data_1f2r_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 1f2r _Structure_validation_residue.Date_analyzed 2016-10-06 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 full ' C' C ' 1' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.492 1.633 0 CA-C-O 121.281 0.562 . . . . 8.6600000000000001 110.187 . . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' C' C ' 2' ' ' CYS . . . . . . . . . . . . . 6.5 m -114.37 66.76 0.68 Allowed 'General case' 0 N--CA 1.491 1.578 0 O-C-N 121.197 -0.939 . . . . 5.8799999999999999 110.205 179.97 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' C' C ' 3' ' ' ALA . . . . . . . . . . . . . . . -46.06 118.39 1.87 Allowed 'General case' 0 N--CA 1.491 1.581 0 O-C-N 121.25 -0.906 . . . . 4.2800000000000002 110.197 179.983 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' C' C ' 4' ' ' VAL . . . . . . . . . . . . . 30.9 t -80.69 117.65 27.02 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.637 0 O-C-N 121.198 -0.939 . . . . 4.21 110.296 -179.947 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' C' C ' 5' ' ' LEU . . . . . 0.42 HD23 ' O ' ' C' ' 7' ' ' GLN . 0.1 OUTLIER -81.77 166.08 20.35 Favored 'General case' 0 N--CA 1.491 1.6 0 O-C-N 121.239 -0.913 . . . . 1.8100000000000001 110.185 179.94 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' C' C ' 6' ' ' ARG . . . . . . . . . . . . . 8.1 mmt180 -87.55 -25.45 23.63 Favored 'General case' 0 N--CA 1.492 1.659 0 O-C-N 121.215 -0.928 . . . . 4.0499999999999998 110.156 179.991 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' C' C ' 7' ' ' GLN . . . . . 0.42 ' O ' HD23 ' C' ' 5' ' ' LEU . 9.6 pt20 -156.22 151.62 21.73 Favored Pre-proline 0 N--CA 1.491 1.591 0 O-C-N 121.26 -0.9 . . . . 2.6200000000000001 110.129 179.984 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' C' C ' 8' ' ' PRO . . . . . . . . . . . . . 3.0 Cg_endo -61.24 123.14 12.25 Favored 'Trans proline' 0 C--N 1.31 -1.461 0 O-C-N 123.749 1.394 . . . . 1.04 110.542 179.997 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' C' C ' 9' ' ' LYS . . . . . 0.461 ' HE3' ' O ' ' C' ' 67' ' ' PRO . 1.0 OUTLIER -63.49 175.97 0.93 Allowed 'General case' 0 N--CA 1.492 1.649 0 O-C-N 121.198 -0.939 . . . . 2.29 110.136 -179.995 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' C' C ' 10' ' ' CYS . . . . . 0.518 ' O ' ' CG1' ' C' ' 11' ' ' VAL . 58.3 m -146.01 141.25 27.49 Favored 'General case' 0 N--CA 1.491 1.606 0 O-C-N 121.283 -0.886 . . . . 1.0800000000000001 110.399 -179.968 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' C' C ' 11' ' ' VAL . . . . . 0.584 ' HA ' ' HA ' ' C' ' 69' ' ' ASP . 32.7 m -155.63 161.29 2.08 Favored 'Isoleucine or valine' 0 N--CA 1.488 1.453 0 O-C-N 120.993 -1.067 . . . . 1.1200000000000001 110.402 179.802 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' C' C ' 12' ' ' LYS . . . . . 0.411 ' HD3' ' HE2' ' C' ' 21' ' ' LYS . 10.2 mttp -120.22 112.67 19.35 Favored 'General case' 0 N--CA 1.491 1.601 0 O-C-N 121.262 -0.899 . . . . 1.74 110.104 179.993 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' C' C ' 13' ' ' LEU . . . . . 0.575 ' CD2' ' CA ' ' C' ' 36' ' ' GLY . 0.8 OUTLIER -81.74 100.02 9.28 Favored 'General case' 0 N--CA 1.491 1.618 0 O-C-N 121.291 -0.88 . . . . 1.5 110.31 -179.942 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' C' C ' 14' ' ' ARG . . . . . 0.439 ' O ' ' HA ' ' C' ' 73' ' ' LEU . 1.9 ttt180 -106.16 135.91 46.79 Favored 'General case' 0 N--CA 1.492 1.647 0 O-C-N 121.236 -0.915 . . . . 2.8199999999999998 110.292 179.93 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' C' C ' 15' ' ' ALA . . . . . 0.55 ' CB ' ' CB ' ' C' ' 18' ' ' SER . . . -91.3 174.12 7.56 Favored 'General case' 0 N--CA 1.492 1.66 0 O-C-N 121.24 -0.913 . . . . 1.1699999999999999 110.233 -179.993 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' C' C ' 16' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -87.39 -49.33 7.3 Favored 'General case' 0 N--CA 1.491 1.622 0 O-C-N 121.262 -0.899 . . . . 1.6000000000000001 110.241 -179.985 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' C' C ' 17' ' ' HIS . . . . . . . . . . . . . 40.3 m170 -111.42 30.11 7.23 Favored 'General case' 0 N--CA 1.491 1.604 0 O-C-N 121.217 -0.927 . . . . 4.4500000000000002 110.23 -179.99 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' C' C ' 18' ' ' SER . . . . . 0.55 ' CB ' ' CB ' ' C' ' 15' ' ' ALA . 37.4 t -101.95 -20.58 14.77 Favored 'General case' 0 N--CA 1.492 1.631 0 O-C-N 121.265 -0.897 . . . . 2.3999999999999999 110.064 179.937 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' C' C ' 19' ' ' ALA . . . . . 0.496 ' HB2' ' CE2' ' I' ' 96' ' ' TYR . . . 65.17 13.81 8.98 Favored 'General case' 0 N--CA 1.491 1.611 0 O-C-N 121.345 -0.847 . . . . 3.1000000000000001 110.262 -179.984 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' C' C ' 20' ' ' CYS . . . . . 0.536 ' SG ' ' CH2' ' I' ' 94' ' ' TRP . 47.4 m -153.13 177.71 10.52 Favored 'General case' 0 N--CA 1.491 1.594 0 O-C-N 121.269 -0.895 . . . . 2.48 110.219 179.982 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' C' C ' 21' ' ' LYS . . . . . 0.463 ' O ' ' HB ' ' I' ' 69' ' ' ILE . 0.1 OUTLIER -145.25 178.11 8.32 Favored 'General case' 0 N--CA 1.491 1.616 0 O-C-N 121.279 -0.888 . . . . 1.6699999999999999 110.169 179.971 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' C' C ' 22' ' ' PHE . . . . . 0.56 ' CE2' ' HD2' ' C' ' 39' ' ' ARG . 25.7 m-85 -125.84 97.15 5.01 Favored 'General case' 0 N--CA 1.491 1.576 0 O-C-N 121.216 -0.928 . . . . 2.3399999999999999 110.23 179.972 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' C' C ' 23' ' ' GLY . . . . . 0.438 ' O ' HG21 ' C' ' 24' ' ' VAL . . . -73.05 115.9 5.36 Favored Glycine 0 N--CA 1.49 2.26 0 N-CA-C 109.479 -1.448 . . . . 0.40000000000000002 109.479 179.955 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' C' C ' 24' ' ' VAL . . . . . 0.456 ' HA ' ' OD2' ' I' ' 72' ' ' ASP . 88.6 t -148.09 150.27 14.5 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.613 0 O-C-N 121.243 -1.151 . . . . 1.1599999999999999 110.259 -179.997 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' C' C ' 25' ' ' ALA . . . . . 0.526 ' CB ' ' HB2' ' I' ' 75' ' ' TYR . . . -129.98 172.83 11.31 Favored 'General case' 0 N--CA 1.492 1.637 0 O-C-N 121.258 -0.901 . . . . 1.21 110.199 179.959 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' C' C ' 26' ' ' ALA . . . . . 0.443 ' HB1' ' O ' ' C' ' 25' ' ' ALA . . . -178.21 158.66 1.19 Allowed 'General case' 0 N--CA 1.492 1.638 0 O-C-N 121.226 -0.921 . . . . 1.22 110.278 -179.976 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' C' C ' 27' ' ' ARG . . . . . . . . . . . . . 3.1 mtm180 -88.93 26.71 1.49 Allowed 'General case' 0 N--CA 1.491 1.59 0 O-C-N 121.293 -0.879 . . . . 3.7400000000000002 110.041 179.851 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' C' C ' 28' ' ' SER . . . . . . . . . . . . . 2.2 m -155.45 107.46 2.64 Favored 'General case' 0 N--CA 1.491 1.597 0 O-C-N 121.285 -0.884 . . . . 1.6799999999999999 110.324 -179.954 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' C' C ' 29' ' ' CYS . . . . . 0.562 ' HB2' ' CD1' ' C' ' 63' ' ' PHE . 6.4 p -46.44 -40.03 11.58 Favored 'General case' 0 N--CA 1.491 1.596 0 O-C-N 121.18 -0.95 . . . . 2.2200000000000002 110.134 179.94 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' C' C ' 30' ' ' GLN . . . . . . . . . . . . . 1.1 mt-30 -64.34 -48.82 74.1 Favored 'General case' 0 N--CA 1.491 1.623 0 O-C-N 121.26 -0.9 . . . . 2.9199999999999999 110.111 179.966 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' C' C ' 31' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER -48.18 -45.78 34.08 Favored 'General case' 0 N--CA 1.491 1.604 0 O-C-N 121.219 -0.925 . . . . 2.1299999999999999 110.196 179.93 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' C' C ' 32' ' ' LEU . . . . . 0.539 HD11 ' CZ ' ' C' ' 63' ' ' PHE . 6.7 mt -61.89 -44.89 95.88 Favored 'General case' 0 N--CA 1.492 1.629 0 O-C-N 121.273 -0.892 . . . . 1.8300000000000001 110.119 179.938 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' C' C ' 33' ' ' LEU . . . . . 0.457 ' CD1' ' HB3' ' C' ' 60' ' ' ASP . 4.0 mt -52.59 -40.76 63.0 Favored 'General case' 0 N--CA 1.491 1.617 0 O-C-N 121.277 -0.889 . . . . 1.3999999999999999 110.222 -179.903 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' C' C ' 34' ' ' ARG . . . . . 0.428 ' O ' ' C ' ' C' ' 35' ' ' LYS . 0.0 OUTLIER -66.34 -64.57 0.83 Allowed 'General case' 0 N--CA 1.491 1.584 0 O-C-N 121.214 -0.929 . . . . 3.2400000000000002 110.244 -179.909 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' C' C ' 35' ' ' LYS . . . . . 0.428 ' C ' ' O ' ' C' ' 34' ' ' ARG . 0.4 OUTLIER -42.44 -43.84 3.78 Favored 'General case' 0 N--CA 1.492 1.654 0 O-C-N 121.327 -0.858 . . . . 2.79 110.296 -179.927 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' C' C ' 36' ' ' GLY . . . . . 0.575 ' CA ' ' CD2' ' C' ' 13' ' ' LEU . . . -62.57 -47.24 90.81 Favored Glycine 0 N--CA 1.49 2.298 0 N-CA-C 109.577 -1.409 . . . . 0.46999999999999997 109.577 -179.979 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' C' C ' 37' ' ' CYS . . . . . 0.42 ' SG ' ' O ' ' C' ' 42' ' ' LEU . 9.9 t -66.94 -19.68 65.77 Favored 'General case' 0 N--CA 1.492 1.655 0 O-C-N 121.247 -1.149 . . . . 2.1499999999999999 110.263 -179.99 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' C' C ' 38' ' ' VAL . . . . . . . . . . . . . 72.9 t -83.77 -33.7 9.74 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.637 0 O-C-N 121.245 -0.91 . . . . 1.55 110.253 -179.971 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' C' C ' 39' ' ' ARG . . . . . 0.56 ' HD2' ' CE2' ' C' ' 22' ' ' PHE . 6.7 mmt-85 -89.96 -22.99 21.67 Favored 'General case' 0 N--CA 1.491 1.609 0 O-C-N 121.276 -0.89 . . . . 3.8100000000000001 110.238 -179.982 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' C' C ' 40' ' ' PHE . . . . . 0.44 ' O ' ' HB2' ' C' ' 41' ' ' GLN . 1.6 m-85 -112.56 -1.23 14.94 Favored 'General case' 0 N--CA 1.491 1.619 0 O-C-N 121.214 -0.929 . . . . 2.2000000000000002 110.236 -179.946 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' C' C ' 41' ' ' GLN . . . . . 0.44 ' HB2' ' O ' ' C' ' 40' ' ' PHE . 28.7 mt-30 55.22 63.63 2.04 Favored 'General case' 0 N--CA 1.491 1.615 0 O-C-N 121.252 -0.905 . . . . 2.6299999999999999 110.099 -179.95 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' C' C ' 42' ' ' LEU . . . . . 0.529 HD11 ' CG ' ' C' ' 74' ' ' LEU . 0.1 OUTLIER -141.86 99.97 6.08 Favored Pre-proline 0 N--CA 1.491 1.593 0 O-C-N 121.244 -0.91 . . . . 1.8 110.172 -179.934 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' C' C ' 43' ' ' PRO . . . . . 0.521 ' O ' ' CB ' ' C' ' 47' ' ' SER . 3.0 Cg_exo -59.97 158.88 27.57 Favored 'Trans proline' 0 C--N 1.312 -1.391 0 O-C-N 123.58 1.305 . . . . 0.84999999999999998 110.522 -179.98 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' C' C ' 44' ' ' MET . . . . . 0.562 ' N ' ' CD ' ' C' ' 45' ' ' PRO . 3.0 mtm -73.5 -50.79 5.87 Favored Pre-proline 0 N--CA 1.49 1.543 0 O-C-N 121.189 -0.945 . . . . 2.5800000000000001 110.774 -179.935 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' C' C ' 45' ' ' PRO . . . . . 0.562 ' CD ' ' N ' ' C' ' 44' ' ' MET . 3.0 Cg_endo -63.95 -61.19 0.13 Allowed 'Trans proline' 0 C--N 1.313 -1.309 0 O-C-N 123.359 1.189 . . . . 0.72999999999999998 110.776 -179.686 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' C' C ' 46' ' ' GLY . . . . . 0.467 ' O ' ' CB ' ' C' ' 47' ' ' SER . . . -87.16 39.62 3.1 Favored Glycine 0 N--CA 1.491 2.366 0 N-CA-C 109.811 -1.316 . . . . 0.73999999999999999 109.811 -179.708 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' C' C ' 47' ' ' SER . . . . . 0.521 ' HB3' ' CD2' ' C' ' 42' ' ' LEU . 0.3 OUTLIER 170.38 131.24 0.02 OUTLIER 'General case' 0 N--CA 1.493 1.712 0 O-C-N 121.226 -1.161 . . . . 1.7 110.106 179.88 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' C' C ' 48' ' ' ARG . . . . . 0.475 ' HG2' ' CG2' ' C' ' 59' ' ' THR . 2.1 mtm180 -134.75 -163.51 1.39 Allowed 'General case' 0 N--CA 1.49 1.564 0 O-C-N 121.249 -0.907 . . . . 2.9199999999999999 110.224 -179.958 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' C' C ' 49' ' ' LEU . . . . . . . . . . . . . 1.9 mp -132.87 174.9 9.85 Favored 'General case' 0 N--CA 1.491 1.608 0 O-C-N 121.204 -0.935 . . . . 1.1899999999999999 110.225 -179.971 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' C' C ' 50' ' ' CYS . . . . . 0.453 ' HB3' HD13 ' C' ' 75' ' ' LEU . 6.1 p -148.78 125.47 11.11 Favored 'General case' 0 N--CA 1.491 1.592 0 O-C-N 121.266 -0.896 . . . . 1.9299999999999999 110.168 179.977 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' C' C ' 51' ' ' LEU . . . . . 0.461 HD21 HD12 ' C' ' 66' ' ' LEU . 6.3 mt -46.58 131.33 11.25 Favored 'General case' 0 N--CA 1.492 1.63 0 O-C-N 121.246 -0.909 . . . . 1.3700000000000001 110.265 -179.926 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' C' C ' 52' ' ' TYR . . . . . 0.459 ' HB3' ' HB3' ' C' ' 71' ' ' GLU . 88.2 t80 -79.34 5.24 12.98 Favored 'General case' 0 N--CA 1.491 1.589 0 O-C-N 121.308 -0.87 . . . . 2.2999999999999998 110.141 179.874 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' C' C ' 53' ' ' GLU . . . . . 0.46 ' O ' ' HB3' ' C' ' 84' ' ' TYR . 3.5 tp10 -89.21 -46.61 8.66 Favored 'General case' 0 N--CA 1.49 1.569 0 O-C-N 121.25 -0.906 . . . . 2.3399999999999999 110.344 -179.941 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' C' C ' 54' ' ' ASP . . . . . . . . . . . . . 1.0 OUTLIER -138.96 15.28 2.66 Favored 'General case' 0 N--CA 1.491 1.59 0 O-C-N 121.246 -0.909 . . . . 2.3599999999999999 110.27 -179.971 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' C' C ' 55' ' ' GLY . . . . . . . . . . . . . . . 66.89 52.47 33.06 Favored Glycine 0 N--CA 1.491 2.31 0 N-CA-C 109.599 -1.4 . . . . 1.03 109.599 -179.981 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' C' C ' 56' ' ' THR . . . . . 0.453 ' OG1' ' HB2' ' C' ' 51' ' ' LEU . 0.3 OUTLIER -95.64 116.74 29.29 Favored 'General case' 0 N--CA 1.492 1.637 0 O-C-N 121.203 -1.174 . . . . 1.51 110.144 179.992 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' C' C ' 57' ' ' GLU . . . . . 0.415 ' C ' HG23 ' C' ' 58' ' ' VAL . 7.2 mt-10 -53.78 129.14 32.43 Favored 'General case' 0 N--CA 1.491 1.617 0 O-C-N 121.258 -0.901 . . . . 2.4399999999999999 110.206 179.957 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' C' C ' 58' ' ' VAL . . . . . 0.417 HG23 ' O ' ' C' ' 56' ' ' THR . 48.9 t -130.01 145.74 35.17 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.596 0 O-C-N 121.244 -0.91 . . . . 1.4399999999999999 110.181 179.965 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' C' C ' 59' ' ' THR . . . . . 0.475 ' CG2' ' HG2' ' C' ' 48' ' ' ARG . 0.2 OUTLIER -146.99 -148.71 0.26 Allowed 'General case' 0 N--CA 1.491 1.607 0 O-C-N 121.257 -0.902 . . . . 1.3100000000000001 110.239 -179.978 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' C' C ' 60' ' ' ASP . . . . . 0.457 ' HB3' ' CD1' ' C' ' 33' ' ' LEU . 2.6 p30 -89.34 9.05 27.54 Favored 'General case' 0 N--CA 1.491 1.6 0 O-C-N 121.185 -0.947 . . . . 2.3300000000000001 110.203 -179.984 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' C' C ' 61' ' ' ASP . . . . . . . . . . . . . 0.6 OUTLIER -123.22 -14.69 7.43 Favored 'General case' 0 N--CA 1.492 1.646 0 O-C-N 121.253 -0.904 . . . . 1.79 110.198 179.974 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' C' C ' 62' ' ' CYS . . . . . . . . . . . . . 0.1 OUTLIER -128.43 11.9 6.39 Favored 'General case' 0 N--CA 1.491 1.59 0 O-C-N 121.263 -0.898 . . . . 1.78 110.154 179.954 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' C' C ' 63' ' ' PHE . . . . . 0.581 ' N ' ' CD ' ' C' ' 64' ' ' PRO . 0.7 OUTLIER -78.33 -46.88 2.06 Favored Pre-proline 0 N--CA 1.49 1.538 0 O-C-N 121.281 -0.887 . . . . 2.2999999999999998 110.957 179.988 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' C' C ' 64' ' ' PRO . . . . . 0.581 ' CD ' ' N ' ' C' ' 63' ' ' PHE . 2.9 Cg_endo -63.34 -19.65 68.68 Favored 'Trans proline' 0 C--N 1.316 -1.176 0 O-C-N 122.998 0.999 . . . . 0.97999999999999998 110.502 -179.98 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' C' C ' 65' ' ' GLY . . . . . . . . . . . . . . . -64.79 -17.79 63.26 Favored Glycine 0 N--CA 1.491 2.324 0 N-CA-C 109.53 -1.428 . . . . 0.88 109.53 -179.982 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' C' C ' 66' ' ' LEU . . . . . 0.461 HD12 HD21 ' C' ' 51' ' ' LEU . 19.8 mt -89.71 153.8 47.84 Favored Pre-proline 0 N--CA 1.491 1.592 0 O-C-N 121.19 -1.183 . . . . 1.28 110.227 -179.985 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' C' C ' 67' ' ' PRO . . . . . 0.472 ' O ' ' O ' ' C' ' 68' ' ' ASN . 3.0 Cg_exo -61.21 -159.72 0.02 OUTLIER 'Trans proline' 0 C--N 1.312 -1.393 0 O-C-N 123.743 1.391 . . . . 0.84999999999999998 110.577 -179.995 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' C' C ' 68' ' ' ASN . . . . . 0.609 ' O ' ' N ' ' C' ' 70' ' ' ALA . 3.3 m120 -61.12 -136.96 0.0 OUTLIER 'General case' 0 N--CA 1.491 1.594 0 O-C-N 121.271 -0.893 . . . . 2.3500000000000001 109.829 179.81 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' C' C ' 69' ' ' ASP . . . . . 0.584 ' HA ' ' HA ' ' C' ' 11' ' ' VAL . 11.2 p30 -28.68 82.53 0.0 OUTLIER 'General case' 0 N--CA 1.495 1.816 0 CA-C-O 121.315 0.579 . . . . 2.0600000000000001 111.924 -179.629 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' C' C ' 70' ' ' ALA . . . . . 0.609 ' N ' ' O ' ' C' ' 68' ' ' ASN . . . -86.51 123.39 31.66 Favored 'General case' 0 N--CA 1.49 1.543 0 O-C-N 121.307 -0.87 . . . . 1.1200000000000001 110.163 179.996 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' C' C ' 71' ' ' GLU . . . . . 0.459 ' HB3' ' HB3' ' C' ' 52' ' ' TYR . 6.6 mt-10 -59.11 86.32 0.01 OUTLIER 'General case' 0 N--CA 1.491 1.623 0 O-C-N 121.211 -0.931 . . . . 2.1099999999999999 110.118 -179.982 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' C' C ' 72' ' ' LEU . . . . . 0.43 ' N ' ' O ' ' C' ' 70' ' ' ALA . 1.0 OUTLIER -89.64 103.73 16.35 Favored 'General case' 0 N--CA 1.491 1.62 0 O-C-N 121.3 -0.875 . . . . 1.1499999999999999 110.246 -179.924 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' C' C ' 73' ' ' LEU . . . . . 0.446 ' HB3' ' SG ' ' C' ' 50' ' ' CYS . 11.1 tp -84.57 157.49 21.21 Favored 'General case' 0 N--CA 1.492 1.637 0 O-C-N 121.245 -0.909 . . . . 1.27 110.18 179.908 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' C' C ' 74' ' ' LEU . . . . . 0.529 ' CG ' HD11 ' C' ' 42' ' ' LEU . 7.5 tp -81.54 134.36 35.5 Favored 'General case' 0 N--CA 1.492 1.629 0 O-C-N 121.287 -0.883 . . . . 1.98 110.241 -179.947 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' C' C ' 75' ' ' LEU . . . . . 0.517 ' CD1' ' HA ' ' C' ' 80' ' ' THR . 10.5 tt -153.84 110.73 3.39 Favored 'General case' 0 N--CA 1.492 1.629 0 O-C-N 121.267 -0.895 . . . . 1.4199999999999999 110.2 -179.965 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' C' C ' 76' ' ' THR . . . . . . . . . . . . . 21.4 p -85.96 168.66 13.96 Favored 'General case' 0 N--CA 1.491 1.621 0 O-C-N 121.235 -0.916 . . . . 1.3 110.182 179.994 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' C' C ' 77' ' ' ALA . . . . . . . . . . . . . . . -68.26 73.82 0.22 Allowed 'General case' 0 N--CA 1.491 1.614 0 O-C-N 121.263 -0.898 . . . . 1.3500000000000001 110.132 -179.974 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' C' C ' 78' ' ' GLY . . . . . . . . . . . . . . . 178.13 -38.98 0.09 OUTLIER Glycine 0 N--CA 1.491 2.34 0 N-CA-C 109.514 -1.435 . . . . 1.2 109.514 179.998 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' C' C ' 79' ' ' GLU . . . . . 0.405 ' O ' ' HG ' ' C' ' 75' ' ' LEU . 9.9 mt-10 -109.69 151.11 27.31 Favored 'General case' 0 N--CA 1.49 1.571 0 O-C-N 121.219 -1.166 . . . . 2.7200000000000002 110.122 -179.993 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' C' C ' 80' ' ' THR . . . . . 0.517 ' HA ' ' CD1' ' C' ' 75' ' ' LEU . 25.4 p -128.87 148.02 50.87 Favored 'General case' 0 N--CA 1.491 1.583 0 O-C-N 121.195 -0.94 . . . . 1.4399999999999999 110.296 -179.989 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' C' C ' 81' ' ' TRP . . . . . 0.416 ' NE1' ' HA2' ' C' ' 83' ' ' GLY . 2.0 t-105 -89.95 112.87 24.4 Favored 'General case' 0 N--CA 1.492 1.628 0 O-C-N 121.286 -0.884 . . . . 1.0 110.128 179.923 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' C' C ' 82' ' ' HIS . . . . . . . . . . . . . 0.4 OUTLIER -44.86 -49.35 10.93 Favored 'General case' 0 N--CA 1.491 1.607 0 O-C-N 121.262 -0.899 . . . . 2.8199999999999998 110.22 179.987 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' C' C ' 83' ' ' GLY . . . . . 0.516 ' O ' ' N ' ' C' ' 85' ' ' VAL . . . 119.84 150.42 8.6 Favored Glycine 0 N--CA 1.49 2.246 0 N-CA-C 109.558 -1.417 . . . . 1.5800000000000001 109.558 179.971 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' C' C ' 84' ' ' TYR . . . . . 0.46 ' HB3' ' O ' ' C' ' 53' ' ' GLU . 68.7 t80 -50.31 89.86 0.0 OUTLIER 'General case' 0 N--CA 1.491 1.608 0 O-C-N 121.301 -1.117 . . . . 3.1099999999999999 110.221 -179.981 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' C' C ' 85' ' ' VAL . . . . . 0.516 ' N ' ' O ' ' C' ' 83' ' ' GLY . 37.9 t -86.69 152.47 3.47 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.557 0 O-C-N 121.215 -0.928 . . . . 3.5800000000000001 110.242 179.985 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' C' C ' 86' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER -113.76 33.51 5.15 Favored 'General case' 0 N--CA 1.491 1.585 0 O-C-N 121.259 -0.901 . . . . 3.6800000000000002 110.124 179.99 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' C' C ' 87' ' ' ASP . . . . . . . . . . . . . 6.2 t70 . . . . . 0 N--CA 1.491 1.591 0 O-C-N 121.221 -0.924 . . . . 4.6100000000000003 110.191 -179.946 . . . . . . . . 0 0 . 1 . 001 nuclear orig full ' I' I ' 1' ' ' MET . . . . . . . . . . . . . 0.8 OUTLIER . . . . . 0 N--CA 1.493 1.682 0 CA-C-O 121.261 0.553 . . . . 24.289999999999999 110.252 . . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' I' I ' 2' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -55.8 -19.65 12.22 Favored 'General case' 0 N--CA 1.492 1.634 0 O-C-N 121.224 -0.923 . . . . 22.629999999999999 110.204 -179.922 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' I' I ' 3' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -48.99 121.91 5.26 Favored 'General case' 0 N--CA 1.491 1.6 0 O-C-N 121.281 -0.887 . . . . 22.350000000000001 110.194 -179.896 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' I' I ' 4' ' ' SER . . . . . 0.526 ' O ' ' CZ ' ' I' ' 5' ' ' ARG . 1.4 p -51.03 102.98 0.05 OUTLIER 'General case' 0 N--CA 1.491 1.602 0 O-C-N 121.211 -0.93 . . . . 20.109999999999999 110.275 -179.914 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' I' I ' 5' ' ' ARG . . . . . 0.526 ' CZ ' ' O ' ' I' ' 4' ' ' SER . 0.1 OUTLIER -125.9 86.29 2.51 Favored 'General case' 0 N--CA 1.491 1.622 0 O-C-N 121.297 -0.877 . . . . 20.780000000000001 110.162 179.981 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' I' I ' 6' ' ' GLY . . . . . 0.465 ' O ' ' CB ' ' I' ' 7' ' ' ALA . . . -127.5 4.57 7.13 Favored Glycine 0 N--CA 1.49 2.298 0 N-CA-C 109.584 -1.406 . . . . 16.870000000000001 109.584 179.949 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' I' I ' 7' ' ' ALA . . . . . 0.465 ' CB ' ' O ' ' I' ' 6' ' ' GLY . . . 171.79 -31.11 0.0 OUTLIER 'General case' 0 N--CA 1.492 1.626 0 O-C-N 121.298 -1.119 . . . . 14.9 110.08 179.926 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' I' I ' 8' ' ' SER . . . . . 0.488 ' O ' ' NE ' ' I' ' 5' ' ' ARG . 0.1 OUTLIER -84.0 164.07 19.54 Favored 'General case' 0 N--CA 1.492 1.638 0 O-C-N 121.231 -0.918 . . . . 14.0 110.136 179.949 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' I' I ' 9' ' ' ALA . . . . . 0.506 ' HB1' ' NE ' ' I' ' 5' ' ' ARG . . . 59.47 151.24 0.09 OUTLIER Pre-proline 0 N--CA 1.492 1.637 0 O-C-N 121.209 -0.932 . . . . 11.24 110.09 -179.917 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' I' I ' 10' ' ' PRO . . . . . 0.404 ' O ' ' C ' ' I' ' 11' ' ' ASP . 3.0 Cg_exo -61.67 -157.63 0.02 OUTLIER 'Trans proline' 0 C--N 1.311 -1.438 0 O-C-N 123.719 1.379 . . . . 11.32 110.66 -179.811 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' I' I ' 11' ' ' ASP . . . . . 0.516 ' N ' ' HD3' ' I' ' 12' ' ' PRO . 6.5 t0 43.05 60.24 10.68 Favored Pre-proline 0 N--CA 1.491 1.611 0 O-C-N 121.301 -0.874 . . . . 9.6300000000000008 110.167 -179.891 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' I' I ' 12' ' ' PRO . . . . . 0.522 ' HG2' ' CG1' ' I' ' 15' ' ' VAL . 3.0 Cg_endo -61.42 164.28 15.68 Favored 'Trans proline' 0 C--N 1.311 -1.442 0 O-C-N 123.738 1.389 . . . . 6.6699999999999999 110.57 179.984 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' I' I ' 13' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -84.22 -18.67 35.8 Favored 'General case' 0 N--CA 1.491 1.601 0 O-C-N 121.219 -0.926 . . . . 7.6100000000000003 110.087 179.944 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' I' I ' 14' ' ' ASP . . . . . . . . . . . . . 14.3 m-20 -92.92 21.38 5.74 Favored 'General case' 0 N--CA 1.491 1.582 0 O-C-N 121.289 -0.882 . . . . 5.29 110.176 179.975 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' I' I ' 15' ' ' VAL . . . . . 0.522 ' CG1' ' HG2' ' I' ' 12' ' ' PRO . 33.5 m -81.55 70.45 0.6 Allowed 'Isoleucine or valine' 0 N--CA 1.491 1.593 0 O-C-N 121.218 -0.926 . . . . 3.0600000000000001 110.347 -179.925 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' I' I ' 16' ' ' ARG . . . . . 0.525 ' CD ' HD12 ' I' ' 77' ' ' LEU . 0.3 OUTLIER 63.1 63.12 1.67 Allowed Pre-proline 0 N--CA 1.491 1.593 0 O-C-N 121.177 -0.952 . . . . 2.9399999999999999 110.235 179.931 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' I' I ' 17' ' ' PRO . . . . . 0.489 ' HD3' ' N ' ' I' ' 16' ' ' ARG . 2.9 Cg_endo -63.63 58.25 0.2 Allowed 'Trans proline' 0 C--N 1.311 -1.433 0 O-C-N 123.695 1.366 . . . . 1.1799999999999999 110.83 -179.925 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' I' I ' 18' ' ' LEU . . . . . 0.497 ' N ' ' O ' ' I' ' 16' ' ' ARG . 13.9 mt 57.74 119.35 0.01 OUTLIER 'General case' 0 N--CA 1.494 1.73 0 O-C-N 121.284 -0.885 . . . . 2.27 110.441 179.819 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' I' I ' 19' ' ' LYS . . . . . 0.435 ' HD3' ' HA ' ' I' ' 77' ' ' LEU . 0.0 OUTLIER -113.5 90.53 17.83 Favored Pre-proline 0 N--CA 1.492 1.664 0 O-C-N 121.21 -0.931 . . . . 2.6699999999999999 110.182 179.939 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' I' I ' 20' ' ' PRO . . . . . 0.453 ' HA ' ' HA ' ' I' ' 35' ' ' ALA . 3.1 Cg_exo -62.81 83.86 0.11 Allowed 'Trans proline' 0 C--N 1.311 -1.402 0 O-C-N 123.692 1.364 . . . . 1.1000000000000001 110.373 179.845 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' I' I ' 21' ' ' CYS . . . . . 0.452 ' O ' HG22 ' I' ' 34' ' ' VAL . 1.3 m -87.54 160.31 18.28 Favored 'General case' 0 N--CA 1.491 1.602 0 O-C-N 121.322 -0.861 . . . . 1.1399999999999999 110.385 -179.829 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' I' I ' 22' ' ' LEU . . . . . . . . . . . . . 21.7 mt -104.5 101.27 10.95 Favored 'General case' 0 N--CA 1.491 1.593 0 O-C-N 121.306 -0.871 . . . . 1.22 109.95 179.829 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' I' I ' 23' ' ' LEU . . . . . 0.442 HD23 ' HB2' ' I' ' 85' ' ' PHE . 2.9 mm? -79.82 144.77 33.23 Favored 'General case' 0 N--CA 1.491 1.592 0 O-C-N 121.268 -0.895 . . . . 1.21 110.286 -179.861 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' I' I ' 24' ' ' ARG . . . . . 0.453 ' HB2' ' HG3' ' I' ' 31' ' ' GLN . 0.0 OUTLIER -140.09 138.6 35.44 Favored 'General case' 0 N--CA 1.491 1.587 0 O-C-N 121.298 -0.876 . . . . 2.4399999999999999 110.197 -179.949 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' I' I ' 25' ' ' ARG . . . . . 0.425 ' HB2' HD22 ' I' ' 50' ' ' LEU . 57.9 ttt180 -107.29 122.85 47.39 Favored 'General case' 0 N--CA 1.491 1.59 0 O-C-N 121.22 -0.925 . . . . 3.3100000000000001 110.229 179.992 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' I' I ' 26' ' ' ASN . . . . . 0.527 ' ND2' ' CB ' ' I' ' 93' ' ' LYS . 8.8 t30 -45.9 165.19 0.02 OUTLIER 'General case' 0 N--CA 1.49 1.572 0 O-C-N 121.247 -0.908 . . . . 3.2799999999999998 110.192 179.995 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' I' I ' 27' ' ' HIS . . . . . 0.447 ' CB ' ' O ' ' I' ' 26' ' ' ASN . 0.2 OUTLIER 65.41 9.12 5.49 Favored 'General case' 0 N--CA 1.491 1.613 0 O-C-N 121.264 -0.898 . . . . 3.71 110.174 -179.956 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' I' I ' 28' ' ' SER . . . . . 0.516 ' O ' ' N ' ' I' ' 30' ' ' ASP . 0.5 OUTLIER -159.77 92.75 1.05 Allowed 'General case' 0 N--CA 1.491 1.609 0 O-C-N 121.268 -0.895 . . . . 2.2000000000000002 110.154 179.949 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' I' I ' 29' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -64.14 70.63 0.03 OUTLIER 'General case' 0 N--CA 1.492 1.628 0 O-C-N 121.255 -0.903 . . . . 3.9199999999999999 110.249 -179.958 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' I' I ' 30' ' ' ASP . . . . . 0.516 ' N ' ' O ' ' I' ' 28' ' ' SER . 0.2 OUTLIER -139.29 113.07 8.51 Favored 'General case' 0 N--CA 1.491 1.609 0 O-C-N 121.21 -0.931 . . . . 2.0299999999999998 110.202 179.933 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' I' I ' 31' ' ' GLN . . . . . 0.453 ' HG3' ' HB2' ' I' ' 24' ' ' ARG . 0.0 OUTLIER -91.11 152.09 20.74 Favored 'General case' 0 N--CA 1.491 1.58 0 O-C-N 121.203 -0.936 . . . . 2.0099999999999998 110.218 -179.968 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' I' I ' 32' ' ' HIS . . . . . 0.417 ' O ' HG11 ' I' ' 34' ' ' VAL . 45.7 m-70 -130.04 124.17 32.24 Favored 'General case' 0 N--CA 1.491 1.584 0 O-C-N 121.235 -0.916 . . . . 2.3900000000000001 110.178 179.974 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' I' I ' 33' ' ' GLY . . . . . . . . . . . . . . . -73.65 117.01 5.61 Favored Glycine 0 N--CA 1.49 2.294 0 N-CA-C 109.506 -1.438 . . . . 0.68999999999999995 109.506 -179.981 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' I' I ' 34' ' ' VAL . . . . . 0.558 ' CG2' ' CD1' ' I' ' 42' ' ' LEU . 3.4 m -125.03 119.33 55.54 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.574 0 O-C-N 121.231 -1.158 . . . . 1.3400000000000001 110.389 -179.947 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' I' I ' 35' ' ' ALA . . . . . 0.453 ' HA ' ' HA ' ' I' ' 20' ' ' PRO . . . -83.39 105.15 14.11 Favored 'General case' 0 N--CA 1.491 1.595 0 O-C-N 121.196 -0.94 . . . . 1.1799999999999999 110.173 179.901 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' I' I ' 36' ' ' ALA . . . . . 0.427 ' HB1' ' HB3' ' I' ' 41' ' ' GLU . . . -138.41 133.99 33.55 Favored 'General case' 0 N--CA 1.492 1.635 0 O-C-N 121.233 -0.917 . . . . 1.1100000000000001 110.263 -179.905 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' I' I ' 37' ' ' SER . . . . . 0.47 ' HB2' ' O ' ' I' ' 16' ' ' ARG . 0.0 OUTLIER -85.3 -71.51 0.52 Allowed 'General case' 0 N--CA 1.491 1.617 0 O-C-N 121.3 -0.875 . . . . 1.4199999999999999 110.084 179.883 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' I' I ' 38' ' ' SER . . . . . 0.465 ' N ' ' OG ' ' I' ' 37' ' ' SER . 6.9 t -83.45 152.13 25.12 Favored 'General case' 0 N--CA 1.491 1.606 0 O-C-N 121.288 -0.882 . . . . 1.8 110.082 179.946 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' I' I ' 39' ' ' LEU . . . . . 0.522 ' CD1' ' O ' ' I' ' 72' ' ' ASP . 0.4 OUTLIER -43.96 -51.95 7.32 Favored 'General case' 0 N--CA 1.491 1.577 0 O-C-N 121.186 -0.946 . . . . 1.97 110.126 179.981 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' I' I ' 40' ' ' GLU . . . . . 0.41 ' C ' ' O ' ' I' ' 39' ' ' LEU . 3.1 mt-10 -42.55 -43.35 3.7 Favored 'General case' 0 N--CA 1.491 1.599 0 O-C-N 121.277 -0.889 . . . . 2.5600000000000001 110.217 179.984 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' I' I ' 41' ' ' GLU . . . . . 0.447 ' O ' ' HG2' ' I' ' 45' ' ' LYS . 13.0 mt-10 -66.27 -45.17 81.4 Favored 'General case' 0 N--CA 1.491 1.609 0 O-C-N 121.293 -0.879 . . . . 2.0 110.246 179.993 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' I' I ' 42' ' ' LEU . . . . . 0.558 ' CD1' ' CG2' ' I' ' 34' ' ' VAL . 14.3 tp -65.45 -55.25 19.01 Favored 'General case' 0 N--CA 1.492 1.637 0 O-C-N 121.246 -0.909 . . . . 1.1899999999999999 110.207 -179.981 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' I' I ' 43' ' ' ARG . . . . . 0.437 ' HD3' HD12 ' I' ' 59' ' ' ILE . 0.0 OUTLIER -44.77 -62.79 1.08 Allowed 'General case' 0 N--CA 1.491 1.624 0 O-C-N 121.288 -0.883 . . . . 2.6899999999999999 110.103 179.891 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' I' I ' 44' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -44.81 -58.8 2.87 Favored 'General case' 0 N--CA 1.491 1.583 0 O-C-N 121.282 -0.887 . . . . 1.78 110.175 179.901 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' I' I ' 45' ' ' LYS . . . . . 0.515 ' O ' ' CD1' ' I' ' 49' ' ' LEU . 67.1 mmtt -47.76 -42.34 25.41 Favored 'General case' 0 N--CA 1.49 1.558 0 O-C-N 121.19 -0.943 . . . . 2.7200000000000002 110.132 179.956 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' I' I ' 46' ' ' ALA . . . . . 0.443 ' O ' ' HB2' ' I' ' 50' ' ' LEU . . . -67.24 -25.42 66.08 Favored 'General case' 0 N--CA 1.491 1.62 0 O-C-N 121.314 -0.866 . . . . 1.1000000000000001 110.175 -179.97 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' I' I ' 47' ' ' CYS . . . . . 0.444 ' HA ' ' HB ' ' I' ' 52' ' ' ILE . 0.0 OUTLIER -75.64 -43.02 49.95 Favored 'General case' 0 N--CA 1.491 1.607 0 O-C-N 121.264 -0.897 . . . . 1.6399999999999999 110.154 179.913 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' I' I ' 48' ' ' GLU . . . . . . . . . . . . . 2.3 tt0 -78.43 -25.56 46.04 Favored 'General case' 0 N--CA 1.491 1.606 0 O-C-N 121.287 -0.883 . . . . 2.1400000000000001 110.221 179.934 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' I' I ' 49' ' ' LEU . . . . . 0.515 ' CD1' ' O ' ' I' ' 45' ' ' LYS . 0.7 OUTLIER -87.26 -42.54 12.85 Favored 'General case' 0 N--CA 1.491 1.612 0 O-C-N 121.222 -0.923 . . . . 1.3600000000000001 110.217 179.98 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' I' I ' 50' ' ' LEU . . . . . 0.452 ' HB2' HG12 ' I' ' 52' ' ' ILE . 43.5 mt -97.56 -2.04 42.62 Favored 'General case' 0 N--CA 1.491 1.591 0 O-C-N 121.28 -0.887 . . . . 1.53 110.235 179.937 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' I' I ' 51' ' ' ALA . . . . . . . . . . . . . . . 60.77 40.68 15.76 Favored 'General case' 0 N--CA 1.491 1.605 0 O-C-N 121.271 -0.893 . . . . 1.4399999999999999 110.214 179.993 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' I' I ' 52' ' ' ILE . . . . . 0.518 HG21 ' CD1' ' I' ' 59' ' ' ILE . 22.6 mm -72.01 86.09 0.37 Allowed 'Isoleucine or valine' 0 N--CA 1.491 1.601 0 O-C-N 121.23 -0.919 . . . . 1.4199999999999999 110.202 -179.961 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' I' I ' 53' ' ' ASP . . . . . 0.496 ' N ' HD12 ' I' ' 56' ' ' LEU . 0.1 OUTLIER -46.1 156.82 0.14 Allowed 'General case' 0 N--CA 1.491 1.616 0 O-C-N 121.218 -0.926 . . . . 2.4199999999999999 110.179 -179.996 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' I' I ' 54' ' ' LYS . . . . . 0.452 ' O ' ' OG1' ' I' ' 57' ' ' THR . 1.4 tptt -72.64 -10.43 59.79 Favored 'General case' 0 N--CA 1.492 1.647 0 O-C-N 121.25 -0.906 . . . . 4.2699999999999996 110.178 -179.997 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' I' I ' 55' ' ' SER . . . . . . . . . . . . . 19.7 t -82.48 -9.95 59.22 Favored 'General case' 0 N--CA 1.491 1.597 0 O-C-N 121.241 -0.912 . . . . 1.9399999999999999 110.057 179.966 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' I' I ' 56' ' ' LEU . . . . . 0.511 ' HB3' ' CB ' ' I' ' 89' ' ' ALA . 8.5 mt -95.7 -2.08 48.69 Favored 'General case' 0 N--CA 1.491 1.623 0 O-C-N 121.29 -0.881 . . . . 1.8100000000000001 110.242 -179.98 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' I' I ' 57' ' ' THR . . . . . 0.478 ' HB ' ' HA ' ' I' ' 58' ' ' PRO . 5.2 p -79.97 166.44 40.6 Favored Pre-proline 0 N--CA 1.491 1.623 0 O-C-N 121.279 -0.888 . . . . 1.52 109.998 179.977 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' I' I ' 58' ' ' PRO . . . . . 0.478 ' HA ' ' HB ' ' I' ' 57' ' ' THR . 2.5 Cg_endo -69.96 128.09 12.18 Favored 'Cis proline' 0 C--N 1.312 -1.346 0 C-N-CA 122.382 -1.924 . . . . 1.6799999999999999 110.828 -0.687 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' I' I ' 59' ' ' ILE . . . . . 0.518 ' CD1' HG21 ' I' ' 52' ' ' ILE . 29.6 mt -66.84 157.6 5.85 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.644 0 O-C-N 121.239 -0.913 . . . . 1.6599999999999999 110.22 179.917 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' I' I ' 60' ' ' THR . . . . . . . . . . . . . 7.9 m -123.06 112.99 18.42 Favored 'General case' 0 N--CA 1.492 1.654 0 O-C-N 121.245 -0.909 . . . . 1.28 110.202 -179.996 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' I' I ' 61' ' ' LEU . . . . . . . . . . . . . 2.7 mt -93.29 95.36 9.3 Favored 'General case' 0 N--CA 1.492 1.629 0 O-C-N 121.236 -0.915 . . . . 1.3899999999999999 110.251 -179.933 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' I' I ' 62' ' ' VAL . . . . . 0.488 HG13 ' CZ2' ' I' ' 94' ' ' TRP . 17.5 m -103.16 131.05 52.36 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.625 0 O-C-N 121.199 -0.938 . . . . 1.22 110.188 179.923 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' I' I ' 63' ' ' LEU . . . . . 0.411 ' O ' ' HA2' ' I' ' 67' ' ' GLY . 18.3 mt -59.72 129.55 42.43 Favored 'General case' 0 N--CA 1.491 1.601 0 O-C-N 121.256 -0.903 . . . . 1.25 110.273 179.992 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' I' I ' 64' ' ' ALA . . . . . 0.436 ' HB2' ' HB3' ' I' ' 84' ' ' LYS . . . -67.08 -30.07 70.01 Favored 'General case' 0 N--CA 1.49 1.573 0 O-C-N 121.239 -0.913 . . . . 1.25 110.221 179.961 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' I' I ' 65' ' ' GLU . . . . . . . . . . . . . 23.9 mt-10 -67.74 -56.4 9.39 Favored 'General case' 0 N--CA 1.491 1.604 0 O-C-N 121.259 -0.901 . . . . 2.5699999999999998 110.24 179.963 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' I' I ' 66' ' ' ASP . . . . . . . . . . . . . 6.3 m-20 -100.33 -51.11 3.73 Favored 'General case' 0 N--CA 1.491 1.612 0 O-C-N 121.261 -0.899 . . . . 1.77 110.175 -179.96 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' I' I ' 67' ' ' GLY . . . . . 0.411 ' HA2' ' O ' ' I' ' 63' ' ' LEU . . . 109.98 8.88 25.25 Favored Glycine 0 N--CA 1.49 2.248 0 N-CA-C 109.596 -1.402 . . . . 0.62 109.596 -179.986 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' I' I ' 68' ' ' THR . . . . . 0.456 HG21 ' HG3' ' C' ' 21' ' ' LYS . 68.1 m -66.34 124.23 22.14 Favored 'General case' 0 N--CA 1.491 1.61 0 O-C-N 121.234 -1.157 . . . . 1.1000000000000001 110.298 179.985 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' I' I ' 69' ' ' ILE . . . . . 0.463 ' HB ' ' O ' ' C' ' 21' ' ' LYS . 21.0 mt -62.96 128.81 25.53 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.626 0 O-C-N 121.261 -0.899 . . . . 1.4099999999999999 110.126 179.928 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' I' I ' 70' ' ' VAL . . . . . . . . . . . . . 15.6 t -106.78 69.91 0.27 Allowed 'Isoleucine or valine' 0 N--CA 1.491 1.58 0 O-C-N 121.293 -0.879 . . . . 1.3 110.188 179.987 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' I' I ' 71' ' ' ASP . . . . . . . . . . . . . 0.7 OUTLIER -88.78 25.75 1.69 Allowed 'General case' 0 N--CA 1.491 1.576 0 O-C-N 121.194 -0.942 . . . . 1.8799999999999999 110.156 179.961 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' I' I ' 72' ' ' ASP . . . . . 0.522 ' O ' ' CD1' ' I' ' 39' ' ' LEU . 8.3 p-10 -130.79 -173.12 2.99 Favored 'General case' 0 N--CA 1.491 1.593 0 O-C-N 121.293 -0.88 . . . . 2.46 109.906 179.766 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' I' I ' 73' ' ' ASP . . . . . 0.521 ' CB ' ' HB2' ' I' ' 39' ' ' LEU . 39.5 p-10 -141.27 30.51 1.76 Allowed 'General case' 0 N--CA 1.491 1.586 0 O-C-N 121.111 -0.993 . . . . 1.6499999999999999 110.452 -179.971 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' I' I ' 74' ' ' ASP . . . . . 0.461 ' O ' ' HB2' ' C' ' 25' ' ' ALA . 1.9 m-20 -130.8 0.12 4.31 Favored 'General case' 0 N--CA 1.491 1.58 0 O-C-N 121.242 -0.911 . . . . 1.6799999999999999 110.083 179.814 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' I' I ' 75' ' ' TYR . . . . . 0.526 ' HB2' ' CB ' ' C' ' 25' ' ' ALA . 53.5 t80 -129.27 -8.26 4.76 Favored 'General case' 0 N--CA 1.491 1.614 0 O-C-N 121.227 -0.921 . . . . 2.2599999999999998 110.652 -179.924 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' I' I ' 76' ' ' PHE . . . . . 0.61 ' CD1' ' O ' ' I' ' 76' ' ' PHE . 0.1 OUTLIER -97.88 2.83 49.63 Favored 'General case' 0 N--CA 1.491 1.576 0 O-C-N 121.033 -1.042 . . . . 2.98 110.088 -179.849 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' I' I ' 77' ' ' LEU . . . . . 0.608 HD23 ' CE2' ' I' ' 76' ' ' PHE . 0.3 OUTLIER -100.25 3.21 43.41 Favored 'General case' 0 N--CA 1.496 1.836 0 O-C-N 121.107 -0.995 . . . . 2.3599999999999999 109.749 178.87 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' I' I ' 78' ' ' CYS . . . . . 0.443 ' O ' ' C ' ' I' ' 79' ' ' LEU . 0.1 OUTLIER -79.65 -53.8 6.48 Favored 'General case' 0 N--CA 1.493 1.696 0 O-C-N 121.154 -0.966 . . . . 2.0299999999999998 110.525 -179.526 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' I' I ' 79' ' ' LEU . . . . . 0.443 ' C ' ' O ' ' I' ' 78' ' ' CYS . 1.4 mt -40.89 153.83 0.22 Allowed Pre-proline 0 N--CA 1.493 1.688 0 O-C-N 121.414 -0.803 . . . . 1.78 109.963 -179.99 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' I' I ' 80' ' ' PRO . . . . . 0.494 ' O ' ' N ' ' I' ' 82' ' ' ASN . 3.3 Cg_exo -59.34 173.36 1.46 Allowed 'Trans proline' 0 C--N 1.311 -1.427 0 O-C-N 123.615 1.324 . . . . 1.1599999999999999 110.66 -179.533 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' I' I ' 81' ' ' SER . . . . . 0.451 ' HB2' ' HG2' ' I' ' 20' ' ' PRO . 0.0 OUTLIER -66.81 59.11 0.04 OUTLIER 'General case' 0 N--CA 1.492 1.641 0 O-C-N 121.363 -0.836 . . . . 1.7 110.076 -179.872 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' I' I ' 82' ' ' ASN . . . . . 0.494 ' N ' ' O ' ' I' ' 80' ' ' PRO . 1.9 m-20 173.12 116.78 0.02 OUTLIER 'General case' 0 N--CA 1.491 1.59 0 O-C-N 121.261 -0.899 . . . . 2.9500000000000002 110.18 -179.872 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' I' I ' 83' ' ' THR . . . . . 0.475 ' HB ' ' CE1' ' I' ' 85' ' ' PHE . 0.2 OUTLIER -157.97 149.57 21.59 Favored 'General case' 0 N--CA 1.491 1.594 0 O-C-N 121.212 -0.93 . . . . 1.51 110.195 179.951 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' I' I ' 84' ' ' LYS . . . . . 0.436 ' HB3' ' HB2' ' I' ' 64' ' ' ALA . 0.5 OUTLIER -82.87 95.99 8.11 Favored 'General case' 0 N--CA 1.491 1.605 0 O-C-N 121.183 -0.948 . . . . 2.0099999999999998 110.172 -179.946 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' I' I ' 85' ' ' PHE . . . . . 0.475 ' CE1' ' HB ' ' I' ' 83' ' ' THR . 2.8 m-85 -93.86 105.28 17.31 Favored 'General case' 0 N--CA 1.491 1.623 0 O-C-N 121.28 -0.887 . . . . 2.2599999999999998 110.22 -179.932 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' I' I ' 86' ' ' VAL . . . . . 0.452 ' HB ' ' O ' ' I' ' 62' ' ' VAL . 92.4 t -80.42 109.61 15.07 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.592 0 O-C-N 121.211 -0.93 . . . . 1.1799999999999999 110.237 -179.991 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' I' I ' 87' ' ' ALA . . . . . . . . . . . . . . . -80.35 128.89 34.08 Favored 'General case' 0 N--CA 1.491 1.616 0 O-C-N 121.239 -0.913 . . . . 1.02 110.244 -179.941 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' I' I ' 88' ' ' LEU . . . . . 0.566 HD21 ' CD1' ' I' ' 94' ' ' TRP . 0.1 OUTLIER -121.62 83.79 2.14 Favored 'General case' 0 N--CA 1.492 1.643 0 O-C-N 121.235 -0.916 . . . . 1.29 110.249 -179.986 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' I' I ' 89' ' ' ALA . . . . . 0.511 ' CB ' ' HB3' ' I' ' 56' ' ' LEU . . . -66.65 63.23 0.05 OUTLIER 'General case' 0 N--CA 1.491 1.596 0 O-C-N 121.247 -0.908 . . . . 1.3500000000000001 110.079 179.927 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' I' I ' 90' ' ' CYS . . . . . 0.5 ' N ' ' O ' ' I' ' 88' ' ' LEU . 2.0 t 43.15 35.72 0.86 Allowed 'General case' 0 N--CA 1.491 1.577 0 O-C-N 121.241 -0.912 . . . . 1.75 110.151 -179.989 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' I' I ' 91' ' ' ASN . . . . . . . . . . . . . 17.2 t-20 -158.46 -57.82 0.07 Allowed 'General case' 0 N--CA 1.491 1.607 0 O-C-N 121.245 -0.909 . . . . 3.0699999999999998 110.224 -179.975 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' I' I ' 92' ' ' GLU . . . . . 0.453 ' HB2' ' HA ' ' I' ' 88' ' ' LEU . 6.2 mp0 -43.39 148.65 0.3 Allowed 'General case' 0 N--CA 1.491 1.579 0 O-C-N 121.231 -0.918 . . . . 1.8 110.205 179.997 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' I' I ' 93' ' ' LYS . . . . . 0.527 ' CB ' ' ND2' ' I' ' 26' ' ' ASN . 19.2 ttpt -62.19 143.11 57.21 Favored 'General case' 0 N--CA 1.491 1.584 0 O-C-N 121.275 -0.891 . . . . 2.7999999999999998 110.219 179.974 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' I' I ' 94' ' ' TRP . . . . . 0.566 ' CD1' HD21 ' I' ' 88' ' ' LEU . 0.0 OUTLIER -76.49 158.1 31.57 Favored 'General case' 0 N--CA 1.491 1.621 0 O-C-N 121.201 -0.937 . . . . 3.6899999999999999 110.243 -179.964 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' I' I ' 95' ' ' THR . . . . . 0.444 ' OG1' HG22 ' I' ' 62' ' ' VAL . 2.6 p -89.6 31.75 0.91 Allowed 'General case' 0 N--CA 1.491 1.601 0 O-C-N 121.182 -0.949 . . . . 2.0800000000000001 110.279 179.979 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' I' I ' 96' ' ' TYR . . . . . 0.566 ' HB2' ' CE3' ' I' ' 94' ' ' TRP . 87.1 t80 -127.01 -60.37 1.21 Allowed 'General case' 0 N--CA 1.492 1.626 0 O-C-N 121.223 -0.923 . . . . 4.5199999999999996 110.207 -179.959 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' I' I ' 97' ' ' ASN . . . . . 0.409 ' O ' ' C ' ' I' ' 98' ' ' ASP . 4.7 t30 42.93 58.13 3.36 Favored 'General case' 0 N--CA 1.492 1.632 0 O-C-N 121.264 -0.898 . . . . 4.25 110.235 179.988 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' I' I ' 98' ' ' ASP . . . . . 0.409 ' C ' ' O ' ' I' ' 97' ' ' ASN . 0.3 OUTLIER 43.22 38.96 1.79 Allowed 'General case' 0 N--CA 1.491 1.605 0 O-C-N 121.215 -0.928 . . . . 4.7000000000000002 110.187 179.964 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' I' I ' 99' ' ' SER . . . . . 0.473 ' CB ' ' O ' ' I' ' 96' ' ' TYR . 34.3 t -94.19 51.73 1.52 Allowed 'General case' 0 N--CA 1.491 1.599 0 O-C-N 121.167 -0.958 . . . . 4.1799999999999997 110.164 -179.998 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' I' I ' 100' ' ' ASP . . . . . . . . . . . . . 24.1 t70 . . . . . 0 N--CA 1.492 1.628 0 O-C-N 121.27 -0.894 . . . . 5.5 110.159 -179.958 . . . . . . . . 0 0 . 1 . 001 nuclear build full ' C' C ' 1' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.492 1.633 0 CA-C-O 121.281 0.562 . . . . 8.32 110.187 . . . . . . . . . 1 1 . 1 . 001 nuclear build full ' C' C ' 2' ' ' CYS . . . . . . . . . . . . . 6.5 m -114.37 66.76 0.68 Allowed 'General case' 0 N--CA 1.491 1.578 0 O-C-N 121.197 -0.939 . . . . 5.73 110.205 179.97 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' C' C ' 3' ' ' ALA . . . . . . . . . . . . . . . -46.06 118.39 1.87 Allowed 'General case' 0 N--CA 1.491 1.581 0 O-C-N 121.25 -0.906 . . . . 3.78 110.197 179.983 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' C' C ' 4' ' ' VAL . . . . . . . . . . . . . 30.9 t -80.69 117.65 27.02 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.637 0 O-C-N 121.198 -0.939 . . . . 3.63 110.296 -179.947 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' C' C ' 5' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -81.77 166.08 20.35 Favored 'General case' 0 N--CA 1.491 1.6 0 O-C-N 121.239 -0.913 . . . . 1.81 110.185 179.94 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' C' C ' 6' ' ' ARG . . . . . . . . . . . . . 8.1 mmt180 -87.55 -25.45 23.63 Favored 'General case' 0 N--CA 1.492 1.659 0 O-C-N 121.215 -0.928 . . . . 3.6 110.156 179.991 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' C' C ' 7' ' ' GLN . . . . . . . . . . . . . 9.6 pt20 -156.22 151.62 21.73 Favored Pre-proline 0 N--CA 1.491 1.591 0 O-C-N 121.26 -0.9 . . . . 2.27 110.129 179.984 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' C' C ' 8' ' ' PRO . . . . . . . . . . . . . 3.0 Cg_endo -61.24 123.14 12.25 Favored 'Trans proline' 0 C--N 1.31 -1.461 0 O-C-N 123.749 1.394 . . . . 0.96 110.542 179.997 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' C' C ' 9' ' ' LYS . . . . . 0.768 ' O ' ' HB1' ' C' ' 25' ' ' ALA . 1.0 OUTLIER -63.49 175.97 0.93 Allowed 'General case' 0 N--CA 1.492 1.649 0 O-C-N 121.198 -0.939 . . . . 1.79 110.136 -179.995 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' C' C ' 10' ' ' CYS . . . . . 0.596 ' C ' HG13 ' C' ' 11' ' ' VAL . 58.3 m -146.01 141.25 27.49 Favored 'General case' 0 N--CA 1.491 1.606 0 O-C-N 121.283 -0.886 . . . . 0.54 110.399 -179.968 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' C' C ' 11' ' ' VAL . . . . . 0.646 ' HA ' ' HA ' ' C' ' 69' ' ' ASP . 32.7 m -155.63 161.29 2.08 Favored 'Isoleucine or valine' 0 N--CA 1.488 1.453 0 O-C-N 120.993 -1.067 . . . . 0.4 110.402 179.802 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' C' C ' 12' ' ' LYS . . . . . 0.456 ' HD3' ' HE2' ' C' ' 21' ' ' LYS . 10.2 mttp -120.22 112.67 19.35 Favored 'General case' 0 N--CA 1.491 1.601 0 O-C-N 121.262 -0.899 . . . . 1.21 110.104 179.993 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' C' C ' 13' ' ' LEU . . . . . 0.782 HD21 ' HA3' ' C' ' 36' ' ' GLY . 0.8 OUTLIER -81.74 100.02 9.28 Favored 'General case' 0 N--CA 1.491 1.618 0 O-C-N 121.291 -0.88 . . . . 0.81 110.31 -179.942 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' C' C ' 14' ' ' ARG . . . . . 0.488 ' O ' ' HA ' ' C' ' 73' ' ' LEU . 1.9 ttt180 -106.16 135.91 46.79 Favored 'General case' 0 N--CA 1.492 1.647 0 O-C-N 121.236 -0.915 . . . . 2.31 110.292 179.93 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' C' C ' 15' ' ' ALA . . . . . 1.043 ' HB3' ' HB3' ' C' ' 18' ' ' SER . . . -91.3 174.12 7.56 Favored 'General case' 0 N--CA 1.492 1.66 0 O-C-N 121.24 -0.913 . . . . 0.61 110.233 -179.993 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' C' C ' 16' ' ' LEU . . . . . 0.438 ' HG ' HD21 ' C' ' 73' ' ' LEU . 0.3 OUTLIER -87.39 -49.33 7.3 Favored 'General case' 0 N--CA 1.491 1.622 0 O-C-N 121.262 -0.899 . . . . 1.03 110.241 -179.985 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' C' C ' 17' ' ' HIS . . . . . . . . . . . . . 4.2 m-70 -111.42 30.11 7.23 Favored 'General case' 0 N--CA 1.491 1.604 0 O-C-N 121.217 -0.927 . . . . 3.74 110.23 -179.99 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' C' C ' 18' ' ' SER . . . . . 1.043 ' HB3' ' HB3' ' C' ' 15' ' ' ALA . 37.4 t -101.95 -20.58 14.77 Favored 'General case' 0 N--CA 1.492 1.631 0 O-C-N 121.265 -0.897 . . . . 2.4 110.064 179.937 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' C' C ' 19' ' ' ALA . . . . . 0.764 ' HB1' ' CE2' ' I' ' 96' ' ' TYR . . . 65.17 13.81 8.98 Favored 'General case' 0 N--CA 1.491 1.611 0 O-C-N 121.345 -0.847 . . . . 2.68 110.262 -179.984 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' C' C ' 20' ' ' CYS . . . . . 0.628 ' HB3' HD11 ' I' ' 69' ' ' ILE . 47.4 m -153.13 177.71 10.52 Favored 'General case' 0 N--CA 1.491 1.594 0 O-C-N 121.269 -0.895 . . . . 2.14 110.219 179.982 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' C' C ' 21' ' ' LYS . . . . . 0.682 ' O ' HD12 ' I' ' 69' ' ' ILE . 0.1 OUTLIER -145.25 178.11 8.32 Favored 'General case' 0 N--CA 1.491 1.616 0 O-C-N 121.279 -0.888 . . . . 1.14 110.169 179.971 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' C' C ' 22' ' ' PHE . . . . . 0.583 ' CE2' ' HD2' ' C' ' 39' ' ' ARG . 25.7 m-85 -125.84 97.15 5.01 Favored 'General case' 0 N--CA 1.491 1.576 0 O-C-N 121.216 -0.928 . . . . 1.51 110.23 179.972 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' C' C ' 23' ' ' GLY . . . . . 0.446 ' C ' HG23 ' C' ' 24' ' ' VAL . . . -73.05 115.9 5.36 Favored Glycine 0 N--CA 1.49 2.26 0 N-CA-C 109.479 -1.448 . . . . 0.4 109.479 179.955 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' C' C ' 24' ' ' VAL . . . . . 0.716 HG22 ' HB3' ' I' ' 72' ' ' ASP . 88.6 t -148.09 150.27 14.5 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.613 0 O-C-N 121.243 -1.151 . . . . 0.46 110.259 -179.997 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' C' C ' 25' ' ' ALA . . . . . 0.768 ' HB1' ' O ' ' C' ' 9' ' ' LYS . . . -129.98 172.83 11.31 Favored 'General case' 0 N--CA 1.492 1.637 0 O-C-N 121.258 -0.901 . . . . 0.52 110.199 179.959 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' C' C ' 26' ' ' ALA . . . . . 0.531 ' HB3' ' HG ' ' C' ' 32' ' ' LEU . . . -178.21 158.66 1.19 Allowed 'General case' 0 N--CA 1.492 1.638 0 O-C-N 121.226 -0.921 . . . . 0.63 110.278 -179.976 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' C' C ' 27' ' ' ARG . . . . . . . . . . . . . 3.1 mtm180 -88.93 26.71 1.49 Allowed 'General case' 0 N--CA 1.491 1.59 0 O-C-N 121.293 -0.879 . . . . 3.15 110.041 179.851 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' C' C ' 28' ' ' SER . . . . . . . . . . . . . 2.2 m -155.45 107.46 2.64 Favored 'General case' 0 N--CA 1.491 1.597 0 O-C-N 121.285 -0.884 . . . . 1.37 110.324 -179.954 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' C' C ' 29' ' ' CYS . . . . . 0.622 ' HA ' HD12 ' C' ' 32' ' ' LEU . 6.4 p -46.44 -40.03 11.58 Favored 'General case' 0 N--CA 1.491 1.596 0 O-C-N 121.18 -0.95 . . . . 1.77 110.134 179.94 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' C' C ' 30' ' ' GLN . . . . . . . . . . . . . 1.1 mt-30 -64.34 -48.82 74.1 Favored 'General case' 0 N--CA 1.491 1.623 0 O-C-N 121.26 -0.9 . . . . 2.34 110.111 179.966 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' C' C ' 31' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER -48.18 -45.78 34.08 Favored 'General case' 0 N--CA 1.491 1.604 0 O-C-N 121.219 -0.925 . . . . 2.13 110.196 179.93 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' C' C ' 32' ' ' LEU . . . . . 0.622 HD12 ' HA ' ' C' ' 29' ' ' CYS . 6.7 mt -61.89 -44.89 95.88 Favored 'General case' 0 N--CA 1.492 1.629 0 O-C-N 121.273 -0.892 . . . . 1.22 110.119 179.938 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' C' C ' 33' ' ' LEU . . . . . 0.911 HD13 ' SD ' ' C' ' 44' ' ' MET . 4.0 mt -52.59 -40.76 63.0 Favored 'General case' 0 N--CA 1.491 1.617 0 O-C-N 121.277 -0.889 . . . . 0.79 110.222 -179.903 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' C' C ' 34' ' ' ARG . . . . . 0.428 ' O ' ' C ' ' C' ' 35' ' ' LYS . 0.0 OUTLIER -66.34 -64.57 0.83 Allowed 'General case' 0 N--CA 1.491 1.584 0 O-C-N 121.214 -0.929 . . . . 2.82 110.244 -179.909 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' C' C ' 35' ' ' LYS . . . . . 0.428 ' C ' ' O ' ' C' ' 34' ' ' ARG . 0.4 OUTLIER -42.44 -43.84 3.78 Favored 'General case' 0 N--CA 1.492 1.654 0 O-C-N 121.327 -0.858 . . . . 2.32 110.296 -179.927 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' C' C ' 36' ' ' GLY . . . . . 0.782 ' HA3' HD21 ' C' ' 13' ' ' LEU . . . -62.57 -47.24 90.81 Favored Glycine 0 N--CA 1.49 2.298 0 N-CA-C 109.577 -1.409 . . . . 0.47 109.577 -179.979 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' C' C ' 37' ' ' CYS . . . . . 0.42 ' SG ' ' O ' ' C' ' 42' ' ' LEU . 9.9 t -66.94 -19.68 65.77 Favored 'General case' 0 N--CA 1.492 1.655 0 O-C-N 121.247 -1.149 . . . . 1.71 110.263 -179.99 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' C' C ' 38' ' ' VAL . . . . . . . . . . . . . 72.9 t -83.77 -33.7 9.74 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.637 0 O-C-N 121.245 -0.91 . . . . 0.88 110.253 -179.971 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' C' C ' 39' ' ' ARG . . . . . 0.583 ' HD2' ' CE2' ' C' ' 22' ' ' PHE . 6.7 mmt-85 -89.96 -22.99 21.67 Favored 'General case' 0 N--CA 1.491 1.609 0 O-C-N 121.276 -0.89 . . . . 3.14 110.238 -179.982 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' C' C ' 40' ' ' PHE . . . . . 0.497 ' HD2' HD23 ' C' ' 13' ' ' LEU . 1.6 m-85 -112.56 -1.23 14.94 Favored 'General case' 0 N--CA 1.491 1.619 0 O-C-N 121.214 -0.929 . . . . 1.35 110.236 -179.946 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' C' C ' 41' ' ' GLN . . . . . 0.438 ' HB2' ' O ' ' C' ' 40' ' ' PHE . 28.7 mt-30 55.22 63.63 2.04 Favored 'General case' 0 N--CA 1.491 1.615 0 O-C-N 121.252 -0.905 . . . . 2.15 110.099 -179.95 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' C' C ' 42' ' ' LEU . . . . . 0.89 HD23 ' HB3' ' C' ' 47' ' ' SER . 0.1 OUTLIER -141.86 99.97 6.08 Favored Pre-proline 0 N--CA 1.491 1.593 0 O-C-N 121.244 -0.91 . . . . 1.23 110.172 -179.934 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' C' C ' 43' ' ' PRO . . . . . 0.521 ' O ' ' CB ' ' C' ' 47' ' ' SER . 3.0 Cg_exo -59.97 158.88 27.57 Favored 'Trans proline' 0 C--N 1.312 -1.391 0 O-C-N 123.58 1.305 . . . . 0.83 110.522 -179.98 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' C' C ' 44' ' ' MET . . . . . 0.911 ' SD ' HD13 ' C' ' 33' ' ' LEU . 3.0 mtm -73.5 -50.79 5.87 Favored Pre-proline 0 N--CA 1.49 1.543 0 O-C-N 121.189 -0.945 . . . . 2.11 110.774 -179.935 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' C' C ' 45' ' ' PRO . . . . . 0.573 ' HD2' ' N ' ' C' ' 44' ' ' MET . 3.0 Cg_endo -63.95 -61.19 0.13 Allowed 'Trans proline' 0 C--N 1.313 -1.309 0 O-C-N 123.359 1.189 . . . . 0.7 110.776 -179.686 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' C' C ' 46' ' ' GLY . . . . . 0.467 ' O ' ' CB ' ' C' ' 47' ' ' SER . . . -87.16 39.62 3.1 Favored Glycine 0 N--CA 1.491 2.366 0 N-CA-C 109.811 -1.316 . . . . 0.72 109.811 -179.708 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' C' C ' 47' ' ' SER . . . . . 0.89 ' HB3' HD23 ' C' ' 42' ' ' LEU . 0.3 OUTLIER 170.38 131.24 0.02 OUTLIER 'General case' 0 N--CA 1.493 1.712 0 O-C-N 121.226 -1.161 . . . . 1.25 110.106 179.88 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' C' C ' 48' ' ' ARG . . . . . 0.947 ' HG2' HG23 ' C' ' 59' ' ' THR . 2.1 mtm180 -134.75 -163.51 1.39 Allowed 'General case' 0 N--CA 1.49 1.564 0 O-C-N 121.249 -0.907 . . . . 2.49 110.224 -179.958 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' C' C ' 49' ' ' LEU . . . . . . . . . . . . . 1.9 mp -132.87 174.9 9.85 Favored 'General case' 0 N--CA 1.491 1.608 0 O-C-N 121.204 -0.935 . . . . 0.64 110.225 -179.971 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' C' C ' 50' ' ' CYS . . . . . 0.45 ' SG ' ' HB3' ' C' ' 73' ' ' LEU . 6.1 p -148.78 125.47 11.11 Favored 'General case' 0 N--CA 1.491 1.592 0 O-C-N 121.266 -0.896 . . . . 1.45 110.168 179.977 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' C' C ' 51' ' ' LEU . . . . . 0.851 HD12 ' HB ' ' C' ' 56' ' ' THR . 6.3 mt -46.58 131.33 11.25 Favored 'General case' 0 N--CA 1.492 1.63 0 O-C-N 121.246 -0.909 . . . . 0.78 110.265 -179.926 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' C' C ' 52' ' ' TYR . . . . . 0.505 ' HB3' ' HB3' ' C' ' 71' ' ' GLU . 88.2 t80 -79.34 5.24 12.98 Favored 'General case' 0 N--CA 1.491 1.589 0 O-C-N 121.308 -0.87 . . . . 1.46 110.141 179.874 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' C' C ' 53' ' ' GLU . . . . . 0.485 ' O ' ' HB3' ' C' ' 84' ' ' TYR . 3.5 tp10 -89.21 -46.61 8.66 Favored 'General case' 0 N--CA 1.49 1.569 0 O-C-N 121.25 -0.906 . . . . 2.34 110.344 -179.941 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' C' C ' 54' ' ' ASP . . . . . . . . . . . . . 1.0 OUTLIER -138.96 15.28 2.66 Favored 'General case' 0 N--CA 1.491 1.59 0 O-C-N 121.246 -0.909 . . . . 2.36 110.27 -179.971 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' C' C ' 55' ' ' GLY . . . . . . . . . . . . . . . 66.89 52.47 33.06 Favored Glycine 0 N--CA 1.491 2.31 0 N-CA-C 109.599 -1.4 . . . . 1.03 109.599 -179.981 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' C' C ' 56' ' ' THR . . . . . 0.851 ' HB ' HD12 ' C' ' 51' ' ' LEU . 0.3 OUTLIER -95.64 116.74 29.29 Favored 'General case' 0 N--CA 1.492 1.637 0 O-C-N 121.203 -1.174 . . . . 0.96 110.144 179.992 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' C' C ' 57' ' ' GLU . . . . . . . . . . . . . 7.2 mt-10 -53.78 129.14 32.43 Favored 'General case' 0 N--CA 1.491 1.617 0 O-C-N 121.258 -0.901 . . . . 2.44 110.206 179.957 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' C' C ' 58' ' ' VAL . . . . . 0.769 HG23 ' O ' ' C' ' 56' ' ' THR . 48.9 t -130.01 145.74 35.17 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.596 0 O-C-N 121.244 -0.91 . . . . 0.85 110.181 179.965 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' C' C ' 59' ' ' THR . . . . . 0.947 HG23 ' HG2' ' C' ' 48' ' ' ARG . 0.2 OUTLIER -146.99 -148.71 0.26 Allowed 'General case' 0 N--CA 1.491 1.607 0 O-C-N 121.257 -0.902 . . . . 0.84 110.239 -179.978 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' C' C ' 60' ' ' ASP . . . . . 0.472 ' HB3' ' SD ' ' C' ' 44' ' ' MET . 2.6 p30 -89.34 9.05 27.54 Favored 'General case' 0 N--CA 1.491 1.6 0 O-C-N 121.185 -0.947 . . . . 2.33 110.203 -179.984 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' C' C ' 61' ' ' ASP . . . . . . . . . . . . . 0.6 OUTLIER -123.22 -14.69 7.43 Favored 'General case' 0 N--CA 1.492 1.646 0 O-C-N 121.253 -0.904 . . . . 1.79 110.198 179.974 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' C' C ' 62' ' ' CYS . . . . . . . . . . . . . 0.1 OUTLIER -128.43 11.9 6.39 Favored 'General case' 0 N--CA 1.491 1.59 0 O-C-N 121.263 -0.898 . . . . 1.36 110.154 179.954 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' C' C ' 63' ' ' PHE . . . . . 0.599 ' N ' ' HD2' ' C' ' 64' ' ' PRO . 0.7 OUTLIER -78.33 -46.88 2.06 Favored Pre-proline 0 N--CA 1.49 1.538 0 O-C-N 121.281 -0.887 . . . . 1.46 110.957 179.988 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' C' C ' 64' ' ' PRO . . . . . 0.599 ' HD2' ' N ' ' C' ' 63' ' ' PHE . 2.9 Cg_endo -63.34 -19.65 68.68 Favored 'Trans proline' 0 C--N 1.316 -1.176 0 O-C-N 122.998 0.999 . . . . 0.91 110.502 -179.98 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' C' C ' 65' ' ' GLY . . . . . . . . . . . . . . . -64.79 -17.79 63.26 Favored Glycine 0 N--CA 1.491 2.324 0 N-CA-C 109.53 -1.428 . . . . 0.79 109.53 -179.982 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' C' C ' 66' ' ' LEU . . . . . 0.586 HD13 HD21 ' C' ' 51' ' ' LEU . 19.8 mt -89.71 153.8 47.84 Favored Pre-proline 0 N--CA 1.491 1.592 0 O-C-N 121.19 -1.183 . . . . 0.72 110.227 -179.985 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' C' C ' 67' ' ' PRO . . . . . 0.483 ' O ' ' HE3' ' C' ' 9' ' ' LYS . 3.0 Cg_exo -61.21 -159.72 0.02 OUTLIER 'Trans proline' 0 C--N 1.312 -1.393 0 O-C-N 123.743 1.391 . . . . 0.85 110.577 -179.995 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' C' C ' 68' ' ' ASN . . . . . 0.609 ' O ' ' N ' ' C' ' 70' ' ' ALA . 3.3 m120 -61.12 -136.96 0.0 OUTLIER 'General case' 0 N--CA 1.491 1.594 0 O-C-N 121.271 -0.893 . . . . 1.9 109.829 179.81 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' C' C ' 69' ' ' ASP . . . . . 0.646 ' HA ' ' HA ' ' C' ' 11' ' ' VAL . 11.2 p30 -28.68 82.53 0.0 OUTLIER 'General case' 0 N--CA 1.495 1.816 0 CA-C-O 121.315 0.579 . . . . 2.06 111.924 -179.629 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' C' C ' 70' ' ' ALA . . . . . 0.609 ' N ' ' O ' ' C' ' 68' ' ' ASN . . . -86.51 123.39 31.66 Favored 'General case' 0 N--CA 1.49 1.543 0 O-C-N 121.307 -0.87 . . . . 0.46 110.163 179.996 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' C' C ' 71' ' ' GLU . . . . . 0.505 ' HB3' ' HB3' ' C' ' 52' ' ' TYR . 6.6 mt-10 -59.11 86.32 0.01 OUTLIER 'General case' 0 N--CA 1.491 1.623 0 O-C-N 121.211 -0.931 . . . . 2.11 110.118 -179.982 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' C' C ' 72' ' ' LEU . . . . . 0.43 ' N ' ' O ' ' C' ' 70' ' ' ALA . 1.0 OUTLIER -89.64 103.73 16.35 Favored 'General case' 0 N--CA 1.491 1.62 0 O-C-N 121.3 -0.875 . . . . 0.4 110.246 -179.924 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' C' C ' 73' ' ' LEU . . . . . 0.488 ' HA ' ' O ' ' C' ' 14' ' ' ARG . 11.1 tp -84.57 157.49 21.21 Favored 'General case' 0 N--CA 1.492 1.637 0 O-C-N 121.245 -0.909 . . . . 0.5 110.18 179.908 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' C' C ' 74' ' ' LEU . . . . . 0.765 ' HG ' HD13 ' C' ' 42' ' ' LEU . 7.5 tp -81.54 134.36 35.5 Favored 'General case' 0 N--CA 1.492 1.629 0 O-C-N 121.287 -0.883 . . . . 1.32 110.241 -179.947 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' C' C ' 75' ' ' LEU . . . . . 0.824 HD11 ' HA ' ' C' ' 80' ' ' THR . 10.5 tt -153.84 110.73 3.39 Favored 'General case' 0 N--CA 1.492 1.629 0 O-C-N 121.267 -0.895 . . . . 0.81 110.2 -179.965 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' C' C ' 76' ' ' THR . . . . . 0.447 HG22 HD11 ' C' ' 42' ' ' LEU . 21.4 p -85.96 168.66 13.96 Favored 'General case' 0 N--CA 1.491 1.621 0 O-C-N 121.235 -0.916 . . . . 0.71 110.182 179.994 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' C' C ' 77' ' ' ALA . . . . . . . . . . . . . . . -68.26 73.82 0.22 Allowed 'General case' 0 N--CA 1.491 1.614 0 O-C-N 121.263 -0.898 . . . . 0.99 110.132 -179.974 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' C' C ' 78' ' ' GLY . . . . . . . . . . . . . . . 178.13 -38.98 0.09 OUTLIER Glycine 0 N--CA 1.491 2.34 0 N-CA-C 109.514 -1.435 . . . . 1.2 109.514 179.998 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' C' C ' 79' ' ' GLU . . . . . 0.411 ' O ' ' HG ' ' C' ' 75' ' ' LEU . 9.9 mt-10 -109.69 151.11 27.31 Favored 'General case' 0 N--CA 1.49 1.571 0 O-C-N 121.219 -1.166 . . . . 2.72 110.122 -179.993 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' C' C ' 80' ' ' THR . . . . . 0.824 ' HA ' HD11 ' C' ' 75' ' ' LEU . 25.4 p -128.87 148.02 50.87 Favored 'General case' 0 N--CA 1.491 1.583 0 O-C-N 121.195 -0.94 . . . . 0.97 110.296 -179.989 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' C' C ' 81' ' ' TRP . . . . . 0.409 ' NE1' ' HA2' ' C' ' 83' ' ' GLY . 2.0 t-105 -89.95 112.87 24.4 Favored 'General case' 0 N--CA 1.492 1.628 0 O-C-N 121.286 -0.884 . . . . 1.0 110.128 179.923 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' C' C ' 82' ' ' HIS . . . . . . . . . . . . . 0.4 OUTLIER -44.86 -49.35 10.93 Favored 'General case' 0 N--CA 1.491 1.607 0 O-C-N 121.262 -0.899 . . . . 2.23 110.22 179.987 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' C' C ' 83' ' ' GLY . . . . . 0.883 ' O ' HG23 ' C' ' 85' ' ' VAL . . . 119.84 150.42 8.6 Favored Glycine 0 N--CA 1.49 2.246 0 N-CA-C 109.558 -1.417 . . . . 1.19 109.558 179.971 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' C' C ' 84' ' ' TYR . . . . . 0.485 ' HB3' ' O ' ' C' ' 53' ' ' GLU . 68.7 t80 -50.31 89.86 0.0 OUTLIER 'General case' 0 N--CA 1.491 1.608 0 O-C-N 121.301 -1.117 . . . . 2.46 110.221 -179.981 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' C' C ' 85' ' ' VAL . . . . . 0.883 HG23 ' O ' ' C' ' 83' ' ' GLY . 37.9 t -86.69 152.47 3.47 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.557 0 O-C-N 121.215 -0.928 . . . . 3.09 110.242 179.985 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' C' C ' 86' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER -113.76 33.51 5.15 Favored 'General case' 0 N--CA 1.491 1.585 0 O-C-N 121.259 -0.901 . . . . 3.4 110.124 179.99 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' C' C ' 87' ' ' ASP . . . . . 0.42 ' H ' HG12 ' C' ' 85' ' ' VAL . 6.2 t70 . . . . . 0 N--CA 1.491 1.591 0 O-C-N 121.221 -0.924 . . . . 4.61 110.191 -179.946 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' I' I ' 1' ' ' MET . . . . . . . . . . . . . 0.8 OUTLIER . . . . . 0 N--CA 1.493 1.682 0 CA-C-O 121.261 0.553 . . . . 23.96 110.252 . . . . . . . . . 1 1 . 1 . 001 nuclear build full ' I' I ' 2' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -55.8 -19.65 12.22 Favored 'General case' 0 N--CA 1.492 1.634 0 O-C-N 121.224 -0.923 . . . . 22.61 110.204 -179.922 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' I' I ' 3' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -48.99 121.91 5.26 Favored 'General case' 0 N--CA 1.491 1.6 0 O-C-N 121.281 -0.887 . . . . 22.07 110.194 -179.896 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' I' I ' 4' ' ' SER . . . . . 0.526 ' O ' ' CZ ' ' I' ' 5' ' ' ARG . 1.4 p -51.03 102.98 0.05 OUTLIER 'General case' 0 N--CA 1.491 1.602 0 O-C-N 121.211 -0.93 . . . . 19.98 110.275 -179.914 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' I' I ' 5' ' ' ARG . . . . . 0.805 ' NE ' ' HB3' ' I' ' 9' ' ' ALA . 0.1 OUTLIER -125.9 86.29 2.51 Favored 'General case' 0 N--CA 1.491 1.622 0 O-C-N 121.297 -0.877 . . . . 20.28 110.162 179.981 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' I' I ' 6' ' ' GLY . . . . . 0.662 ' O ' ' HB2' ' I' ' 7' ' ' ALA . . . -127.5 4.57 7.13 Favored Glycine 0 N--CA 1.49 2.298 0 N-CA-C 109.584 -1.406 . . . . 16.77 109.584 179.949 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' I' I ' 7' ' ' ALA . . . . . 0.662 ' HB2' ' O ' ' I' ' 6' ' ' GLY . . . 171.79 -31.11 0.0 OUTLIER 'General case' 0 N--CA 1.492 1.626 0 O-C-N 121.298 -1.119 . . . . 14.72 110.08 179.926 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' I' I ' 8' ' ' SER . . . . . 0.537 ' O ' ' HB3' ' I' ' 9' ' ' ALA . 0.1 OUTLIER -84.0 164.07 19.54 Favored 'General case' 0 N--CA 1.492 1.638 0 O-C-N 121.231 -0.918 . . . . 13.82 110.136 179.949 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' I' I ' 9' ' ' ALA . . . . . 0.805 ' HB3' ' NE ' ' I' ' 5' ' ' ARG . . . 59.47 151.24 0.09 OUTLIER Pre-proline 0 N--CA 1.492 1.637 0 O-C-N 121.209 -0.932 . . . . 11.18 110.09 -179.917 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' I' I ' 10' ' ' PRO . . . . . 0.425 ' HD3' ' HA ' ' I' ' 9' ' ' ALA . 3.0 Cg_exo -61.67 -157.63 0.02 OUTLIER 'Trans proline' 0 C--N 1.311 -1.438 0 O-C-N 123.719 1.379 . . . . 10.55 110.66 -179.811 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' I' I ' 11' ' ' ASP . . . . . 0.527 ' N ' ' HD3' ' I' ' 12' ' ' PRO . 6.5 t0 43.05 60.24 10.68 Favored Pre-proline 0 N--CA 1.491 1.611 0 O-C-N 121.301 -0.874 . . . . 9.63 110.167 -179.891 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' I' I ' 12' ' ' PRO . . . . . 0.601 ' HD2' HG11 ' I' ' 15' ' ' VAL . 3.0 Cg_endo -61.42 164.28 15.68 Favored 'Trans proline' 0 C--N 1.311 -1.442 0 O-C-N 123.738 1.389 . . . . 6.11 110.57 179.984 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' I' I ' 13' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -84.22 -18.67 35.8 Favored 'General case' 0 N--CA 1.491 1.601 0 O-C-N 121.219 -0.926 . . . . 7.61 110.087 179.944 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' I' I ' 14' ' ' ASP . . . . . . . . . . . . . 14.3 m-20 -92.92 21.38 5.74 Favored 'General case' 0 N--CA 1.491 1.582 0 O-C-N 121.289 -0.882 . . . . 5.29 110.176 179.975 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' I' I ' 15' ' ' VAL . . . . . 0.611 HG23 ' O ' ' I' ' 15' ' ' VAL . 33.5 m -81.55 70.45 0.6 Allowed 'Isoleucine or valine' 0 N--CA 1.491 1.593 0 O-C-N 121.218 -0.926 . . . . 2.52 110.347 -179.925 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' I' I ' 16' ' ' ARG . . . . . 0.781 ' HD3' HD13 ' I' ' 77' ' ' LEU . 0.3 OUTLIER 63.1 63.12 1.67 Allowed Pre-proline 0 N--CA 1.491 1.593 0 O-C-N 121.177 -0.952 . . . . 2.49 110.235 179.931 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' I' I ' 17' ' ' PRO . . . . . 0.497 ' HD3' ' N ' ' I' ' 16' ' ' ARG . 2.9 Cg_endo -63.63 58.25 0.2 Allowed 'Trans proline' 0 C--N 1.311 -1.433 0 O-C-N 123.695 1.366 . . . . 1.04 110.83 -179.925 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' I' I ' 18' ' ' LEU . . . . . 0.508 HD22 ' HB1' ' I' ' 35' ' ' ALA . 13.9 mt 57.74 119.35 0.01 OUTLIER 'General case' 0 N--CA 1.494 1.73 0 O-C-N 121.284 -0.885 . . . . 1.81 110.441 179.819 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' I' I ' 19' ' ' LYS . . . . . 0.469 ' HD3' ' HA ' ' I' ' 77' ' ' LEU . 0.0 OUTLIER -113.5 90.53 17.83 Favored Pre-proline 0 N--CA 1.492 1.664 0 O-C-N 121.21 -0.931 . . . . 2.2 110.182 179.939 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' I' I ' 20' ' ' PRO . . . . . 0.505 ' HA ' ' O ' ' I' ' 34' ' ' VAL . 3.1 Cg_exo -62.81 83.86 0.11 Allowed 'Trans proline' 0 C--N 1.311 -1.402 0 O-C-N 123.692 1.364 . . . . 1.1 110.373 179.845 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' I' I ' 21' ' ' CYS . . . . . 0.465 ' O ' HG22 ' I' ' 34' ' ' VAL . 1.3 m -87.54 160.31 18.28 Favored 'General case' 0 N--CA 1.491 1.602 0 O-C-N 121.322 -0.861 . . . . 0.75 110.385 -179.829 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' I' I ' 22' ' ' LEU . . . . . . . . . . . . . 21.7 mt -104.5 101.27 10.95 Favored 'General case' 0 N--CA 1.491 1.593 0 O-C-N 121.306 -0.871 . . . . 0.53 109.95 179.829 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' I' I ' 23' ' ' LEU . . . . . 0.452 ' HA ' HD13 ' I' ' 23' ' ' LEU . 2.9 mm? -79.82 144.77 33.23 Favored 'General case' 0 N--CA 1.491 1.592 0 O-C-N 121.268 -0.895 . . . . 0.53 110.286 -179.861 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' I' I ' 24' ' ' ARG . . . . . 0.475 ' HB2' ' HG3' ' I' ' 31' ' ' GLN . 0.0 OUTLIER -140.09 138.6 35.44 Favored 'General case' 0 N--CA 1.491 1.587 0 O-C-N 121.298 -0.876 . . . . 1.86 110.197 -179.949 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' I' I ' 25' ' ' ARG . . . . . 0.455 ' HB2' HD22 ' I' ' 50' ' ' LEU . 57.9 ttt180 -107.29 122.85 47.39 Favored 'General case' 0 N--CA 1.491 1.59 0 O-C-N 121.22 -0.925 . . . . 2.82 110.229 179.992 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' I' I ' 26' ' ' ASN . . . . . 0.631 ' ND2' ' HB3' ' I' ' 93' ' ' LYS . 7.1 t-20 -45.9 165.19 0.02 OUTLIER 'General case' 0 N--CA 1.49 1.572 0 O-C-N 121.247 -0.908 . . . . 2.99 110.192 179.995 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' I' I ' 27' ' ' HIS . . . . . 0.447 ' CB ' ' O ' ' I' ' 26' ' ' ASN . 0.2 OUTLIER 65.41 9.12 5.49 Favored 'General case' 0 N--CA 1.491 1.613 0 O-C-N 121.264 -0.898 . . . . 3.33 110.174 -179.956 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' I' I ' 28' ' ' SER . . . . . 0.516 ' O ' ' N ' ' I' ' 30' ' ' ASP . 0.5 OUTLIER -159.77 92.75 1.05 Allowed 'General case' 0 N--CA 1.491 1.609 0 O-C-N 121.268 -0.895 . . . . 1.95 110.154 179.949 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' I' I ' 29' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -64.14 70.63 0.03 OUTLIER 'General case' 0 N--CA 1.492 1.628 0 O-C-N 121.255 -0.903 . . . . 3.32 110.249 -179.958 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' I' I ' 30' ' ' ASP . . . . . 0.516 ' N ' ' O ' ' I' ' 28' ' ' SER . 0.2 OUTLIER -139.29 113.07 8.51 Favored 'General case' 0 N--CA 1.491 1.609 0 O-C-N 121.21 -0.931 . . . . 2.03 110.202 179.933 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' I' I ' 31' ' ' GLN . . . . . 0.475 ' HG3' ' HB2' ' I' ' 24' ' ' ARG . 0.0 OUTLIER -91.11 152.09 20.74 Favored 'General case' 0 N--CA 1.491 1.58 0 O-C-N 121.203 -0.936 . . . . 1.95 110.218 -179.968 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' I' I ' 32' ' ' HIS . . . . . 0.485 ' O ' HG13 ' I' ' 34' ' ' VAL . 35.3 m80 -130.04 124.17 32.24 Favored 'General case' 0 N--CA 1.491 1.584 0 O-C-N 121.235 -0.916 . . . . 1.77 110.178 179.974 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' I' I ' 33' ' ' GLY . . . . . . . . . . . . . . . -73.65 117.01 5.61 Favored Glycine 0 N--CA 1.49 2.294 0 N-CA-C 109.506 -1.438 . . . . 0.69 109.506 -179.981 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' I' I ' 34' ' ' VAL . . . . . 0.645 ' O ' HG23 ' I' ' 34' ' ' VAL . 3.4 m -125.03 119.33 55.54 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.574 0 O-C-N 121.231 -1.158 . . . . 1.01 110.389 -179.947 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' I' I ' 35' ' ' ALA . . . . . 0.508 ' HB1' HD22 ' I' ' 18' ' ' LEU . . . -83.39 105.15 14.11 Favored 'General case' 0 N--CA 1.491 1.595 0 O-C-N 121.196 -0.94 . . . . 0.57 110.173 179.901 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' I' I ' 36' ' ' ALA . . . . . 0.528 ' HB1' ' N ' ' I' ' 42' ' ' LEU . . . -138.41 133.99 33.55 Favored 'General case' 0 N--CA 1.492 1.635 0 O-C-N 121.233 -0.917 . . . . 0.52 110.263 -179.905 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' I' I ' 37' ' ' SER . . . . . 0.472 ' HB2' ' O ' ' I' ' 16' ' ' ARG . 0.0 OUTLIER -85.3 -71.51 0.52 Allowed 'General case' 0 N--CA 1.491 1.617 0 O-C-N 121.3 -0.875 . . . . 1.27 110.084 179.883 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' I' I ' 38' ' ' SER . . . . . 0.465 ' N ' ' OG ' ' I' ' 37' ' ' SER . 6.9 t -83.45 152.13 25.12 Favored 'General case' 0 N--CA 1.491 1.606 0 O-C-N 121.288 -0.882 . . . . 1.47 110.082 179.946 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' I' I ' 39' ' ' LEU . . . . . 0.861 HD12 ' O ' ' I' ' 72' ' ' ASP . 0.4 OUTLIER -43.96 -51.95 7.32 Favored 'General case' 0 N--CA 1.491 1.577 0 O-C-N 121.186 -0.946 . . . . 1.32 110.126 179.981 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' I' I ' 40' ' ' GLU . . . . . 0.41 ' C ' ' O ' ' I' ' 39' ' ' LEU . 3.1 mt-10 -42.55 -43.35 3.7 Favored 'General case' 0 N--CA 1.491 1.599 0 O-C-N 121.277 -0.889 . . . . 2.56 110.217 179.984 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' I' I ' 41' ' ' GLU . . . . . 0.465 ' O ' ' HG2' ' I' ' 45' ' ' LYS . 13.0 mt-10 -66.27 -45.17 81.4 Favored 'General case' 0 N--CA 1.491 1.609 0 O-C-N 121.293 -0.879 . . . . 2.0 110.246 179.993 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' I' I ' 42' ' ' LEU . . . . . 0.558 ' CD1' ' CG2' ' I' ' 34' ' ' VAL . 14.3 tp -65.45 -55.25 19.01 Favored 'General case' 0 N--CA 1.492 1.637 0 O-C-N 121.246 -0.909 . . . . 0.54 110.207 -179.981 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' I' I ' 43' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -44.77 -62.79 1.08 Allowed 'General case' 0 N--CA 1.491 1.624 0 O-C-N 121.288 -0.883 . . . . 2.14 110.103 179.891 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' I' I ' 44' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -44.81 -58.8 2.87 Favored 'General case' 0 N--CA 1.491 1.583 0 O-C-N 121.282 -0.887 . . . . 1.45 110.175 179.901 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' I' I ' 45' ' ' LYS . . . . . 0.515 ' O ' ' CD1' ' I' ' 49' ' ' LEU . 67.1 mmtt -47.76 -42.34 25.41 Favored 'General case' 0 N--CA 1.49 1.558 0 O-C-N 121.19 -0.943 . . . . 2.18 110.132 179.956 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' I' I ' 46' ' ' ALA . . . . . 0.433 ' O ' ' HB2' ' I' ' 50' ' ' LEU . . . -67.24 -25.42 66.08 Favored 'General case' 0 N--CA 1.491 1.62 0 O-C-N 121.314 -0.866 . . . . 0.5 110.175 -179.97 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' I' I ' 47' ' ' CYS . . . . . 0.44 ' SG ' ' HB ' ' I' ' 52' ' ' ILE . 0.0 OUTLIER -75.64 -43.02 49.95 Favored 'General case' 0 N--CA 1.491 1.607 0 O-C-N 121.264 -0.897 . . . . 1.36 110.154 179.913 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' I' I ' 48' ' ' GLU . . . . . . . . . . . . . 2.3 tt0 -78.43 -25.56 46.04 Favored 'General case' 0 N--CA 1.491 1.606 0 O-C-N 121.287 -0.883 . . . . 2.14 110.221 179.934 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' I' I ' 49' ' ' LEU . . . . . 0.515 ' CD1' ' O ' ' I' ' 45' ' ' LYS . 0.7 OUTLIER -87.26 -42.54 12.85 Favored 'General case' 0 N--CA 1.491 1.612 0 O-C-N 121.222 -0.923 . . . . 0.74 110.217 179.98 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' I' I ' 50' ' ' LEU . . . . . 0.551 ' O ' ' HB3' ' I' ' 51' ' ' ALA . 43.5 mt -97.56 -2.04 42.62 Favored 'General case' 0 N--CA 1.491 1.591 0 O-C-N 121.28 -0.887 . . . . 0.9 110.235 179.937 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' I' I ' 51' ' ' ALA . . . . . 0.551 ' HB3' ' O ' ' I' ' 50' ' ' LEU . . . 60.77 40.68 15.76 Favored 'General case' 0 N--CA 1.491 1.605 0 O-C-N 121.271 -0.893 . . . . 0.98 110.214 179.993 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' I' I ' 52' ' ' ILE . . . . . 0.863 HD12 ' HB2' ' I' ' 89' ' ' ALA . 22.6 mm -72.01 86.09 0.37 Allowed 'Isoleucine or valine' 0 N--CA 1.491 1.601 0 O-C-N 121.23 -0.919 . . . . 1.12 110.202 -179.961 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' I' I ' 53' ' ' ASP . . . . . 0.492 ' N ' HD12 ' I' ' 56' ' ' LEU . 0.1 OUTLIER -46.1 156.82 0.14 Allowed 'General case' 0 N--CA 1.491 1.616 0 O-C-N 121.218 -0.926 . . . . 2.42 110.179 -179.996 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' I' I ' 54' ' ' LYS . . . . . 0.452 ' O ' ' OG1' ' I' ' 57' ' ' THR . 1.4 tptt -72.64 -10.43 59.79 Favored 'General case' 0 N--CA 1.492 1.647 0 O-C-N 121.25 -0.906 . . . . 3.87 110.178 -179.997 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' I' I ' 55' ' ' SER . . . . . . . . . . . . . 19.7 t -82.48 -9.95 59.22 Favored 'General case' 0 N--CA 1.491 1.597 0 O-C-N 121.241 -0.912 . . . . 1.63 110.057 179.966 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' I' I ' 56' ' ' LEU . . . . . 0.892 ' HB3' ' HB1' ' I' ' 89' ' ' ALA . 8.5 mt -95.7 -2.08 48.69 Favored 'General case' 0 N--CA 1.491 1.623 0 O-C-N 121.29 -0.881 . . . . 1.3 110.242 -179.98 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' I' I ' 57' ' ' THR . . . . . 0.742 HG22 HG13 ' I' ' 59' ' ' ILE . 5.2 p -79.97 166.44 40.6 Favored Pre-proline 0 N--CA 1.491 1.623 0 O-C-N 121.279 -0.888 . . . . 1.19 109.998 179.977 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' I' I ' 58' ' ' PRO . . . . . 0.541 ' C ' ' HA ' ' I' ' 57' ' ' THR . 2.5 Cg_endo -69.96 128.09 12.18 Favored 'Cis proline' 0 C--N 1.312 -1.346 0 C-N-CA 122.382 -1.924 . . . . 1.68 110.828 -0.687 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' I' I ' 59' ' ' ILE . . . . . 0.856 ' CD1' HG21 ' I' ' 52' ' ' ILE . 29.6 mt -66.84 157.6 5.85 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.644 0 O-C-N 121.239 -0.913 . . . . 1.09 110.22 179.917 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' I' I ' 60' ' ' THR . . . . . 0.424 HG22 HG13 ' I' ' 62' ' ' VAL . 7.9 m -123.06 112.99 18.42 Favored 'General case' 0 N--CA 1.492 1.654 0 O-C-N 121.245 -0.909 . . . . 0.84 110.202 -179.996 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' I' I ' 61' ' ' LEU . . . . . . . . . . . . . 2.7 mt -93.29 95.36 9.3 Favored 'General case' 0 N--CA 1.492 1.629 0 O-C-N 121.236 -0.915 . . . . 0.84 110.251 -179.933 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' I' I ' 62' ' ' VAL . . . . . 0.804 HG11 ' CZ2' ' I' ' 94' ' ' TRP . 17.5 m -103.16 131.05 52.36 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.625 0 O-C-N 121.199 -0.938 . . . . 0.57 110.188 179.923 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' I' I ' 63' ' ' LEU . . . . . 0.565 HD12 ' HB ' ' I' ' 68' ' ' THR . 18.3 mt -59.72 129.55 42.43 Favored 'General case' 0 N--CA 1.491 1.601 0 O-C-N 121.256 -0.903 . . . . 0.59 110.273 179.992 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' I' I ' 64' ' ' ALA . . . . . 0.668 ' HB2' ' CG2' ' I' ' 86' ' ' VAL . . . -67.08 -30.07 70.01 Favored 'General case' 0 N--CA 1.49 1.573 0 O-C-N 121.239 -0.913 . . . . 0.73 110.221 179.961 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' I' I ' 65' ' ' GLU . . . . . . . . . . . . . 23.9 mt-10 -67.74 -56.4 9.39 Favored 'General case' 0 N--CA 1.491 1.604 0 O-C-N 121.259 -0.901 . . . . 2.57 110.24 179.963 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' I' I ' 66' ' ' ASP . . . . . . . . . . . . . 6.3 m-20 -100.33 -51.11 3.73 Favored 'General case' 0 N--CA 1.491 1.612 0 O-C-N 121.261 -0.899 . . . . 1.77 110.175 -179.96 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' I' I ' 67' ' ' GLY . . . . . 0.406 ' HA2' ' O ' ' I' ' 63' ' ' LEU . . . 109.98 8.88 25.25 Favored Glycine 0 N--CA 1.49 2.248 0 N-CA-C 109.596 -1.402 . . . . 0.57 109.596 -179.986 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' I' I ' 68' ' ' THR . . . . . 0.565 ' HB ' HD12 ' I' ' 63' ' ' LEU . 68.1 m -66.34 124.23 22.14 Favored 'General case' 0 N--CA 1.491 1.61 0 O-C-N 121.234 -1.157 . . . . 0.5 110.298 179.985 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' I' I ' 69' ' ' ILE . . . . . 0.682 HD12 ' O ' ' C' ' 21' ' ' LYS . 21.0 mt -62.96 128.81 25.53 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.626 0 O-C-N 121.261 -0.899 . . . . 0.79 110.126 179.928 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' I' I ' 70' ' ' VAL . . . . . 0.576 HG11 ' HB2' ' I' ' 76' ' ' PHE . 15.6 t -106.78 69.91 0.27 Allowed 'Isoleucine or valine' 0 N--CA 1.491 1.58 0 O-C-N 121.293 -0.879 . . . . 0.65 110.188 179.987 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' I' I ' 71' ' ' ASP . . . . . . . . . . . . . 0.7 OUTLIER -88.78 25.75 1.69 Allowed 'General case' 0 N--CA 1.491 1.576 0 O-C-N 121.194 -0.942 . . . . 1.88 110.156 179.961 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' I' I ' 72' ' ' ASP . . . . . 0.861 ' O ' HD12 ' I' ' 39' ' ' LEU . 8.3 p-10 -130.79 -173.12 2.99 Favored 'General case' 0 N--CA 1.491 1.593 0 O-C-N 121.293 -0.88 . . . . 2.46 109.906 179.766 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' I' I ' 73' ' ' ASP . . . . . 0.541 ' CB ' ' HB2' ' I' ' 39' ' ' LEU . 39.5 p-10 -141.27 30.51 1.76 Allowed 'General case' 0 N--CA 1.491 1.586 0 O-C-N 121.111 -0.993 . . . . 1.65 110.452 -179.971 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' I' I ' 74' ' ' ASP . . . . . 0.596 ' O ' ' HB3' ' C' ' 25' ' ' ALA . 1.9 m-20 -130.8 0.12 4.31 Favored 'General case' 0 N--CA 1.491 1.58 0 O-C-N 121.242 -0.911 . . . . 1.68 110.083 179.814 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' I' I ' 75' ' ' TYR . . . . . 0.526 ' HB2' ' CB ' ' C' ' 25' ' ' ALA . 53.5 t80 -129.27 -8.26 4.76 Favored 'General case' 0 N--CA 1.491 1.614 0 O-C-N 121.227 -0.921 . . . . 1.36 110.652 -179.924 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' I' I ' 76' ' ' PHE . . . . . 0.623 ' CE2' HD21 ' I' ' 77' ' ' LEU . 0.1 OUTLIER -97.88 2.83 49.63 Favored 'General case' 0 N--CA 1.491 1.576 0 O-C-N 121.033 -1.042 . . . . 2.2 110.088 -179.849 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' I' I ' 77' ' ' LEU . . . . . 0.781 HD13 ' HD3' ' I' ' 16' ' ' ARG . 0.3 OUTLIER -100.25 3.21 43.41 Favored 'General case' 0 N--CA 1.496 1.836 0 O-C-N 121.107 -0.995 . . . . 1.59 109.749 178.87 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' I' I ' 78' ' ' CYS . . . . . 0.443 ' O ' ' C ' ' I' ' 79' ' ' LEU . 0.1 OUTLIER -79.65 -53.8 6.48 Favored 'General case' 0 N--CA 1.493 1.696 0 O-C-N 121.154 -0.966 . . . . 1.82 110.525 -179.526 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' I' I ' 79' ' ' LEU . . . . . 0.443 ' C ' ' O ' ' I' ' 78' ' ' CYS . 1.4 mt -40.89 153.83 0.22 Allowed Pre-proline 0 N--CA 1.493 1.688 0 O-C-N 121.414 -0.803 . . . . 1.16 109.963 -179.99 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' I' I ' 80' ' ' PRO . . . . . 0.494 ' O ' ' N ' ' I' ' 82' ' ' ASN . 3.3 Cg_exo -59.34 173.36 1.46 Allowed 'Trans proline' 0 C--N 1.311 -1.427 0 O-C-N 123.615 1.324 . . . . 1.0 110.66 -179.533 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' I' I ' 81' ' ' SER . . . . . 0.481 ' HB2' ' HG2' ' I' ' 20' ' ' PRO . 0.0 OUTLIER -66.81 59.11 0.04 OUTLIER 'General case' 0 N--CA 1.492 1.641 0 O-C-N 121.363 -0.836 . . . . 1.48 110.076 -179.872 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' I' I ' 82' ' ' ASN . . . . . 0.494 ' N ' ' O ' ' I' ' 80' ' ' PRO . 1.9 m-20 173.12 116.78 0.02 OUTLIER 'General case' 0 N--CA 1.491 1.59 0 O-C-N 121.261 -0.899 . . . . 2.27 110.18 -179.872 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' I' I ' 83' ' ' THR . . . . . 0.483 ' HB ' ' CE1' ' I' ' 85' ' ' PHE . 0.2 OUTLIER -157.97 149.57 21.59 Favored 'General case' 0 N--CA 1.491 1.594 0 O-C-N 121.212 -0.93 . . . . 0.94 110.195 179.951 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' I' I ' 84' ' ' LYS . . . . . 0.462 ' HB3' ' HB3' ' I' ' 64' ' ' ALA . 0.5 OUTLIER -82.87 95.99 8.11 Favored 'General case' 0 N--CA 1.491 1.605 0 O-C-N 121.183 -0.948 . . . . 1.42 110.172 -179.946 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' I' I ' 85' ' ' PHE . . . . . 0.483 ' CE1' ' HB ' ' I' ' 83' ' ' THR . 2.8 m-85 -93.86 105.28 17.31 Favored 'General case' 0 N--CA 1.491 1.623 0 O-C-N 121.28 -0.887 . . . . 1.35 110.22 -179.932 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' I' I ' 86' ' ' VAL . . . . . 0.761 HG21 HG21 ' I' ' 95' ' ' THR . 92.4 t -80.42 109.61 15.07 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.592 0 O-C-N 121.211 -0.93 . . . . 0.44 110.237 -179.991 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' I' I ' 87' ' ' ALA . . . . . . . . . . . . . . . -80.35 128.89 34.08 Favored 'General case' 0 N--CA 1.491 1.616 0 O-C-N 121.239 -0.913 . . . . 0.51 110.244 -179.941 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' I' I ' 88' ' ' LEU . . . . . 0.698 HD22 ' CD1' ' I' ' 94' ' ' TRP . 0.1 OUTLIER -121.62 83.79 2.14 Favored 'General case' 0 N--CA 1.492 1.643 0 O-C-N 121.235 -0.916 . . . . 0.72 110.249 -179.986 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' I' I ' 89' ' ' ALA . . . . . 0.892 ' HB1' ' HB3' ' I' ' 56' ' ' LEU . . . -66.65 63.23 0.05 OUTLIER 'General case' 0 N--CA 1.491 1.596 0 O-C-N 121.247 -0.908 . . . . 1.19 110.079 179.927 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' I' I ' 90' ' ' CYS . . . . . 0.5 ' N ' ' O ' ' I' ' 88' ' ' LEU . 2.0 t 43.15 35.72 0.86 Allowed 'General case' 0 N--CA 1.491 1.577 0 O-C-N 121.241 -0.912 . . . . 1.48 110.151 -179.989 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' I' I ' 91' ' ' ASN . . . . . . . . . . . . . 17.2 t-20 -158.46 -57.82 0.07 Allowed 'General case' 0 N--CA 1.491 1.607 0 O-C-N 121.245 -0.909 . . . . 2.77 110.224 -179.975 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' I' I ' 92' ' ' GLU . . . . . 0.507 ' HB2' ' HA ' ' I' ' 88' ' ' LEU . 6.2 mp0 -43.39 148.65 0.3 Allowed 'General case' 0 N--CA 1.491 1.579 0 O-C-N 121.231 -0.918 . . . . 1.8 110.205 179.997 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' I' I ' 93' ' ' LYS . . . . . 0.631 ' HB3' ' ND2' ' I' ' 26' ' ' ASN . 19.2 ttpt -62.19 143.11 57.21 Favored 'General case' 0 N--CA 1.491 1.584 0 O-C-N 121.275 -0.891 . . . . 2.46 110.219 179.974 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' I' I ' 94' ' ' TRP . . . . . 0.804 ' CZ2' HG11 ' I' ' 62' ' ' VAL . 0.0 OUTLIER -76.49 158.1 31.57 Favored 'General case' 0 N--CA 1.491 1.621 0 O-C-N 121.201 -0.937 . . . . 2.87 110.243 -179.964 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' I' I ' 95' ' ' THR . . . . . 0.761 HG21 HG21 ' I' ' 86' ' ' VAL . 2.6 p -89.6 31.75 0.91 Allowed 'General case' 0 N--CA 1.491 1.601 0 O-C-N 121.182 -0.949 . . . . 1.75 110.279 179.979 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' I' I ' 96' ' ' TYR . . . . . 0.764 ' CE2' ' HB1' ' C' ' 19' ' ' ALA . 87.1 t80 -127.01 -60.37 1.21 Allowed 'General case' 0 N--CA 1.492 1.626 0 O-C-N 121.223 -0.923 . . . . 3.91 110.207 -179.959 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' I' I ' 97' ' ' ASN . . . . . 0.409 ' O ' ' C ' ' I' ' 98' ' ' ASP . 4.7 t30 42.93 58.13 3.36 Favored 'General case' 0 N--CA 1.492 1.632 0 O-C-N 121.264 -0.898 . . . . 3.7 110.235 179.988 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' I' I ' 98' ' ' ASP . . . . . 0.409 ' C ' ' O ' ' I' ' 97' ' ' ASN . 0.3 OUTLIER 43.22 38.96 1.79 Allowed 'General case' 0 N--CA 1.491 1.605 0 O-C-N 121.215 -0.928 . . . . 4.7 110.187 179.964 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' I' I ' 99' ' ' SER . . . . . 0.473 ' CB ' ' O ' ' I' ' 96' ' ' TYR . 34.3 t -94.19 51.73 1.52 Allowed 'General case' 0 N--CA 1.491 1.599 0 O-C-N 121.167 -0.958 . . . . 4.15 110.164 -179.998 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' I' I ' 100' ' ' ASP . . . . . . . . . . . . . 24.1 t70 . . . . . 0 N--CA 1.492 1.628 0 O-C-N 121.27 -0.894 . . . . 5.5 110.159 -179.958 . . . . . . . . 0 0 . 1 . 001 nuclear nobuild full ' C' C ' 1' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.492 1.633 0 CA-C-O 121.281 0.562 . . . . 8.3200000000000003 110.187 . . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' C' C ' 2' ' ' CYS . . . . . . . . . . . . . 6.5 m -114.37 66.76 0.68 Allowed 'General case' 0 N--CA 1.491 1.578 0 O-C-N 121.197 -0.939 . . . . 5.7300000000000004 110.205 179.97 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' C' C ' 3' ' ' ALA . . . . . . . . . . . . . . . -46.06 118.39 1.87 Allowed 'General case' 0 N--CA 1.491 1.581 0 O-C-N 121.25 -0.906 . . . . 3.7799999999999998 110.197 179.983 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' C' C ' 4' ' ' VAL . . . . . . . . . . . . . 30.9 t -80.69 117.65 27.02 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.637 0 O-C-N 121.198 -0.939 . . . . 3.6299999999999999 110.296 -179.947 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' C' C ' 5' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -81.77 166.08 20.35 Favored 'General case' 0 N--CA 1.491 1.6 0 O-C-N 121.239 -0.913 . . . . 1.8100000000000001 110.185 179.94 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' C' C ' 6' ' ' ARG . . . . . . . . . . . . . 8.1 mmt180 -87.55 -25.45 23.63 Favored 'General case' 0 N--CA 1.492 1.659 0 O-C-N 121.215 -0.928 . . . . 3.6000000000000001 110.156 179.991 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' C' C ' 7' ' ' GLN . . . . . . . . . . . . . 9.6 pt20 -156.22 151.62 21.73 Favored Pre-proline 0 N--CA 1.491 1.591 0 O-C-N 121.26 -0.9 . . . . 2.27 110.129 179.984 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' C' C ' 8' ' ' PRO . . . . . . . . . . . . . 3.0 Cg_endo -61.24 123.14 12.25 Favored 'Trans proline' 0 C--N 1.31 -1.461 0 O-C-N 123.749 1.394 . . . . 0.95999999999999996 110.542 179.997 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' C' C ' 9' ' ' LYS . . . . . 0.768 ' O ' ' HB1' ' C' ' 25' ' ' ALA . 1.0 OUTLIER -63.49 175.97 0.93 Allowed 'General case' 0 N--CA 1.492 1.649 0 O-C-N 121.198 -0.939 . . . . 1.79 110.136 -179.995 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' C' C ' 10' ' ' CYS . . . . . 0.596 ' C ' HG13 ' C' ' 11' ' ' VAL . 58.3 m -146.01 141.25 27.49 Favored 'General case' 0 N--CA 1.491 1.606 0 O-C-N 121.283 -0.886 . . . . 0.54000000000000004 110.399 -179.968 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' C' C ' 11' ' ' VAL . . . . . 0.646 ' HA ' ' HA ' ' C' ' 69' ' ' ASP . 32.7 m -155.63 161.29 2.08 Favored 'Isoleucine or valine' 0 N--CA 1.488 1.453 0 O-C-N 120.993 -1.067 . . . . 0.40000000000000002 110.402 179.802 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' C' C ' 12' ' ' LYS . . . . . 0.456 ' HD3' ' HE2' ' C' ' 21' ' ' LYS . 10.2 mttp -120.22 112.67 19.35 Favored 'General case' 0 N--CA 1.491 1.601 0 O-C-N 121.262 -0.899 . . . . 1.21 110.104 179.993 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' C' C ' 13' ' ' LEU . . . . . 0.782 HD21 ' HA3' ' C' ' 36' ' ' GLY . 0.8 OUTLIER -81.74 100.02 9.28 Favored 'General case' 0 N--CA 1.491 1.618 0 O-C-N 121.291 -0.88 . . . . 0.81000000000000005 110.31 -179.942 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' C' C ' 14' ' ' ARG . . . . . 0.488 ' O ' ' HA ' ' C' ' 73' ' ' LEU . 1.9 ttt180 -106.16 135.91 46.79 Favored 'General case' 0 N--CA 1.492 1.647 0 O-C-N 121.236 -0.915 . . . . 2.3100000000000001 110.292 179.93 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' C' C ' 15' ' ' ALA . . . . . 1.043 ' HB3' ' HB3' ' C' ' 18' ' ' SER . . . -91.3 174.12 7.56 Favored 'General case' 0 N--CA 1.492 1.66 0 O-C-N 121.24 -0.913 . . . . 0.60999999999999999 110.233 -179.993 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' C' C ' 16' ' ' LEU . . . . . 0.438 ' HG ' HD21 ' C' ' 73' ' ' LEU . 0.3 OUTLIER -87.39 -49.33 7.3 Favored 'General case' 0 N--CA 1.491 1.622 0 O-C-N 121.262 -0.899 . . . . 1.03 110.241 -179.985 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' C' C ' 17' ' ' HIS . . . . . . . . . . . . . 40.3 m170 -111.42 30.11 7.23 Favored 'General case' 0 N--CA 1.491 1.604 0 O-C-N 121.217 -0.927 . . . . 3.7400000000000002 110.23 -179.99 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' C' C ' 18' ' ' SER . . . . . 1.043 ' HB3' ' HB3' ' C' ' 15' ' ' ALA . 37.4 t -101.95 -20.58 14.77 Favored 'General case' 0 N--CA 1.492 1.631 0 O-C-N 121.265 -0.897 . . . . 2.3999999999999999 110.064 179.937 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' C' C ' 19' ' ' ALA . . . . . 0.764 ' HB1' ' CE2' ' I' ' 96' ' ' TYR . . . 65.17 13.81 8.98 Favored 'General case' 0 N--CA 1.491 1.611 0 O-C-N 121.345 -0.847 . . . . 2.6800000000000002 110.262 -179.984 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' C' C ' 20' ' ' CYS . . . . . 0.628 ' HB3' HD11 ' I' ' 69' ' ' ILE . 47.4 m -153.13 177.71 10.52 Favored 'General case' 0 N--CA 1.491 1.594 0 O-C-N 121.269 -0.895 . . . . 2.1400000000000001 110.219 179.982 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' C' C ' 21' ' ' LYS . . . . . 0.682 ' O ' HD12 ' I' ' 69' ' ' ILE . 0.1 OUTLIER -145.25 178.11 8.32 Favored 'General case' 0 N--CA 1.491 1.616 0 O-C-N 121.279 -0.888 . . . . 1.1399999999999999 110.169 179.971 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' C' C ' 22' ' ' PHE . . . . . 0.583 ' CE2' ' HD2' ' C' ' 39' ' ' ARG . 25.7 m-85 -125.84 97.15 5.01 Favored 'General case' 0 N--CA 1.491 1.576 0 O-C-N 121.216 -0.928 . . . . 1.51 110.23 179.972 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' C' C ' 23' ' ' GLY . . . . . 0.446 ' C ' HG23 ' C' ' 24' ' ' VAL . . . -73.05 115.9 5.36 Favored Glycine 0 N--CA 1.49 2.26 0 N-CA-C 109.479 -1.448 . . . . 0.40000000000000002 109.479 179.955 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' C' C ' 24' ' ' VAL . . . . . 0.716 HG22 ' HB3' ' I' ' 72' ' ' ASP . 88.6 t -148.09 150.27 14.5 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.613 0 O-C-N 121.243 -1.151 . . . . 0.46000000000000002 110.259 -179.997 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' C' C ' 25' ' ' ALA . . . . . 0.768 ' HB1' ' O ' ' C' ' 9' ' ' LYS . . . -129.98 172.83 11.31 Favored 'General case' 0 N--CA 1.492 1.637 0 O-C-N 121.258 -0.901 . . . . 0.52000000000000002 110.199 179.959 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' C' C ' 26' ' ' ALA . . . . . 0.531 ' HB3' ' HG ' ' C' ' 32' ' ' LEU . . . -178.21 158.66 1.19 Allowed 'General case' 0 N--CA 1.492 1.638 0 O-C-N 121.226 -0.921 . . . . 0.63 110.278 -179.976 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' C' C ' 27' ' ' ARG . . . . . . . . . . . . . 3.1 mtm180 -88.93 26.71 1.49 Allowed 'General case' 0 N--CA 1.491 1.59 0 O-C-N 121.293 -0.879 . . . . 3.1499999999999999 110.041 179.851 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' C' C ' 28' ' ' SER . . . . . . . . . . . . . 2.2 m -155.45 107.46 2.64 Favored 'General case' 0 N--CA 1.491 1.597 0 O-C-N 121.285 -0.884 . . . . 1.3700000000000001 110.324 -179.954 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' C' C ' 29' ' ' CYS . . . . . 0.622 ' HA ' HD12 ' C' ' 32' ' ' LEU . 6.4 p -46.44 -40.03 11.58 Favored 'General case' 0 N--CA 1.491 1.596 0 O-C-N 121.18 -0.95 . . . . 1.77 110.134 179.94 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' C' C ' 30' ' ' GLN . . . . . . . . . . . . . 1.1 mt-30 -64.34 -48.82 74.1 Favored 'General case' 0 N--CA 1.491 1.623 0 O-C-N 121.26 -0.9 . . . . 2.3399999999999999 110.111 179.966 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' C' C ' 31' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER -48.18 -45.78 34.08 Favored 'General case' 0 N--CA 1.491 1.604 0 O-C-N 121.219 -0.925 . . . . 2.1299999999999999 110.196 179.93 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' C' C ' 32' ' ' LEU . . . . . 0.622 HD12 ' HA ' ' C' ' 29' ' ' CYS . 6.7 mt -61.89 -44.89 95.88 Favored 'General case' 0 N--CA 1.492 1.629 0 O-C-N 121.273 -0.892 . . . . 1.22 110.119 179.938 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' C' C ' 33' ' ' LEU . . . . . 0.911 HD13 ' SD ' ' C' ' 44' ' ' MET . 4.0 mt -52.59 -40.76 63.0 Favored 'General case' 0 N--CA 1.491 1.617 0 O-C-N 121.277 -0.889 . . . . 0.79000000000000004 110.222 -179.903 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' C' C ' 34' ' ' ARG . . . . . 0.428 ' O ' ' C ' ' C' ' 35' ' ' LYS . 0.0 OUTLIER -66.34 -64.57 0.83 Allowed 'General case' 0 N--CA 1.491 1.584 0 O-C-N 121.214 -0.929 . . . . 2.8199999999999998 110.244 -179.909 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' C' C ' 35' ' ' LYS . . . . . 0.428 ' C ' ' O ' ' C' ' 34' ' ' ARG . 0.4 OUTLIER -42.44 -43.84 3.78 Favored 'General case' 0 N--CA 1.492 1.654 0 O-C-N 121.327 -0.858 . . . . 2.3199999999999998 110.296 -179.927 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' C' C ' 36' ' ' GLY . . . . . 0.782 ' HA3' HD21 ' C' ' 13' ' ' LEU . . . -62.57 -47.24 90.81 Favored Glycine 0 N--CA 1.49 2.298 0 N-CA-C 109.577 -1.409 . . . . 0.46999999999999997 109.577 -179.979 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' C' C ' 37' ' ' CYS . . . . . 0.42 ' SG ' ' O ' ' C' ' 42' ' ' LEU . 9.9 t -66.94 -19.68 65.77 Favored 'General case' 0 N--CA 1.492 1.655 0 O-C-N 121.247 -1.149 . . . . 1.71 110.263 -179.99 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' C' C ' 38' ' ' VAL . . . . . . . . . . . . . 72.9 t -83.77 -33.7 9.74 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.637 0 O-C-N 121.245 -0.91 . . . . 0.88 110.253 -179.971 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' C' C ' 39' ' ' ARG . . . . . 0.583 ' HD2' ' CE2' ' C' ' 22' ' ' PHE . 6.7 mmt-85 -89.96 -22.99 21.67 Favored 'General case' 0 N--CA 1.491 1.609 0 O-C-N 121.276 -0.89 . . . . 3.1400000000000001 110.238 -179.982 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' C' C ' 40' ' ' PHE . . . . . 0.497 ' HD2' HD23 ' C' ' 13' ' ' LEU . 1.6 m-85 -112.56 -1.23 14.94 Favored 'General case' 0 N--CA 1.491 1.619 0 O-C-N 121.214 -0.929 . . . . 1.3500000000000001 110.236 -179.946 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' C' C ' 41' ' ' GLN . . . . . 0.438 ' HB2' ' O ' ' C' ' 40' ' ' PHE . 28.7 mt-30 55.22 63.63 2.04 Favored 'General case' 0 N--CA 1.491 1.615 0 O-C-N 121.252 -0.905 . . . . 2.1499999999999999 110.099 -179.95 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' C' C ' 42' ' ' LEU . . . . . 0.89 HD23 ' HB3' ' C' ' 47' ' ' SER . 0.1 OUTLIER -141.86 99.97 6.08 Favored Pre-proline 0 N--CA 1.491 1.593 0 O-C-N 121.244 -0.91 . . . . 1.23 110.172 -179.934 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' C' C ' 43' ' ' PRO . . . . . 0.521 ' O ' ' CB ' ' C' ' 47' ' ' SER . 3.0 Cg_exo -59.97 158.88 27.57 Favored 'Trans proline' 0 C--N 1.312 -1.391 0 O-C-N 123.58 1.305 . . . . 0.82999999999999996 110.522 -179.98 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' C' C ' 44' ' ' MET . . . . . 0.911 ' SD ' HD13 ' C' ' 33' ' ' LEU . 3.0 mtm -73.5 -50.79 5.87 Favored Pre-proline 0 N--CA 1.49 1.543 0 O-C-N 121.189 -0.945 . . . . 2.1099999999999999 110.774 -179.935 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' C' C ' 45' ' ' PRO . . . . . 0.573 ' HD2' ' N ' ' C' ' 44' ' ' MET . 3.0 Cg_endo -63.95 -61.19 0.13 Allowed 'Trans proline' 0 C--N 1.313 -1.309 0 O-C-N 123.359 1.189 . . . . 0.69999999999999996 110.776 -179.686 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' C' C ' 46' ' ' GLY . . . . . 0.467 ' O ' ' CB ' ' C' ' 47' ' ' SER . . . -87.16 39.62 3.1 Favored Glycine 0 N--CA 1.491 2.366 0 N-CA-C 109.811 -1.316 . . . . 0.71999999999999997 109.811 -179.708 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' C' C ' 47' ' ' SER . . . . . 0.89 ' HB3' HD23 ' C' ' 42' ' ' LEU . 0.3 OUTLIER 170.38 131.24 0.02 OUTLIER 'General case' 0 N--CA 1.493 1.712 0 O-C-N 121.226 -1.161 . . . . 1.25 110.106 179.88 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' C' C ' 48' ' ' ARG . . . . . 0.947 ' HG2' HG23 ' C' ' 59' ' ' THR . 2.1 mtm180 -134.75 -163.51 1.39 Allowed 'General case' 0 N--CA 1.49 1.564 0 O-C-N 121.249 -0.907 . . . . 2.4900000000000002 110.224 -179.958 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' C' C ' 49' ' ' LEU . . . . . . . . . . . . . 1.9 mp -132.87 174.9 9.85 Favored 'General case' 0 N--CA 1.491 1.608 0 O-C-N 121.204 -0.935 . . . . 0.64000000000000001 110.225 -179.971 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' C' C ' 50' ' ' CYS . . . . . 0.45 ' SG ' ' HB3' ' C' ' 73' ' ' LEU . 6.1 p -148.78 125.47 11.11 Favored 'General case' 0 N--CA 1.491 1.592 0 O-C-N 121.266 -0.896 . . . . 1.45 110.168 179.977 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' C' C ' 51' ' ' LEU . . . . . 0.851 HD12 ' HB ' ' C' ' 56' ' ' THR . 6.3 mt -46.58 131.33 11.25 Favored 'General case' 0 N--CA 1.492 1.63 0 O-C-N 121.246 -0.909 . . . . 0.78000000000000003 110.265 -179.926 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' C' C ' 52' ' ' TYR . . . . . 0.505 ' HB3' ' HB3' ' C' ' 71' ' ' GLU . 88.2 t80 -79.34 5.24 12.98 Favored 'General case' 0 N--CA 1.491 1.589 0 O-C-N 121.308 -0.87 . . . . 1.46 110.141 179.874 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' C' C ' 53' ' ' GLU . . . . . 0.485 ' O ' ' HB3' ' C' ' 84' ' ' TYR . 3.5 tp10 -89.21 -46.61 8.66 Favored 'General case' 0 N--CA 1.49 1.569 0 O-C-N 121.25 -0.906 . . . . 2.3399999999999999 110.344 -179.941 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' C' C ' 54' ' ' ASP . . . . . . . . . . . . . 1.0 OUTLIER -138.96 15.28 2.66 Favored 'General case' 0 N--CA 1.491 1.59 0 O-C-N 121.246 -0.909 . . . . 2.3599999999999999 110.27 -179.971 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' C' C ' 55' ' ' GLY . . . . . . . . . . . . . . . 66.89 52.47 33.06 Favored Glycine 0 N--CA 1.491 2.31 0 N-CA-C 109.599 -1.4 . . . . 1.03 109.599 -179.981 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' C' C ' 56' ' ' THR . . . . . 0.851 ' HB ' HD12 ' C' ' 51' ' ' LEU . 0.3 OUTLIER -95.64 116.74 29.29 Favored 'General case' 0 N--CA 1.492 1.637 0 O-C-N 121.203 -1.174 . . . . 0.95999999999999996 110.144 179.992 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' C' C ' 57' ' ' GLU . . . . . . . . . . . . . 7.2 mt-10 -53.78 129.14 32.43 Favored 'General case' 0 N--CA 1.491 1.617 0 O-C-N 121.258 -0.901 . . . . 2.4399999999999999 110.206 179.957 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' C' C ' 58' ' ' VAL . . . . . 0.769 HG23 ' O ' ' C' ' 56' ' ' THR . 48.9 t -130.01 145.74 35.17 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.596 0 O-C-N 121.244 -0.91 . . . . 0.84999999999999998 110.181 179.965 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' C' C ' 59' ' ' THR . . . . . 0.947 HG23 ' HG2' ' C' ' 48' ' ' ARG . 0.2 OUTLIER -146.99 -148.71 0.26 Allowed 'General case' 0 N--CA 1.491 1.607 0 O-C-N 121.257 -0.902 . . . . 0.83999999999999997 110.239 -179.978 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' C' C ' 60' ' ' ASP . . . . . 0.472 ' HB3' ' SD ' ' C' ' 44' ' ' MET . 2.6 p30 -89.34 9.05 27.54 Favored 'General case' 0 N--CA 1.491 1.6 0 O-C-N 121.185 -0.947 . . . . 2.3300000000000001 110.203 -179.984 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' C' C ' 61' ' ' ASP . . . . . . . . . . . . . 0.6 OUTLIER -123.22 -14.69 7.43 Favored 'General case' 0 N--CA 1.492 1.646 0 O-C-N 121.253 -0.904 . . . . 1.79 110.198 179.974 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' C' C ' 62' ' ' CYS . . . . . . . . . . . . . 0.1 OUTLIER -128.43 11.9 6.39 Favored 'General case' 0 N--CA 1.491 1.59 0 O-C-N 121.263 -0.898 . . . . 1.3600000000000001 110.154 179.954 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' C' C ' 63' ' ' PHE . . . . . 0.599 ' N ' ' HD2' ' C' ' 64' ' ' PRO . 0.7 OUTLIER -78.33 -46.88 2.06 Favored Pre-proline 0 N--CA 1.49 1.538 0 O-C-N 121.281 -0.887 . . . . 1.46 110.957 179.988 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' C' C ' 64' ' ' PRO . . . . . 0.599 ' HD2' ' N ' ' C' ' 63' ' ' PHE . 2.9 Cg_endo -63.34 -19.65 68.68 Favored 'Trans proline' 0 C--N 1.316 -1.176 0 O-C-N 122.998 0.999 . . . . 0.91000000000000003 110.502 -179.98 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' C' C ' 65' ' ' GLY . . . . . . . . . . . . . . . -64.79 -17.79 63.26 Favored Glycine 0 N--CA 1.491 2.324 0 N-CA-C 109.53 -1.428 . . . . 0.79000000000000004 109.53 -179.982 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' C' C ' 66' ' ' LEU . . . . . 0.586 HD13 HD21 ' C' ' 51' ' ' LEU . 19.8 mt -89.71 153.8 47.84 Favored Pre-proline 0 N--CA 1.491 1.592 0 O-C-N 121.19 -1.183 . . . . 0.71999999999999997 110.227 -179.985 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' C' C ' 67' ' ' PRO . . . . . 0.483 ' O ' ' HE3' ' C' ' 9' ' ' LYS . 3.0 Cg_exo -61.21 -159.72 0.02 OUTLIER 'Trans proline' 0 C--N 1.312 -1.393 0 O-C-N 123.743 1.391 . . . . 0.84999999999999998 110.577 -179.995 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' C' C ' 68' ' ' ASN . . . . . 0.609 ' O ' ' N ' ' C' ' 70' ' ' ALA . 3.3 m120 -61.12 -136.96 0.0 OUTLIER 'General case' 0 N--CA 1.491 1.594 0 O-C-N 121.271 -0.893 . . . . 1.8999999999999999 109.829 179.81 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' C' C ' 69' ' ' ASP . . . . . 0.646 ' HA ' ' HA ' ' C' ' 11' ' ' VAL . 11.2 p30 -28.68 82.53 0.0 OUTLIER 'General case' 0 N--CA 1.495 1.816 0 CA-C-O 121.315 0.579 . . . . 2.0600000000000001 111.924 -179.629 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' C' C ' 70' ' ' ALA . . . . . 0.609 ' N ' ' O ' ' C' ' 68' ' ' ASN . . . -86.51 123.39 31.66 Favored 'General case' 0 N--CA 1.49 1.543 0 O-C-N 121.307 -0.87 . . . . 0.46000000000000002 110.163 179.996 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' C' C ' 71' ' ' GLU . . . . . 0.505 ' HB3' ' HB3' ' C' ' 52' ' ' TYR . 6.6 mt-10 -59.11 86.32 0.01 OUTLIER 'General case' 0 N--CA 1.491 1.623 0 O-C-N 121.211 -0.931 . . . . 2.1099999999999999 110.118 -179.982 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' C' C ' 72' ' ' LEU . . . . . 0.43 ' N ' ' O ' ' C' ' 70' ' ' ALA . 1.0 OUTLIER -89.64 103.73 16.35 Favored 'General case' 0 N--CA 1.491 1.62 0 O-C-N 121.3 -0.875 . . . . 0.40000000000000002 110.246 -179.924 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' C' C ' 73' ' ' LEU . . . . . 0.488 ' HA ' ' O ' ' C' ' 14' ' ' ARG . 11.1 tp -84.57 157.49 21.21 Favored 'General case' 0 N--CA 1.492 1.637 0 O-C-N 121.245 -0.909 . . . . 0.5 110.18 179.908 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' C' C ' 74' ' ' LEU . . . . . 0.765 ' HG ' HD13 ' C' ' 42' ' ' LEU . 7.5 tp -81.54 134.36 35.5 Favored 'General case' 0 N--CA 1.492 1.629 0 O-C-N 121.287 -0.883 . . . . 1.3200000000000001 110.241 -179.947 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' C' C ' 75' ' ' LEU . . . . . 0.824 HD11 ' HA ' ' C' ' 80' ' ' THR . 10.5 tt -153.84 110.73 3.39 Favored 'General case' 0 N--CA 1.492 1.629 0 O-C-N 121.267 -0.895 . . . . 0.81000000000000005 110.2 -179.965 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' C' C ' 76' ' ' THR . . . . . 0.447 HG22 HD11 ' C' ' 42' ' ' LEU . 21.4 p -85.96 168.66 13.96 Favored 'General case' 0 N--CA 1.491 1.621 0 O-C-N 121.235 -0.916 . . . . 0.70999999999999996 110.182 179.994 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' C' C ' 77' ' ' ALA . . . . . . . . . . . . . . . -68.26 73.82 0.22 Allowed 'General case' 0 N--CA 1.491 1.614 0 O-C-N 121.263 -0.898 . . . . 0.98999999999999999 110.132 -179.974 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' C' C ' 78' ' ' GLY . . . . . . . . . . . . . . . 178.13 -38.98 0.09 OUTLIER Glycine 0 N--CA 1.491 2.34 0 N-CA-C 109.514 -1.435 . . . . 1.2 109.514 179.998 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' C' C ' 79' ' ' GLU . . . . . 0.411 ' O ' ' HG ' ' C' ' 75' ' ' LEU . 9.9 mt-10 -109.69 151.11 27.31 Favored 'General case' 0 N--CA 1.49 1.571 0 O-C-N 121.219 -1.166 . . . . 2.7200000000000002 110.122 -179.993 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' C' C ' 80' ' ' THR . . . . . 0.824 ' HA ' HD11 ' C' ' 75' ' ' LEU . 25.4 p -128.87 148.02 50.87 Favored 'General case' 0 N--CA 1.491 1.583 0 O-C-N 121.195 -0.94 . . . . 0.96999999999999997 110.296 -179.989 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' C' C ' 81' ' ' TRP . . . . . 0.409 ' NE1' ' HA2' ' C' ' 83' ' ' GLY . 2.0 t-105 -89.95 112.87 24.4 Favored 'General case' 0 N--CA 1.492 1.628 0 O-C-N 121.286 -0.884 . . . . 1.0 110.128 179.923 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' C' C ' 82' ' ' HIS . . . . . . . . . . . . . 0.4 OUTLIER -44.86 -49.35 10.93 Favored 'General case' 0 N--CA 1.491 1.607 0 O-C-N 121.262 -0.899 . . . . 2.23 110.22 179.987 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' C' C ' 83' ' ' GLY . . . . . 0.883 ' O ' HG23 ' C' ' 85' ' ' VAL . . . 119.84 150.42 8.6 Favored Glycine 0 N--CA 1.49 2.246 0 N-CA-C 109.558 -1.417 . . . . 1.1899999999999999 109.558 179.971 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' C' C ' 84' ' ' TYR . . . . . 0.485 ' HB3' ' O ' ' C' ' 53' ' ' GLU . 68.7 t80 -50.31 89.86 0.0 OUTLIER 'General case' 0 N--CA 1.491 1.608 0 O-C-N 121.301 -1.117 . . . . 2.46 110.221 -179.981 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' C' C ' 85' ' ' VAL . . . . . 0.883 HG23 ' O ' ' C' ' 83' ' ' GLY . 37.9 t -86.69 152.47 3.47 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.557 0 O-C-N 121.215 -0.928 . . . . 3.0899999999999999 110.242 179.985 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' C' C ' 86' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER -113.76 33.51 5.15 Favored 'General case' 0 N--CA 1.491 1.585 0 O-C-N 121.259 -0.901 . . . . 3.3999999999999999 110.124 179.99 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' C' C ' 87' ' ' ASP . . . . . 0.42 ' H ' HG12 ' C' ' 85' ' ' VAL . 6.2 t70 . . . . . 0 N--CA 1.491 1.591 0 O-C-N 121.221 -0.924 . . . . 4.6100000000000003 110.191 -179.946 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' I' I ' 1' ' ' MET . . . . . . . . . . . . . 0.8 OUTLIER . . . . . 0 N--CA 1.493 1.682 0 CA-C-O 121.261 0.553 . . . . 23.960000000000001 110.252 . . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' I' I ' 2' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -55.8 -19.65 12.22 Favored 'General case' 0 N--CA 1.492 1.634 0 O-C-N 121.224 -0.923 . . . . 22.609999999999999 110.204 -179.922 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' I' I ' 3' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -48.99 121.91 5.26 Favored 'General case' 0 N--CA 1.491 1.6 0 O-C-N 121.281 -0.887 . . . . 22.07 110.194 -179.896 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' I' I ' 4' ' ' SER . . . . . 0.526 ' O ' ' CZ ' ' I' ' 5' ' ' ARG . 1.4 p -51.03 102.98 0.05 OUTLIER 'General case' 0 N--CA 1.491 1.602 0 O-C-N 121.211 -0.93 . . . . 19.98 110.275 -179.914 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' I' I ' 5' ' ' ARG . . . . . 0.805 ' NE ' ' HB3' ' I' ' 9' ' ' ALA . 0.1 OUTLIER -125.9 86.29 2.51 Favored 'General case' 0 N--CA 1.491 1.622 0 O-C-N 121.297 -0.877 . . . . 20.280000000000001 110.162 179.981 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' I' I ' 6' ' ' GLY . . . . . 0.662 ' O ' ' HB2' ' I' ' 7' ' ' ALA . . . -127.5 4.57 7.13 Favored Glycine 0 N--CA 1.49 2.298 0 N-CA-C 109.584 -1.406 . . . . 16.77 109.584 179.949 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' I' I ' 7' ' ' ALA . . . . . 0.662 ' HB2' ' O ' ' I' ' 6' ' ' GLY . . . 171.79 -31.11 0.0 OUTLIER 'General case' 0 N--CA 1.492 1.626 0 O-C-N 121.298 -1.119 . . . . 14.720000000000001 110.08 179.926 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' I' I ' 8' ' ' SER . . . . . 0.537 ' O ' ' HB3' ' I' ' 9' ' ' ALA . 0.1 OUTLIER -84.0 164.07 19.54 Favored 'General case' 0 N--CA 1.492 1.638 0 O-C-N 121.231 -0.918 . . . . 13.82 110.136 179.949 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' I' I ' 9' ' ' ALA . . . . . 0.805 ' HB3' ' NE ' ' I' ' 5' ' ' ARG . . . 59.47 151.24 0.09 OUTLIER Pre-proline 0 N--CA 1.492 1.637 0 O-C-N 121.209 -0.932 . . . . 11.18 110.09 -179.917 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' I' I ' 10' ' ' PRO . . . . . 0.425 ' HD3' ' HA ' ' I' ' 9' ' ' ALA . 3.0 Cg_exo -61.67 -157.63 0.02 OUTLIER 'Trans proline' 0 C--N 1.311 -1.438 0 O-C-N 123.719 1.379 . . . . 10.550000000000001 110.66 -179.811 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' I' I ' 11' ' ' ASP . . . . . 0.527 ' N ' ' HD3' ' I' ' 12' ' ' PRO . 6.5 t0 43.05 60.24 10.68 Favored Pre-proline 0 N--CA 1.491 1.611 0 O-C-N 121.301 -0.874 . . . . 9.6300000000000008 110.167 -179.891 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' I' I ' 12' ' ' PRO . . . . . 0.601 ' HD2' HG11 ' I' ' 15' ' ' VAL . 3.0 Cg_endo -61.42 164.28 15.68 Favored 'Trans proline' 0 C--N 1.311 -1.442 0 O-C-N 123.738 1.389 . . . . 6.1100000000000003 110.57 179.984 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' I' I ' 13' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -84.22 -18.67 35.8 Favored 'General case' 0 N--CA 1.491 1.601 0 O-C-N 121.219 -0.926 . . . . 7.6100000000000003 110.087 179.944 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' I' I ' 14' ' ' ASP . . . . . . . . . . . . . 14.3 m-20 -92.92 21.38 5.74 Favored 'General case' 0 N--CA 1.491 1.582 0 O-C-N 121.289 -0.882 . . . . 5.29 110.176 179.975 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' I' I ' 15' ' ' VAL . . . . . 0.611 HG23 ' O ' ' I' ' 15' ' ' VAL . 33.5 m -81.55 70.45 0.6 Allowed 'Isoleucine or valine' 0 N--CA 1.491 1.593 0 O-C-N 121.218 -0.926 . . . . 2.52 110.347 -179.925 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' I' I ' 16' ' ' ARG . . . . . 0.781 ' HD3' HD13 ' I' ' 77' ' ' LEU . 0.3 OUTLIER 63.1 63.12 1.67 Allowed Pre-proline 0 N--CA 1.491 1.593 0 O-C-N 121.177 -0.952 . . . . 2.4900000000000002 110.235 179.931 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' I' I ' 17' ' ' PRO . . . . . 0.497 ' HD3' ' N ' ' I' ' 16' ' ' ARG . 2.9 Cg_endo -63.63 58.25 0.2 Allowed 'Trans proline' 0 C--N 1.311 -1.433 0 O-C-N 123.695 1.366 . . . . 1.04 110.83 -179.925 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' I' I ' 18' ' ' LEU . . . . . 0.508 HD22 ' HB1' ' I' ' 35' ' ' ALA . 13.9 mt 57.74 119.35 0.01 OUTLIER 'General case' 0 N--CA 1.494 1.73 0 O-C-N 121.284 -0.885 . . . . 1.8100000000000001 110.441 179.819 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' I' I ' 19' ' ' LYS . . . . . 0.469 ' HD3' ' HA ' ' I' ' 77' ' ' LEU . 0.0 OUTLIER -113.5 90.53 17.83 Favored Pre-proline 0 N--CA 1.492 1.664 0 O-C-N 121.21 -0.931 . . . . 2.2000000000000002 110.182 179.939 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' I' I ' 20' ' ' PRO . . . . . 0.505 ' HA ' ' O ' ' I' ' 34' ' ' VAL . 3.1 Cg_exo -62.81 83.86 0.11 Allowed 'Trans proline' 0 C--N 1.311 -1.402 0 O-C-N 123.692 1.364 . . . . 1.1000000000000001 110.373 179.845 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' I' I ' 21' ' ' CYS . . . . . 0.465 ' O ' HG22 ' I' ' 34' ' ' VAL . 1.3 m -87.54 160.31 18.28 Favored 'General case' 0 N--CA 1.491 1.602 0 O-C-N 121.322 -0.861 . . . . 0.75 110.385 -179.829 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' I' I ' 22' ' ' LEU . . . . . . . . . . . . . 21.7 mt -104.5 101.27 10.95 Favored 'General case' 0 N--CA 1.491 1.593 0 O-C-N 121.306 -0.871 . . . . 0.53000000000000003 109.95 179.829 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' I' I ' 23' ' ' LEU . . . . . 0.452 HD13 ' HA ' ' I' ' 23' ' ' LEU . 2.9 mm? -79.82 144.77 33.23 Favored 'General case' 0 N--CA 1.491 1.592 0 O-C-N 121.268 -0.895 . . . . 0.53000000000000003 110.286 -179.861 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' I' I ' 24' ' ' ARG . . . . . 0.475 ' HB2' ' HG3' ' I' ' 31' ' ' GLN . 0.0 OUTLIER -140.09 138.6 35.44 Favored 'General case' 0 N--CA 1.491 1.587 0 O-C-N 121.298 -0.876 . . . . 1.8600000000000001 110.197 -179.949 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' I' I ' 25' ' ' ARG . . . . . 0.455 ' HB2' HD22 ' I' ' 50' ' ' LEU . 57.9 ttt180 -107.29 122.85 47.39 Favored 'General case' 0 N--CA 1.491 1.59 0 O-C-N 121.22 -0.925 . . . . 2.8199999999999998 110.229 179.992 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' I' I ' 26' ' ' ASN . . . . . 0.527 ' ND2' ' CB ' ' I' ' 93' ' ' LYS . 8.8 t30 -45.9 165.19 0.02 OUTLIER 'General case' 0 N--CA 1.49 1.572 0 O-C-N 121.247 -0.908 . . . . 2.9900000000000002 110.192 179.995 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' I' I ' 27' ' ' HIS . . . . . 0.447 ' CB ' ' O ' ' I' ' 26' ' ' ASN . 0.2 OUTLIER 65.41 9.12 5.49 Favored 'General case' 0 N--CA 1.491 1.613 0 O-C-N 121.264 -0.898 . . . . 3.3300000000000001 110.174 -179.956 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' I' I ' 28' ' ' SER . . . . . 0.516 ' O ' ' N ' ' I' ' 30' ' ' ASP . 0.5 OUTLIER -159.77 92.75 1.05 Allowed 'General case' 0 N--CA 1.491 1.609 0 O-C-N 121.268 -0.895 . . . . 1.95 110.154 179.949 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' I' I ' 29' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -64.14 70.63 0.03 OUTLIER 'General case' 0 N--CA 1.492 1.628 0 O-C-N 121.255 -0.903 . . . . 3.3199999999999998 110.249 -179.958 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' I' I ' 30' ' ' ASP . . . . . 0.516 ' N ' ' O ' ' I' ' 28' ' ' SER . 0.2 OUTLIER -139.29 113.07 8.51 Favored 'General case' 0 N--CA 1.491 1.609 0 O-C-N 121.21 -0.931 . . . . 2.0299999999999998 110.202 179.933 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' I' I ' 31' ' ' GLN . . . . . 0.475 ' HG3' ' HB2' ' I' ' 24' ' ' ARG . 0.0 OUTLIER -91.11 152.09 20.74 Favored 'General case' 0 N--CA 1.491 1.58 0 O-C-N 121.203 -0.936 . . . . 1.95 110.218 -179.968 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' I' I ' 32' ' ' HIS . . . . . 0.485 ' O ' HG13 ' I' ' 34' ' ' VAL . 45.7 m-70 -130.04 124.17 32.24 Favored 'General case' 0 N--CA 1.491 1.584 0 O-C-N 121.235 -0.916 . . . . 1.77 110.178 179.974 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' I' I ' 33' ' ' GLY . . . . . . . . . . . . . . . -73.65 117.01 5.61 Favored Glycine 0 N--CA 1.49 2.294 0 N-CA-C 109.506 -1.438 . . . . 0.68999999999999995 109.506 -179.981 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' I' I ' 34' ' ' VAL . . . . . 0.645 HG23 ' O ' ' I' ' 34' ' ' VAL . 3.4 m -125.03 119.33 55.54 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.574 0 O-C-N 121.231 -1.158 . . . . 1.01 110.389 -179.947 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' I' I ' 35' ' ' ALA . . . . . 0.508 ' HB1' HD22 ' I' ' 18' ' ' LEU . . . -83.39 105.15 14.11 Favored 'General case' 0 N--CA 1.491 1.595 0 O-C-N 121.196 -0.94 . . . . 0.56999999999999995 110.173 179.901 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' I' I ' 36' ' ' ALA . . . . . 0.528 ' HB1' ' N ' ' I' ' 42' ' ' LEU . . . -138.41 133.99 33.55 Favored 'General case' 0 N--CA 1.492 1.635 0 O-C-N 121.233 -0.917 . . . . 0.52000000000000002 110.263 -179.905 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' I' I ' 37' ' ' SER . . . . . 0.472 ' HB2' ' O ' ' I' ' 16' ' ' ARG . 0.0 OUTLIER -85.3 -71.51 0.52 Allowed 'General case' 0 N--CA 1.491 1.617 0 O-C-N 121.3 -0.875 . . . . 1.27 110.084 179.883 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' I' I ' 38' ' ' SER . . . . . 0.465 ' N ' ' OG ' ' I' ' 37' ' ' SER . 6.9 t -83.45 152.13 25.12 Favored 'General case' 0 N--CA 1.491 1.606 0 O-C-N 121.288 -0.882 . . . . 1.47 110.082 179.946 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' I' I ' 39' ' ' LEU . . . . . 0.861 HD12 ' O ' ' I' ' 72' ' ' ASP . 0.4 OUTLIER -43.96 -51.95 7.32 Favored 'General case' 0 N--CA 1.491 1.577 0 O-C-N 121.186 -0.946 . . . . 1.3200000000000001 110.126 179.981 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' I' I ' 40' ' ' GLU . . . . . 0.41 ' C ' ' O ' ' I' ' 39' ' ' LEU . 3.1 mt-10 -42.55 -43.35 3.7 Favored 'General case' 0 N--CA 1.491 1.599 0 O-C-N 121.277 -0.889 . . . . 2.5600000000000001 110.217 179.984 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' I' I ' 41' ' ' GLU . . . . . 0.465 ' O ' ' HG2' ' I' ' 45' ' ' LYS . 13.0 mt-10 -66.27 -45.17 81.4 Favored 'General case' 0 N--CA 1.491 1.609 0 O-C-N 121.293 -0.879 . . . . 2.0 110.246 179.993 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' I' I ' 42' ' ' LEU . . . . . 0.558 ' CD1' ' CG2' ' I' ' 34' ' ' VAL . 14.3 tp -65.45 -55.25 19.01 Favored 'General case' 0 N--CA 1.492 1.637 0 O-C-N 121.246 -0.909 . . . . 0.54000000000000004 110.207 -179.981 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' I' I ' 43' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -44.77 -62.79 1.08 Allowed 'General case' 0 N--CA 1.491 1.624 0 O-C-N 121.288 -0.883 . . . . 2.1400000000000001 110.103 179.891 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' I' I ' 44' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -44.81 -58.8 2.87 Favored 'General case' 0 N--CA 1.491 1.583 0 O-C-N 121.282 -0.887 . . . . 1.45 110.175 179.901 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' I' I ' 45' ' ' LYS . . . . . 0.515 ' O ' ' CD1' ' I' ' 49' ' ' LEU . 67.1 mmtt -47.76 -42.34 25.41 Favored 'General case' 0 N--CA 1.49 1.558 0 O-C-N 121.19 -0.943 . . . . 2.1800000000000002 110.132 179.956 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' I' I ' 46' ' ' ALA . . . . . 0.433 ' O ' ' HB2' ' I' ' 50' ' ' LEU . . . -67.24 -25.42 66.08 Favored 'General case' 0 N--CA 1.491 1.62 0 O-C-N 121.314 -0.866 . . . . 0.5 110.175 -179.97 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' I' I ' 47' ' ' CYS . . . . . 0.44 ' SG ' ' HB ' ' I' ' 52' ' ' ILE . 0.0 OUTLIER -75.64 -43.02 49.95 Favored 'General case' 0 N--CA 1.491 1.607 0 O-C-N 121.264 -0.897 . . . . 1.3600000000000001 110.154 179.913 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' I' I ' 48' ' ' GLU . . . . . . . . . . . . . 2.3 tt0 -78.43 -25.56 46.04 Favored 'General case' 0 N--CA 1.491 1.606 0 O-C-N 121.287 -0.883 . . . . 2.1400000000000001 110.221 179.934 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' I' I ' 49' ' ' LEU . . . . . 0.515 ' CD1' ' O ' ' I' ' 45' ' ' LYS . 0.7 OUTLIER -87.26 -42.54 12.85 Favored 'General case' 0 N--CA 1.491 1.612 0 O-C-N 121.222 -0.923 . . . . 0.73999999999999999 110.217 179.98 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' I' I ' 50' ' ' LEU . . . . . 0.551 ' O ' ' HB3' ' I' ' 51' ' ' ALA . 43.5 mt -97.56 -2.04 42.62 Favored 'General case' 0 N--CA 1.491 1.591 0 O-C-N 121.28 -0.887 . . . . 0.90000000000000002 110.235 179.937 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' I' I ' 51' ' ' ALA . . . . . 0.551 ' HB3' ' O ' ' I' ' 50' ' ' LEU . . . 60.77 40.68 15.76 Favored 'General case' 0 N--CA 1.491 1.605 0 O-C-N 121.271 -0.893 . . . . 0.97999999999999998 110.214 179.993 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' I' I ' 52' ' ' ILE . . . . . 0.863 HD12 ' HB2' ' I' ' 89' ' ' ALA . 22.6 mm -72.01 86.09 0.37 Allowed 'Isoleucine or valine' 0 N--CA 1.491 1.601 0 O-C-N 121.23 -0.919 . . . . 1.1200000000000001 110.202 -179.961 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' I' I ' 53' ' ' ASP . . . . . 0.492 ' N ' HD12 ' I' ' 56' ' ' LEU . 0.1 OUTLIER -46.1 156.82 0.14 Allowed 'General case' 0 N--CA 1.491 1.616 0 O-C-N 121.218 -0.926 . . . . 2.4199999999999999 110.179 -179.996 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' I' I ' 54' ' ' LYS . . . . . 0.452 ' O ' ' OG1' ' I' ' 57' ' ' THR . 1.4 tptt -72.64 -10.43 59.79 Favored 'General case' 0 N--CA 1.492 1.647 0 O-C-N 121.25 -0.906 . . . . 3.8700000000000001 110.178 -179.997 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' I' I ' 55' ' ' SER . . . . . . . . . . . . . 19.7 t -82.48 -9.95 59.22 Favored 'General case' 0 N--CA 1.491 1.597 0 O-C-N 121.241 -0.912 . . . . 1.6299999999999999 110.057 179.966 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' I' I ' 56' ' ' LEU . . . . . 0.892 ' HB3' ' HB1' ' I' ' 89' ' ' ALA . 8.5 mt -95.7 -2.08 48.69 Favored 'General case' 0 N--CA 1.491 1.623 0 O-C-N 121.29 -0.881 . . . . 1.3 110.242 -179.98 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' I' I ' 57' ' ' THR . . . . . 0.742 HG22 HG13 ' I' ' 59' ' ' ILE . 5.2 p -79.97 166.44 40.6 Favored Pre-proline 0 N--CA 1.491 1.623 0 O-C-N 121.279 -0.888 . . . . 1.1899999999999999 109.998 179.977 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' I' I ' 58' ' ' PRO . . . . . 0.541 ' C ' ' HA ' ' I' ' 57' ' ' THR . 2.5 Cg_endo -69.96 128.09 12.18 Favored 'Cis proline' 0 C--N 1.312 -1.346 0 C-N-CA 122.382 -1.924 . . . . 1.6799999999999999 110.828 -0.687 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' I' I ' 59' ' ' ILE . . . . . 0.856 ' CD1' HG21 ' I' ' 52' ' ' ILE . 29.6 mt -66.84 157.6 5.85 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.644 0 O-C-N 121.239 -0.913 . . . . 1.0900000000000001 110.22 179.917 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' I' I ' 60' ' ' THR . . . . . 0.424 HG22 HG13 ' I' ' 62' ' ' VAL . 7.9 m -123.06 112.99 18.42 Favored 'General case' 0 N--CA 1.492 1.654 0 O-C-N 121.245 -0.909 . . . . 0.83999999999999997 110.202 -179.996 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' I' I ' 61' ' ' LEU . . . . . . . . . . . . . 2.7 mt -93.29 95.36 9.3 Favored 'General case' 0 N--CA 1.492 1.629 0 O-C-N 121.236 -0.915 . . . . 0.83999999999999997 110.251 -179.933 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' I' I ' 62' ' ' VAL . . . . . 0.804 HG11 ' CZ2' ' I' ' 94' ' ' TRP . 17.5 m -103.16 131.05 52.36 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.625 0 O-C-N 121.199 -0.938 . . . . 0.56999999999999995 110.188 179.923 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' I' I ' 63' ' ' LEU . . . . . 0.565 HD12 ' HB ' ' I' ' 68' ' ' THR . 18.3 mt -59.72 129.55 42.43 Favored 'General case' 0 N--CA 1.491 1.601 0 O-C-N 121.256 -0.903 . . . . 0.58999999999999997 110.273 179.992 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' I' I ' 64' ' ' ALA . . . . . 0.668 ' HB2' ' CG2' ' I' ' 86' ' ' VAL . . . -67.08 -30.07 70.01 Favored 'General case' 0 N--CA 1.49 1.573 0 O-C-N 121.239 -0.913 . . . . 0.72999999999999998 110.221 179.961 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' I' I ' 65' ' ' GLU . . . . . . . . . . . . . 23.9 mt-10 -67.74 -56.4 9.39 Favored 'General case' 0 N--CA 1.491 1.604 0 O-C-N 121.259 -0.901 . . . . 2.5699999999999998 110.24 179.963 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' I' I ' 66' ' ' ASP . . . . . . . . . . . . . 6.3 m-20 -100.33 -51.11 3.73 Favored 'General case' 0 N--CA 1.491 1.612 0 O-C-N 121.261 -0.899 . . . . 1.77 110.175 -179.96 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' I' I ' 67' ' ' GLY . . . . . 0.406 ' HA2' ' O ' ' I' ' 63' ' ' LEU . . . 109.98 8.88 25.25 Favored Glycine 0 N--CA 1.49 2.248 0 N-CA-C 109.596 -1.402 . . . . 0.56999999999999995 109.596 -179.986 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' I' I ' 68' ' ' THR . . . . . 0.565 ' HB ' HD12 ' I' ' 63' ' ' LEU . 68.1 m -66.34 124.23 22.14 Favored 'General case' 0 N--CA 1.491 1.61 0 O-C-N 121.234 -1.157 . . . . 0.5 110.298 179.985 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' I' I ' 69' ' ' ILE . . . . . 0.682 HD12 ' O ' ' C' ' 21' ' ' LYS . 21.0 mt -62.96 128.81 25.53 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.626 0 O-C-N 121.261 -0.899 . . . . 0.79000000000000004 110.126 179.928 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' I' I ' 70' ' ' VAL . . . . . 0.576 HG11 ' HB2' ' I' ' 76' ' ' PHE . 15.6 t -106.78 69.91 0.27 Allowed 'Isoleucine or valine' 0 N--CA 1.491 1.58 0 O-C-N 121.293 -0.879 . . . . 0.65000000000000002 110.188 179.987 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' I' I ' 71' ' ' ASP . . . . . . . . . . . . . 0.7 OUTLIER -88.78 25.75 1.69 Allowed 'General case' 0 N--CA 1.491 1.576 0 O-C-N 121.194 -0.942 . . . . 1.8799999999999999 110.156 179.961 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' I' I ' 72' ' ' ASP . . . . . 0.861 ' O ' HD12 ' I' ' 39' ' ' LEU . 8.3 p-10 -130.79 -173.12 2.99 Favored 'General case' 0 N--CA 1.491 1.593 0 O-C-N 121.293 -0.88 . . . . 2.46 109.906 179.766 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' I' I ' 73' ' ' ASP . . . . . 0.541 ' CB ' ' HB2' ' I' ' 39' ' ' LEU . 39.5 p-10 -141.27 30.51 1.76 Allowed 'General case' 0 N--CA 1.491 1.586 0 O-C-N 121.111 -0.993 . . . . 1.6499999999999999 110.452 -179.971 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' I' I ' 74' ' ' ASP . . . . . 0.596 ' O ' ' HB3' ' C' ' 25' ' ' ALA . 1.9 m-20 -130.8 0.12 4.31 Favored 'General case' 0 N--CA 1.491 1.58 0 O-C-N 121.242 -0.911 . . . . 1.6799999999999999 110.083 179.814 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' I' I ' 75' ' ' TYR . . . . . 0.526 ' HB2' ' CB ' ' C' ' 25' ' ' ALA . 53.5 t80 -129.27 -8.26 4.76 Favored 'General case' 0 N--CA 1.491 1.614 0 O-C-N 121.227 -0.921 . . . . 1.3600000000000001 110.652 -179.924 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' I' I ' 76' ' ' PHE . . . . . 0.623 ' CE2' HD21 ' I' ' 77' ' ' LEU . 0.1 OUTLIER -97.88 2.83 49.63 Favored 'General case' 0 N--CA 1.491 1.576 0 O-C-N 121.033 -1.042 . . . . 2.2000000000000002 110.088 -179.849 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' I' I ' 77' ' ' LEU . . . . . 0.781 HD13 ' HD3' ' I' ' 16' ' ' ARG . 0.3 OUTLIER -100.25 3.21 43.41 Favored 'General case' 0 N--CA 1.496 1.836 0 O-C-N 121.107 -0.995 . . . . 1.5900000000000001 109.749 178.87 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' I' I ' 78' ' ' CYS . . . . . 0.443 ' O ' ' C ' ' I' ' 79' ' ' LEU . 0.1 OUTLIER -79.65 -53.8 6.48 Favored 'General case' 0 N--CA 1.493 1.696 0 O-C-N 121.154 -0.966 . . . . 1.8200000000000001 110.525 -179.526 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' I' I ' 79' ' ' LEU . . . . . 0.443 ' C ' ' O ' ' I' ' 78' ' ' CYS . 1.4 mt -40.89 153.83 0.22 Allowed Pre-proline 0 N--CA 1.493 1.688 0 O-C-N 121.414 -0.803 . . . . 1.1599999999999999 109.963 -179.99 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' I' I ' 80' ' ' PRO . . . . . 0.494 ' O ' ' N ' ' I' ' 82' ' ' ASN . 3.3 Cg_exo -59.34 173.36 1.46 Allowed 'Trans proline' 0 C--N 1.311 -1.427 0 O-C-N 123.615 1.324 . . . . 1.0 110.66 -179.533 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' I' I ' 81' ' ' SER . . . . . 0.481 ' HB2' ' HG2' ' I' ' 20' ' ' PRO . 0.0 OUTLIER -66.81 59.11 0.04 OUTLIER 'General case' 0 N--CA 1.492 1.641 0 O-C-N 121.363 -0.836 . . . . 1.48 110.076 -179.872 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' I' I ' 82' ' ' ASN . . . . . 0.494 ' N ' ' O ' ' I' ' 80' ' ' PRO . 1.9 m-20 173.12 116.78 0.02 OUTLIER 'General case' 0 N--CA 1.491 1.59 0 O-C-N 121.261 -0.899 . . . . 2.27 110.18 -179.872 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' I' I ' 83' ' ' THR . . . . . 0.483 ' HB ' ' CE1' ' I' ' 85' ' ' PHE . 0.2 OUTLIER -157.97 149.57 21.59 Favored 'General case' 0 N--CA 1.491 1.594 0 O-C-N 121.212 -0.93 . . . . 0.93999999999999995 110.195 179.951 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' I' I ' 84' ' ' LYS . . . . . 0.462 ' HB3' ' HB3' ' I' ' 64' ' ' ALA . 0.5 OUTLIER -82.87 95.99 8.11 Favored 'General case' 0 N--CA 1.491 1.605 0 O-C-N 121.183 -0.948 . . . . 1.4199999999999999 110.172 -179.946 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' I' I ' 85' ' ' PHE . . . . . 0.483 ' CE1' ' HB ' ' I' ' 83' ' ' THR . 2.8 m-85 -93.86 105.28 17.31 Favored 'General case' 0 N--CA 1.491 1.623 0 O-C-N 121.28 -0.887 . . . . 1.3500000000000001 110.22 -179.932 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' I' I ' 86' ' ' VAL . . . . . 0.761 HG21 HG21 ' I' ' 95' ' ' THR . 92.4 t -80.42 109.61 15.07 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.592 0 O-C-N 121.211 -0.93 . . . . 0.44 110.237 -179.991 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' I' I ' 87' ' ' ALA . . . . . . . . . . . . . . . -80.35 128.89 34.08 Favored 'General case' 0 N--CA 1.491 1.616 0 O-C-N 121.239 -0.913 . . . . 0.51000000000000001 110.244 -179.941 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' I' I ' 88' ' ' LEU . . . . . 0.698 HD22 ' CD1' ' I' ' 94' ' ' TRP . 0.1 OUTLIER -121.62 83.79 2.14 Favored 'General case' 0 N--CA 1.492 1.643 0 O-C-N 121.235 -0.916 . . . . 0.71999999999999997 110.249 -179.986 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' I' I ' 89' ' ' ALA . . . . . 0.892 ' HB1' ' HB3' ' I' ' 56' ' ' LEU . . . -66.65 63.23 0.05 OUTLIER 'General case' 0 N--CA 1.491 1.596 0 O-C-N 121.247 -0.908 . . . . 1.1899999999999999 110.079 179.927 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' I' I ' 90' ' ' CYS . . . . . 0.5 ' N ' ' O ' ' I' ' 88' ' ' LEU . 2.0 t 43.15 35.72 0.86 Allowed 'General case' 0 N--CA 1.491 1.577 0 O-C-N 121.241 -0.912 . . . . 1.48 110.151 -179.989 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' I' I ' 91' ' ' ASN . . . . . . . . . . . . . 17.2 t-20 -158.46 -57.82 0.07 Allowed 'General case' 0 N--CA 1.491 1.607 0 O-C-N 121.245 -0.909 . . . . 2.77 110.224 -179.975 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' I' I ' 92' ' ' GLU . . . . . 0.507 ' HB2' ' HA ' ' I' ' 88' ' ' LEU . 6.2 mp0 -43.39 148.65 0.3 Allowed 'General case' 0 N--CA 1.491 1.579 0 O-C-N 121.231 -0.918 . . . . 1.8 110.205 179.997 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' I' I ' 93' ' ' LYS . . . . . 0.527 ' CB ' ' ND2' ' I' ' 26' ' ' ASN . 19.2 ttpt -62.19 143.11 57.21 Favored 'General case' 0 N--CA 1.491 1.584 0 O-C-N 121.275 -0.891 . . . . 2.46 110.219 179.974 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' I' I ' 94' ' ' TRP . . . . . 0.804 ' CZ2' HG11 ' I' ' 62' ' ' VAL . 0.0 OUTLIER -76.49 158.1 31.57 Favored 'General case' 0 N--CA 1.491 1.621 0 O-C-N 121.201 -0.937 . . . . 2.8700000000000001 110.243 -179.964 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' I' I ' 95' ' ' THR . . . . . 0.761 HG21 HG21 ' I' ' 86' ' ' VAL . 2.6 p -89.6 31.75 0.91 Allowed 'General case' 0 N--CA 1.491 1.601 0 O-C-N 121.182 -0.949 . . . . 1.75 110.279 179.979 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' I' I ' 96' ' ' TYR . . . . . 0.764 ' CE2' ' HB1' ' C' ' 19' ' ' ALA . 87.1 t80 -127.01 -60.37 1.21 Allowed 'General case' 0 N--CA 1.492 1.626 0 O-C-N 121.223 -0.923 . . . . 3.9100000000000001 110.207 -179.959 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' I' I ' 97' ' ' ASN . . . . . 0.409 ' O ' ' C ' ' I' ' 98' ' ' ASP . 4.7 t30 42.93 58.13 3.36 Favored 'General case' 0 N--CA 1.492 1.632 0 O-C-N 121.264 -0.898 . . . . 3.7000000000000002 110.235 179.988 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' I' I ' 98' ' ' ASP . . . . . 0.409 ' C ' ' O ' ' I' ' 97' ' ' ASN . 0.3 OUTLIER 43.22 38.96 1.79 Allowed 'General case' 0 N--CA 1.491 1.605 0 O-C-N 121.215 -0.928 . . . . 4.7000000000000002 110.187 179.964 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' I' I ' 99' ' ' SER . . . . . 0.473 ' CB ' ' O ' ' I' ' 96' ' ' TYR . 34.3 t -94.19 51.73 1.52 Allowed 'General case' 0 N--CA 1.491 1.599 0 O-C-N 121.167 -0.958 . . . . 4.1500000000000004 110.164 -179.998 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' I' I ' 100' ' ' ASP . . . . . . . . . . . . . 24.1 t70 . . . . . 0 N--CA 1.492 1.628 0 O-C-N 121.27 -0.894 . . . . 5.5 110.159 -179.958 . . . . . . . . 0 0 . 1 stop_ save_