28 0 CA-C-O 120.858 0.361 . . . . 0.0 110.393 174.265 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 89' ' ' LYS . . . . . . . . . . . . . 63.9 mttp -62.69 -38.57 90.92 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 116.044 -0.525 . . . . 0.0 110.605 176.617 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 90' ' ' ASN . . . . . 0.415 ' O ' ' HB3' ' A' ' 94' ' ' ASN . 95.4 m-20 -62.64 -42.94 99.88 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.201 -0.454 . . . . 0.0 111.242 -178.9 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 91' ' ' TYR . . . . . . . . . . . . . 43.3 m-85 -59.25 -45.67 90.56 Favored 'General case' 0 C--O 1.235 0.334 0 CA-C-O 121.09 0.471 . . . . 0.0 110.14 177.217 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 92' ' ' CYS . . . . . 0.613 ' HA ' ' HB2' ' A' ' 96' ' ' LEU . 57.9 m -71.45 -43.52 66.53 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 115.626 -0.715 . . . . 0.0 112.014 -175.552 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 93' ' ' ARG . . . . . . . . . . . . . 18.8 mtp180 -84.58 -7.77 59.14 Favored 'General case' 0 C--N 1.325 -0.457 0 N-CA-C 112.454 0.538 . . . . 0.0 112.454 -173.576 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 94' ' ' ASN . . . . . 0.415 ' HB3' ' O ' ' A' ' 90' ' ' ASN . 12.3 t-20 -111.1 -61.26 1.72 Allowed 'General case' 0 C--N 1.328 -0.355 0 CA-C-O 120.769 0.319 . . . . 0.0 111.859 179.006 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 95' ' ' HIS . . . . . . . . . . . . . 0.2 OUTLIER -87.67 -34.57 18.39 Favored 'General case' 0 C--N 1.324 -0.531 0 N-CA-C 112.363 0.505 . . . . 0.0 112.363 -175.473 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 96' ' ' LEU . . . . . 0.613 ' HB2' ' HA ' ' A' ' 92' ' ' CYS . 85.4 mt -91.65 12.45 21.05 Favored 'General case' 0 C--N 1.324 -0.507 0 C-N-CA 121.215 -0.194 . . . . 0.0 111.212 -176.809 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 97' ' ' SER . . . . . 0.511 ' N ' ' HD2' ' A' ' 98' ' ' PRO . 18.6 m -50.85 -50.2 75.46 Favored Pre-proline 0 CA--C 1.539 0.541 0 N-CA-C 112.284 0.476 . . . . 0.0 112.284 179.483 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 98' ' ' PRO . . . . . 0.511 ' HD2' ' N ' ' A' ' 97' ' ' SER . 13.8 Cg_endo -58.09 -41.33 68.85 Favored 'Trans proline' 0 C--N 1.358 1.034 0 C-N-CA 121.962 1.775 . . . . 0.0 112.585 177.622 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 99' ' ' LEU . . . . . 0.406 ' O ' ' HB3' ' A' ' 64' ' ' PHE . 11.2 mp -79.8 -29.74 40.37 Favored 'General case' 0 C--N 1.326 -0.416 0 CA-C-N 116.459 -0.337 . . . . 0.0 111.801 -174.972 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 100' ' ' TYR . . . . . . . . . . . . . 46.3 t80 -52.74 -40.73 63.35 Favored 'General case' 0 C--N 1.328 -0.349 0 C-N-CA 122.795 0.438 . . . . 0.0 111.434 -176.738 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 101' ' ' MET . . . . . . . . . . . . . 64.5 mtt -89.94 -0.53 57.62 Favored 'General case' 0 C--N 1.325 -0.469 0 CA-C-N 116.258 -0.428 . . . . 0.0 111.69 -176.755 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 102' ' ' LYS . . . . . 0.458 ' HG3' ' O ' ' A' ' 98' ' ' PRO . 97.3 mttt -91.13 161.89 14.9 Favored 'General case' 0 C--N 1.326 -0.444 0 CA-C-O 121.047 0.451 . . . . 0.0 110.438 179.493 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 103' ' ' SER . . . . . 0.56 ' HA ' ' HA ' ' A' ' 63' ' ' SER . 29.0 t -82.12 154.87 25.33 Favored 'General case' 0 N--CA 1.447 -0.598 0 N-CA-C 108.881 -0.785 . . . . 0.0 108.881 172.423 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 104' ' ' LEU . . . . . . . . . . . . . 23.6 tp -61.62 -25.35 67.3 Favored 'General case' 0 C--N 1.321 -0.671 0 CA-C-O 121.092 0.473 . . . . 0.0 110.4 -179.041 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 105' ' ' SER . . . . . . . . . . . . . 35.5 t -86.27 -14.4 43.87 Favored 'General case' 0 C--N 1.327 -0.377 0 CA-C-N 116.003 -0.544 . . . . 0.0 111.375 178.855 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 106' ' ' GLU . . . . . 0.525 ' HG3' ' HB3' ' A' ' 103' ' ' SER . 49.4 mt-10 -93.03 4.72 53.52 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-O 120.861 0.362 . . . . 0.0 111.113 -177.258 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 107' ' ' ILE . . . . . 0.55 HG21 ' HZ ' ' A' ' 137' ' ' PHE . 74.7 mt -95.81 118.13 41.42 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.756 0 CA-C-O 121.23 0.538 . . . . 0.0 111.035 -177.456 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 108' ' ' LEU . . . . . . . . . . . . . 7.6 mp -97.05 138.88 21.27 Favored Pre-proline 0 C--N 1.323 -0.582 0 CA-C-N 115.364 -0.835 . . . . 0.0 110.038 -179.992 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 109' ' ' PRO . . . . . . . . . . . . . 11.2 Cg_endo -56.7 -35.74 97.82 Favored 'Trans proline' 0 C--O 1.234 0.322 0 C-N-CA 122.63 2.22 . . . . 0.0 112.268 177.404 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 110' ' ' ALA . . . . . . . . . . . . . . . -70.61 -29.67 66.13 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.236 -0.438 . . . . 0.0 111.232 179.788 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 111' ' ' ASP . . . . . . . . . . . . . 33.2 t70 -68.27 -41.52 80.92 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-O 121.073 0.463 . . . . 0.0 110.048 179.997 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 112' ' ' ILE . . . . . . . . . . . . . 18.7 mt -67.1 -43.04 88.99 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.355 0 CA-C-N 115.809 -0.632 . . . . 0.0 109.698 176.385 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 113' ' ' GLN . . . . . 0.596 ' HG2' ' HA ' ' A' ' 154' ' ' VAL . 0.0 OUTLIER -55.16 -41.62 72.1 Favored 'General case' 0 C--O 1.233 0.211 0 CA-C-N 115.627 -0.715 . . . . 0.0 111.023 176.568 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild full ' A' A ' 114' ' ' SER . . . . . . . . . . . . . 14.3 t -59.75 -46.54 88.85 Favored 'General case' 0 N--CA 1.453 -0.319 0 CA-C-N 116.101 -0.5 . . . . 0.0 110.387 178.889 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 115' ' ' ILE . . . . . . . . . . . . . 69.3 mt -55.88 -51.93 54.91 Favored 'Isoleucine or valine' 0 C--O 1.233 0.225 0 CA-C-O 120.919 0.39 . . . . 0.0 110.918 -179.485 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 116' ' ' ILE . . . . . . . . . . . . . 49.8 mm -62.08 -39.38 83.6 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.322 0 CA-C-N 115.902 -0.59 . . . . 0.0 111.225 -178.421 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 117' ' ' ASN . . . . . 0.416 HD22 ' C ' ' A' ' 117' ' ' ASN . 0.2 OUTLIER -69.81 -39.27 76.62 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-O 120.929 0.395 . . . . 0.0 110.503 -178.873 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild full ' A' A ' 118' ' ' GLU . . . . . . . . . . . . . 49.5 mt-10 -80.76 -8.7 59.75 Favored 'General case' 0 C--N 1.327 -0.374 0 CA-C-N 116.368 -0.378 . . . . 0.0 111.271 -177.192 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 119' ' ' THR . . . . . . . . . . . . . 89.5 m -89.88 123.47 33.85 Favored 'General case' 0 C--N 1.326 -0.438 0 CA-C-O 120.834 0.349 . . . . 0.0 110.912 176.17 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 120' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -98.9 80.52 2.51 Favored 'General case' 0 C--N 1.326 -0.443 0 CA-C-O 121.041 0.448 . . . . 0.0 110.692 178.358 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 121' ' ' LEU . . . . . . . . . . . . . 65.1 mt -132.54 -175.77 3.87 Favored 'General case' 0 C--N 1.324 -0.543 0 CA-C-N 115.713 -0.676 . . . . 0.0 109.747 178.463 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 122' ' ' ALA . . . . . . . . . . . . . . . -72.6 146.04 46.92 Favored 'General case' 0 C--N 1.325 -0.499 0 CA-C-N 116.434 -0.348 . . . . 0.0 110.33 177.722 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 123' ' ' LYS . . . . . 0.516 ' O ' ' HG3' ' A' ' 127' ' ' LYS . 59.6 pttt -58.54 -29.53 66.41 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-O 120.844 0.354 . . . . 0.0 110.915 -179.71 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 124' ' ' ASN . . . . . . . . . . . . . 14.4 m120 -68.34 -40.47 81.56 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.178 -0.465 . . . . 0.0 110.48 178.642 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 125' ' ' THR . . . . . . . . . . . . . 6.2 m -67.67 -35.76 79.46 Favored 'General case' 0 C--N 1.327 -0.378 0 CA-C-N 116.095 -0.502 . . . . 0.0 110.219 179.273 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 126' ' ' LEU . . . . . . . . . . . . . 90.7 mt -64.72 -37.17 86.7 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 115.885 -0.598 . . . . 0.0 110.493 178.068 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 127' ' ' LYS . . . . . 0.516 ' HG3' ' O ' ' A' ' 123' ' ' LYS . 97.7 mttt -68.58 -28.87 67.33 Favored 'General case' 0 C--N 1.332 -0.192 0 CA-C-N 116.092 -0.503 . . . . 0.0 110.835 178.032 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 128' ' ' ALA . . . . . . . . . . . . . . . -65.79 -43.86 87.45 Favored 'General case' 0 C--N 1.327 -0.378 0 CA-C-O 120.981 0.42 . . . . 0.0 110.492 176.606 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 129' ' ' ILE . . . . . . . . . . . . . 47.9 mt -64.71 -47.08 90.22 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.221 0 CA-C-N 115.909 -0.587 . . . . 0.0 109.773 176.166 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 130' ' ' ARG . . . . . 0.409 HH11 ' HD3' ' A' ' 130' ' ' ARG . 5.5 tpt180 -52.87 -45.05 67.28 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 115.587 -0.733 . . . . 0.0 110.882 174.768 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 131' ' ' ASN . . . . . . . . . . . . . 10.5 t30 -61.97 -55.95 24.15 Favored 'General case' 0 C--N 1.326 -0.445 0 CA-C-N 116.144 -0.48 . . . . 0.0 111.744 -176.872 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 132' ' ' THR . . . . . 0.408 ' O ' HG13 ' A' ' 136' ' ' ILE . 14.9 t -65.59 -33.03 74.96 Favored 'General case' 0 CA--C 1.531 0.222 0 C-N-CA 120.84 -0.344 . . . . 0.0 110.938 -175.371 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 133' ' ' ALA . . . . . . . . . . . . . . . -69.75 -46.39 65.97 Favored 'General case' 0 C--N 1.331 -0.205 0 CA-C-O 120.919 0.39 . . . . 0.0 110.515 178.358 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 134' ' ' SER . . . . . . . . . . . . . 22.9 t -61.0 -37.67 83.32 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 115.893 -0.594 . . . . 0.0 110.27 -179.977 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 135' ' ' GLN . . . . . . . . . . . . . 1.1 mp0 -59.08 -45.34 91.08 Favored 'General case' 0 C--N 1.331 -0.232 0 CA-C-N 116.401 -0.363 . . . . 0.0 111.042 176.489 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 136' ' ' ILE . . . . . 0.408 HG13 ' O ' ' A' ' 132' ' ' THR . 73.1 mt -65.03 -47.79 86.55 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.296 0 CA-C-O 120.904 0.383 . . . . 0.0 110.691 179.017 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 137' ' ' PHE . . . . . 0.55 ' HZ ' HG21 ' A' ' 107' ' ' ILE . 41.8 m-85 -62.28 -47.06 85.98 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 116.195 -0.457 . . . . 0.0 111.696 -179.645 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 138' ' ' ARG . . . . . 0.419 ' O ' ' HG2' ' A' ' 142' ' ' GLU . 11.3 ptm180 -74.05 -21.03 60.1 Favored 'General case' 0 C--N 1.327 -0.385 0 C-N-CA 120.538 -0.465 . . . . 0.0 110.853 -176.39 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 139' ' ' LEU . . . . . . . . . . . . . 62.6 tp -63.59 -41.8 98.32 Favored 'General case' 0 C--O 1.234 0.266 0 N-CA-C 109.232 -0.655 . . . . 0.0 109.232 173.256 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 140' ' ' ALA . . . . . 0.501 ' HB1' ' HB3' ' A' ' 145' ' ' ALA . . . -65.24 -32.57 74.31 Favored 'General case' 0 C--N 1.326 -0.429 0 CA-C-N 115.495 -0.775 . . . . 0.0 110.152 176.211 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 141' ' ' ILE . . . . . . . . . . . . . 60.4 mt -64.94 -44.16 96.15 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.29 0 CA-C-N 116.233 -0.44 . . . . 0.0 110.191 175.653 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 142' ' ' GLU . . . . . 0.419 ' HG2' ' O ' ' A' ' 138' ' ' ARG . 34.3 mm-40 -63.33 -29.31 70.64 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-O 121.088 0.471 . . . . 0.0 110.716 177.71 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 143' ' ' ASN . . . . . 0.469 HD22 ' N ' ' A' ' 143' ' ' ASN . 0.9 OUTLIER -93.23 0.85 57.2 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.064 -0.517 . . . . 0.0 111.003 -179.031 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild full ' A' A ' 144' ' ' ARG . . . . . . . . . . . . . 35.1 mtp85 57.47 36.0 26.5 Favored 'General case' 0 N--CA 1.464 0.26 0 CA-C-N 115.752 -0.658 . . . . 0.0 112.272 -178.933 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 145' ' ' ALA . . . . . 0.501 ' HB3' ' HB1' ' A' ' 140' ' ' ALA . . . -82.29 -33.73 28.97 Favored 'General case' 0 C--N 1.325 -0.5 0 N-CA-C 109.268 -0.641 . . . . 0.0 109.268 173.357 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 146' ' ' ILE . . . . . . . . . . . . . 9.8 tt -159.22 125.63 0.54 Allowed 'Isoleucine or valine' 0 C--N 1.324 -0.526 0 CA-C-N 114.873 -1.058 . . . . 0.0 109.433 178.998 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 147' ' ' ASP . . . . . . . . . . . . . 20.9 t70 -99.1 68.46 1.68 Allowed 'General case' 0 C--N 1.319 -0.738 0 CA-C-O 121.662 0.744 . . . . 0.0 109.624 178.575 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 148' ' ' PHE . . . . . 0.482 ' O ' ' HD3' ' A' ' 150' ' ' PRO . 55.8 t80 -169.38 126.44 0.92 Allowed 'General case' 0 C--N 1.321 -0.667 0 CA-C-N 115.086 -0.961 . . . . 0.0 109.178 -179.158 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 149' ' ' ASN . . . . . . . . . . . . . 48.8 t-20 -108.52 95.96 17.85 Favored Pre-proline 0 C--N 1.323 -0.57 0 N-CA-C 110.076 -0.342 . . . . 0.0 110.076 179.272 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 150' ' ' PRO . . . . . 0.482 ' HD3' ' O ' ' A' ' 148' ' ' PHE . 21.6 Cg_exo -65.34 -26.37 56.04 Favored 'Trans proline' 0 C--N 1.342 0.229 0 C-N-CA 122.756 2.304 . . . . 0.0 112.03 -179.626 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 151' ' ' ALA . . . . . . . . . . . . . . . -72.6 -20.38 61.31 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 115.941 -0.572 . . . . 0.0 110.806 -178.032 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 152' ' ' ASP . . . . . . . . . . . . . 28.3 t70 -70.76 -24.91 62.69 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-O 121.089 0.471 . . . . 0.0 110.149 178.488 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 153' ' ' TYR . . . . . . . . . . . . . 58.8 m-85 -83.86 -1.47 54.5 Favored 'General case' 0 C--N 1.327 -0.374 0 CA-C-N 115.772 -0.649 . . . . 0.0 110.51 179.585 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 154' ' ' VAL . . . . . 0.596 ' HA ' ' HG2' ' A' ' 113' ' ' GLN . 55.9 t -88.74 111.52 22.72 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.504 0 CA-C-N 115.807 -0.633 . . . . 0.0 110.311 179.65 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 155' ' ' ARG . . . . . . . . . . . . . 83.9 mtm180 -83.99 141.24 31.35 Favored 'General case' 0 C--N 1.319 -0.742 0 CA-C-N 115.41 -0.814 . . . . 0.0 109.944 179.807 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 156' ' ' ILE . . . . . 0.4 ' HA ' ' HD3' ' A' ' 157' ' ' PRO . 50.7 mm -96.97 113.67 63.35 Favored Pre-proline 0 C--N 1.319 -0.741 0 N-CA-C 109.408 -0.59 . . . . 0.0 109.408 178.704 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 157' ' ' PRO . . . . . 0.4 ' HD3' ' HA ' ' A' ' 156' ' ' ILE . 28.4 Cg_exo -61.8 130.02 29.74 Favored 'Trans proline' 0 N--CA 1.46 -0.444 0 C-N-CA 122.53 2.153 . . . . 0.0 112.196 -177.754 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 158' ' ' LYS . . . . . . . . . . . . . 43.5 mtmt -109.35 41.48 1.64 Allowed 'General case' 0 C--N 1.319 -0.75 0 N-CA-C 109.184 -0.673 . . . . 0.0 109.184 178.809 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 159' ' ' ILE . . . . . . . . . . . . . 50.4 mt -78.34 75.46 0.66 Allowed 'Isoleucine or valine' 0 C--N 1.324 -0.532 0 CA-C-N 115.288 -0.869 . . . . 0.0 110.896 -175.841 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 160' ' ' ALA . . . . . . . . . . . . . . . -124.13 14.96 9.12 Favored 'General case' 0 C--N 1.322 -0.6 0 CA-C-O 122.277 1.037 . . . . 0.0 108.855 172.601 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 161' ' ' LEU . . . . . . . . . . . . . 0.9 OUTLIER -128.42 30.97 5.09 Favored 'General case' 0 C--N 1.315 -0.894 0 CA-C-N 113.813 -1.539 . . . . 0.0 109.748 -177.663 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 162' ' ' GLU . . . . . . . . . . . . . 8.2 tp10 79.48 151.44 0.11 Allowed 'General case' 0 C--O 1.233 0.226 0 CA-C-N 114.632 -1.167 . . . . 0.0 110.725 -175.458 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 163' ' ' HIS . . . . . . . . . . . . . 27.3 p-80 -99.7 136.88 38.97 Favored 'General case' 0 C--N 1.325 -0.466 0 CA-C-N 115.79 -0.641 . . . . 0.0 111.145 -173.708 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 164' ' ' HIS . . . . . . . . . . . . . 8.5 p80 -144.06 23.95 1.67 Allowed 'General case' 0 C--N 1.323 -0.568 0 CA-C-N 115.843 -0.617 . . . . 0.0 110.122 174.348 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 165' ' ' HIS . . . . . . . . . . . . . 72.7 t60 -75.93 88.65 2.92 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 115.489 -0.778 . . . . 0.0 109.351 172.292 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 166' ' ' HIS . . . . . . . . . . . . . 28.4 t-80 -117.61 121.4 40.81 Favored 'General case' 0 C--N 1.321 -0.65 0 CA-C-N 115.969 -0.559 . . . . 0.0 110.336 -179.647 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 167' ' ' HIS . . . . . . . . . . . . . 80.2 t60 -86.8 131.38 34.14 Favored 'General case' 0 C--N 1.32 -0.714 0 CA-C-N 115.703 -0.681 . . . . 0.0 110.031 -178.934 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 168' ' ' HIS . . . . . . . . . . . . . 47.3 t-80 . . . . . 0 C--O 1.247 0.968 0 CA-C-O 118.396 -0.812 . . . . 0.0 109.696 179.434 . . . . . . . . 0 0 . 1 . 019 nuclear nobuild full ' A' A ' 61' ' ' ARG . . . . . . . . . . . . . 13.7 ttt85 . . . . . 0 N--CA 1.476 0.87 0 N-CA-C 108.756 -0.831 . . . . 0.0 108.756 . . . . . . . . . 0 0 . 1 . 019 nuclear nobuild full ' A' A ' 62' ' ' ASP . . . . . 0.643 ' HB3' ' HB2' ' A' ' 66' ' ' ASP . 3.3 m-20 74.17 158.7 0.21 Allowed 'General case' 0 N--CA 1.467 0.378 0 CA-C-O 121.352 0.596 . . . . 0.0 111.47 174.947 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 63' ' ' SER . . . . . . . . . . . . . 78.6 p -100.42 179.86 4.32 Favored 'General case' 0 C--N 1.319 -0.72 0 N-CA-C 109.274 -0.639 . . . . 0.0 109.274 176.255 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 64' ' ' PHE . . . . . 0.476 ' HB3' ' O ' ' A' ' 99' ' ' LEU . 74.6 t80 -63.45 -35.93 82.05 Favored 'General case' 0 C--N 1.327 -0.378 0 C-N-CA 120.862 -0.335 . . . . 0.0 110.384 -177.409 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 65' ' ' GLY . . . . . . . . . . . . . . . -60.0 -38.33 94.05 Favored Glycine 0 N--CA 1.452 -0.249 0 C-N-CA 120.964 -0.636 . . . . 0.0 112.411 178.072 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 66' ' ' ASP . . . . . 0.643 ' HB2' ' HB3' ' A' ' 62' ' ' ASP . 16.4 m-20 -65.8 -43.57 88.33 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-O 120.917 0.389 . . . . 0.0 110.417 -179.921 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 67' ' ' TRP . . . . . . . . . . . . . 98.7 m95 -73.02 -34.21 66.21 Favored 'General case' 0 C--N 1.326 -0.43 0 CA-C-N 115.938 -0.573 . . . . 0.0 111.026 179.675 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 68' ' ' ALA . . . . . 0.547 ' O ' ' HG ' ' A' ' 72' ' ' LEU . . . -61.02 -44.22 97.73 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-O 120.903 0.382 . . . . 0.0 110.101 175.564 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 69' ' ' GLU . . . . . . . . . . . . . 31.2 tt0 -59.75 -45.98 90.57 Favored 'General case' 0 C--O 1.232 0.14 0 CA-C-N 115.806 -0.634 . . . . 0.0 110.22 175.127 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 70' ' ' LYS . . . . . . . . . . . . . 51.5 tttp -57.69 -42.95 84.69 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-N 115.541 -0.754 . . . . 0.0 110.442 179.326 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 71' ' ' PHE . . . . . . . . . . . . . 77.9 t80 -62.31 -49.99 73.44 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-N 115.77 -0.65 . . . . 0.0 110.627 176.525 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 72' ' ' LEU . . . . . 0.547 ' HG ' ' O ' ' A' ' 68' ' ' ALA . 93.4 mt -56.57 -41.54 77.08 Favored 'General case' 0 C--N 1.327 -0.379 0 CA-C-N 116.163 -0.472 . . . . 0.0 110.794 -179.915 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 73' ' ' LYS . . . . . 0.438 ' HA ' ' HB3' ' A' ' 76' ' ' GLU . 36.9 tttp -77.49 -28.45 52.21 Favored 'General case' 0 C--N 1.324 -0.514 0 CA-C-N 116.024 -0.535 . . . . 0.0 111.441 -175.963 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 74' ' ' SER . . . . . 0.43 ' O ' ' HB2' ' A' ' 78' ' ' ASP . 95.3 p -65.67 -31.43 72.44 Favored 'General case' 0 C--N 1.33 -0.262 0 C-N-CA 120.493 -0.483 . . . . 0.0 109.988 178.254 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 75' ' ' LYS . . . . . . . . . . . . . 0.8 OUTLIER -79.32 -42.0 26.7 Favored 'General case' 0 C--O 1.234 0.262 0 CA-C-N 116.444 -0.344 . . . . 0.0 110.509 173.606 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 76' ' ' GLU . . . . . 0.438 ' HB3' ' HA ' ' A' ' 73' ' ' LYS . 42.8 tt0 -52.43 -50.16 63.12 Favored 'General case' 0 CA--C 1.532 0.261 0 CA-C-N 116.137 -0.483 . . . . 0.0 110.776 175.307 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 77' ' ' ALA . . . . . . . . . . . . . . . -73.79 -30.13 62.57 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 115.958 -0.565 . . . . 0.0 111.726 -178.94 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 78' ' ' ASP . . . . . 0.43 ' HB2' ' O ' ' A' ' 74' ' ' SER . 16.1 t70 -62.03 -40.53 96.03 Favored 'General case' 0 N--CA 1.464 0.237 0 CA-C-O 120.985 0.421 . . . . 0.0 110.436 179.802 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 79' ' ' GLY . . . . . . . . . . . . . . . 121.01 33.26 0.99 Allowed Glycine 0 N--CA 1.447 -0.582 0 C-N-CA 120.702 -0.761 . . . . 0.0 113.269 176.291 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 80' ' ' VAL . . . . . . . . . . . . . 24.3 m -81.22 147.01 6.58 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.451 0 N-CA-C 109.894 -0.41 . . . . 0.0 109.894 176.471 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 81' ' ' SER . . . . . . . . . . . . . 23.2 t -68.14 155.58 39.31 Favored 'General case' 0 C--N 1.321 -0.649 0 CA-C-O 120.939 0.399 . . . . 0.0 110.952 -178.071 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 82' ' ' VAL . . . . . . . . . . . . . 7.5 p -56.8 -33.93 42.27 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.24 0 CA-C-N 115.769 -0.65 . . . . 0.0 111.457 -177.893 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 83' ' ' SER . . . . . . . . . . . . . 16.0 m -60.65 -39.62 89.0 Favored 'General case' 0 C--O 1.235 0.299 0 CA-C-O 121.061 0.458 . . . . 0.0 110.592 178.347 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 84' ' ' GLN . . . . . . . . . . . . . 5.8 tp-100 -76.01 -39.36 55.93 Favored 'General case' 0 C--N 1.327 -0.392 0 CA-C-N 116.175 -0.466 . . . . 0.0 109.912 -179.909 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 85' ' ' LEU . . . . . 0.445 HD22 ' HA ' ' A' ' 85' ' ' LEU . 0.3 OUTLIER -63.03 -40.23 97.12 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.06 -0.518 . . . . 0.0 109.932 178.548 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild full ' A' A ' 86' ' ' ASN . . . . . 0.572 ' HA ' ' HD2' ' A' ' 89' ' ' LYS . 80.2 m-20 -62.58 -37.51 86.46 Favored 'General case' 0 CA--C 1.516 -0.338 0 CA-C-N 116.018 -0.537 . . . . 0.0 110.918 176.201 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 87' ' ' SER . . . . . . . . . . . . . 9.6 t -60.8 -41.82 96.39 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-O 120.888 0.375 . . . . 0.0 110.07 178.435 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 88' ' ' TYR . . . . . . . . . . . . . 34.0 m-85 -60.43 -34.43 73.96 Favored 'General case' 0 C--N 1.332 -0.171 0 CA-C-N 116.05 -0.523 . . . . 0.0 110.755 176.681 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 89' ' ' LYS . . . . . 0.572 ' HD2' ' HA ' ' A' ' 86' ' ' ASN . 56.3 mttm -63.88 -39.35 93.98 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.377 -0.374 . . . . 0.0 110.504 176.255 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 90' ' ' ASN . . . . . . . . . . . . . 23.9 m120 -60.0 -34.84 73.88 Favored 'General case' 0 C--O 1.233 0.228 0 CA-C-O 121.061 0.458 . . . . 0.0 110.495 177.164 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 91' ' ' TYR . . . . . . . . . . . . . 31.3 m-85 -80.75 -62.9 1.53 Allowed 'General case' 0 C--N 1.325 -0.467 0 CA-C-N 116.251 -0.431 . . . . 0.0 110.841 179.295 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 92' ' ' CYS . . . . . 0.454 ' HA ' ' HB2' ' A' ' 96' ' ' LEU . 70.2 m -68.54 -49.53 58.79 Favored 'General case' 0 C--N 1.324 -0.502 0 N-CA-C 112.595 0.591 . . . . 0.0 112.595 -171.4 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 93' ' ' ARG . . . . . 0.55 ' O ' ' HD3' ' A' ' 93' ' ' ARG . 0.7 OUTLIER -83.21 -38.41 22.3 Favored 'General case' 0 C--N 1.32 -0.708 0 C-N-CA 120.681 -0.408 . . . . 0.0 111.069 -171.639 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild full ' A' A ' 94' ' ' ASN . . . . . . . . . . . . . 6.7 t30 -91.8 -41.49 10.63 Favored 'General case' 0 C--N 1.326 -0.431 0 N-CA-C 112.172 0.434 . . . . 0.0 112.172 -172.72 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 95' ' ' HIS . . . . . . . . . . . . . 45.6 m80 -88.7 -49.43 6.86 Favored 'General case' 0 C--N 1.328 -0.343 0 N-CA-C 112.069 0.396 . . . . 0.0 112.069 178.678 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 96' ' ' LEU . . . . . 0.56 ' HG ' HD12 ' A' ' 99' ' ' LEU . 9.9 mp -84.91 26.69 0.82 Allowed 'General case' 0 C--N 1.324 -0.507 0 CA-C-N 116.318 -0.401 . . . . 0.0 111.214 -175.743 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 97' ' ' SER . . . . . 0.501 ' N ' ' HD2' ' A' ' 98' ' ' PRO . 5.2 m -53.96 -52.05 71.58 Favored Pre-proline 0 CA--C 1.538 0.498 0 CA-C-N 116.174 -0.467 . . . . 0.0 112.167 -178.762 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 98' ' ' PRO . . . . . 0.501 ' HD2' ' N ' ' A' ' 97' ' ' SER . 18.8 Cg_endo -59.6 -38.27 83.15 Favored 'Trans proline' 0 C--N 1.355 0.92 0 C-N-CA 121.814 1.676 . . . . 0.0 112.142 178.162 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 99' ' ' LEU . . . . . 0.56 HD12 ' HG ' ' A' ' 96' ' ' LEU . 65.4 mt -69.26 -25.31 64.21 Favored 'General case' 0 C--N 1.327 -0.391 0 CA-C-N 116.103 -0.499 . . . . 0.0 111.157 -176.094 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 100' ' ' TYR . . . . . . . . . . . . . 0.2 OUTLIER -58.05 -34.13 69.76 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.361 -0.381 . . . . 0.0 111.449 179.784 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 101' ' ' MET . . . . . . . . . . . . . 23.8 ttt -98.08 2.99 49.28 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-O 121.499 0.666 . . . . 0.0 110.472 -178.773 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 102' ' ' LYS . . . . . 0.579 ' HB3' ' OE2' ' A' ' 106' ' ' GLU . 8.5 mtpm? -102.98 167.67 9.69 Favored 'General case' 0 C--N 1.322 -0.6 0 CA-C-N 115.872 -0.604 . . . . 0.0 110.277 -179.133 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 103' ' ' SER . . . . . 0.541 ' O ' HG13 ' A' ' 107' ' ' ILE . 44.3 m -110.14 136.03 50.0 Favored 'General case' 0 C--N 1.319 -0.723 0 N-CA-C 109.248 -0.649 . . . . 0.0 109.248 178.936 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 104' ' ' LEU . . . . . . . . . . . . . 1.6 pp -60.58 -13.43 14.18 Favored 'General case' 0 C--N 1.325 -0.487 0 N-CA-C 112.541 0.571 . . . . 0.0 112.541 -175.167 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 105' ' ' SER . . . . . . . . . . . . . 35.3 t -87.08 -14.61 40.92 Favored 'General case' 0 C--N 1.327 -0.404 0 CA-C-N 116.518 -0.31 . . . . 0.0 110.882 178.296 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 106' ' ' GLU . . . . . 0.579 ' OE2' ' HB3' ' A' ' 102' ' ' LYS . 0.8 OUTLIER -123.02 12.44 9.66 Favored 'General case' 0 CA--C 1.532 0.271 0 CA-C-O 121.162 0.506 . . . . 0.0 111.077 179.283 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild full ' A' A ' 107' ' ' ILE . . . . . 0.541 HG13 ' O ' ' A' ' 103' ' ' SER . 77.4 mt -90.06 121.66 40.55 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.276 0 CA-C-N 116.018 -0.537 . . . . 0.0 109.884 173.607 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 108' ' ' LEU . . . . . . . . . . . . . 7.6 mp -85.48 147.52 47.02 Favored Pre-proline 0 C--N 1.323 -0.576 0 CA-C-N 116.105 -0.498 . . . . 0.0 110.723 -178.997 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 109' ' ' PRO . . . . . 0.455 ' HB3' ' HB2' ' A' ' 153' ' ' TYR . 35.2 Cg_exo -59.32 -31.61 95.33 Favored 'Trans proline' 0 N--CA 1.465 -0.191 0 C-N-CA 122.551 2.167 . . . . 0.0 111.249 174.136 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 110' ' ' ALA . . . . . 0.403 ' HA ' ' HB3' ' A' ' 113' ' ' GLN . . . -75.82 -20.91 57.81 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 115.742 -0.663 . . . . 0.0 111.108 179.129 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 111' ' ' ASP . . . . . . . . . . . . . 23.5 t0 -71.83 -48.49 45.8 Favored 'General case' 0 C--N 1.327 -0.413 0 N-CA-C 109.009 -0.737 . . . . 0.0 109.009 178.222 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 112' ' ' ILE . . . . . . . . . . . . . 46.4 mt -63.76 -38.49 82.44 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.284 0 CA-C-N 115.345 -0.843 . . . . 0.0 109.624 173.895 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 113' ' ' GLN . . . . . 0.403 ' HB3' ' HA ' ' A' ' 110' ' ' ALA . 27.2 tp60 -53.86 -44.49 70.4 Favored 'General case' 0 C--N 1.33 -0.241 0 CA-C-N 115.32 -0.855 . . . . 0.0 110.584 176.743 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 114' ' ' SER . . . . . . . . . . . . . 45.0 m -59.11 -46.61 87.86 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 115.821 -0.627 . . . . 0.0 110.509 178.898 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 115' ' ' ILE . . . . . . . . . . . . . 66.2 mt -56.86 -49.64 78.13 Favored 'Isoleucine or valine' 0 C--O 1.234 0.248 0 CA-C-O 120.967 0.413 . . . . 0.0 110.855 177.921 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 116' ' ' ILE . . . . . 0.448 HG13 HG11 ' A' ' 154' ' ' VAL . 47.6 mm -57.59 -42.44 81.27 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.262 0 CA-C-N 115.892 -0.594 . . . . 0.0 111.245 -179.886 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 117' ' ' ASN . . . . . . . . . . . . . 13.2 m120 -71.37 -30.93 66.74 Favored 'General case' 0 C--N 1.326 -0.451 0 CA-C-N 116.328 -0.396 . . . . 0.0 111.438 -176.991 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 118' ' ' GLU . . . . . . . . . . . . . 43.0 mt-10 -89.33 -5.26 57.67 Favored 'General case' 0 C--N 1.326 -0.428 0 CA-C-O 120.735 0.303 . . . . 0.0 111.279 -178.362 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 119' ' ' THR . . . . . . . . . . . . . 98.3 m -79.32 112.37 16.48 Favored 'General case' 0 C--N 1.323 -0.587 0 CA-C-O 121.078 0.466 . . . . 0.0 111.009 176.59 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 120' ' ' LYS . . . . . . . . . . . . . 69.6 mmtt -94.37 83.03 4.11 Favored 'General case' 0 C--N 1.325 -0.487 0 CA-C-N 116.31 -0.405 . . . . 0.0 110.121 176.289 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 121' ' ' LEU . . . . . 0.457 HD13 HG21 ' A' ' 125' ' ' THR . 77.8 mt -145.46 -175.35 4.68 Favored 'General case' 0 C--N 1.323 -0.564 0 CA-C-N 115.744 -0.662 . . . . 0.0 109.768 179.938 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 122' ' ' ALA . . . . . . . . . . . . . . . -62.66 149.49 43.43 Favored 'General case' 0 C--N 1.324 -0.525 0 CA-C-N 116.488 -0.324 . . . . 0.0 110.978 178.565 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 123' ' ' LYS . . . . . . . . . . . . . 17.8 ptpt -61.65 -30.96 71.06 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.132 -0.485 . . . . 0.0 111.475 -177.174 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 124' ' ' ASN . . . . . . . . . . . . . 9.6 t30 -66.29 -40.46 90.05 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-O 120.69 0.281 . . . . 0.0 110.436 176.15 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 125' ' ' THR . . . . . 0.589 ' O ' HG13 ' A' ' 129' ' ' ILE . 53.9 m -64.14 -39.13 93.37 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 116.197 -0.456 . . . . 0.0 110.678 179.151 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 126' ' ' LEU . . . . . . . . . . . . . 89.3 mt -56.58 -48.73 76.77 Favored 'General case' 0 C--O 1.234 0.25 0 CA-C-O 121.254 0.55 . . . . 0.0 110.24 177.253 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 127' ' ' LYS . . . . . . . . . . . . . 98.4 mttt -63.76 -40.03 95.72 Favored 'General case' 0 C--N 1.327 -0.37 0 CA-C-N 115.434 -0.803 . . . . 0.0 110.614 177.535 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 128' ' ' ALA . . . . . . . . . . . . . . . -64.65 -34.66 78.81 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.104 -0.498 . . . . 0.0 111.661 -178.872 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 129' ' ' ILE . . . . . 0.589 HG13 ' O ' ' A' ' 125' ' ' THR . 78.0 mt -62.47 -50.45 79.8 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.282 0 CA-C-O 121.052 0.453 . . . . 0.0 109.951 176.254 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 130' ' ' ARG . . . . . 0.505 ' HD2' ' HB ' ' A' ' 154' ' ' VAL . 47.8 ttt180 -60.72 -44.3 96.78 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 115.693 -0.685 . . . . 0.0 110.472 176.072 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 131' ' ' ASN . . . . . . . . . . . . . 2.8 t-20 -56.24 -48.45 76.5 Favored 'General case' 0 C--N 1.326 -0.413 0 CA-C-N 115.889 -0.596 . . . . 0.0 110.518 178.295 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 132' ' ' THR . . . . . . . . . . . . . 96.7 m -57.41 -51.4 69.55 Favored 'General case' 0 C--N 1.327 -0.404 0 CA-C-N 115.973 -0.558 . . . . 0.0 110.802 177.414 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 133' ' ' ALA . . . . . . . . . . . . . . . -61.1 -42.9 99.36 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 115.909 -0.587 . . . . 0.0 111.446 -178.634 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 134' ' ' SER . . . . . . . . . . . . . 51.1 p -64.18 -30.16 71.23 Favored 'General case' 0 C--N 1.33 -0.263 0 N-CA-C 111.755 0.28 . . . . 0.0 111.755 -176.73 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 135' ' ' GLN . . . . . . . . . . . . . 41.4 mt-30 -71.35 -38.37 71.63 Favored 'General case' 0 C--N 1.328 -0.329 0 C-N-CA 120.924 -0.31 . . . . 0.0 110.298 176.101 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 136' ' ' ILE . . . . . . . . . . . . . 65.7 mt -61.1 -46.11 97.28 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.251 0 CA-C-N 116.196 -0.456 . . . . 0.0 110.452 177.818 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 137' ' ' PHE . . . . . 0.484 ' O ' HG13 ' A' ' 141' ' ' ILE . 64.4 m-85 -66.03 -38.31 88.09 Favored 'General case' 0 C--N 1.33 -0.245 0 CA-C-N 116.355 -0.384 . . . . 0.0 110.827 177.745 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 138' ' ' ARG . . . . . 0.491 ' O ' ' HG3' ' A' ' 142' ' ' GLU . 19.9 mtp85 -59.19 -45.55 90.78 Favored 'General case' 0 CA--C 1.518 -0.279 0 CA-C-O 120.725 0.298 . . . . 0.0 110.739 175.952 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 139' ' ' LEU . . . . . . . . . . . . . 48.4 tp -55.81 -36.4 67.39 Favored 'General case' 0 C--N 1.327 -0.386 0 CA-C-N 115.753 -0.658 . . . . 0.0 110.42 178.697 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 140' ' ' ALA . . . . . 0.518 ' HB1' ' HB3' ' A' ' 145' ' ' ALA . . . -69.88 -45.14 68.33 Favored 'General case' 0 C--N 1.324 -0.518 0 CA-C-N 115.858 -0.61 . . . . 0.0 110.748 176.032 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 141' ' ' ILE . . . . . 0.575 ' HA ' ' O ' ' A' ' 146' ' ' ILE . 78.5 mt -55.86 -46.94 80.28 Favored 'Isoleucine or valine' 0 C--O 1.234 0.275 0 CA-C-O 120.997 0.427 . . . . 0.0 110.94 177.606 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 142' ' ' GLU . . . . . 0.491 ' HG3' ' O ' ' A' ' 138' ' ' ARG . 91.7 mt-10 -63.24 -27.55 69.43 Favored 'General case' 0 C--N 1.326 -0.416 0 CA-C-N 115.844 -0.616 . . . . 0.0 111.373 -177.564 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 143' ' ' ASN . . . . . . . . . . . . . 29.0 m-80 -99.49 14.64 29.14 Favored 'General case' 0 C--N 1.327 -0.402 0 CA-C-N 116.329 -0.396 . . . . 0.0 111.418 -178.704 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 144' ' ' ARG . . . . . . . . . . . . . 16.7 mmm180 65.68 27.94 11.23 Favored 'General case' 0 N--CA 1.468 0.462 0 N-CA-C 112.424 0.527 . . . . 0.0 112.424 176.409 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 145' ' ' ALA . . . . . 0.518 ' HB3' ' HB1' ' A' ' 140' ' ' ALA . . . -84.76 -39.66 18.17 Favored 'General case' 0 C--N 1.323 -0.568 0 CA-C-O 121.157 0.503 . . . . 0.0 110.51 177.918 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 146' ' ' ILE . . . . . 0.575 ' O ' ' HA ' ' A' ' 141' ' ' ILE . 15.5 tt -145.36 155.41 13.5 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.423 0 CA-C-N 115.688 -0.687 . . . . 0.0 109.217 -179.154 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 147' ' ' ASP . . . . . . . . . . . . . 3.8 m-20 -105.01 -1.56 25.58 Favored 'General case' 0 C--N 1.327 -0.401 0 N-CA-C 112.381 0.512 . . . . 0.0 112.381 -175.448 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 148' ' ' PHE . . . . . 0.461 ' H ' HG12 ' A' ' 146' ' ' ILE . 50.0 p90 -142.13 165.34 27.7 Favored 'General case' 0 C--N 1.322 -0.614 0 CA-C-O 120.76 0.314 . . . . 0.0 110.998 -176.569 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 149' ' ' ASN . . . . . . . . . . . . . 44.9 t-20 -119.11 101.8 49.44 Favored Pre-proline 0 C--N 1.322 -0.616 0 CA-C-N 116.021 -0.536 . . . . 0.0 110.549 -176.306 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 150' ' ' PRO . . . . . . . . . . . . . 35.2 Cg_exo -59.35 -32.69 97.1 Favored 'Trans proline' 0 C--N 1.342 0.197 0 C-N-CA 122.838 2.359 . . . . 0.0 112.724 178.915 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 151' ' ' ALA . . . . . 0.529 ' HA ' HG23 ' A' ' 154' ' ' VAL . . . -74.81 -19.47 60.18 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-O 121.047 0.451 . . . . 0.0 110.968 -178.466 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 152' ' ' ASP . . . . . . . . . . . . . 24.8 t70 -71.74 -19.81 61.98 Favored 'General case' 0 C--N 1.325 -0.46 0 CA-C-N 115.762 -0.653 . . . . 0.0 110.033 178.662 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 153' ' ' TYR . . . . . 0.455 ' HB2' ' HB3' ' A' ' 109' ' ' PRO . 68.6 m-85 -95.77 1.77 53.49 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 115.744 -0.662 . . . . 0.0 111.513 -178.238 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 154' ' ' VAL . . . . . 0.529 HG23 ' HA ' ' A' ' 151' ' ' ALA . 98.0 t -72.32 123.53 27.1 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.514 0 CA-C-O 121.043 0.449 . . . . 0.0 110.514 -178.954 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 155' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -86.12 101.58 13.11 Favored 'General case' 0 C--N 1.32 -0.711 0 N-CA-C 109.251 -0.648 . . . . 0.0 109.251 179.279 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 156' ' ' ILE . . . . . 0.415 HD13 ' HD3' ' A' ' 130' ' ' ARG . 0.9 OUTLIER -71.12 131.31 87.17 Favored Pre-proline 0 C--N 1.325 -0.469 0 N-CA-C 109.275 -0.639 . . . . 0.0 109.275 176.146 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild full ' A' A ' 157' ' ' PRO . . . . . 0.417 ' HB2' HG13 ' A' ' 159' ' ' ILE . 92.4 Cg_endo -82.42 148.71 14.62 Favored 'Trans proline' 0 N--CA 1.456 -0.685 0 C-N-CA 122.522 2.148 . . . . 0.0 112.856 -176.088 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 158' ' ' LYS . . . . . . . . . . . . . 97.7 mttt -101.33 -38.77 7.91 Favored 'General case' 0 C--N 1.324 -0.54 0 N-CA-C 109.212 -0.662 . . . . 0.0 109.212 175.156 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 159' ' ' ILE . . . . . 0.417 HG13 ' HB2' ' A' ' 157' ' ' PRO . 59.1 mt 60.39 88.71 0.05 OUTLIER 'Isoleucine or valine' 0 C--O 1.233 0.194 0 CA-C-N 114.863 -1.062 . . . . 0.0 111.621 176.32 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 160' ' ' ALA . . . . . . . . . . . . . . . -87.72 110.55 20.53 Favored 'General case' 0 C--N 1.32 -0.68 0 CA-C-N 115.782 -0.645 . . . . 0.0 109.633 176.126 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 161' ' ' LEU . . . . . . . . . . . . . 80.6 mt -63.96 114.7 4.27 Favored 'General case' 0 C--N 1.323 -0.583 0 CA-C-N 115.84 -0.618 . . . . 0.0 110.6 -177.909 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 162' ' ' GLU . . . . . . . . . . . . . 5.4 tm-20 -157.63 -46.03 0.07 Allowed 'General case' 0 C--N 1.322 -0.617 0 CA-C-N 115.092 -0.958 . . . . 0.0 109.731 -172.733 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 163' ' ' HIS . . . . . . . . . . . . . 4.8 m-70 -49.17 109.43 0.26 Allowed 'General case' 0 N--CA 1.463 0.202 0 O-C-N 123.984 0.802 . . . . 0.0 111.172 -173.633 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 164' ' ' HIS . . . . . . . . . . . . . 98.5 m-70 -89.34 96.18 10.6 Favored 'General case' 0 C--N 1.324 -0.533 0 CA-C-N 115.612 -0.722 . . . . 0.0 111.179 -173.44 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 165' ' ' HIS . . . . . . . . . . . . . 12.1 t-80 61.12 29.39 18.84 Favored 'General case' 0 CA--C 1.532 0.262 0 CA-C-N 115.416 -0.811 . . . . 0.0 110.971 175.132 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 166' ' ' HIS . . . . . . . . . . . . . 14.6 t-80 -83.11 -1.59 53.23 Favored 'General case' 0 C--N 1.327 -0.37 0 C-N-CA 120.719 -0.393 . . . . 0.0 110.476 -179.894 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 167' ' ' HIS . . . . . . . . . . . . . 24.1 p80 -141.76 169.24 17.96 Favored 'General case' 0 C--N 1.324 -0.527 0 N-CA-C 109.685 -0.487 . . . . 0.0 109.685 175.606 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 168' ' ' HIS . . . . . . . . . . . . . 21.4 p80 . . . . . 0 C--O 1.247 0.929 0 N-CA-C 108.964 -0.754 . . . . 0.0 108.964 172.408 . . . . . . . . 0 0 . 1 . 020 nuclear nobuild full ' A' A ' 61' ' ' ARG . . . . . . . . . . . . . 45.7 mtm180 . . . . . 0 N--CA 1.477 0.913 0 CA-C-O 120.857 0.36 . . . . 0.0 110.127 . . . . . . . . . 0 0 . 1 . 020 nuclear nobuild full ' A' A ' 62' ' ' ASP . . . . . . . . . . . . . 6.6 m-20 -109.8 149.04 30.4 Favored 'General case' 0 C--N 1.322 -0.628 0 CA-C-N 116.266 -0.425 . . . . 0.0 110.544 -178.351 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 63' ' ' SER . . . . . 0.564 ' HA ' ' HA ' ' A' ' 103' ' ' SER . 39.5 t -90.94 146.73 23.64 Favored 'General case' 0 C--N 1.321 -0.657 0 CA-C-N 116.195 -0.457 . . . . 0.0 110.341 179.458 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 64' ' ' PHE . . . . . 0.48 ' HB2' HD11 ' A' ' 107' ' ' ILE . 78.9 t80 -59.85 -31.82 70.12 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 115.82 -0.627 . . . . 0.0 109.999 178.37 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 65' ' ' GLY . . . . . . . . . . . . . . . -59.24 -31.7 70.14 Favored Glycine 0 N--CA 1.447 -0.582 0 CA-C-N 115.685 -0.689 . . . . 0.0 112.571 178.894 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 66' ' ' ASP . . . . . . . . . . . . . 39.0 t70 -79.66 -48.38 13.81 Favored 'General case' 0 C--N 1.329 -0.308 0 C-N-CA 120.911 -0.316 . . . . 0.0 110.491 -179.959 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 67' ' ' TRP . . . . . . . . . . . . . 83.8 m95 -62.16 -36.59 82.31 Favored 'General case' 0 N--CA 1.465 0.282 0 CA-C-N 116.474 -0.33 . . . . 0.0 111.32 179.582 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 68' ' ' ALA . . . . . 0.595 ' O ' ' HG ' ' A' ' 72' ' ' LEU . . . -63.93 -50.92 66.77 Favored 'General case' 0 C--N 1.325 -0.495 0 CA-C-N 116.273 -0.421 . . . . 0.0 110.535 177.28 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 69' ' ' GLU . . . . . . . . . . . . . 14.9 tp10 -61.88 -35.18 77.58 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.083 -0.508 . . . . 0.0 110.07 178.055 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 70' ' ' LYS . . . . . . . . . . . . . 48.5 tttp -59.17 -44.97 92.16 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 115.932 -0.577 . . . . 0.0 110.325 177.145 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 71' ' ' PHE . . . . . . . . . . . . . 79.5 t80 -69.28 -41.22 77.14 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-O 120.98 0.419 . . . . 0.0 110.441 178.912 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 72' ' ' LEU . . . . . 0.595 ' HG ' ' O ' ' A' ' 68' ' ' ALA . 86.1 mt -63.9 -34.28 77.6 Favored 'General case' 0 C--N 1.325 -0.478 0 CA-C-N 116.14 -0.482 . . . . 0.0 110.526 179.647 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 73' ' ' LYS . . . . . 0.452 ' O ' ' HB3' ' A' ' 76' ' ' GLU . 14.0 ttmm -84.08 -33.33 24.43 Favored 'General case' 0 C--N 1.324 -0.543 0 CA-C-N 116.138 -0.483 . . . . 0.0 111.238 -176.505 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 74' ' ' SER . . . . . . . . . . . . . 15.4 p -71.47 -30.58 66.16 Favored 'General case' 0 C--N 1.324 -0.501 0 N-CA-C 110.051 -0.352 . . . . 0.0 110.051 175.982 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 75' ' ' LYS . . . . . 0.506 ' O ' ' HB3' ' A' ' 78' ' ' ASP . 22.0 tptp -76.62 -32.05 57.8 Favored 'General case' 0 N--CA 1.447 -0.612 0 CA-C-O 121.302 0.572 . . . . 0.0 109.475 174.589 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 76' ' ' GLU . . . . . 0.452 ' HB3' ' O ' ' A' ' 73' ' ' LYS . 30.3 tt0 -58.88 -47.87 83.43 Favored 'General case' 0 C--N 1.327 -0.407 0 CA-C-N 115.377 -0.829 . . . . 0.0 110.072 172.921 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 77' ' ' ALA . . . . . . . . . . . . . . . -76.08 -16.24 59.96 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 115.808 -0.633 . . . . 0.0 111.018 178.584 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 78' ' ' ASP . . . . . 0.506 ' HB3' ' O ' ' A' ' 75' ' ' LYS . 3.8 t70 -65.57 -53.78 37.09 Favored 'General case' 0 C--N 1.331 -0.218 0 CA-C-N 116.014 -0.539 . . . . 0.0 110.519 177.101 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 79' ' ' GLY . . . . . . . . . . . . . . . 142.34 63.97 0.03 OUTLIER Glycine 0 N--CA 1.446 -0.69 0 C-N-CA 120.506 -0.854 . . . . 0.0 112.26 178.495 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 80' ' ' VAL . . . . . . . . . . . . . 36.0 m -115.5 158.43 15.86 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.644 0 CA-C-O 120.759 0.314 . . . . 0.0 110.808 179.634 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 81' ' ' SER . . . . . . . . . . . . . 47.5 t -78.72 151.48 32.11 Favored 'General case' 0 C--N 1.321 -0.665 0 N-CA-C 109.487 -0.56 . . . . 0.0 109.487 174.777 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 82' ' ' VAL . . . . . . . . . . . . . 8.3 p -56.68 -34.4 42.57 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.329 0 CA-C-O 120.834 0.35 . . . . 0.0 110.667 177.631 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 83' ' ' SER . . . . . . . . . . . . . 3.4 m -62.98 -42.42 99.83 Favored 'General case' 0 C--O 1.235 0.291 0 CA-C-O 121.425 0.631 . . . . 0.0 110.181 178.199 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 84' ' ' GLN . . . . . 0.431 ' HG3' ' CE2' ' A' ' 88' ' ' TYR . 23.4 tp60 -74.78 -33.78 62.32 Favored 'General case' 0 C--N 1.325 -0.486 0 CA-C-N 115.497 -0.774 . . . . 0.0 110.389 -179.519 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 85' ' ' LEU . . . . . . . . . . . . . 36.7 tp -68.99 -42.97 75.79 Favored 'General case' 0 C--N 1.323 -0.562 0 CA-C-N 116.084 -0.507 . . . . 0.0 110.607 178.966 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 86' ' ' ASN . . . . . . . . . . . . . 86.3 m-20 -60.36 -44.83 95.21 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.32 -0.4 . . . . 0.0 111.075 178.78 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 87' ' ' SER . . . . . . . . . . . . . 2.0 p -63.58 -38.31 90.65 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 116.649 -0.25 . . . . 0.0 111.201 -179.489 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 88' ' ' TYR . . . . . 0.451 ' HB3' HD22 ' A' ' 72' ' ' LEU . 10.7 m-85 -60.48 -47.95 83.9 Favored 'General case' 0 N--CA 1.465 0.282 0 CA-C-O 121.037 0.446 . . . . 0.0 110.515 175.082 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 89' ' ' LYS . . . . . 0.525 ' HG2' HD13 ' A' ' 72' ' ' LEU . 68.4 mttm -63.38 -37.66 88.12 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 115.787 -0.642 . . . . 0.0 110.767 179.64 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 90' ' ' ASN . . . . . 0.516 ' O ' ' HB3' ' A' ' 94' ' ' ASN . 7.4 m-80 -62.48 -47.65 83.05 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.302 -0.408 . . . . 0.0 111.008 177.354 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 91' ' ' TYR . . . . . 0.785 ' HA ' ' HD2' ' A' ' 95' ' ' HIS . 14.0 m-85 -57.23 -45.36 83.95 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-O 120.991 0.424 . . . . 0.0 110.507 175.693 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 92' ' ' CYS . . . . . 0.56 ' SG ' ' HB1' ' A' ' 68' ' ' ALA . 47.8 t -66.54 -54.08 27.63 Favored 'General case' 0 C--N 1.321 -0.668 0 CA-C-N 115.507 -0.769 . . . . 0.0 112.407 -175.561 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 93' ' ' ARG . . . . . . . . . . . . . 31.7 ttm-85 -82.45 -35.02 27.91 Favored 'General case' 0 C--N 1.326 -0.451 0 N-CA-C 111.965 0.357 . . . . 0.0 111.965 -171.751 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 94' ' ' ASN . . . . . 0.516 ' HB3' ' O ' ' A' ' 90' ' ' ASN . 22.0 t-20 -83.97 -51.6 7.01 Favored 'General case' 0 C--N 1.326 -0.43 0 CA-C-O 120.651 0.262 . . . . 0.0 111.582 -176.583 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 95' ' ' HIS . . . . . 0.785 ' HD2' ' HA ' ' A' ' 91' ' ' TYR . 96.5 m-70 -85.49 -42.91 14.03 Favored 'General case' 0 C--N 1.327 -0.371 0 CA-C-O 120.701 0.286 . . . . 0.0 111.452 -174.207 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 96' ' ' LEU . . . . . 0.454 HD21 ' HB2' ' A' ' 133' ' ' ALA . 10.1 mp -91.56 26.73 2.21 Favored 'General case' 0 C--N 1.326 -0.435 0 CA-C-O 120.864 0.364 . . . . 0.0 110.464 -179.794 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 97' ' ' SER . . . . . 0.526 ' OG ' ' HD3' ' A' ' 98' ' ' PRO . 0.5 OUTLIER -55.44 -47.12 99.35 Favored Pre-proline 0 CA--C 1.539 0.526 0 N-CA-C 113.02 0.748 . . . . 0.0 113.02 -178.481 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild full ' A' A ' 98' ' ' PRO . . . . . 0.526 ' HD3' ' OG ' ' A' ' 97' ' ' SER . 38.8 Cg_exo -58.08 -34.91 98.99 Favored 'Trans proline' 0 C--N 1.358 1.066 0 C-N-CA 121.663 1.575 . . . . 0.0 111.967 178.095 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 99' ' ' LEU . . . . . 0.455 HD22 HG23 ' A' ' 107' ' ' ILE . 33.2 mt -79.02 -36.82 40.5 Favored 'General case' 0 C--N 1.327 -0.391 0 CA-C-N 115.874 -0.603 . . . . 0.0 110.282 -177.275 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 100' ' ' TYR . . . . . . . . . . . . . 25.8 t80 -60.47 -24.82 65.56 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 115.509 -0.769 . . . . 0.0 111.072 -177.112 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 101' ' ' MET . . . . . . . . . . . . . 65.4 mtt -97.72 -2.58 40.94 Favored 'General case' 0 C--N 1.327 -0.375 0 CA-C-N 116.21 -0.45 . . . . 0.0 111.784 -177.153 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 102' ' ' LYS . . . . . . . . . . . . . 87.7 mttt -102.53 167.35 9.99 Favored 'General case' 0 C--O 1.237 0.402 0 CA-C-O 121.026 0.441 . . . . 0.0 111.012 -179.312 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 103' ' ' SER . . . . . 0.564 ' HA ' ' HA ' ' A' ' 63' ' ' SER . 5.2 m -83.13 156.77 23.1 Favored 'General case' 0 C--N 1.323 -0.569 0 CA-C-N 115.82 -0.627 . . . . 0.0 109.69 174.702 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 104' ' ' LEU . . . . . . . . . . . . . 52.1 tp -55.83 -45.11 78.44 Favored 'General case' 0 C--N 1.325 -0.457 0 CA-C-N 116.501 -0.318 . . . . 0.0 111.525 -176.828 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 105' ' ' SER . . . . . . . . . . . . . 14.8 m -87.12 0.38 55.36 Favored 'General case' 0 C--N 1.325 -0.493 0 CA-C-N 116.453 -0.34 . . . . 0.0 111.896 -174.572 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 106' ' ' GLU . . . . . . . . . . . . . 44.3 mt-10 -104.02 -2.46 25.98 Favored 'General case' 0 C--N 1.327 -0.377 0 O-C-N 122.247 -0.283 . . . . 0.0 111.624 -178.372 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 107' ' ' ILE . . . . . 0.48 HD11 ' HB2' ' A' ' 64' ' ' PHE . 66.9 mt -81.15 126.82 39.87 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.556 0 CA-C-O 121.133 0.492 . . . . 0.0 111.303 -178.116 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 108' ' ' LEU . . . . . . . . . . . . . 62.9 mt -97.61 147.28 32.78 Favored Pre-proline 0 C--N 1.323 -0.583 0 CA-C-N 115.724 -0.671 . . . . 0.0 110.444 -179.488 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 109' ' ' PRO . . . . . . . . . . . . . 19.1 Cg_endo -60.18 -30.33 91.06 Favored 'Trans proline' 0 N--CA 1.464 -0.241 0 C-N-CA 122.351 2.034 . . . . 0.0 111.352 174.977 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 110' ' ' ALA . . . . . . . . . . . . . . . -65.17 -29.85 70.71 Favored 'General case' 0 N--CA 1.454 -0.257 0 CA-C-N 115.868 -0.605 . . . . 0.0 111.043 178.662 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 111' ' ' ASP . . . . . 0.414 ' O ' HG13 ' A' ' 115' ' ' ILE . 79.2 m-20 -64.91 -51.26 62.85 Favored 'General case' 0 CA--C 1.519 -0.244 0 CA-C-O 121.141 0.496 . . . . 0.0 110.025 179.226 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 112' ' ' ILE . . . . . 0.485 ' O ' HG12 ' A' ' 116' ' ' ILE . 30.6 mt -65.16 -40.61 89.36 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.491 0 CA-C-N 115.67 -0.696 . . . . 0.0 110.15 179.741 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 113' ' ' GLN . . . . . . . . . . . . . 6.7 tp-100 -59.01 -42.54 90.35 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.018 -0.537 . . . . 0.0 110.514 175.663 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 114' ' ' SER . . . . . . . . . . . . . 7.4 t -60.25 -45.58 92.78 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-N 116.257 -0.429 . . . . 0.0 109.862 178.304 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 115' ' ' ILE . . . . . 0.414 HG13 ' O ' ' A' ' 111' ' ' ASP . 75.8 mt -56.69 -47.23 82.76 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.221 0 CA-C-N 116.434 -0.348 . . . . 0.0 110.822 178.401 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 116' ' ' ILE . . . . . 0.485 HG12 ' O ' ' A' ' 112' ' ' ILE . 50.3 mm -61.09 -40.99 87.61 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.36 0 CA-C-O 121.108 0.48 . . . . 0.0 110.876 179.165 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 117' ' ' ASN . . . . . . . . . . . . . 46.8 t-20 -71.6 -42.03 68.21 Favored 'General case' 0 C--N 1.324 -0.515 0 CA-C-N 115.797 -0.638 . . . . 0.0 111.067 -177.032 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 118' ' ' GLU . . . . . . . . . . . . . 46.9 mt-10 -80.65 -16.76 53.21 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.253 -0.43 . . . . 0.0 112.035 -174.467 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 119' ' ' THR . . . . . . . . . . . . . 94.8 m -82.0 112.86 19.46 Favored 'General case' 0 C--N 1.325 -0.481 0 CA-C-O 121.331 0.586 . . . . 0.0 110.96 179.985 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 120' ' ' LYS . . . . . . . . . . . . . 24.1 mtmt -93.47 63.24 3.47 Favored 'General case' 0 C--N 1.323 -0.548 0 CA-C-N 115.441 -0.799 . . . . 0.0 110.544 -177.959 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 121' ' ' LEU . . . . . . . . . . . . . 88.8 mt -126.92 -175.75 3.51 Favored 'General case' 0 C--N 1.322 -0.62 0 CA-C-N 115.16 -0.927 . . . . 0.0 109.939 178.305 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 122' ' ' ALA . . . . . . . . . . . . . . . -64.01 157.12 25.97 Favored 'General case' 0 C--N 1.327 -0.37 0 CA-C-O 120.964 0.411 . . . . 0.0 111.808 -176.729 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 123' ' ' LYS . . . . . . . . . . . . . 48.3 mmtm -62.01 -38.39 88.47 Favored 'General case' 0 C--N 1.331 -0.237 0 CA-C-N 115.979 -0.555 . . . . 0.0 111.12 -177.926 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 124' ' ' ASN . . . . . . . . . . . . . 28.9 p30 -65.45 -27.31 68.42 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.321 -0.399 . . . . 0.0 111.064 179.453 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 125' ' ' THR . . . . . 0.495 ' O ' HG13 ' A' ' 129' ' ' ILE . 10.2 m -76.18 -39.2 55.38 Favored 'General case' 0 C--N 1.325 -0.47 0 CA-C-N 116.257 -0.429 . . . . 0.0 110.061 179.125 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 126' ' ' LEU . . . . . 0.433 ' HB3' HG23 ' A' ' 116' ' ' ILE . 84.5 mt -62.42 -44.83 95.5 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.008 -0.542 . . . . 0.0 110.141 177.289 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 127' ' ' LYS . . . . . . . . . . . . . 98.6 mttt -59.7 -43.53 94.04 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 115.774 -0.648 . . . . 0.0 110.18 177.384 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 128' ' ' ALA . . . . . . . . . . . . . . . -60.71 -39.12 87.36 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 115.7 -0.682 . . . . 0.0 111.308 -178.861 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 129' ' ' ILE . . . . . 0.495 HG13 ' O ' ' A' ' 125' ' ' THR . 87.6 mt -58.36 -51.65 68.73 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.245 0 CA-C-N 116.462 -0.336 . . . . 0.0 110.654 178.394 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 130' ' ' ARG . . . . . 0.705 HH21 ' HA ' ' A' ' 152' ' ' ASP . 33.4 ttt-85 -65.15 -45.97 82.8 Favored 'General case' 0 C--N 1.331 -0.206 0 C-N-CA 120.885 -0.326 . . . . 0.0 110.92 179.079 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 131' ' ' ASN . . . . . . . . . . . . . 10.9 m120 -53.15 -53.06 56.06 Favored 'General case' 0 N--CA 1.466 0.343 0 O-C-N 123.184 0.302 . . . . 0.0 110.833 179.654 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 132' ' ' THR . . . . . 0.533 ' O ' HG12 ' A' ' 136' ' ' ILE . 29.7 m -55.7 -45.23 77.9 Favored 'General case' 0 C--N 1.327 -0.401 0 CA-C-N 116.303 -0.408 . . . . 0.0 110.824 -179.997 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 133' ' ' ALA . . . . . 0.454 ' HB2' HD21 ' A' ' 96' ' ' LEU . . . -64.3 -42.84 96.17 Favored 'General case' 0 C--N 1.331 -0.207 0 CA-C-N 116.21 -0.45 . . . . 0.0 111.388 -179.356 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 134' ' ' SER . . . . . 0.45 ' O ' ' HG3' ' A' ' 138' ' ' ARG . 70.5 p -64.4 -32.69 74.41 Favored 'General case' 0 C--N 1.33 -0.246 0 C-N-CA 121.033 -0.267 . . . . 0.0 110.959 -178.704 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 135' ' ' GLN . . . . . . . . . . . . . 1.2 mp0 -62.88 -41.18 99.3 Favored 'General case' 0 C--N 1.331 -0.206 0 CA-C-O 120.779 0.323 . . . . 0.0 110.245 175.169 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 136' ' ' ILE . . . . . 0.561 HD12 ' HA ' ' A' ' 68' ' ' ALA . 23.1 mm -61.63 -50.77 78.93 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.25 0 CA-C-N 116.014 -0.539 . . . . 0.0 110.402 178.737 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 137' ' ' PHE . . . . . 0.492 ' O ' HG13 ' A' ' 141' ' ' ILE . 62.2 m-85 -62.14 -38.15 87.88 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 115.843 -0.617 . . . . 0.0 111.405 -179.529 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 138' ' ' ARG . . . . . 0.587 ' O ' ' HG2' ' A' ' 142' ' ' GLU . 68.2 mtp180 -64.7 -37.54 87.94 Favored 'General case' 0 C--N 1.329 -0.314 0 C-N-CA 120.823 -0.351 . . . . 0.0 110.877 179.356 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 139' ' ' LEU . . . . . . . . . . . . . 63.4 tp -57.54 -41.77 81.59 Favored 'General case' 0 C--N 1.327 -0.387 0 CA-C-O 121.107 0.479 . . . . 0.0 109.975 176.301 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 140' ' ' ALA . . . . . . . . . . . . . . . -66.6 -38.74 87.63 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 115.716 -0.675 . . . . 0.0 110.711 177.355 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 141' ' ' ILE . . . . . 0.546 ' HA ' ' O ' ' A' ' 146' ' ' ILE . 75.7 mt -64.07 -43.74 97.58 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.268 0 CA-C-N 116.3 -0.409 . . . . 0.0 110.73 177.168 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 142' ' ' GLU . . . . . 0.587 ' HG2' ' O ' ' A' ' 138' ' ' ARG . 39.7 mm-40 -62.77 -30.43 71.44 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.274 -0.421 . . . . 0.0 110.955 179.434 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 143' ' ' ASN . . . . . 0.403 ' N ' HD22 ' A' ' 143' ' ' ASN . 0.9 OUTLIER -91.23 1.9 56.76 Favored 'General case' 0 N--CA 1.464 0.229 0 CA-C-N 116.269 -0.423 . . . . 0.0 110.919 179.987 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild full ' A' A ' 144' ' ' ARG . . . . . . . . . . . . . 24.5 mtp85 57.68 40.92 26.1 Favored 'General case' 0 C--O 1.233 0.233 0 CA-C-N 115.633 -0.712 . . . . 0.0 112.054 -177.892 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 145' ' ' ALA . . . . . . . . . . . . . . . -88.41 -28.78 20.7 Favored 'General case' 0 C--N 1.324 -0.508 0 N-CA-C 109.338 -0.616 . . . . 0.0 109.338 172.435 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 146' ' ' ILE . . . . . 0.546 ' O ' ' HA ' ' A' ' 141' ' ' ILE . 13.4 tt -155.07 146.49 13.18 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.479 0 CA-C-N 115.237 -0.892 . . . . 0.0 108.941 177.493 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 147' ' ' ASP . . . . . . . . . . . . . 7.6 m-20 -110.48 24.02 13.51 Favored 'General case' 0 C--N 1.323 -0.548 0 CA-C-O 121.283 0.563 . . . . 0.0 110.192 179.53 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 148' ' ' PHE . . . . . 0.48 ' H ' HG12 ' A' ' 146' ' ' ILE . 1.2 m-85 -129.97 143.95 51.07 Favored 'General case' 0 C--N 1.323 -0.572 0 CA-C-N 115.631 -0.713 . . . . 0.0 110.336 -178.712 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 149' ' ' ASN . . . . . . . . . . . . . 48.0 t-20 -126.36 91.14 48.39 Favored Pre-proline 0 C--N 1.321 -0.664 0 CA-C-N 116.131 -0.486 . . . . 0.0 110.003 178.494 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 150' ' ' PRO . . . . . . . . . . . . . 35.8 Cg_exo -62.19 -26.52 77.78 Favored 'Trans proline' 0 C--N 1.343 0.258 0 C-N-CA 122.798 2.332 . . . . 0.0 112.082 -179.582 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 151' ' ' ALA . . . . . . . . . . . . . . . -70.21 -27.6 64.62 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 116.124 -0.489 . . . . 0.0 111.179 -177.635 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 152' ' ' ASP . . . . . 0.705 ' HA ' HH21 ' A' ' 130' ' ' ARG . 19.3 t70 -75.58 -17.65 59.98 Favored 'General case' 0 C--N 1.323 -0.552 0 CA-C-O 120.887 0.375 . . . . 0.0 110.514 -179.53 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 153' ' ' TYR . . . . . . . . . . . . . 43.7 m-85 -83.35 -10.84 58.23 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.243 -0.435 . . . . 0.0 110.653 178.819 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 154' ' ' VAL . . . . . . . . . . . . . 41.9 t -72.7 117.77 16.79 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.396 0 CA-C-N 116.101 -0.5 . . . . 0.0 110.945 -178.987 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 155' ' ' ARG . . . . . . . . . . . . . 3.8 mmp_? -89.91 131.68 35.7 Favored 'General case' 0 C--N 1.319 -0.719 0 CA-C-N 116.133 -0.485 . . . . 0.0 110.326 174.016 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 156' ' ' ILE . . . . . 0.427 ' HA ' ' HD2' ' A' ' 157' ' ' PRO . 1.9 mp -91.96 117.08 67.54 Favored Pre-proline 0 C--N 1.31 -1.109 0 N-CA-C 107.988 -1.116 . . . . 0.0 107.988 173.481 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 157' ' ' PRO . . . . . 0.427 ' HD2' ' HA ' ' A' ' 156' ' ' ILE . 5.7 Cg_endo -48.57 130.55 22.24 Favored 'Trans proline' 0 C--N 1.345 0.368 0 C-N-CA 123.22 2.613 . . . . 0.0 112.488 -173.657 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 158' ' ' LYS . . . . . . . . . . . . . 57.2 mtmt -89.33 40.31 0.98 Allowed 'General case' 0 C--N 1.324 -0.522 0 CA-C-N 115.601 -0.727 . . . . 0.0 110.33 -176.006 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 159' ' ' ILE . . . . . . . . . . . . . 22.4 mt -80.52 68.58 0.49 Allowed 'Isoleucine or valine' 0 C--N 1.326 -0.428 0 CA-C-N 115.75 -0.659 . . . . 0.0 109.553 178.43 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 160' ' ' ALA . . . . . . . . . . . . . . . -114.7 105.48 13.1 Favored 'General case' 0 C--N 1.321 -0.652 0 CA-C-N 115.573 -0.739 . . . . 0.0 109.855 178.734 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 161' ' ' LEU . . . . . . . . . . . . . 71.8 mt -95.13 3.99 54.14 Favored 'General case' 0 C--N 1.32 -0.694 0 CA-C-N 115.927 -0.579 . . . . 0.0 110.211 -178.156 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 162' ' ' GLU . . . . . . . . . . . . . 50.7 mt-10 -66.02 136.01 55.45 Favored 'General case' 0 C--N 1.325 -0.465 0 CA-C-N 115.391 -0.822 . . . . 0.0 110.529 178.161 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 163' ' ' HIS . . . . . . . . . . . . . 68.1 m80 -85.76 54.65 3.2 Favored 'General case' 0 C--N 1.323 -0.586 0 N-CA-C 109.519 -0.549 . . . . 0.0 109.519 179.659 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 164' ' ' HIS . . . . . . . . . . . . . 9.9 t-160 -103.31 11.2 37.02 Favored 'General case' 0 C--N 1.326 -0.431 0 CA-C-N 115.678 -0.692 . . . . 0.0 110.013 -175.822 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 165' ' ' HIS . . . . . . . . . . . . . 48.6 m-70 -119.15 149.91 40.93 Favored 'General case' 0 C--N 1.323 -0.558 0 CA-C-N 115.776 -0.647 . . . . 0.0 109.528 177.491 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 166' ' ' HIS . . . . . . . . . . . . . 21.9 p80 -123.35 89.51 3.11 Favored 'General case' 0 C--N 1.326 -0.43 0 CA-C-O 121.619 0.724 . . . . 0.0 111.137 176.726 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 167' ' ' HIS . . . . . . . . . . . . . 8.6 p80 -155.9 145.21 20.8 Favored 'General case' 0 C--N 1.323 -0.581 0 CA-C-N 115.773 -0.649 . . . . 0.0 109.803 176.311 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 168' ' ' HIS . . . . . . . . . . . . . 68.9 m-70 . . . . . 0 C--O 1.248 0.999 0 CA-C-O 118.677 -0.678 . . . . 0.0 109.576 179.962 . . . . . . . . 0 0 . 1 stop_ save_