data_6dri_residue ############################ # Computer software used # ############################ save_MolProbity _Software.Sf_category software _Software.Sf_framecode MolProbity _Software.Entry_ID ? _Software.ID 1 _Software.Name MolProbity _Software.Version 4.0 _Software.Details . save_ save_CYRANGE _Software.Sf_category software _Software.Sf_framecode CYRANGE _Software.Entry_ID ? _Software.ID 2 _Software.Name CYRANGE _Software.Version 2.0 _Software.Details . save_ save_Structure_validation_residue _Structure_validation_residue.Sf_category structure_validation _Structure_validation_residue.Sf_framecode Structure_validation_residue _Structure_validation_residue.Entry_ID ? _Structure_validation_residue.List_ID 1 _Structure_validation_residue.PDB_accession_code 6dri _Structure_validation_residue.Date_analyzed 2019-06-14 loop_ _Residue_analysis_software.Software_ID _Residue_analysis_software.Software_label _Residue_analysis_software.Method_ID _Residue_analysis_software.Method_label _Residue_analysis_software.Entry_ID _Residue_analysis_software.Structure_validation_oneline_list_ID 1 MolProbity . . ? 1 2 CYRANGE . . ? 1 stop_ loop_ _Residue_analysis.ID _Residue_analysis.PDB_model_num _Residue_analysis.Hydrogen_positions _Residue_analysis.MolProbity_flips _Residue_analysis.Cyrange_core_flag _Residue_analysis.Two_letter_chain_ID _Residue_analysis.PDB_strand_ID _Residue_analysis.PDB_residue_no _Residue_analysis.PDB_ins_code _Residue_analysis.PDB_residue_name _Residue_analysis.Assembly_ID _Residue_analysis.Entity_assembly_ID _Residue_analysis.Entity_ID _Residue_analysis.Comp_ID _Residue_analysis.Comp_index_ID _Residue_analysis.Clash_value _Residue_analysis.Clash_source_PDB_atom_name _Residue_analysis.Clash_destination_PDB_atom_name _Residue_analysis.Clash_destination_PDB_strand_ID _Residue_analysis.Clash_destination_PDB_residue_no _Residue_analysis.Clash_destination_PDB_ins_code _Residue_analysis.Clash_destination_PDB_residue_name _Residue_analysis.Cbeta_deviation_value _Residue_analysis.Rotamer_score _Residue_analysis.Rotamer_name _Residue_analysis.Ramachandran_phi _Residue_analysis.Ramachandran_psi _Residue_analysis.Ramachandran_score _Residue_analysis.Ramachandran_evaluation _Residue_analysis.Ramachandran_type _Residue_analysis.Bond_outlier_count _Residue_analysis.Worst_bond _Residue_analysis.Worst_bond_value _Residue_analysis.Worst_bond_sigma _Residue_analysis.Angle_outlier_count _Residue_analysis.Worst_angle _Residue_analysis.Worst_angle_value _Residue_analysis.Worst_angle_sigma _Residue_analysis.RNA_phosphate_perpendicular_outlier _Residue_analysis.RNA_suitness_score _Residue_analysis.RNA_suite_conformer _Residue_analysis.RNA_suite_triage _Residue_analysis.Max_b_factor _Residue_analysis.Tau_angle _Residue_analysis.Omega_dihedral _Residue_analysis.Disulfide_chi1 _Residue_analysis.Disulfide_chi2 _Residue_analysis.Disulfide_chi3 _Residue_analysis.Disulfide_ss_angle _Residue_analysis.Disulfide_ss _Residue_analysis.Disulfide_ss_angle_prime _Residue_analysis.Disulfide_chi2prime _Residue_analysis.Disulfide_chi1prime _Residue_analysis.Outlier_count_separate_geometry _Residue_analysis.Outlier_count _Residue_analysis.Entry_ID _Residue_analysis.Structure_validation_residue_list_ID . 001 nuclear orig core ' A' A ' 4' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.436 -1.142 0 N-CA-C 108.353 -0.98 . . . . 0.0 108.353 . . . . . . . . . 0 0 . 1 . 001 nuclear orig core ' A' A ' 5' ' ' ASP . . . . . 0.688 ' OD2' ' HB ' ' A' ' 35' ' ' VAL . 16.6 m-20 -59.85 141.56 55.16 Favored 'General case' 0 C--O 1.253 1.265 0 O-C-N 123.728 0.643 . . . . 0.0 110.068 177.001 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 0.2 OUTLIER -69.22 152.02 45.59 Favored 'General case' 0 C--N 1.307 -1.277 0 CA-C-N 115.678 -0.692 . . . . 0.0 109.63 -178.394 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 7' ' ' LYS . . . . . . . . . . . . . 8.6 ptpp? -85.61 -34.49 21.39 Favored 'General case' 0 C--N 1.31 -1.132 0 C-N-CA 123.659 0.784 . . . . 0.0 112.845 -175.875 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 8' ' ' ASN . . . . . . . . . . . . . 90.2 m-20 -94.33 -21.05 19.23 Favored 'General case' 0 C--N 1.299 -1.587 0 CA-C-N 115.978 -0.555 . . . . 0.0 111.108 -175.803 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 9' ' ' PHE . . . . . 0.58 ' HD2' ' SG ' ' A' ' 33' ' ' CYS . 37.3 t80 -83.55 129.42 34.97 Favored 'General case' 0 C--N 1.301 -1.507 0 N-CA-C 107.013 -1.477 . . . . 0.0 107.013 175.953 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 10' ' ' ASP . . . . . . . . . . . . . 12.5 t70 -86.76 107.05 18.09 Favored 'General case' 0 C--N 1.307 -1.28 0 C-N-CA 118.762 -1.175 . . . . 0.0 110.111 -179.831 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 11' ' ' CYS . . . . . 0.517 ' SG ' ' HB3' ' A' ' 5' ' ' ASP . 50.9 m -73.58 -27.34 61.26 Favored 'General case' 0 C--N 1.297 -1.706 0 CA-C-N 114.901 -1.045 . . . . 0.0 111.822 -176.406 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 12' ' ' ARG . . . . . . . . . . . . . 34.4 mmt180 -76.66 -45.88 28.01 Favored 'General case' 0 CA--C 1.506 -0.735 0 CA-C-O 120.859 0.362 . . . . 0.0 110.304 -175.217 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 37.2 ttm180 -61.26 -49.66 76.17 Favored 'General case' 0 C--N 1.31 -1.152 0 CA-C-N 115.384 -0.825 . . . . 0.0 109.239 178.616 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 14' ' ' SER . . . . . . . . . . . . . 23.7 m -59.86 -35.19 74.28 Favored 'General case' 0 CA--C 1.547 0.837 0 O-C-N 123.678 0.611 . . . . 0.0 111.629 -178.752 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 47.6 tp -71.69 -41.48 68.59 Favored 'General case' 0 C--N 1.322 -0.616 0 N-CA-C 109.643 -0.502 . . . . 0.0 109.643 178.316 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 16' ' ' ARG . . . . . . . . . . . . . 21.0 tpp180 -67.46 -35.06 78.46 Favored 'General case' 0 N--CA 1.427 -1.604 0 C-N-CA 123.9 0.88 . . . . 0.0 111.47 179.908 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 17' ' ' ASN . . . . . . . . . . . . . 86.0 m-20 -67.96 -47.4 68.75 Favored 'General case' 0 CA--C 1.5 -0.95 0 N-CA-C 108.611 -0.885 . . . . 0.0 108.611 178.266 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . 113.23 19.26 6.79 Favored Glycine 0 N--CA 1.421 -2.311 0 CA-C-N 114.426 -1.261 . . . . 0.0 110.518 -176.056 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 19' ' ' ASP . . . . . . . . . . . . . 10.4 m-20 -58.33 -38.99 78.26 Favored 'General case' 0 CA--C 1.5 -0.971 0 CA-C-O 121.276 0.56 . . . . 0.0 110.055 179.666 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 20' ' ' CYS . . . . . 0.406 ' HA ' ' HG3' ' A' ' 29' ' ' MET . 34.8 t -78.43 -4.01 46.24 Favored 'General case' 0 C--N 1.306 -1.296 0 CA-C-N 115.623 -0.717 . . . . 0.0 111.977 -176.395 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 21' ' ' ASP . . . . . . . . . . . . . 12.3 t70 -99.35 -9.72 23.18 Favored 'General case' 0 C--N 1.315 -0.923 0 CA-C-O 122.233 1.015 . . . . 0.0 108.469 178.402 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 22' ' ' ASN . . . . . . . . . . . . . 25.0 t-20 -84.3 122.59 29.12 Favored 'General case' 0 C--N 1.315 -0.915 0 CA-C-N 114.765 -1.107 . . . . 0.0 108.19 178.902 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 23' ' ' ASP . . . . . . . . . . . . . 20.1 t70 -55.2 -41.47 72.03 Favored 'General case' 0 C--N 1.318 -0.765 0 N-CA-C 113.266 0.839 . . . . 0.0 113.266 -176.368 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 14.4 m-20 -78.44 -16.33 57.69 Favored 'General case' 0 C--N 1.311 -1.073 0 CA-C-O 121.51 0.671 . . . . 0.0 111.405 -176.345 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 25' ' ' LYS . . . . . . . . . . . . . 34.9 mttm -95.06 -7.46 39.49 Favored 'General case' 0 C--N 1.303 -1.445 0 CA-C-N 115.87 -0.605 . . . . 0.0 111.74 176.588 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 26' ' ' LEU . . . . . . . . . . . . . 85.7 mt -55.74 -43.92 77.06 Favored 'General case' 0 C--N 1.314 -0.951 0 O-C-N 123.141 0.275 . . . . 0.0 111.043 176.881 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 27' ' ' LEU . . . . . . . . . . . . . 24.1 tp -57.21 -49.49 75.83 Favored 'General case' 0 N--CA 1.436 -1.162 0 CA-C-O 121.327 0.584 . . . . 0.0 109.498 176.987 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 28' ' ' GLU . . . . . . . . . . . . . 40.3 tt0 -58.19 -36.94 73.82 Favored 'General case' 0 C--N 1.325 -0.464 0 CA-C-N 114.559 -1.201 . . . . 0.0 109.977 -179.266 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 29' ' ' MET . . . . . 0.406 ' HG3' ' HA ' ' A' ' 20' ' ' CYS . 82.7 mmm -83.89 -23.23 31.33 Favored 'General case' 0 C--N 1.3 -1.554 0 CA-C-N 115.173 -0.921 . . . . 0.0 111.658 -174.825 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 30' ' ' GLY . . . . . . . . . . . . . . . -66.77 -28.46 73.78 Favored Glycine 0 C--N 1.308 -1.027 0 CA-C-N 115.192 -0.913 . . . . 0.0 112.234 179.638 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 31' ' ' TYR . . . . . . . . . . . . . 30.0 p90 -105.0 -34.01 8.14 Favored 'General case' 0 N--CA 1.435 -1.221 0 N-CA-C 113.404 0.89 . . . . 0.0 113.404 177.06 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 32' ' ' TYR . . . . . 0.421 ' HB3' ' CD2' ' A' ' 9' ' ' PHE . 19.2 m-85 -71.44 -62.05 1.55 Allowed 'General case' 0 C--N 1.308 -1.229 0 N-CA-C 113.623 0.971 . . . . 0.0 113.623 178.33 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 33' ' ' CYS . . . . . 0.58 ' SG ' ' HD2' ' A' ' 9' ' ' PHE . 62.6 m -134.31 70.3 73.17 Favored Pre-proline 0 C--N 1.299 -1.63 0 C-N-CA 119.896 -0.721 . . . . 0.0 110.988 -177.31 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 34' ' ' PRO . . . . . . . . . . . . . 71.7 Cg_endo -75.87 -23.77 12.11 Favored 'Trans proline' 0 N--CA 1.445 -1.331 0 C-N-CA 122.154 1.903 . . . . 0.0 112.438 -175.408 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 35' ' ' VAL . . . . . 0.688 ' HB ' ' OD2' ' A' ' 5' ' ' ASP . 39.3 t -82.73 -36.72 13.52 Favored 'Isoleucine or valine' 0 N--CA 1.424 -1.751 0 N-CA-C 108.826 -0.805 . . . . 0.0 108.826 -177.145 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 36' ' ' THR . . . . . . . . . . . . . 48.2 m -64.12 -34.86 79.01 Favored 'General case' 0 CA--C 1.546 0.804 0 CA-C-N 115.305 -0.861 . . . . 0.0 110.635 175.362 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 37' ' ' CYS . . . . . . . . . . . . . 90.9 m -84.79 2.11 43.71 Favored 'General case' 0 C--N 1.322 -0.59 0 CA-C-O 121.087 0.47 . . . . 0.0 112.243 177.767 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 38' ' ' GLY . . . . . . . . . . . . . . . 69.58 26.58 74.33 Favored Glycine 0 N--CA 1.445 -0.744 0 CA-C-N 116.124 -0.489 . . . . 0.0 114.224 176.086 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 39' ' ' PHE . . . . . . . . . . . . . 26.8 m-85 -75.05 -34.66 61.87 Favored 'General case' 0 CA--C 1.507 -0.687 0 N-CA-C 108.464 -0.939 . . . . 0.0 108.464 178.402 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 40' ' ' CYS . . . . . . . . . . . . . 3.3 p . . . . . 0 C--N 1.306 -1.285 0 CA-C-N 114.537 -1.211 . . . . 0.0 109.989 -179.488 . . . . . . . . 0 0 . 1 . 002 nuclear orig core ' A' A ' 4' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.433 -1.325 0 N-CA-C 109.571 -0.529 . . . . 0.0 109.571 . . . . . . . . . 0 0 . 1 . 002 nuclear orig core ' A' A ' 5' ' ' ASP . . . . . 0.62 ' OD2' ' HB ' ' A' ' 35' ' ' VAL . 4.2 m-20 -65.55 160.79 21.61 Favored 'General case' 0 C--N 1.307 -1.244 0 O-C-N 123.779 0.674 . . . . 0.0 109.803 179.381 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 0.6 OUTLIER -71.25 139.87 50.19 Favored 'General case' 0 C--N 1.309 -1.179 0 N-CA-C 106.537 -1.653 . . . . 0.0 106.537 179.147 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 7' ' ' LYS . . . . . . . . . . . . . 19.5 ptmt -82.19 -26.56 33.25 Favored 'General case' 0 C--N 1.303 -1.421 0 N-CA-C 113.691 0.997 . . . . 0.0 113.691 -171.098 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 8' ' ' ASN . . . . . . . . . . . . . 37.8 m-80 -89.86 -31.22 17.43 Favored 'General case' 0 C--N 1.294 -1.809 0 CA-C-O 121.451 0.644 . . . . 0.0 109.4 -179.23 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 9' ' ' PHE . . . . . 0.452 ' CD2' ' HB3' ' A' ' 32' ' ' TYR . 32.9 t80 -76.55 119.37 20.29 Favored 'General case' 0 N--CA 1.424 -1.771 0 N-CA-C 107.751 -1.203 . . . . 0.0 107.751 176.691 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 10' ' ' ASP . . . . . . . . . . . . . 15.4 t70 -88.39 96.14 10.48 Favored 'General case' 0 C--N 1.294 -1.828 0 N-CA-C 109.002 -0.74 . . . . 0.0 109.002 -179.905 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 11' ' ' CYS . . . . . . . . . . . . . 96.1 m -70.35 -19.53 63.04 Favored 'General case' 0 C--N 1.312 -1.036 0 CA-C-N 115.387 -0.824 . . . . 0.0 111.902 -178.441 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 12' ' ' ARG . . . . . . . . . . . . . 36.3 mmt180 -66.8 -43.36 84.06 Favored 'General case' 0 C--N 1.319 -0.746 0 N-CA-C 108.805 -0.813 . . . . 0.0 108.805 178.287 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 58.6 ttp180 -64.01 -50.08 69.91 Favored 'General case' 0 C--O 1.211 -0.953 0 CA-C-N 115.327 -0.851 . . . . 0.0 109.511 175.52 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 14' ' ' SER . . . . . . . . . . . . . 11.7 m -57.4 -40.07 77.46 Favored 'General case' 0 C--O 1.252 1.194 0 C-N-CA 122.909 0.483 . . . . 0.0 112.087 -178.621 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 46.0 tp -64.77 -41.14 96.1 Favored 'General case' 0 C--N 1.327 -0.388 0 CA-C-O 121.306 0.574 . . . . 0.0 110.259 179.686 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 16' ' ' ARG . . . . . . . . . . . . . 60.5 mtm180 -77.82 -28.2 50.2 Favored 'General case' 0 C--N 1.305 -1.342 0 CA-C-N 116.036 -0.529 . . . . 0.0 111.475 179.523 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 17' ' ' ASN . . . . . . . . . . . . . 0.9 OUTLIER -69.1 -25.93 64.67 Favored 'General case' 0 N--CA 1.477 0.899 0 CA-C-N 115.811 -0.631 . . . . 0.0 111.226 178.277 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . 102.89 6.4 46.11 Favored Glycine 0 N--CA 1.439 -1.101 0 C-N-CA 120.527 -0.844 . . . . 0.0 112.273 178.024 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 19' ' ' ASP . . . . . . . . . . . . . 15.6 m-20 -73.13 -27.25 61.57 Favored 'General case' 0 CA--C 1.504 -0.805 0 CA-C-O 120.937 0.398 . . . . 0.0 111.53 -178.631 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 20' ' ' CYS . . . . . . . . . . . . . 46.6 t -81.29 -9.91 59.67 Favored 'General case' 0 C--N 1.306 -1.303 0 CA-C-O 121.669 0.747 . . . . 0.0 110.051 179.92 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 21' ' ' ASP . . . . . . . . . . . . . 28.3 t70 -101.67 -8.9 21.37 Favored 'General case' 0 C--N 1.318 -0.791 0 CA-C-O 121.998 0.904 . . . . 0.0 108.946 177.509 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 22' ' ' ASN . . . . . . . . . . . . . 52.5 t-20 -88.09 123.06 32.38 Favored 'General case' 0 C--N 1.305 -1.368 0 CA-C-N 115.453 -0.794 . . . . 0.0 109.215 -178.896 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 23' ' ' ASP . . . . . . . . . . . . . 6.9 m-20 -59.38 -35.34 73.75 Favored 'General case' 0 CA--C 1.507 -0.688 0 C-N-CA 123.61 0.764 . . . . 0.0 111.466 179.857 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 11.8 t70 -66.6 -32.6 74.03 Favored 'General case' 0 C--N 1.311 -1.104 0 C-N-CA 123.59 0.756 . . . . 0.0 111.802 -179.207 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 25' ' ' LYS . . . . . 0.511 ' O ' ' HG2' ' A' ' 29' ' ' MET . 33.8 mmtp -94.01 -2.44 53.01 Favored 'General case' 0 C--N 1.31 -1.117 0 CA-C-N 116.124 -0.489 . . . . 0.0 112.234 -177.358 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 26' ' ' LEU . . . . . . . . . . . . . 88.6 mt -58.89 -38.6 79.22 Favored 'General case' 0 N--CA 1.469 0.504 0 N-CA-C 112.834 0.679 . . . . 0.0 112.834 -176.95 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 27' ' ' LEU . . . . . . . . . . . . . 24.4 tp -55.28 -49.89 70.93 Favored 'General case' 0 N--CA 1.437 -1.092 0 N-CA-C 109.436 -0.579 . . . . 0.0 109.436 176.376 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 28' ' ' GLU . . . . . . . . . . . . . 5.7 mm-40 -61.86 -36.78 82.26 Favored 'General case' 0 C--N 1.324 -0.518 0 CA-C-N 114.603 -1.18 . . . . 0.0 109.141 -179.22 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 29' ' ' MET . . . . . 0.511 ' HG2' ' O ' ' A' ' 25' ' ' LYS . 22.3 mmt -70.94 -27.45 63.77 Favored 'General case' 0 C--O 1.203 -1.384 0 CA-C-N 115.203 -0.908 . . . . 0.0 110.885 -175.324 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 30' ' ' GLY . . . . . . . . . . . . . . . -68.42 -34.4 79.49 Favored Glycine 0 C--N 1.312 -0.777 0 C-N-CA 120.186 -1.007 . . . . 0.0 112.768 -178.321 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 31' ' ' TYR . . . . . . . . . . . . . 36.3 p90 -103.15 -27.6 12.44 Favored 'General case' 0 N--CA 1.441 -0.883 0 N-CA-C 113.663 0.986 . . . . 0.0 113.663 179.913 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 32' ' ' TYR . . . . . 0.452 ' HB3' ' CD2' ' A' ' 9' ' ' PHE . 23.0 m-85 -83.35 -36.83 24.06 Favored 'General case' 0 C--N 1.29 -2.018 0 N-CA-C 112.626 0.602 . . . . 0.0 112.626 175.852 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 33' ' ' CYS . . . . . . . . . . . . . 61.0 m -134.71 49.86 4.26 Favored Pre-proline 0 CA--C 1.565 1.528 0 N-CA-C 113.369 0.878 . . . . 0.0 113.369 -174.893 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 34' ' ' PRO . . . . . 0.52 ' HD2' ' HA ' ' A' ' 5' ' ' ASP . 21.7 Cg_endo -57.33 -32.3 93.43 Favored 'Trans proline' 0 C--N 1.38 2.21 0 C-N-CA 122.733 2.289 . . . . 0.0 113.591 -178.916 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 35' ' ' VAL . . . . . 0.62 ' HB ' ' OD2' ' A' ' 5' ' ' ASP . 45.3 t -87.07 -46.76 16.21 Favored 'Isoleucine or valine' 0 C--N 1.299 -1.629 0 C-N-CA 119.917 -0.713 . . . . 0.0 110.892 -177.46 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 36' ' ' THR . . . . . . . . . . . . . 19.5 m -61.56 -40.95 96.56 Favored 'General case' 0 C--N 1.312 -1.053 0 CA-C-N 115.972 -0.558 . . . . 0.0 111.769 -177.336 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 37' ' ' CYS . . . . . . . . . . . . . 94.4 m -91.95 10.91 26.92 Favored 'General case' 0 C--N 1.312 -1.058 0 N-CA-C 113.173 0.805 . . . . 0.0 113.173 -179.163 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 38' ' ' GLY . . . . . . . . . . . . . . . 69.87 48.61 40.33 Favored Glycine 0 CA--C 1.524 0.645 0 N-CA-C 115.761 1.064 . . . . 0.0 115.761 172.908 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 39' ' ' PHE . . . . . 0.468 ' CD2' ' HA ' ' A' ' 34' ' ' PRO . 93.1 m-85 -96.32 -40.1 9.3 Favored 'General case' 0 C--N 1.303 -1.424 0 N-CA-C 107.749 -1.204 . . . . 0.0 107.749 173.183 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 40' ' ' CYS . . . . . . . . . . . . . 49.8 t . . . . . 0 C--N 1.309 -1.156 0 N-CA-C 107.878 -1.156 . . . . 0.0 107.878 179.868 . . . . . . . . 0 0 . 1 . 003 nuclear orig core ' A' A ' 4' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.501 -0.905 0 N-CA-C 108.64 -0.874 . . . . 0.0 108.64 . . . . . . . . . 0 0 . 1 . 003 nuclear orig core ' A' A ' 5' ' ' ASP . . . . . 0.573 ' HB3' ' SG ' ' A' ' 11' ' ' CYS . 44.4 m-20 -60.69 141.62 56.63 Favored 'General case' 0 C--N 1.317 -0.825 0 O-C-N 123.733 0.645 . . . . 0.0 110.2 178.945 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 13.3 tp10 -64.11 140.39 58.86 Favored 'General case' 0 N--CA 1.443 -0.825 0 C-N-CA 123.682 0.793 . . . . 0.0 111.543 -178.95 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 7' ' ' LYS . . . . . . . . . . . . . 10.3 ptpp? -85.18 -29.97 24.3 Favored 'General case' 0 N--CA 1.441 -0.905 0 C-N-CA 124.353 1.061 . . . . 0.0 111.227 -176.498 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 8' ' ' ASN . . . . . . . . . . . . . 44.9 m-80 -86.74 -9.17 56.52 Favored 'General case' 0 C--N 1.308 -1.208 0 CA-C-O 121.817 0.818 . . . . 0.0 110.83 -178.497 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 9' ' ' PHE . . . . . . . . . . . . . 36.5 t80 -112.16 144.96 40.68 Favored 'General case' 0 C--N 1.287 -2.12 0 N-CA-C 105.524 -2.028 . . . . 0.0 105.524 -178.834 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 10' ' ' ASP . . . . . . . . . . . . . 15.3 t70 -104.49 98.77 8.49 Favored 'General case' 0 C--N 1.304 -1.403 0 C-N-CA 117.779 -1.568 . . . . 0.0 110.417 179.274 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 11' ' ' CYS . . . . . 0.573 ' SG ' ' HB3' ' A' ' 5' ' ' ASP . 76.1 m -68.33 -20.34 64.72 Favored 'General case' 0 C--N 1.304 -1.393 0 CA-C-N 114.51 -1.223 . . . . 0.0 112.274 -177.924 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 12' ' ' ARG . . . . . . . . . . . . . 7.3 mmt180 -76.6 -46.58 25.51 Favored 'General case' 0 C--N 1.315 -0.899 0 N-CA-C 107.628 -1.249 . . . . 0.0 107.628 -176.793 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 54.9 ttp180 -61.91 -40.95 97.25 Favored 'General case' 0 C--O 1.213 -0.846 0 CA-C-N 115.501 -0.772 . . . . 0.0 109.504 175.51 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 14' ' ' SER . . . . . . . . . . . . . 23.4 m -65.84 -28.02 68.67 Favored 'General case' 0 C--N 1.318 -0.773 0 CA-C-O 121.18 0.515 . . . . 0.0 111.252 179.01 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 2.3 tm? -77.56 -39.36 46.04 Favored 'General case' 0 C--N 1.316 -0.87 0 N-CA-C 107.803 -1.184 . . . . 0.0 107.803 177.267 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 16' ' ' ARG . . . . . . . . . . . . . 23.7 mtp180 -68.24 -44.89 74.65 Favored 'General case' 0 C--N 1.323 -0.548 0 CA-C-N 115.633 -0.712 . . . . 0.0 111.817 179.326 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 17' ' ' ASN . . . . . . . . . . . . . 85.3 m-20 -64.96 -37.95 89.35 Favored 'General case' 0 CA--C 1.496 -1.131 0 CA-C-O 121.67 0.747 . . . . 0.0 109.111 177.164 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . 107.74 5.45 33.63 Favored Glycine 0 N--CA 1.416 -2.657 0 CA-C-N 114.652 -1.158 . . . . 0.0 111.5 -179.122 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 19' ' ' ASP . . . . . . . . . . . . . 30.5 m-20 -57.9 -38.22 75.44 Favored 'General case' 0 N--CA 1.494 1.775 0 CA-C-O 121.618 0.723 . . . . 0.0 109.299 179.345 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 20' ' ' CYS . . . . . . . . . . . . . 44.5 t -61.45 -25.55 67.3 Favored 'General case' 0 C--N 1.31 -1.144 0 CA-C-N 114.198 -1.365 . . . . 0.0 111.982 -178.117 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 21' ' ' ASP . . . . . . . . . . . . . 28.5 t70 -111.28 -9.25 14.3 Favored 'General case' 0 C--N 1.319 -0.725 0 CA-C-O 121.646 0.736 . . . . 0.0 110.248 -179.194 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 22' ' ' ASN . . . . . . . . . . . . . 51.8 t-20 -75.54 119.51 19.7 Favored 'General case' 0 C--N 1.313 -0.996 0 CA-C-N 115.317 -0.856 . . . . 0.0 108.904 -177.272 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 23' ' ' ASP . . . . . . . . . . . . . 6.1 m-20 -54.06 -36.71 63.4 Favored 'General case' 0 CA--C 1.501 -0.914 0 C-N-CA 123.545 0.738 . . . . 0.0 112.505 -177.906 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 35.8 m-20 -72.62 -21.41 61.11 Favored 'General case' 0 C--N 1.308 -1.205 0 CA-C-N 115.969 -0.56 . . . . 0.0 111.504 -175.549 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 25' ' ' LYS . . . . . 0.525 ' O ' ' HG2' ' A' ' 29' ' ' MET . 13.3 mptt -104.6 -5.19 21.69 Favored 'General case' 0 C--N 1.311 -1.08 0 N-CA-C 112.1 0.407 . . . . 0.0 112.1 178.29 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 26' ' ' LEU . . . . . . . . . . . . . 62.8 mt -52.07 -38.88 58.63 Favored 'General case' 0 N--CA 1.479 0.981 0 N-CA-C 114.657 1.354 . . . . 0.0 114.657 -175.162 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 27' ' ' LEU . . . . . . . . . . . . . 29.6 tp -54.81 -52.72 61.82 Favored 'General case' 0 N--CA 1.44 -0.953 0 CA-C-O 121.048 0.451 . . . . 0.0 109.935 178.059 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 28' ' ' GLU . . . . . 0.492 ' HA ' ' CE2' ' A' ' 31' ' ' TYR . 43.6 mt-10 -65.2 -33.2 75.43 Favored 'General case' 0 N--CA 1.442 -0.829 0 CA-C-N 115.296 -0.865 . . . . 0.0 109.685 -178.197 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 29' ' ' MET . . . . . 0.525 ' HG2' ' O ' ' A' ' 25' ' ' LYS . 72.7 mmm -75.75 -26.54 57.5 Favored 'General case' 0 C--N 1.31 -1.151 0 CA-C-N 115.263 -0.88 . . . . 0.0 111.003 -174.71 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 30' ' ' GLY . . . . . 0.457 ' HA2' ' CE2' ' A' ' 39' ' ' PHE . . . -65.63 -37.31 93.45 Favored Glycine 0 CA--C 1.494 -1.232 0 O-C-N 123.944 0.778 . . . . 0.0 112.174 -178.955 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 31' ' ' TYR . . . . . 0.492 ' CE2' ' HA ' ' A' ' 28' ' ' GLU . 52.3 p90 -96.72 -34.74 11.24 Favored 'General case' 0 N--CA 1.433 -1.307 0 C-N-CA 119.697 -0.801 . . . . 0.0 112.755 178.901 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 32' ' ' TYR . . . . . . . . . . . . . 27.5 m-85 -69.71 -50.42 43.79 Favored 'General case' 0 C--N 1.312 -1.024 0 N-CA-C 112.954 0.724 . . . . 0.0 112.954 177.403 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 33' ' ' CYS . . . . . . . . . . . . . 29.8 m -130.45 69.58 82.16 Favored Pre-proline 0 C--O 1.259 1.574 0 C-N-CA 120.128 -0.629 . . . . 0.0 111.388 -175.836 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 34' ' ' PRO . . . . . . . . . . . . . 38.2 Cg_endo -65.28 -26.54 56.37 Favored 'Trans proline' 0 C--N 1.362 1.268 0 C-N-CA 122.429 2.086 . . . . 0.0 112.067 -177.944 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 35' ' ' VAL . . . . . . . . . . . . . 33.5 t -86.78 -49.89 14.52 Favored 'Isoleucine or valine' 0 N--CA 1.433 -1.302 0 CA-C-N 116.091 -0.504 . . . . 0.0 110.966 -176.198 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 36' ' ' THR . . . . . 0.475 ' HG1' ' CG ' ' A' ' 5' ' ' ASP . 29.0 m -55.68 -52.14 64.87 Favored 'General case' 0 C--N 1.316 -0.875 0 C-N-CA 123.28 0.632 . . . . 0.0 112.644 -177.685 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 37' ' ' CYS . . . . . 0.565 ' HB2' ' CE2' ' A' ' 39' ' ' PHE . 59.6 m -76.83 -11.43 59.83 Favored 'General case' 0 C--N 1.305 -1.333 0 N-CA-C 112.659 0.614 . . . . 0.0 112.659 -176.886 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 38' ' ' GLY . . . . . . . . . . . . . . . 88.97 46.78 4.38 Favored Glycine 0 N--CA 1.442 -0.96 0 C-N-CA 120.391 -0.909 . . . . 0.0 113.724 176.827 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 39' ' ' PHE . . . . . 0.565 ' CE2' ' HB2' ' A' ' 37' ' ' CYS . 98.1 m-85 -98.31 -59.88 1.66 Allowed 'General case' 0 C--N 1.308 -1.225 0 N-CA-C 108.51 -0.922 . . . . 0.0 108.51 176.374 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 40' ' ' CYS . . . . . . . . . . . . . 42.2 t . . . . . 0 C--N 1.307 -1.271 0 N-CA-C 108.05 -1.093 . . . . 0.0 108.05 -177.065 . . . . . . . . 0 0 . 1 . 004 nuclear orig core ' A' A ' 4' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.439 -1.015 0 N-CA-C 109.879 -0.415 . . . . 0.0 109.879 . . . . . . . . . 0 0 . 1 . 004 nuclear orig core ' A' A ' 5' ' ' ASP . . . . . 0.426 ' HA ' ' HD2' ' A' ' 34' ' ' PRO . 61.4 m-20 -66.24 149.8 49.79 Favored 'General case' 0 C--O 1.256 1.414 0 N-CA-C 109.174 -0.676 . . . . 0.0 109.174 176.182 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 10.4 tp10 -65.81 144.64 56.72 Favored 'General case' 0 C--N 1.302 -1.484 0 C-N-CA 123.665 0.786 . . . . 0.0 110.679 -179.243 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 7' ' ' LYS . . . . . . . . . . . . . 11.3 ptpp? -85.45 -25.78 26.72 Favored 'General case' 0 C--N 1.321 -0.631 0 CA-C-O 121.047 0.451 . . . . 0.0 111.927 -174.76 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 8' ' ' ASN . . . . . . . . . . . . . 10.7 p30 -98.05 5.33 48.83 Favored 'General case' 0 C--N 1.313 -0.992 0 CA-C-O 121.471 0.653 . . . . 0.0 111.11 -179.361 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 9' ' ' PHE . . . . . . . . . . . . . 39.2 t80 -120.99 141.01 51.11 Favored 'General case' 0 C--N 1.298 -1.659 0 N-CA-C 107.21 -1.404 . . . . 0.0 107.21 -178.731 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 10' ' ' ASP . . . . . . . . . . . . . 14.1 t70 -104.53 107.78 18.88 Favored 'General case' 0 N--CA 1.434 -1.231 0 C-N-CA 118.792 -1.163 . . . . 0.0 110.295 179.026 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 11' ' ' CYS . . . . . . . . . . . . . 72.1 m -78.01 -22.75 48.8 Favored 'General case' 0 C--N 1.278 -2.535 0 CA-C-N 114.748 -1.114 . . . . 0.0 112.997 -177.499 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 12' ' ' ARG . . . . . 0.438 ' O ' ' HG3' ' A' ' 16' ' ' ARG . 18.9 mmm180 -68.84 -45.25 71.62 Favored 'General case' 0 C--N 1.323 -0.545 0 N-CA-C 108.86 -0.793 . . . . 0.0 108.86 177.633 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 39.4 ttm180 -57.45 -48.77 78.29 Favored 'General case' 0 C--N 1.312 -1.037 0 CA-C-N 115.19 -0.914 . . . . 0.0 110.236 176.441 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 14' ' ' SER . . . . . . . . . . . . . 24.0 m -59.96 -35.09 74.21 Favored 'General case' 0 C--N 1.313 -1.0 0 CA-C-N 115.455 -0.793 . . . . 0.0 110.995 178.981 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 15' ' ' LEU . . . . . 0.406 ' HA ' ' HB3' ' A' ' 20' ' ' CYS . 35.0 tp -72.66 -40.87 65.98 Favored 'General case' 0 C--N 1.32 -0.699 0 CA-C-N 116.113 -0.494 . . . . 0.0 110.306 178.769 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 16' ' ' ARG . . . . . 0.438 ' HG3' ' O ' ' A' ' 12' ' ' ARG . 97.8 mtt180 -68.29 -31.45 70.89 Favored 'General case' 0 C--N 1.316 -0.867 0 N-CA-C 112.44 0.533 . . . . 0.0 112.44 -179.889 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 17' ' ' ASN . . . . . . . . . . . . . 40.4 m-80 -88.7 -24.16 22.79 Favored 'General case' 0 CA--C 1.497 -1.088 0 N-CA-C 113.353 0.871 . . . . 0.0 113.353 -177.384 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . 110.42 5.11 28.39 Favored Glycine 0 C--N 1.301 -1.365 0 C-N-CA 119.044 -1.55 . . . . 0.0 112.834 178.654 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 19' ' ' ASP . . . . . . . . . . . . . 21.5 m-20 -70.23 -32.64 70.6 Favored 'General case' 0 CA--C 1.498 -1.025 0 CA-C-O 121.429 0.633 . . . . 0.0 109.564 -179.697 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 20' ' ' CYS . . . . . 0.406 ' HB3' ' HA ' ' A' ' 15' ' ' LEU . 45.4 t -78.5 -11.91 59.98 Favored 'General case' 0 C--N 1.304 -1.388 0 CA-C-N 114.624 -1.171 . . . . 0.0 110.419 -178.694 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 21' ' ' ASP . . . . . . . . . . . . . 26.5 t70 -106.33 -10.26 16.44 Favored 'General case' 0 C--N 1.319 -0.741 0 CA-C-O 121.651 0.739 . . . . 0.0 110.167 -179.531 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 22' ' ' ASN . . . . . 0.402 ' O ' ' HG ' ' A' ' 26' ' ' LEU . 25.9 t-20 -86.13 121.62 28.99 Favored 'General case' 0 C--N 1.302 -1.483 0 CA-C-N 115.237 -0.892 . . . . 0.0 109.984 -175.332 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 23' ' ' ASP . . . . . . . . . . . . . 24.7 t70 -61.18 -38.47 86.62 Favored 'General case' 0 C--N 1.32 -0.704 0 O-C-N 123.576 0.548 . . . . 0.0 112.453 -174.757 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 13.8 m-20 -64.8 -32.67 74.46 Favored 'General case' 0 N--CA 1.482 1.164 0 CA-C-O 121.466 0.651 . . . . 0.0 110.814 179.235 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 25' ' ' LYS . . . . . 0.457 ' O ' ' HG2' ' A' ' 29' ' ' MET . 13.5 mmmm -88.11 -11.49 46.86 Favored 'General case' 0 C--N 1.311 -1.073 0 CA-C-N 115.671 -0.695 . . . . 0.0 111.605 -177.162 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 26' ' ' LEU . . . . . 0.402 ' HG ' ' O ' ' A' ' 22' ' ' ASN . 60.1 mt -58.1 -31.25 66.95 Favored 'General case' 0 C--O 1.221 -0.422 0 N-CA-C 114.132 1.16 . . . . 0.0 114.132 -176.421 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 27' ' ' LEU . . . . . . . . . . . . . 34.3 tp -56.35 -52.03 66.07 Favored 'General case' 0 N--CA 1.44 -0.955 0 CA-C-O 121.441 0.639 . . . . 0.0 109.356 176.445 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 28' ' ' GLU . . . . . 0.539 ' HA ' ' CE2' ' A' ' 31' ' ' TYR . 44.5 mt-10 -65.93 -31.83 72.98 Favored 'General case' 0 N--CA 1.434 -1.246 0 CA-C-N 114.679 -1.146 . . . . 0.0 109.606 179.884 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 29' ' ' MET . . . . . 0.457 ' HG2' ' O ' ' A' ' 25' ' ' LYS . 22.2 mmt -74.21 -24.77 59.38 Favored 'General case' 0 C--O 1.196 -1.754 0 CA-C-N 115.924 -0.58 . . . . 0.0 110.193 -176.623 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 30' ' ' GLY . . . . . . . . . . . . . . . -71.01 -25.47 75.71 Favored Glycine 0 N--CA 1.448 -0.501 0 C-N-CA 120.501 -0.857 . . . . 0.0 112.046 -179.489 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 31' ' ' TYR . . . . . 0.539 ' CE2' ' HA ' ' A' ' 28' ' ' GLU . 52.7 p90 -105.33 -34.65 7.79 Favored 'General case' 0 N--CA 1.429 -1.482 0 C-N-CA 119.342 -0.943 . . . . 0.0 113.142 176.921 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 32' ' ' TYR . . . . . . . . . . . . . 32.8 m-85 -74.11 -43.56 57.12 Favored 'General case' 0 C--N 1.302 -1.49 0 C-N-CA 120.8 -0.36 . . . . 0.0 111.964 176.075 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 33' ' ' CYS . . . . . . . . . . . . . 39.9 m -135.44 57.61 20.92 Favored Pre-proline 0 C--O 1.253 1.243 0 N-CA-C 112.889 0.7 . . . . 0.0 112.889 -172.799 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 34' ' ' PRO . . . . . 0.459 ' HA ' ' CD2' ' A' ' 39' ' ' PHE . 37.5 Cg_endo -64.19 -27.08 64.59 Favored 'Trans proline' 0 C--N 1.364 1.345 0 C-N-CA 121.874 1.716 . . . . 0.0 111.798 -179.041 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 35' ' ' VAL . . . . . . . . . . . . . 44.4 t -86.95 -56.48 5.24 Favored 'Isoleucine or valine' 0 N--CA 1.43 -1.448 0 CA-C-N 115.794 -0.639 . . . . 0.0 110.945 -177.197 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 36' ' ' THR . . . . . . . . . . . . . 97.4 m -59.27 -39.82 84.13 Favored 'General case' 0 CA--C 1.549 0.907 0 N-CA-C 112.738 0.644 . . . . 0.0 112.738 -177.217 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 37' ' ' CYS . . . . . . . . . . . . . 90.4 m -81.16 2.2 28.61 Favored 'General case' 0 C--N 1.31 -1.11 0 N-CA-C 113.235 0.828 . . . . 0.0 113.235 -179.843 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 38' ' ' GLY . . . . . . . . . . . . . . . 77.12 23.39 68.86 Favored Glycine 0 N--CA 1.447 -0.584 0 N-CA-C 114.901 0.721 . . . . 0.0 114.901 174.123 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 39' ' ' PHE . . . . . 0.459 ' CD2' ' HA ' ' A' ' 34' ' ' PRO . 97.9 m-85 -72.45 -51.17 21.43 Favored 'General case' 0 C--N 1.317 -0.828 0 N-CA-C 106.917 -1.512 . . . . 0.0 106.917 175.273 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 40' ' ' CYS . . . . . . . . . . . . . 51.3 t . . . . . 0 N--CA 1.43 -1.467 0 CA-C-N 114.168 -1.378 . . . . 0.0 108.028 178.433 . . . . . . . . 0 0 . 1 . 005 nuclear orig core ' A' A ' 4' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.427 -1.585 0 N-CA-C 108.107 -1.071 . . . . 0.0 108.107 . . . . . . . . . 0 0 . 1 . 005 nuclear orig core ' A' A ' 5' ' ' ASP . . . . . 0.627 ' OD2' ' HB ' ' A' ' 35' ' ' VAL . 11.0 m-20 -60.89 146.21 47.4 Favored 'General case' 0 C--N 1.316 -0.857 0 N-CA-C 109.407 -0.59 . . . . 0.0 109.407 175.124 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 9.7 tp10 -72.15 142.03 49.1 Favored 'General case' 0 C--N 1.31 -1.15 0 C-N-CA 123.077 0.551 . . . . 0.0 111.006 -178.781 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 7' ' ' LYS . . . . . . . . . . . . . 18.3 ptmt -85.72 -27.87 25.0 Favored 'General case' 0 C--N 1.326 -0.416 0 CA-C-O 122.32 1.057 . . . . 0.0 110.812 179.663 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 8' ' ' ASN . . . . . . . . . . . . . 19.5 m120 -88.06 15.76 6.96 Favored 'General case' 0 C--N 1.305 -1.365 0 CA-C-N 114.819 -1.082 . . . . 0.0 110.616 -178.713 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 9' ' ' PHE . . . . . . . . . . . . . 40.3 t80 -142.17 143.24 32.87 Favored 'General case' 0 N--CA 1.414 -2.255 0 N-CA-C 104.59 -2.374 . . . . 0.0 104.59 179.275 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 10' ' ' ASP . . . . . 0.411 ' OD1' ' HD3' ' A' ' 12' ' ' ARG . 20.1 t70 -104.7 104.0 13.72 Favored 'General case' 0 C--N 1.302 -1.458 0 C-N-CA 118.144 -1.422 . . . . 0.0 111.009 179.062 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 11' ' ' CYS . . . . . 0.493 ' SG ' ' HB3' ' A' ' 5' ' ' ASP . 71.7 m -71.32 -16.2 62.44 Favored 'General case' 0 C--N 1.301 -1.511 0 CA-C-N 115.073 -0.967 . . . . 0.0 113.562 -177.885 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 12' ' ' ARG . . . . . 0.412 ' O ' ' HG3' ' A' ' 16' ' ' ARG . 3.9 mpt_? -70.5 -51.22 30.44 Favored 'General case' 0 CA--C 1.493 -1.215 0 N-CA-C 106.62 -1.622 . . . . 0.0 106.62 178.533 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 41.3 ttm180 -49.77 -53.01 27.67 Favored 'General case' 0 C--N 1.319 -0.725 0 CA-C-N 114.168 -1.378 . . . . 0.0 110.513 175.905 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 14' ' ' SER . . . . . . . . . . . . . 12.2 m -55.18 -38.76 68.75 Favored 'General case' 0 C--O 1.253 1.283 0 CA-C-N 115.923 -0.581 . . . . 0.0 111.691 179.748 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 15' ' ' LEU . . . . . 0.409 ' HA ' ' HB3' ' A' ' 20' ' ' CYS . 30.6 tp -79.03 -36.94 40.28 Favored 'General case' 0 C--N 1.327 -0.393 0 CA-C-N 116.436 -0.347 . . . . 0.0 111.008 -178.323 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 16' ' ' ARG . . . . . 0.412 ' HG3' ' O ' ' A' ' 12' ' ' ARG . 98.4 mtt180 -65.92 -37.23 85.54 Favored 'General case' 0 C--N 1.315 -0.895 0 CA-C-O 121.296 0.569 . . . . 0.0 110.707 177.966 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 17' ' ' ASN . . . . . . . . . . . . . 91.9 m-20 -76.0 -43.32 44.84 Favored 'General case' 0 CA--C 1.494 -1.201 0 CA-C-N 115.771 -0.649 . . . . 0.0 110.531 179.152 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . 112.94 7.36 21.76 Favored Glycine 0 C--N 1.297 -1.635 0 C-N-CA 119.882 -1.151 . . . . 0.0 111.783 177.794 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 19' ' ' ASP . . . . . . . . . . . . . 12.7 m-20 -68.87 -31.81 71.02 Favored 'General case' 0 C--O 1.212 -0.906 0 N-CA-C 108.267 -1.012 . . . . 0.0 108.267 177.918 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 20' ' ' CYS . . . . . 0.409 ' HB3' ' HA ' ' A' ' 15' ' ' LEU . 45.3 t -69.84 -10.06 57.04 Favored 'General case' 0 C--N 1.309 -1.179 0 CA-C-N 114.076 -1.42 . . . . 0.0 111.272 -179.264 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 21' ' ' ASP . . . . . . . . . . . . . 35.1 t70 -116.69 -8.92 11.38 Favored 'General case' 0 N--CA 1.468 0.43 0 CA-C-O 121.446 0.641 . . . . 0.0 110.388 -179.597 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 22' ' ' ASN . . . . . 0.481 ' O ' ' HG ' ' A' ' 26' ' ' LEU . 34.5 t30 -87.83 128.9 35.34 Favored 'General case' 0 C--N 1.324 -0.541 0 CA-C-N 115.575 -0.739 . . . . 0.0 111.706 -175.925 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 23' ' ' ASP . . . . . . . . . . . . . 5.6 p-10 -52.05 -43.94 64.04 Favored 'General case' 0 C--O 1.241 0.622 0 C-N-CA 124.84 1.256 . . . . 0.0 113.826 -176.057 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 2.8 p30 -74.17 -13.86 60.87 Favored 'General case' 0 N--CA 1.473 0.714 0 C-N-CA 120.331 -0.548 . . . . 0.0 112.404 -176.272 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 25' ' ' LYS . . . . . 0.464 ' O ' ' HG2' ' A' ' 29' ' ' MET . 46.5 mmtm -100.05 -13.35 19.07 Favored 'General case' 0 C--N 1.309 -1.17 0 C-N-CA 120.916 -0.314 . . . . 0.0 110.898 179.795 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 26' ' ' LEU . . . . . 0.481 ' HG ' ' O ' ' A' ' 22' ' ' ASN . 84.6 mt -56.67 -40.96 76.46 Favored 'General case' 0 C--O 1.2 -1.528 0 N-CA-C 115.4 1.63 . . . . 0.0 115.4 -171.707 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 27' ' ' LEU . . . . . . . . . . . . . 20.1 tp -61.01 -44.83 96.84 Favored 'General case' 0 N--CA 1.442 -0.851 0 CA-C-N 119.042 0.837 . . . . 0.0 110.007 -179.377 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 28' ' ' GLU . . . . . 0.493 ' HA ' ' CE1' ' A' ' 31' ' ' TYR . 40.1 tt0 -65.6 -34.27 77.84 Favored 'General case' 0 C--O 1.242 0.695 0 CA-C-N 115.431 -0.804 . . . . 0.0 108.969 178.945 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 29' ' ' MET . . . . . 0.464 ' HG2' ' O ' ' A' ' 25' ' ' LYS . 25.0 mmt -75.22 -23.58 57.6 Favored 'General case' 0 C--O 1.202 -1.434 0 CA-C-N 114.844 -1.071 . . . . 0.0 109.488 -178.365 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 30' ' ' GLY . . . . . . . . . . . . . . . -62.45 -40.75 99.48 Favored Glycine 0 N--CA 1.436 -1.325 0 CA-C-N 116.165 -0.471 . . . . 0.0 111.947 -179.678 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 31' ' ' TYR . . . . . 0.493 ' CE1' ' HA ' ' A' ' 28' ' ' GLU . 29.7 p90 -93.29 -35.8 12.89 Favored 'General case' 0 C--N 1.305 -1.367 0 C-N-CA 119.704 -0.799 . . . . 0.0 112.859 179.03 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 32' ' ' TYR . . . . . . . . . . . . . 24.8 m-85 -73.12 -44.54 60.09 Favored 'General case' 0 C--N 1.309 -1.156 0 N-CA-C 114.173 1.175 . . . . 0.0 114.173 178.076 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 33' ' ' CYS . . . . . . . . . . . . . 62.3 m -138.19 60.72 23.42 Favored Pre-proline 0 C--N 1.308 -1.214 0 N-CA-C 111.596 0.221 . . . . 0.0 111.596 -175.602 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 34' ' ' PRO . . . . . 0.437 ' HD2' ' HA ' ' A' ' 5' ' ' ASP . 32.1 Cg_endo -63.22 -29.57 73.61 Favored 'Trans proline' 0 C--N 1.363 1.305 0 C-N-CA 122.008 1.805 . . . . 0.0 112.279 -176.927 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 35' ' ' VAL . . . . . 0.627 ' HB ' ' OD2' ' A' ' 5' ' ' ASP . 43.3 t -87.35 -46.36 16.13 Favored 'Isoleucine or valine' 0 N--CA 1.428 -1.549 0 CA-C-N 116.149 -0.478 . . . . 0.0 111.656 -175.835 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 36' ' ' THR . . . . . . . . . . . . . 22.1 m -65.23 -38.6 90.91 Favored 'General case' 0 C--N 1.315 -0.892 0 CA-C-N 116.119 -0.491 . . . . 0.0 111.228 -178.8 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 37' ' ' CYS . . . . . 0.417 ' SG ' ' HB3' ' A' ' 29' ' ' MET . 76.4 m -84.73 0.99 48.59 Favored 'General case' 0 C--N 1.316 -0.88 0 N-CA-C 112.845 0.683 . . . . 0.0 112.845 -178.978 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 38' ' ' GLY . . . . . . . . . . . . . . . 81.61 21.31 62.16 Favored Glycine 0 N--CA 1.448 -0.533 0 N-CA-C 116.028 1.171 . . . . 0.0 116.028 172.777 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 39' ' ' PHE . . . . . . . . . . . . . 97.4 m-85 -73.53 -44.64 57.11 Favored 'General case' 0 CA--C 1.501 -0.904 0 N-CA-C 107.481 -1.303 . . . . 0.0 107.481 175.021 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 40' ' ' CYS . . . . . . . . . . . . . 61.5 m . . . . . 0 C--N 1.295 -1.765 0 CA-C-N 114.237 -1.347 . . . . 0.0 108.088 176.591 . . . . . . . . 0 0 . 1 . 006 nuclear orig core ' A' A ' 4' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.429 -1.501 0 N-CA-C 107.487 -1.301 . . . . 0.0 107.487 . . . . . . . . . 0 0 . 1 . 006 nuclear orig core ' A' A ' 5' ' ' ASP . . . . . 0.521 ' OD2' ' HB ' ' A' ' 35' ' ' VAL . 11.7 m-20 -65.15 155.63 34.28 Favored 'General case' 0 C--N 1.313 -1.021 0 O-C-N 123.517 0.511 . . . . 0.0 110.476 -179.654 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 0.5 OUTLIER -84.39 151.12 24.89 Favored 'General case' 0 C--N 1.306 -1.317 0 N-CA-C 108.278 -1.008 . . . . 0.0 108.278 179.824 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 7' ' ' LYS . . . . . . . . . . . . . 7.2 ptpp? -85.4 -36.31 20.77 Favored 'General case' 0 C--N 1.316 -0.852 0 N-CA-C 112.89 0.7 . . . . 0.0 112.89 -174.141 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 8' ' ' ASN . . . . . . . . . . . . . 92.3 m-20 -87.12 -29.37 21.88 Favored 'General case' 0 C--N 1.294 -1.825 0 N-CA-C 109.493 -0.558 . . . . 0.0 109.493 -176.58 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 9' ' ' PHE . . . . . . . . . . . . . 29.0 t80 -69.55 137.45 52.43 Favored 'General case' 0 N--CA 1.434 -1.249 0 N-CA-C 108.163 -1.051 . . . . 0.0 108.163 176.861 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 10' ' ' ASP . . . . . . . . . . . . . 45.7 t0 -91.62 92.97 8.71 Favored 'General case' 0 C--N 1.304 -1.394 0 CA-C-O 121.55 0.69 . . . . 0.0 110.082 -178.259 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 11' ' ' CYS . . . . . . . . . . . . . 66.3 m -73.08 -34.44 66.23 Favored 'General case' 0 C--N 1.302 -1.491 0 CA-C-N 115.283 -0.871 . . . . 0.0 111.114 -179.108 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 12' ' ' ARG . . . . . . . . . . . . . 21.9 mmt180 -69.03 -49.69 55.37 Favored 'General case' 0 CA--C 1.516 -0.364 0 CA-C-O 120.88 0.371 . . . . 0.0 111.045 -175.761 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 8.7 ttp180 -66.36 -41.26 89.75 Favored 'General case' 0 C--N 1.309 -1.176 0 CA-C-N 116.12 -0.491 . . . . 0.0 110.971 179.637 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 14' ' ' SER . . . . . . . . . . . . . 50.2 m -60.92 -36.46 79.37 Favored 'General case' 0 C--O 1.251 1.156 0 CA-C-O 121.538 0.685 . . . . 0.0 110.594 177.429 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 54.8 tp -66.27 -43.55 86.09 Favored 'General case' 0 C--N 1.325 -0.488 0 CA-C-N 115.478 -0.783 . . . . 0.0 109.975 177.568 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 16' ' ' ARG . . . . . . . . . . . . . 81.7 mtp180 -69.63 -32.99 71.99 Favored 'General case' 0 C--N 1.315 -0.926 0 CA-C-N 116.175 -0.466 . . . . 0.0 112.239 178.965 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 17' ' ' ASN . . . . . . . . . . . . . 88.0 m-20 -68.43 -47.4 67.3 Favored 'General case' 0 CA--C 1.501 -0.911 0 CA-C-O 121.663 0.744 . . . . 0.0 110.547 -179.394 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . 123.66 11.89 4.79 Favored Glycine 0 N--CA 1.429 -1.788 0 N-CA-C 110.67 -0.972 . . . . 0.0 110.67 -174.655 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 19' ' ' ASP . . . . . . . . . . . . . 32.4 m-20 -71.09 -33.0 69.77 Favored 'General case' 0 CA--C 1.505 -0.786 0 N-CA-C 108.861 -0.792 . . . . 0.0 108.861 179.512 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 20' ' ' CYS . . . . . . . . . . . . . 53.4 t -82.81 0.24 44.77 Favored 'General case' 0 C--N 1.31 -1.12 0 CA-C-N 114.589 -1.187 . . . . 0.0 110.345 -178.084 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 21' ' ' ASP . . . . . . . . . . . . . 20.9 t70 -115.85 -10.49 11.68 Favored 'General case' 0 C--N 1.315 -0.932 0 CA-C-N 115.716 -0.674 . . . . 0.0 109.604 178.502 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 22' ' ' ASN . . . . . 0.449 ' O ' ' HG ' ' A' ' 26' ' ' LEU . 37.3 t-20 -87.8 121.78 30.64 Favored 'General case' 0 C--N 1.319 -0.758 0 CA-C-N 115.832 -0.622 . . . . 0.0 110.408 -177.057 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 23' ' ' ASP . . . . . . . . . . . . . 28.6 t70 -50.77 -46.67 59.59 Favored 'General case' 0 C--N 1.317 -0.806 0 C-N-CA 124.821 1.248 . . . . 0.0 113.379 -177.726 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 48.6 m-20 -64.66 -36.13 83.26 Favored 'General case' 0 N--CA 1.476 0.839 0 CA-C-O 121.365 0.602 . . . . 0.0 110.485 -177.927 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 25' ' ' LYS . . . . . . . . . . . . . 13.7 mptt -84.65 -12.38 54.05 Favored 'General case' 0 C--N 1.311 -1.078 0 CA-C-N 115.334 -0.848 . . . . 0.0 112.663 -175.946 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 26' ' ' LEU . . . . . 0.449 ' HG ' ' O ' ' A' ' 22' ' ' ASN . 74.7 mt -58.04 -36.08 72.23 Favored 'General case' 0 C--O 1.22 -0.496 0 N-CA-C 112.264 0.468 . . . . 0.0 112.264 -178.206 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 27' ' ' LEU . . . . . . . . . . . . . 26.2 tp -57.09 -50.64 72.15 Favored 'General case' 0 N--CA 1.437 -1.119 0 N-CA-C 109.906 -0.405 . . . . 0.0 109.906 176.899 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 28' ' ' GLU . . . . . 0.517 ' HA ' ' CE1' ' A' ' 31' ' ' TYR . 43.8 tt0 -64.48 -31.6 72.88 Favored 'General case' 0 C--O 1.244 0.781 0 CA-C-N 115.483 -0.781 . . . . 0.0 109.824 -179.742 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 29' ' ' MET . . . . . 0.4 ' HE3' ' HA ' ' A' ' 29' ' ' MET . 0.3 OUTLIER -73.4 -30.68 63.42 Favored 'General case' 0 C--O 1.207 -1.14 0 CA-C-N 115.009 -0.996 . . . . 0.0 109.84 -177.752 . . . . . . . . 3 3 . 1 . 006 nuclear orig core ' A' A ' 30' ' ' GLY . . . . . . . . . . . . . . . -65.15 -29.35 75.11 Favored Glycine 0 N--CA 1.444 -0.779 0 O-C-N 123.621 0.576 . . . . 0.0 112.886 -179.262 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 31' ' ' TYR . . . . . 0.517 ' CE1' ' HA ' ' A' ' 28' ' ' GLU 0.266 39.9 p90 -100.09 -37.51 8.93 Favored 'General case' 0 N--CA 1.438 -1.074 0 N-CA-C 113.791 1.034 . . . . 0.0 113.791 178.432 . . . . . . . . 3 3 . 1 . 006 nuclear orig core ' A' A ' 32' ' ' TYR . . . . . . . . . . . . . 29.2 m-85 -74.26 -48.56 27.84 Favored 'General case' 0 C--N 1.303 -1.415 0 N-CA-C 113.765 1.024 . . . . 0.0 113.765 177.472 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 33' ' ' CYS . . . . . . . . . . . . . 36.3 m -135.52 66.78 65.4 Favored Pre-proline 0 C--N 1.308 -1.234 0 C-N-CA 120.436 -0.505 . . . . 0.0 110.871 -177.024 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 34' ' ' PRO . . . . . 0.413 ' HD2' ' HA ' ' A' ' 5' ' ' ASP . 46.7 Cg_endo -65.99 -24.77 52.48 Favored 'Trans proline' 0 C--N 1.362 1.285 0 C-N-CA 122.404 2.07 . . . . 0.0 112.135 -176.624 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 35' ' ' VAL . . . . . 0.521 ' HB ' ' OD2' ' A' ' 5' ' ' ASP . 54.7 t -86.59 -46.87 16.45 Favored 'Isoleucine or valine' 0 C--N 1.302 -1.494 0 C-N-CA 120.479 -0.489 . . . . 0.0 110.787 -177.16 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 36' ' ' THR . . . . . . . . . . . . . 30.8 m -56.75 -39.57 74.23 Favored 'General case' 0 CA--C 1.55 0.946 0 CA-C-O 121.343 0.592 . . . . 0.0 111.587 179.986 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 37' ' ' CYS . . . . . . . . . . . . . 94.7 m -88.73 4.35 47.7 Favored 'General case' 0 C--N 1.309 -1.156 0 N-CA-C 113.251 0.834 . . . . 0.0 113.251 179.239 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 38' ' ' GLY . . . . . . . . . . . . . . . 72.12 35.89 60.64 Favored Glycine 0 C--O 1.222 -0.596 0 N-CA-C 115.599 0.999 . . . . 0.0 115.599 174.375 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 39' ' ' PHE . . . . . . . . . . . . . 98.4 m-85 -86.77 -37.59 17.7 Favored 'General case' 0 C--N 1.311 -1.108 0 N-CA-C 107.713 -1.218 . . . . 0.0 107.713 174.361 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 40' ' ' CYS . . . . . . . . . . . . . 69.3 m . . . . . 0 C--N 1.304 -1.407 0 CA-C-N 114.167 -1.378 . . . . 0.0 108.775 179.762 . . . . . . . . 0 0 . 1 . 007 nuclear orig core ' A' A ' 4' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.437 -1.106 0 N-CA-C 109.595 -0.52 . . . . 0.0 109.595 . . . . . . . . . 0 0 . 1 . 007 nuclear orig core ' A' A ' 5' ' ' ASP . . . . . 0.522 ' HB3' ' SG ' ' A' ' 11' ' ' CYS . 23.7 m-20 -58.83 143.18 48.24 Favored 'General case' 0 C--N 1.314 -0.971 0 O-C-N 124.05 0.843 . . . . 0.0 111.81 178.461 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 10.0 tp10 -70.59 135.67 48.64 Favored 'General case' 0 N--CA 1.443 -0.818 0 C-N-CA 123.495 0.718 . . . . 0.0 110.312 178.004 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 7' ' ' LYS . . . . . . . . . . . . . 9.9 ptpp? -85.71 -20.66 29.01 Favored 'General case' 0 C--N 1.314 -0.977 0 CA-C-O 121.386 0.612 . . . . 0.0 111.041 -178.741 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 8' ' ' ASN . . . . . . . . . . . . . 13.7 m120 -86.71 16.83 4.38 Favored 'General case' 0 C--N 1.311 -1.07 0 CA-C-O 121.789 0.804 . . . . 0.0 110.157 -179.193 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 9' ' ' PHE . . . . . 0.455 ' HD1' ' SG ' ' A' ' 33' ' ' CYS . 36.8 t80 -144.87 144.09 30.93 Favored 'General case' 0 N--CA 1.418 -2.03 0 N-CA-C 105.633 -1.988 . . . . 0.0 105.633 -178.425 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 10' ' ' ASP . . . . . . . . . . . . . 19.7 t70 -100.51 102.62 13.84 Favored 'General case' 0 C--N 1.313 -0.986 0 C-N-CA 118.941 -1.104 . . . . 0.0 110.603 178.088 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 11' ' ' CYS . . . . . 0.522 ' SG ' ' HB3' ' A' ' 5' ' ' ASP . 60.8 m -66.09 -31.79 72.86 Favored 'General case' 0 C--N 1.294 -1.814 0 CA-C-N 114.083 -1.417 . . . . 0.0 112.776 -175.711 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 12' ' ' ARG . . . . . . . . . . . . . 37.6 mmt180 -66.0 -50.46 64.18 Favored 'General case' 0 CA--C 1.514 -0.416 0 N-CA-C 109.711 -0.477 . . . . 0.0 109.711 179.684 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 38.6 ttm180 -53.51 -56.45 16.9 Favored 'General case' 0 C--N 1.322 -0.622 0 C-N-CA 124.741 1.216 . . . . 0.0 111.775 -178.24 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 14' ' ' SER . . . . . . . . . . . . . 20.1 m -61.22 -35.15 76.44 Favored 'General case' 0 C--O 1.249 1.066 0 CA-C-O 120.948 0.404 . . . . 0.0 111.818 -178.101 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 1.3 tm? -68.65 -41.42 79.37 Favored 'General case' 0 CA--C 1.544 0.72 0 N-CA-C 108.098 -1.075 . . . . 0.0 108.098 179.439 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 16' ' ' ARG . . . . . . . . . . . . . 73.8 mtp180 -64.19 -45.99 85.94 Favored 'General case' 0 N--CA 1.467 0.416 0 CA-C-N 115.546 -0.752 . . . . 0.0 111.702 178.593 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 17' ' ' ASN . . . . . . . . . . . . . 73.3 m-20 -61.09 -33.63 73.66 Favored 'General case' 0 N--CA 1.485 1.305 0 CA-C-O 121.652 0.739 . . . . 0.0 110.942 -178.734 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . 103.29 19.07 13.03 Favored Glycine 0 N--CA 1.429 -1.824 0 N-CA-C 110.027 -1.229 . . . . 0.0 110.027 -178.06 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 19' ' ' ASP . . . . . . . . . . . . . 52.6 m-20 -70.04 -28.59 65.59 Favored 'General case' 0 C--O 1.213 -0.827 0 CA-C-O 120.85 0.357 . . . . 0.0 110.549 -178.403 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 20' ' ' CYS . . . . . . . . . . . . . 23.8 t -84.26 -5.28 59.24 Favored 'General case' 0 C--N 1.317 -0.835 0 CA-C-O 121.578 0.704 . . . . 0.0 109.697 -179.173 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 21' ' ' ASP . . . . . . . . . . . . . 29.7 t70 -98.55 -11.24 22.39 Favored 'General case' 0 C--N 1.314 -0.964 0 N-CA-C 108.686 -0.857 . . . . 0.0 108.686 175.016 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 22' ' ' ASN . . . . . . . . . . . . . 35.5 t30 -88.54 123.64 33.24 Favored 'General case' 0 C--N 1.316 -0.856 0 CA-C-N 115.241 -0.89 . . . . 0.0 110.042 179.242 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 23' ' ' ASP . . . . . 0.432 ' HA ' ' HG ' ' A' ' 26' ' ' LEU . 21.7 t70 -58.68 -36.72 74.66 Favored 'General case' 0 C--N 1.323 -0.581 0 C-N-CA 122.969 0.507 . . . . 0.0 111.957 -178.163 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 27.2 t70 -62.97 -24.81 68.07 Favored 'General case' 0 N--CA 1.475 0.799 0 CA-C-N 115.969 -0.559 . . . . 0.0 111.732 179.5 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 25' ' ' LYS . . . . . . . . . . . . . 69.3 mmtt -111.96 10.24 20.54 Favored 'General case' 0 N--CA 1.442 -0.852 0 N-CA-C 113.101 0.778 . . . . 0.0 113.101 -177.807 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 26' ' ' LEU . . . . . 0.432 ' HG ' ' HA ' ' A' ' 23' ' ' ASP . 65.9 mt -62.76 -46.56 87.49 Favored 'General case' 0 C--N 1.314 -0.941 0 N-CA-C 112.886 0.698 . . . . 0.0 112.886 -179.929 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 27' ' ' LEU . . . . . . . . . . . . . 2.7 mm? -65.13 -42.69 93.64 Favored 'General case' 0 CA--C 1.48 -1.714 0 N-CA-C 108.508 -0.923 . . . . 0.0 108.508 -179.237 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 28' ' ' GLU . . . . . 0.53 ' HA ' ' CE1' ' A' ' 31' ' ' TYR . 38.6 tt0 -58.45 -36.97 74.49 Favored 'General case' 0 N--CA 1.442 -0.848 0 O-C-N 124.346 1.029 . . . . 0.0 109.932 -179.492 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 29' ' ' MET . . . . . . . . . . . . . 78.2 mmm -80.33 -27.6 38.33 Favored 'General case' 0 N--CA 1.429 -1.512 0 CA-C-N 115.936 -0.575 . . . . 0.0 111.216 -178.204 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 30' ' ' GLY . . . . . . . . . . . . . . . -75.33 -44.64 21.62 Favored Glycine 0 N--CA 1.43 -1.708 0 CA-C-N 115.526 -0.761 . . . . 0.0 111.673 178.065 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 31' ' ' TYR . . . . . 0.53 ' CE1' ' HA ' ' A' ' 28' ' ' GLU 0.265 12.9 p90 -77.58 -32.33 53.62 Favored 'General case' 0 N--CA 1.436 -1.153 0 C-N-CA 119.592 -0.843 . . . . 0.0 113.166 -179.346 . . . . . . . . 3 3 . 1 . 007 nuclear orig core ' A' A ' 32' ' ' TYR . . . . . . . . . . . . . 22.6 m-85 -79.07 -54.36 6.09 Favored 'General case' 0 C--N 1.301 -1.505 0 N-CA-C 113.223 0.823 . . . . 0.0 113.223 175.409 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 33' ' ' CYS . . . . . 0.455 ' SG ' ' HD1' ' A' ' 9' ' ' PHE . 53.4 m -129.11 71.68 81.99 Favored Pre-proline 0 C--O 1.264 1.839 0 C-N-CA 120.152 -0.619 . . . . 0.0 111.956 -174.45 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 34' ' ' PRO . . . . . 0.467 ' HB2' ' SG ' ' A' ' 40' ' ' CYS . 48.7 Cg_endo -66.52 -25.91 47.58 Favored 'Trans proline' 0 C--N 1.362 1.285 0 C-N-CA 122.69 2.26 . . . . 0.0 112.163 -176.201 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 35' ' ' VAL . . . . . 0.495 ' HB ' ' OD1' ' A' ' 5' ' ' ASP . 22.0 t -87.04 -40.79 14.24 Favored 'Isoleucine or valine' 0 N--CA 1.425 -1.712 0 CA-C-N 116.162 -0.472 . . . . 0.0 110.844 -176.822 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 36' ' ' THR . . . . . . . . . . . . . 58.9 m -58.1 -43.65 87.21 Favored 'General case' 0 C--N 1.321 -0.662 0 C-N-CA 123.3 0.64 . . . . 0.0 112.097 -179.618 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 37' ' ' CYS . . . . . 0.524 ' HB2' ' CE2' ' A' ' 39' ' ' PHE . 88.7 m -87.51 6.76 32.56 Favored 'General case' 0 C--N 1.313 -0.991 0 C-N-CA 119.696 -0.802 . . . . 0.0 112.007 179.433 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 38' ' ' GLY . . . . . . . . . . . . . . . 64.43 45.91 91.92 Favored Glycine 0 N--CA 1.439 -1.158 0 CA-C-N 116.32 -0.4 . . . . 0.0 114.068 177.045 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 39' ' ' PHE . . . . . 0.524 ' CE2' ' HB2' ' A' ' 37' ' ' CYS . 98.2 m-85 -85.68 -49.89 7.62 Favored 'General case' 0 CA--C 1.498 -1.022 0 N-CA-C 107.247 -1.39 . . . . 0.0 107.247 173.805 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 40' ' ' CYS . . . . . 0.467 ' SG ' ' HB2' ' A' ' 34' ' ' PRO . 25.3 p . . . . . 0 N--CA 1.424 -1.744 0 CA-C-N 114.771 -1.104 . . . . 0.0 109.528 177.013 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 4' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.442 -0.832 0 N-CA-C 109.497 -0.557 . . . . 0.0 109.497 . . . . . . . . . 0 0 . 1 . 008 nuclear orig core ' A' A ' 5' ' ' ASP . . . . . 0.546 ' HB3' ' SG ' ' A' ' 11' ' ' CYS . 24.0 m-20 -65.49 149.56 49.83 Favored 'General case' 0 C--O 1.248 1.02 0 N-CA-C 108.887 -0.783 . . . . 0.0 108.887 174.683 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 10.8 tp10 -70.03 130.7 42.87 Favored 'General case' 0 C--N 1.301 -1.538 0 N-CA-C 109.409 -0.589 . . . . 0.0 109.409 178.734 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 7' ' ' LYS . . . . . . . . . . . . . 10.8 ptpp? -85.51 -20.02 30.32 Favored 'General case' 0 C--N 1.321 -0.653 0 CA-C-O 121.097 0.475 . . . . 0.0 110.895 -176.845 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 8' ' ' ASN . . . . . . . . . . . . . 89.2 m-20 -84.49 2.64 40.05 Favored 'General case' 0 C--N 1.316 -0.859 0 CA-C-N 115.465 -0.789 . . . . 0.0 110.053 179.16 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 9' ' ' PHE . . . . . . . . . . . . . 45.4 t80 -127.95 154.25 45.78 Favored 'General case' 0 C--N 1.303 -1.433 0 N-CA-C 107.773 -1.195 . . . . 0.0 107.773 -174.986 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 10' ' ' ASP . . . . . . . . . . . . . 9.3 t70 -104.9 101.26 10.85 Favored 'General case' 0 CA--C 1.493 -1.234 0 C-N-CA 118.624 -1.23 . . . . 0.0 110.647 178.195 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 11' ' ' CYS . . . . . 0.546 ' SG ' ' HB3' ' A' ' 5' ' ' ASP . 92.4 m -72.8 -25.52 61.18 Favored 'General case' 0 C--N 1.286 -2.163 0 CA-C-N 115.34 -0.845 . . . . 0.0 112.615 -178.286 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 12' ' ' ARG . . . . . 0.542 ' O ' ' HG2' ' A' ' 16' ' ' ARG . 28.0 mmm180 -70.07 -53.41 17.58 Favored 'General case' 0 C--N 1.318 -0.803 0 N-CA-C 110.045 -0.354 . . . . 0.0 110.045 -178.406 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 43.9 ttp180 -63.13 -37.49 87.4 Favored 'General case' 0 C--N 1.309 -1.166 0 CA-C-N 115.951 -0.568 . . . . 0.0 110.133 179.464 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 14' ' ' SER . . . . . . . . . . . . . 49.6 m -63.61 -32.79 74.37 Favored 'General case' 0 C--O 1.246 0.905 0 CA-C-O 121.261 0.553 . . . . 0.0 110.977 177.258 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 53.6 tp -70.94 -40.73 71.88 Favored 'General case' 0 N--CA 1.442 -0.845 0 N-CA-C 109.177 -0.675 . . . . 0.0 109.177 177.611 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 16' ' ' ARG . . . . . 0.542 ' HG2' ' O ' ' A' ' 12' ' ' ARG . 31.4 mmm180 -70.04 -33.76 72.38 Favored 'General case' 0 C--N 1.314 -0.971 0 CA-C-N 115.546 -0.752 . . . . 0.0 111.193 -178.942 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 17' ' ' ASN . . . . . . . . . . . . . 89.6 m-20 -71.05 -39.14 72.43 Favored 'General case' 0 CA--C 1.489 -1.376 0 CA-C-O 121.522 0.677 . . . . 0.0 110.428 -179.864 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . 114.02 8.61 17.39 Favored Glycine 0 N--CA 1.426 -1.973 0 CA-C-N 114.833 -1.076 . . . . 0.0 111.016 -177.178 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 19' ' ' ASP . . . . . . . . . . . . . 59.9 m-20 -66.92 -38.13 85.63 Favored 'General case' 0 CA--C 1.502 -0.883 0 CA-C-O 121.235 0.541 . . . . 0.0 109.893 -179.406 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 20' ' ' CYS . . . . . . . . . . . . . 42.7 t -73.32 -13.42 61.11 Favored 'General case' 0 C--N 1.311 -1.068 0 CA-C-N 114.997 -1.001 . . . . 0.0 110.752 -178.945 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 21' ' ' ASP . . . . . . . . . . . . . 27.6 t70 -109.78 -4.48 16.04 Favored 'General case' 0 C--N 1.313 -1.019 0 CA-C-O 121.893 0.854 . . . . 0.0 110.46 179.043 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 22' ' ' ASN . . . . . . . . . . . . . 39.8 t-20 -77.64 116.33 18.11 Favored 'General case' 0 C--N 1.314 -0.946 0 N-CA-C 109.2 -0.667 . . . . 0.0 109.2 -178.363 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 23' ' ' ASP . . . . . . . . . . . . . 17.6 m-20 -56.99 -43.82 82.09 Favored 'General case' 0 C--N 1.321 -0.642 0 CA-C-N 115.088 -0.96 . . . . 0.0 112.202 -174.611 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 33.7 t70 -66.33 -31.35 72.09 Favored 'General case' 0 C--N 1.324 -0.529 0 CA-C-O 121.023 0.439 . . . . 0.0 111.085 -178.156 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 25' ' ' LYS . . . . . 0.425 ' O ' ' HG2' ' A' ' 29' ' ' MET . 54.3 mtpt -95.89 -4.45 43.54 Favored 'General case' 0 C--O 1.209 -1.048 0 N-CA-C 112.386 0.513 . . . . 0.0 112.386 -177.555 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 26' ' ' LEU . . . . . . . . . . . . . 55.6 mt -48.3 -46.83 36.65 Favored 'General case' 0 N--CA 1.483 1.219 0 N-CA-C 114.705 1.372 . . . . 0.0 114.705 -178.602 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 27' ' ' LEU . . . . . . . . . . . . . 22.3 tp -59.17 -45.31 91.33 Favored 'General case' 0 N--CA 1.446 -0.67 0 CA-C-O 121.286 0.565 . . . . 0.0 110.018 178.954 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 28' ' ' GLU . . . . . 0.618 ' HA ' ' CE1' ' A' ' 31' ' ' TYR . 35.2 tt0 -64.04 -35.47 80.82 Favored 'General case' 0 N--CA 1.444 -0.743 0 CA-C-N 114.791 -1.095 . . . . 0.0 109.55 179.696 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 29' ' ' MET . . . . . 0.425 ' HG2' ' O ' ' A' ' 25' ' ' LYS . 79.6 mmm -78.31 -19.42 53.59 Favored 'General case' 0 C--N 1.302 -1.486 0 CA-C-N 114.803 -1.09 . . . . 0.0 110.205 -177.626 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 30' ' ' GLY . . . . . 0.419 ' HA2' ' CE1' ' A' ' 39' ' ' PHE . . . -71.46 -22.27 78.62 Favored Glycine 0 N--CA 1.436 -1.367 0 CA-C-N 115.01 -0.995 . . . . 0.0 111.996 177.762 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 31' ' ' TYR . . . . . 0.618 ' CE1' ' HA ' ' A' ' 28' ' ' GLU . 27.6 p90 -104.54 -34.67 8.13 Favored 'General case' 0 N--CA 1.436 -1.152 0 C-N-CA 119.609 -0.836 . . . . 0.0 112.383 174.82 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 32' ' ' TYR . . . . . . . . . . . . . 37.4 m-85 -67.34 -47.99 68.85 Favored 'General case' 0 C--N 1.309 -1.186 0 CA-C-N 115.918 -0.583 . . . . 0.0 112.179 174.379 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 33' ' ' CYS . . . . . 0.42 ' HB3' ' HB ' ' A' ' 36' ' ' THR . 35.3 m -140.39 64.7 25.4 Favored Pre-proline 0 C--N 1.306 -1.313 0 C-N-CA 120.355 -0.538 . . . . 0.0 111.667 -177.356 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 34' ' ' PRO . . . . . 0.442 ' HD2' ' HA ' ' A' ' 5' ' ' ASP . 31.1 Cg_endo -63.21 -27.63 72.68 Favored 'Trans proline' 0 C--N 1.366 1.489 0 C-N-CA 122.562 2.174 . . . . 0.0 111.817 -178.92 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 35' ' ' VAL . . . . . 0.415 ' HB ' ' OD2' ' A' ' 5' ' ' ASP . 57.8 t -84.9 -47.25 17.22 Favored 'Isoleucine or valine' 0 N--CA 1.419 -1.977 0 CA-C-N 115.473 -0.785 . . . . 0.0 110.255 -176.178 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 36' ' ' THR . . . . . 0.42 ' HB ' ' HB3' ' A' ' 33' ' ' CYS . 23.8 m -59.9 -42.9 94.85 Favored 'General case' 0 C--N 1.317 -0.843 0 CA-C-N 115.859 -0.61 . . . . 0.0 111.248 179.71 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 37' ' ' CYS . . . . . . . . . . . . . 77.9 m -79.05 -8.13 58.69 Favored 'General case' 0 C--N 1.319 -0.749 0 N-CA-C 112.222 0.453 . . . . 0.0 112.222 179.661 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 38' ' ' GLY . . . . . . . . . . . . . . . 77.49 40.08 24.11 Favored Glycine 0 N--CA 1.445 -0.736 0 N-CA-C 114.985 0.754 . . . . 0.0 114.985 174.54 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 39' ' ' PHE . . . . . 0.419 ' CE1' ' HA2' ' A' ' 30' ' ' GLY . 87.3 m-85 -78.35 -32.14 48.94 Favored 'General case' 0 C--N 1.317 -0.843 0 N-CA-C 108.519 -0.919 . . . . 0.0 108.519 175.245 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 40' ' ' CYS . . . . . . . . . . . . . 1.5 p . . . . . 0 C--N 1.303 -1.451 0 CA-C-N 114.224 -1.353 . . . . 0.0 109.658 -178.592 . . . . . . . . 0 0 . 1 . 009 nuclear orig core ' A' A ' 4' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.432 -1.357 0 N-CA-C 109.72 -0.474 . . . . 0.0 109.72 . . . . . . . . . 0 0 . 1 . 009 nuclear orig core ' A' A ' 5' ' ' ASP . . . . . 0.669 ' HB3' ' SG ' ' A' ' 11' ' ' CYS . 43.9 m-20 -64.32 141.44 58.77 Favored 'General case' 0 C--O 1.25 1.106 0 N-CA-C 108.761 -0.829 . . . . 0.0 108.761 175.777 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -70.44 150.0 46.66 Favored 'General case' 0 C--N 1.307 -1.269 0 CA-C-O 121.497 0.665 . . . . 0.0 110.796 -176.992 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 7' ' ' LYS . . . . . . . . . . . . . 9.2 ptpp? -85.51 -25.36 26.87 Favored 'General case' 0 C--N 1.307 -1.244 0 CA-C-N 115.133 -0.94 . . . . 0.0 111.997 -177.222 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 8' ' ' ASN . . . . . . . . . . . . . 42.5 m-80 -95.12 1.99 55.02 Favored 'General case' 0 C--N 1.31 -1.143 0 CA-C-N 115.849 -0.614 . . . . 0.0 110.592 -178.101 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 9' ' ' PHE . . . . . 0.422 ' CD2' ' HB3' ' A' ' 32' ' ' TYR . 34.1 t80 -121.75 137.32 54.81 Favored 'General case' 0 C--N 1.291 -1.966 0 N-CA-C 107.099 -1.445 . . . . 0.0 107.099 -178.731 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 10' ' ' ASP . . . . . . . . . . . . . 8.8 t70 -94.24 103.09 15.12 Favored 'General case' 0 C--N 1.309 -1.177 0 C-N-CA 119.678 -0.809 . . . . 0.0 109.914 -177.884 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 11' ' ' CYS . . . . . 0.669 ' SG ' ' HB3' ' A' ' 5' ' ' ASP . 73.8 m -75.03 -28.71 60.57 Favored 'General case' 0 C--N 1.293 -1.886 0 CA-C-N 115.312 -0.858 . . . . 0.0 112.985 -175.51 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 12' ' ' ARG . . . . . . . . . . . . . 28.2 mmt180 -73.86 -44.44 55.49 Favored 'General case' 0 C--N 1.317 -0.822 0 N-CA-C 109.069 -0.715 . . . . 0.0 109.069 -178.186 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 38.3 ttm180 -60.89 -46.83 89.07 Favored 'General case' 0 C--N 1.318 -0.761 0 CA-C-N 115.238 -0.892 . . . . 0.0 109.874 178.242 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 14' ' ' SER . . . . . . . . . . . . . 44.7 m -61.37 -34.6 75.59 Favored 'General case' 0 C--N 1.319 -0.752 0 CA-C-N 115.746 -0.661 . . . . 0.0 111.48 179.953 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 50.2 tp -72.72 -44.38 61.78 Favored 'General case' 0 C--N 1.312 -1.059 0 C-N-CA 120.688 -0.405 . . . . 0.0 110.968 179.611 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 16' ' ' ARG . . . . . . . . . . . . . 21.9 mtm180 -70.17 -35.56 74.07 Favored 'General case' 0 C--N 1.314 -0.953 0 CA-C-N 116.006 -0.543 . . . . 0.0 112.449 -177.848 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 17' ' ' ASN . . . . . . . . . . . . . 35.5 m-80 -77.1 -26.04 52.91 Favored 'General case' 0 CA--C 1.498 -1.038 0 CA-C-O 121.056 0.455 . . . . 0.0 111.612 178.68 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . 104.56 7.03 40.34 Favored Glycine 0 N--CA 1.433 -1.56 0 C-N-CA 119.685 -1.245 . . . . 0.0 112.469 178.448 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 19' ' ' ASP . . . . . . . . . . . . . 6.0 m-20 -64.65 -35.97 82.74 Favored 'General case' 0 CA--C 1.499 -1.0 0 N-CA-C 108.779 -0.823 . . . . 0.0 108.779 178.15 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 20' ' ' CYS . . . . . 0.405 ' HA ' ' HG3' ' A' ' 29' ' ' MET . 39.3 t -57.04 -31.16 64.88 Favored 'General case' 0 C--N 1.315 -0.897 0 CA-C-N 114.667 -1.152 . . . . 0.0 111.606 178.904 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 21' ' ' ASP . . . . . . . . . . . . . 17.8 t70 -106.37 -9.3 16.81 Favored 'General case' 0 C--N 1.316 -0.889 0 CA-C-N 115.812 -0.631 . . . . 0.0 111.388 -176.49 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 22' ' ' ASN . . . . . . . . . . . . . 54.7 t30 -77.17 131.35 38.23 Favored 'General case' 0 C--N 1.311 -1.067 0 O-C-N 122.237 -0.289 . . . . 0.0 110.989 -174.535 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 23' ' ' ASP . . . . . . . . . . . . . 26.7 t70 -51.76 -48.14 63.82 Favored 'General case' 0 N--CA 1.473 0.705 0 C-N-CA 123.958 0.903 . . . . 0.0 113.065 -174.233 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 32.4 t70 -61.79 -22.76 65.72 Favored 'General case' 0 N--CA 1.48 1.046 0 N-CA-C 112.304 0.483 . . . . 0.0 112.304 -179.823 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 25' ' ' LYS . . . . . 0.547 ' O ' ' HG2' ' A' ' 29' ' ' MET . 69.8 mmtt -101.58 -16.27 16.81 Favored 'General case' 0 C--N 1.305 -1.369 0 C-N-CA 120.475 -0.49 . . . . 0.0 111.614 -174.174 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 26' ' ' LEU . . . . . . . . . . . . . 83.3 mt -48.18 -50.32 29.44 Favored 'General case' 0 N--CA 1.475 0.785 0 N-CA-C 115.699 1.74 . . . . 0.0 115.699 -172.395 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 27' ' ' LEU . . . . . . . . . . . . . 1.6 tm? -60.51 -43.5 97.01 Favored 'General case' 0 N--CA 1.448 -0.574 0 N-CA-C 109.026 -0.731 . . . . 0.0 109.026 -178.239 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 28' ' ' GLU . . . . . 0.439 ' HA ' ' CZ ' ' A' ' 31' ' ' TYR . 1.2 mp0 -65.05 -34.88 79.48 Favored 'General case' 0 CA--C 1.503 -0.864 0 CA-C-N 114.926 -1.034 . . . . 0.0 110.442 178.988 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 29' ' ' MET . . . . . 0.547 ' HG2' ' O ' ' A' ' 25' ' ' LYS . 70.9 mmm -70.5 -25.64 63.23 Favored 'General case' 0 C--N 1.316 -0.888 0 CA-C-N 116.107 -0.497 . . . . 0.0 110.552 -177.269 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 30' ' ' GLY . . . . . . . . . . . . . . . -68.3 -25.98 74.41 Favored Glycine 0 N--CA 1.448 -0.538 0 CA-C-N 115.586 -0.734 . . . . 0.0 112.36 -179.851 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 31' ' ' TYR . . . . . 0.439 ' CZ ' ' HA ' ' A' ' 28' ' ' GLU . 25.9 p90 -109.48 -33.79 6.7 Favored 'General case' 0 N--CA 1.441 -0.885 0 N-CA-C 113.354 0.872 . . . . 0.0 113.354 177.655 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 32' ' ' TYR . . . . . 0.422 ' HB3' ' CD2' ' A' ' 9' ' ' PHE . 21.3 m-85 -69.74 -48.04 60.86 Favored 'General case' 0 C--N 1.304 -1.382 0 N-CA-C 112.317 0.488 . . . . 0.0 112.317 176.679 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 33' ' ' CYS . . . . . . . . . . . . . 34.8 m -136.57 69.73 60.06 Favored Pre-proline 0 C--N 1.306 -1.305 0 C-N-CA 119.436 -0.905 . . . . 0.0 111.35 -177.55 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 34' ' ' PRO . . . . . 0.404 ' HD2' ' HA ' ' A' ' 5' ' ' ASP . 56.2 Cg_endo -69.96 -23.5 29.83 Favored 'Trans proline' 0 N--CA 1.448 -1.18 0 C-N-CA 121.977 1.785 . . . . 0.0 111.487 -178.416 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 35' ' ' VAL . . . . . . . . . . . . . 41.7 t -87.49 -52.45 11.5 Favored 'Isoleucine or valine' 0 C--N 1.296 -1.758 0 CA-C-N 115.696 -0.684 . . . . 0.0 111.015 -177.966 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 36' ' ' THR . . . . . 0.417 ' HG1' ' CG ' ' A' ' 5' ' ' ASP . 58.4 m -61.95 -35.38 78.28 Favored 'General case' 0 CA--C 1.55 0.973 0 N-CA-C 112.224 0.453 . . . . 0.0 112.224 -178.203 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 37' ' ' CYS . . . . . . . . . . . . . 92.5 m -90.94 2.99 55.81 Favored 'General case' 0 C--N 1.308 -1.196 0 N-CA-C 113.337 0.866 . . . . 0.0 113.337 179.603 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 38' ' ' GLY . . . . . . . . . . . . . . . 72.25 46.49 34.21 Favored Glycine 0 CA--C 1.525 0.701 0 N-CA-C 115.062 0.785 . . . . 0.0 115.062 175.259 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 39' ' ' PHE . . . . . 0.402 ' CD1' ' HA ' ' A' ' 34' ' ' PRO . 96.4 m-85 -95.09 -43.08 8.28 Favored 'General case' 0 C--N 1.306 -1.313 0 N-CA-C 107.864 -1.162 . . . . 0.0 107.864 173.756 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 40' ' ' CYS . . . . . . . . . . . . . 49.5 t . . . . . 0 N--CA 1.429 -1.505 0 CA-C-N 114.449 -1.25 . . . . 0.0 108.33 -178.613 . . . . . . . . 0 0 . 1 . 010 nuclear orig core ' A' A ' 4' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.433 -1.297 0 CA-C-O 120.481 0.181 . . . . 0.0 110.627 . . . . . . . . . 0 0 . 1 . 010 nuclear orig core ' A' A ' 5' ' ' ASP . . . . . . . . . . . . . 69.6 m-20 -60.83 147.27 43.34 Favored 'General case' 0 C--N 1.315 -0.916 0 O-C-N 124.009 0.818 . . . . 0.0 110.623 176.773 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 10.7 tp10 -69.02 133.21 47.83 Favored 'General case' 0 C--N 1.308 -1.235 0 CA-C-N 115.922 -0.581 . . . . 0.0 110.058 178.92 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 7' ' ' LYS . . . . . . . . . . . . . 8.8 ptpp? -81.62 -23.55 36.94 Favored 'General case' 0 CA--C 1.512 -0.515 0 CA-C-O 121.298 0.571 . . . . 0.0 110.979 -178.04 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 8' ' ' ASN . . . . . . . . . . . . . 12.7 m120 -86.55 16.8 4.29 Favored 'General case' 0 C--N 1.308 -1.196 0 CA-C-N 115.004 -0.998 . . . . 0.0 110.317 178.594 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 9' ' ' PHE . . . . . . . . . . . . . 0.3 OUTLIER -139.6 138.22 36.0 Favored 'General case' 0 N--CA 1.422 -1.865 0 N-CA-C 105.819 -1.919 . . . . 0.0 105.819 -176.927 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 10' ' ' ASP . . . . . . . . . . . . . 12.3 t70 -104.75 88.71 2.98 Favored 'General case' 0 C--N 1.303 -1.451 0 N-CA-C 108.274 -1.009 . . . . 0.0 108.274 174.518 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 11' ' ' CYS . . . . . . . . . . . . . 95.4 m -79.63 -6.17 56.55 Favored 'General case' 0 C--N 1.301 -1.502 0 N-CA-C 112.732 0.641 . . . . 0.0 112.732 -177.316 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 12' ' ' ARG . . . . . 0.46 ' O ' ' HG2' ' A' ' 16' ' ' ARG . 6.4 mmp_? -65.54 -51.11 62.28 Favored 'General case' 0 N--CA 1.444 -0.753 0 N-CA-C 107.198 -1.408 . . . . 0.0 107.198 173.034 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 58.3 ttp180 -62.0 -44.7 96.18 Favored 'General case' 0 CA--C 1.519 -0.223 0 CA-C-N 115.592 -0.731 . . . . 0.0 110.352 177.135 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 14' ' ' SER . . . . . . . . . . . . . 14.9 m -58.95 -31.73 68.97 Favored 'General case' 0 CA--C 1.543 0.704 0 CA-C-O 120.849 0.357 . . . . 0.0 111.159 178.789 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 38.8 tp -80.12 -40.14 28.07 Favored 'General case' 0 C--N 1.318 -0.772 0 N-CA-C 110.418 -0.216 . . . . 0.0 110.418 178.921 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 16' ' ' ARG . . . . . 0.46 ' HG2' ' O ' ' A' ' 12' ' ' ARG . 38.8 mmt180 -61.95 -37.9 86.47 Favored 'General case' 0 C--O 1.22 -0.467 0 CA-C-N 115.929 -0.578 . . . . 0.0 110.342 177.121 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 17' ' ' ASN . . . . . . . . . . . . . 0.9 OUTLIER -77.78 -49.97 13.29 Favored 'General case' 0 C--N 1.316 -0.86 0 CA-C-N 115.665 -0.698 . . . . 0.0 111.562 179.884 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . 129.79 -2.05 5.98 Favored Glycine 0 N--CA 1.446 -0.65 0 C-N-CA 120.03 -1.081 . . . . 0.0 112.751 -179.312 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 19' ' ' ASP . . . . . . . . . . . . . 6.2 m-20 -63.11 -37.86 88.87 Favored 'General case' 0 N--CA 1.477 0.897 0 CA-C-O 121.557 0.694 . . . . 0.0 110.237 -179.956 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 20' ' ' CYS . . . . . . . . . . . . . 43.8 t -71.3 -9.07 57.53 Favored 'General case' 0 C--N 1.311 -1.071 0 CA-C-N 114.789 -1.096 . . . . 0.0 111.526 -178.699 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 21' ' ' ASP . . . . . . . . . . . . . 32.6 t70 -116.58 -7.67 11.58 Favored 'General case' 0 C--N 1.32 -0.702 0 CA-C-O 121.478 0.656 . . . . 0.0 110.432 -179.768 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 22' ' ' ASN . . . . . . . . . . . . . 33.6 t30 -74.9 118.93 18.41 Favored 'General case' 0 C--N 1.308 -1.201 0 CA-C-N 115.801 -0.636 . . . . 0.0 110.722 -176.563 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 23' ' ' ASP . . . . . . . . . . . . . 11.4 m-20 -52.25 -40.06 61.17 Favored 'General case' 0 N--CA 1.479 0.978 0 C-N-CA 124.396 1.078 . . . . 0.0 111.836 -176.225 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 33.8 t70 -59.29 -38.75 80.95 Favored 'General case' 0 C--N 1.321 -0.652 0 CA-C-N 116.0 -0.546 . . . . 0.0 112.002 -178.692 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 25' ' ' LYS . . . . . 0.458 ' O ' ' HG2' ' A' ' 29' ' ' MET . 72.1 mmtt -100.47 2.11 41.8 Favored 'General case' 0 C--N 1.308 -1.214 0 N-CA-C 112.827 0.677 . . . . 0.0 112.827 -175.659 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 26' ' ' LEU . . . . . . . . . . . . . 55.9 mt -58.3 -35.49 71.92 Favored 'General case' 0 C--O 1.219 -0.525 0 N-CA-C 113.741 1.015 . . . . 0.0 113.741 -176.877 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 27' ' ' LEU . . . . . . . . . . . . . 1.5 tm? -55.31 -51.09 67.82 Favored 'General case' 0 N--CA 1.439 -0.982 0 N-CA-C 108.933 -0.765 . . . . 0.0 108.933 178.748 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 28' ' ' GLU . . . . . 0.542 ' HA ' ' CE2' ' A' ' 31' ' ' TYR . 43.9 mt-10 -64.87 -34.46 78.44 Favored 'General case' 0 CA--C 1.505 -0.752 0 CA-C-N 115.515 -0.766 . . . . 0.0 110.385 -179.704 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 29' ' ' MET . . . . . 0.458 ' HG2' ' O ' ' A' ' 25' ' ' LYS . 72.2 mmm -76.02 -21.82 56.44 Favored 'General case' 0 C--N 1.311 -1.07 0 CA-C-N 115.565 -0.743 . . . . 0.0 111.541 -174.653 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 30' ' ' GLY . . . . . . . . . . . . . . . -68.53 -37.69 85.6 Favored Glycine 0 CA--C 1.5 -0.862 0 C-N-CA 121.008 -0.615 . . . . 0.0 111.728 -179.892 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 31' ' ' TYR . . . . . 0.542 ' CE2' ' HA ' ' A' ' 28' ' ' GLU . 40.2 p90 -91.25 -36.84 13.67 Favored 'General case' 0 N--CA 1.433 -1.304 0 C-N-CA 119.77 -0.772 . . . . 0.0 112.005 177.775 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 32' ' ' TYR . . . . . . . . . . . . . 22.5 m-85 -65.72 -57.77 7.26 Favored 'General case' 0 C--N 1.316 -0.89 0 N-CA-C 113.259 0.837 . . . . 0.0 113.259 177.42 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 33' ' ' CYS . . . . . . . . . . . . . 98.5 m -135.05 80.62 47.48 Favored Pre-proline 0 C--N 1.305 -1.362 0 CA-C-O 121.376 0.608 . . . . 0.0 112.429 -177.694 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 34' ' ' PRO . . . . . 0.433 ' HA ' ' CD1' ' A' ' 39' ' ' PHE . 73.5 Cg_endo -72.59 -20.38 23.45 Favored 'Trans proline' 0 N--CA 1.45 -1.083 0 C-N-CA 122.576 2.184 . . . . 0.0 111.616 -178.404 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 35' ' ' VAL . . . . . . . . . . . . . 21.7 t -86.34 -55.93 5.99 Favored 'Isoleucine or valine' 0 C--N 1.295 -1.794 0 C-N-CA 120.431 -0.508 . . . . 0.0 110.178 -177.852 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 36' ' ' THR . . . . . . . . . . . . . 55.4 m -59.98 -40.12 88.04 Favored 'General case' 0 C--N 1.318 -0.79 0 N-CA-C 112.706 0.632 . . . . 0.0 112.706 -179.201 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 37' ' ' CYS . . . . . 0.402 ' SG ' ' HB3' ' A' ' 29' ' ' MET . 71.9 m -86.1 11.2 12.29 Favored 'General case' 0 C--N 1.307 -1.274 0 N-CA-C 113.212 0.819 . . . . 0.0 113.212 -177.429 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 38' ' ' GLY . . . . . . . . . . . . . . . 73.81 40.18 45.62 Favored Glycine 0 C--N 1.33 0.21 0 N-CA-C 115.332 0.893 . . . . 0.0 115.332 172.102 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 39' ' ' PHE . . . . . 0.433 ' CD1' ' HA ' ' A' ' 34' ' ' PRO . 95.5 m-85 -96.43 -37.9 10.25 Favored 'General case' 0 C--N 1.299 -1.62 0 N-CA-C 108.294 -1.002 . . . . 0.0 108.294 174.36 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 40' ' ' CYS . . . . . 0.411 ' SG ' ' HB2' ' A' ' 34' ' ' PRO . 6.5 p . . . . . 0 C--N 1.314 -0.972 0 CA-C-N 114.93 -1.032 . . . . 0.0 109.855 178.352 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 4' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.43 -1.435 0 N-CA-C 109.627 -0.508 . . . . 0.0 109.627 . . . . . . . . . 0 0 . 1 . 011 nuclear orig core ' A' A ' 5' ' ' ASP . . . . . 0.554 ' HB3' ' SG ' ' A' ' 11' ' ' CYS . 14.6 m-20 -63.23 145.43 55.53 Favored 'General case' 0 C--N 1.308 -1.207 0 O-C-N 123.9 0.75 . . . . 0.0 110.654 179.8 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 6' ' ' GLU . . . . . 0.409 ' OE2' ' HB2' ' A' ' 8' ' ' ASN . 0.3 OUTLIER -70.21 124.18 23.48 Favored 'General case' 0 C--N 1.306 -1.283 0 N-CA-C 105.495 -2.039 . . . . 0.0 105.495 176.239 . . . . . . . . 3 3 . 1 . 011 nuclear orig core ' A' A ' 7' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -79.19 -21.37 46.47 Favored 'General case' 0 C--N 1.321 -0.639 0 N-CA-C 113.597 0.962 . . . . 0.0 113.597 -170.687 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 8' ' ' ASN . . . . . 0.409 ' HB2' ' OE2' ' A' ' 6' ' ' GLU . 32.7 m-80 -81.7 -23.03 37.05 Favored 'General case' 0 C--N 1.304 -1.407 0 N-CA-C 108.873 -0.788 . . . . 0.0 108.873 -178.964 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 9' ' ' PHE . . . . . . . . . . . . . 28.7 t80 -81.67 142.32 32.82 Favored 'General case' 0 N--CA 1.428 -1.54 0 CA-C-N 114.593 -1.185 . . . . 0.0 108.362 178.524 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 10' ' ' ASP . . . . . . . . . . . . . 8.9 t70 -92.18 97.14 10.72 Favored 'General case' 0 C--N 1.305 -1.346 0 C-N-CA 118.856 -1.137 . . . . 0.0 109.018 178.759 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 11' ' ' CYS . . . . . 0.554 ' SG ' ' HB3' ' A' ' 5' ' ' ASP . 72.8 m -73.83 -23.06 59.59 Favored 'General case' 0 C--N 1.297 -1.682 0 CA-C-N 115.231 -0.895 . . . . 0.0 111.546 -177.23 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 12' ' ' ARG . . . . . . . . . . . . . 19.9 mmm180 -74.19 -44.56 52.9 Favored 'General case' 0 C--N 1.325 -0.473 0 N-CA-C 109.354 -0.61 . . . . 0.0 109.354 -177.235 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 58.2 ttp180 -56.32 -49.12 75.24 Favored 'General case' 0 C--N 1.321 -0.66 0 C-N-CA 124.253 1.021 . . . . 0.0 108.597 176.083 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 14' ' ' SER . . . . . . . . . . . . . 20.7 m -60.38 -32.73 71.58 Favored 'General case' 0 C--N 1.313 -1.008 0 CA-C-N 114.794 -1.093 . . . . 0.0 111.911 -179.35 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 15' ' ' LEU . . . . . 0.437 ' HA ' ' HB3' ' A' ' 20' ' ' CYS . 29.9 tp -78.08 -39.32 41.93 Favored 'General case' 0 C--N 1.309 -1.174 0 O-C-N 121.973 -0.455 . . . . 0.0 110.559 179.765 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 16' ' ' ARG . . . . . . . . . . . . . 66.6 mtt180 -70.04 -35.93 74.66 Favored 'General case' 0 C--N 1.316 -0.873 0 CA-C-N 115.874 -0.603 . . . . 0.0 111.88 179.663 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 17' ' ' ASN . . . . . . . . . . . . . 95.0 m-20 -70.86 -44.13 67.03 Favored 'General case' 0 CA--C 1.495 -1.136 0 CA-C-O 121.662 0.744 . . . . 0.0 109.533 178.688 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . 118.82 2.65 14.25 Favored Glycine 0 N--CA 1.424 -2.13 0 CA-C-N 114.556 -1.202 . . . . 0.0 110.948 -177.144 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 19' ' ' ASP . . . . . . . . . . . . . 28.0 m-20 -60.16 -41.65 93.27 Favored 'General case' 0 N--CA 1.484 1.256 0 CA-C-O 122.354 1.073 . . . . 0.0 108.518 -179.893 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 20' ' ' CYS . . . . . 0.437 ' HB3' ' HA ' ' A' ' 15' ' ' LEU . 43.2 t -79.6 -3.18 45.9 Favored 'General case' 0 C--N 1.302 -1.46 0 CA-C-N 113.689 -1.596 . . . . 0.0 111.056 -176.548 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 21' ' ' ASP . . . . . . . . . . . . . 32.1 t70 -121.93 -9.75 8.73 Favored 'General case' 0 C--N 1.312 -1.06 0 CA-C-O 121.445 0.641 . . . . 0.0 110.626 -176.275 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 22' ' ' ASN . . . . . 0.424 ' O ' ' HG ' ' A' ' 26' ' ' LEU . 55.0 t-20 -87.26 125.04 33.96 Favored 'General case' 0 C--N 1.31 -1.13 0 N-CA-C 108.909 -0.775 . . . . 0.0 108.909 -177.542 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 23' ' ' ASP . . . . . . . . . . . . . 28.8 t70 -55.22 -36.77 66.33 Favored 'General case' 0 C--N 1.318 -0.767 0 C-N-CA 124.165 0.986 . . . . 0.0 111.782 -179.658 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 31.6 t70 -68.45 -29.51 68.17 Favored 'General case' 0 C--N 1.316 -0.877 0 CA-C-N 115.951 -0.568 . . . . 0.0 111.516 -178.368 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 25' ' ' LYS . . . . . . . . . . . . . 13.2 mptt -100.02 1.55 42.57 Favored 'General case' 0 C--N 1.316 -0.89 0 CA-C-N 116.079 -0.509 . . . . 0.0 112.336 -178.018 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 26' ' ' LEU . . . . . 0.424 ' HG ' ' O ' ' A' ' 22' ' ' ASN . 59.3 mt -62.89 -38.36 90.62 Favored 'General case' 0 C--O 1.214 -0.787 0 N-CA-C 114.737 1.384 . . . . 0.0 114.737 -175.262 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 27' ' ' LEU . . . . . . . . . . . . . 2.0 tm? -59.95 -47.24 86.62 Favored 'General case' 0 N--CA 1.441 -0.921 0 N-CA-C 108.607 -0.886 . . . . 0.0 108.607 -179.285 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 28' ' ' GLU . . . . . 0.565 ' HA ' ' CZ ' ' A' ' 31' ' ' TYR . 34.0 tt0 -64.81 -35.63 81.71 Favored 'General case' 0 C--N 1.311 -1.105 0 CA-C-N 115.401 -0.818 . . . . 0.0 110.139 179.708 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 29' ' ' MET . . . . . 0.503 ' HB3' ' SG ' ' A' ' 37' ' ' CYS . 76.1 mmm -82.64 -12.17 57.84 Favored 'General case' 0 C--N 1.3 -1.563 0 CA-C-N 115.477 -0.783 . . . . 0.0 111.897 -175.03 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 30' ' ' GLY . . . . . . . . . . . . . . . -75.35 -36.96 43.09 Favored Glycine 0 C--N 1.307 -1.037 0 N-CA-C 111.113 -0.795 . . . . 0.0 111.113 177.77 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 31' ' ' TYR . . . . . 0.565 ' CZ ' ' HA ' ' A' ' 28' ' ' GLU . 24.8 p90 -84.78 -27.98 26.5 Favored 'General case' 0 N--CA 1.441 -0.914 0 C-N-CA 119.681 -0.808 . . . . 0.0 112.24 176.408 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 32' ' ' TYR . . . . . . . . . . . . . 30.6 m-85 -77.43 -61.38 2.01 Favored 'General case' 0 C--N 1.295 -1.799 0 N-CA-C 113.737 1.014 . . . . 0.0 113.737 174.961 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 33' ' ' CYS . . . . . . . . . . . . . 31.4 m -132.58 72.86 77.38 Favored Pre-proline 0 C--N 1.303 -1.441 0 C-N-CA 119.734 -0.786 . . . . 0.0 111.466 -175.308 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 34' ' ' PRO . . . . . 0.487 ' HD2' ' HA ' ' A' ' 5' ' ' ASP . 34.6 Cg_endo -62.48 -26.86 76.58 Favored 'Trans proline' 0 C--N 1.363 1.304 0 C-N-CA 122.703 2.269 . . . . 0.0 112.323 -178.549 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 35' ' ' VAL . . . . . . . . . . . . . 38.5 t -85.92 -49.68 15.06 Favored 'Isoleucine or valine' 0 C--N 1.296 -1.754 0 C-N-CA 120.133 -0.627 . . . . 0.0 110.472 -177.45 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 36' ' ' THR . . . . . . . . . . . . . 20.9 m -58.94 -38.51 79.16 Favored 'General case' 0 C--N 1.32 -0.685 0 C-N-CA 123.072 0.549 . . . . 0.0 111.279 -178.917 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 37' ' ' CYS . . . . . 0.503 ' SG ' ' HB3' ' A' ' 29' ' ' MET . 64.6 m -87.91 10.8 17.52 Favored 'General case' 0 C--N 1.312 -1.061 0 CA-C-N 115.9 -0.591 . . . . 0.0 112.246 -178.488 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 38' ' ' GLY . . . . . . . . . . . . . . . 74.73 19.84 79.74 Favored Glycine 0 CA--C 1.522 0.489 0 N-CA-C 116.197 1.239 . . . . 0.0 116.197 172.145 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 39' ' ' PHE . . . . . . . . . . . . . 97.3 m-85 -79.15 -43.01 24.85 Favored 'General case' 0 C--N 1.317 -0.828 0 CA-C-N 118.153 0.976 . . . . 0.0 108.419 176.908 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 40' ' ' CYS . . . . . . . . . . . . . 61.1 m . . . . . 0 C--N 1.303 -1.424 0 CA-C-N 114.728 -1.124 . . . . 0.0 108.618 178.44 . . . . . . . . 0 0 . 1 . 012 nuclear orig core ' A' A ' 4' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.435 -1.192 0 N-CA-C 108.701 -0.852 . . . . 0.0 108.701 . . . . . . . . . 0 0 . 1 . 012 nuclear orig core ' A' A ' 5' ' ' ASP . . . . . 0.468 ' HB3' ' SG ' ' A' ' 11' ' ' CYS . 24.5 m-20 -56.95 148.83 20.15 Favored 'General case' 0 C--O 1.25 1.129 0 O-C-N 124.095 0.872 . . . . 0.0 110.056 179.907 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 6' ' ' GLU . . . . . 0.464 ' OE1' ' HG2' ' A' ' 7' ' ' LYS . 9.4 tp10 -72.54 145.68 47.28 Favored 'General case' 0 N--CA 1.423 -1.818 0 CA-C-O 121.387 0.613 . . . . 0.0 111.226 -176.562 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 7' ' ' LYS . . . . . 0.464 ' HG2' ' OE1' ' A' ' 6' ' ' GLU . 8.0 ptpp? -84.27 -25.2 29.55 Favored 'General case' 0 C--N 1.315 -0.925 0 CA-C-N 115.085 -0.961 . . . . 0.0 110.885 -175.609 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 8' ' ' ASN . . . . . . . . . . . . . 15.0 m120 -87.64 4.89 42.16 Favored 'General case' 0 C--N 1.309 -1.187 0 CA-C-N 115.086 -0.961 . . . . 0.0 110.047 -178.001 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 9' ' ' PHE . . . . . . . . . . . . . 20.6 t80 -129.72 143.83 51.0 Favored 'General case' 0 N--CA 1.417 -2.111 0 N-CA-C 107.354 -1.351 . . . . 0.0 107.354 -176.704 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 10' ' ' ASP . . . . . . . . . . . . . 12.1 t70 -103.04 100.9 10.86 Favored 'General case' 0 C--N 1.303 -1.432 0 N-CA-C 108.447 -0.946 . . . . 0.0 108.447 179.617 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 11' ' ' CYS . . . . . 0.468 ' SG ' ' HB3' ' A' ' 5' ' ' ASP . 74.1 m -72.57 -26.38 61.7 Favored 'General case' 0 C--N 1.284 -2.263 0 N-CA-C 113.375 0.88 . . . . 0.0 113.375 -175.004 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 12' ' ' ARG . . . . . . . . . . . . . 37.1 mmt180 -73.17 -49.05 30.28 Favored 'General case' 0 C--N 1.319 -0.728 0 C-N-CA 120.549 -0.461 . . . . 0.0 110.004 -179.792 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 55.2 ttp180 -61.17 -42.72 99.06 Favored 'General case' 0 C--N 1.324 -0.525 0 CA-C-N 115.993 -0.549 . . . . 0.0 110.69 -179.919 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 14' ' ' SER . . . . . . . . . . . . . 16.8 m -66.3 -40.9 90.31 Favored 'General case' 0 C--N 1.312 -1.038 0 CA-C-O 121.185 0.517 . . . . 0.0 110.51 -178.756 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 61.7 tp -63.69 -44.55 93.35 Favored 'General case' 0 C--O 1.238 0.473 0 CA-C-N 115.946 -0.57 . . . . 0.0 110.717 178.704 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 16' ' ' ARG . . . . . . . . . . . . . 78.1 mtp180 -71.56 -28.59 63.96 Favored 'General case' 0 C--N 1.316 -0.89 0 CA-C-N 115.6 -0.727 . . . . 0.0 112.3 -178.786 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 17' ' ' ASN . . . . . . . . . . . . . 13.1 m-80 -77.82 -33.39 52.4 Favored 'General case' 0 CA--C 1.493 -1.22 0 CA-C-O 120.97 0.414 . . . . 0.0 111.89 177.522 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . 116.4 17.19 6.23 Favored Glycine 0 C--N 1.295 -1.728 0 C-N-CA 119.72 -1.228 . . . . 0.0 112.804 177.612 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 19' ' ' ASP . . . . . . . . . . . . . 4.4 m-20 -63.8 -35.45 80.65 Favored 'General case' 0 CA--C 1.505 -0.753 0 CA-C-O 120.99 0.424 . . . . 0.0 111.929 179.203 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 20' ' ' CYS . . . . . . . . . . . . . 11.1 t -85.63 -2.97 58.72 Favored 'General case' 0 C--N 1.309 -1.178 0 CA-C-O 121.851 0.834 . . . . 0.0 109.389 -176.335 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 21' ' ' ASP . . . . . . . . . . . . . 31.2 t70 -105.83 -9.33 17.25 Favored 'General case' 0 C--N 1.319 -0.755 0 CA-C-O 122.404 1.097 . . . . 0.0 108.717 176.692 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 22' ' ' ASN . . . . . . . . . . . . . 49.4 t-20 -87.45 115.07 24.61 Favored 'General case' 0 C--N 1.304 -1.391 0 CA-C-N 114.505 -1.225 . . . . 0.0 108.427 -176.978 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 23' ' ' ASP . . . . . 0.454 ' HA ' ' HG ' ' A' ' 26' ' ' LEU . 7.7 m-20 -56.91 -37.65 71.73 Favored 'General case' 0 N--CA 1.475 0.776 0 N-CA-C 112.607 0.595 . . . . 0.0 112.607 -178.252 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 29.5 m-20 -69.12 -24.15 64.07 Favored 'General case' 0 C--N 1.321 -0.657 0 CA-C-N 116.375 -0.375 . . . . 0.0 111.465 -179.227 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 25' ' ' LYS . . . . . . . . . . . . . 14.0 mptt -107.17 8.7 30.22 Favored 'General case' 0 C--N 1.313 -1.006 0 N-CA-C 113.044 0.757 . . . . 0.0 113.044 -178.825 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 26' ' ' LEU . . . . . 0.454 ' HG ' ' HA ' ' A' ' 23' ' ' ASP . 73.7 mt -59.09 -48.32 82.05 Favored 'General case' 0 N--CA 1.472 0.646 0 N-CA-C 113.502 0.927 . . . . 0.0 113.502 -177.908 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 27' ' ' LEU . . . . . . . . . . . . . 22.1 tp -59.67 -48.52 81.34 Favored 'General case' 0 N--CA 1.44 -0.971 0 N-CA-C 108.952 -0.759 . . . . 0.0 108.952 178.894 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 28' ' ' GLU . . . . . . . . . . . . . 4.7 tp10 -55.74 -37.89 69.06 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 114.055 -1.429 . . . . 0.0 108.935 -177.679 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 29' ' ' MET . . . . . . . . . . . . . 78.5 mmm -84.47 -28.22 26.95 Favored 'General case' 0 C--N 1.309 -1.167 0 CA-C-N 114.997 -1.001 . . . . 0.0 112.4 -173.834 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 30' ' ' GLY . . . . . . . . . . . . . . . -72.69 -32.44 61.54 Favored Glycine 0 N--CA 1.431 -1.638 0 C-N-CA 120.567 -0.825 . . . . 0.0 112.461 -177.76 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 31' ' ' TYR . . . . . . . . . . . . . 47.2 p90 -90.61 -34.79 15.33 Favored 'General case' 0 CA--C 1.5 -0.948 0 C-N-CA 117.935 -1.506 . . . . 0.0 112.349 177.514 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 32' ' ' TYR . . . . . . . . . . . . . 31.4 m-85 -68.69 -41.92 78.51 Favored 'General case' 0 C--N 1.312 -1.022 0 C-N-CA 120.212 -0.595 . . . . 0.0 112.328 176.326 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 33' ' ' CYS . . . . . . . . . . . . . 54.9 m -132.59 64.75 72.64 Favored Pre-proline 0 C--O 1.259 1.553 0 N-CA-C 112.421 0.526 . . . . 0.0 112.421 -176.346 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 34' ' ' PRO . . . . . . . . . . . . . 38.6 Cg_endo -67.1 -29.87 39.28 Favored 'Trans proline' 0 N--CA 1.453 -0.908 0 C-N-CA 122.011 1.807 . . . . 0.0 111.718 -178.674 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 35' ' ' VAL . . . . . . . . . . . . . 47.3 t -87.38 -50.08 14.13 Favored 'Isoleucine or valine' 0 N--CA 1.43 -1.455 0 CA-C-N 115.7 -0.682 . . . . 0.0 111.653 -175.379 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 36' ' ' THR . . . . . . . . . . . . . 95.6 m -58.39 -37.69 75.79 Favored 'General case' 0 CA--C 1.545 0.772 0 N-CA-C 112.552 0.575 . . . . 0.0 112.552 -178.683 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 37' ' ' CYS . . . . . . . . . . . . . 85.7 m -78.21 -23.62 47.42 Favored 'General case' 0 C--N 1.322 -0.59 0 C-N-CA 119.233 -0.987 . . . . 0.0 111.897 177.668 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 38' ' ' GLY . . . . . . . . . . . . . . . 96.49 41.12 3.73 Favored Glycine 0 N--CA 1.445 -0.727 0 C-N-CA 119.998 -1.096 . . . . 0.0 113.193 179.154 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 39' ' ' PHE . . . . . . . . . . . . . 91.4 m-85 -97.47 -38.9 9.41 Favored 'General case' 0 C--N 1.314 -0.943 0 N-CA-C 107.777 -1.194 . . . . 0.0 107.777 174.276 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 40' ' ' CYS . . . . . . . . . . . . . 41.9 t . . . . . 0 C--N 1.299 -1.591 0 CA-C-N 113.97 -1.468 . . . . 0.0 108.723 -176.416 . . . . . . . . 0 0 . 1 . 013 nuclear orig core ' A' A ' 4' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.446 -0.649 0 N-CA-C 108.781 -0.822 . . . . 0.0 108.781 . . . . . . . . . 0 0 . 1 . 013 nuclear orig core ' A' A ' 5' ' ' ASP . . . . . 0.585 ' HB3' ' SG ' ' A' ' 11' ' ' CYS . 54.3 m-20 -67.44 143.25 56.35 Favored 'General case' 0 C--O 1.248 0.995 0 O-C-N 123.473 0.483 . . . . 0.0 111.122 179.04 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 9.8 tp10 -66.86 140.88 57.81 Favored 'General case' 0 C--N 1.316 -0.869 0 C-N-CA 124.054 0.942 . . . . 0.0 109.741 177.563 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 7' ' ' LYS . . . . . . . . . . . . . 20.8 ptmt -85.44 -23.36 27.9 Favored 'General case' 0 N--CA 1.441 -0.89 0 CA-C-O 121.464 0.649 . . . . 0.0 111.101 -178.652 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 8' ' ' ASN . . . . . . . . . . . . . 38.1 m-80 -86.91 14.66 6.92 Favored 'General case' 0 N--CA 1.48 1.057 0 CA-C-N 114.953 -1.021 . . . . 0.0 110.673 -178.565 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 9' ' ' PHE . . . . . . . . . . . . . 15.3 t80 -141.34 132.95 27.07 Favored 'General case' 0 N--CA 1.41 -2.469 0 N-CA-C 105.232 -2.136 . . . . 0.0 105.232 -178.774 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 10' ' ' ASP . . . . . . . . . . . . . 9.1 t70 -91.78 96.79 10.61 Favored 'General case' 0 C--N 1.297 -1.7 0 C-N-CA 118.63 -1.228 . . . . 0.0 108.774 -179.713 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 11' ' ' CYS . . . . . 0.585 ' SG ' ' HB3' ' A' ' 5' ' ' ASP . 60.0 m -68.33 -30.21 69.14 Favored 'General case' 0 C--N 1.3 -1.546 0 CA-C-N 115.706 -0.679 . . . . 0.0 112.215 -175.574 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 12' ' ' ARG . . . . . . . . . . . . . 30.6 mmt180 -69.36 -47.46 64.25 Favored 'General case' 0 CA--C 1.508 -0.635 0 N-CA-C 110.008 -0.368 . . . . 0.0 110.008 179.468 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 54.6 ttp180 -58.71 -42.25 88.21 Favored 'General case' 0 C--N 1.315 -0.894 0 C-N-CA 122.967 0.507 . . . . 0.0 109.918 176.865 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 14' ' ' SER . . . . . . . . . . . . . 26.2 m -64.51 -33.42 75.84 Favored 'General case' 0 C--N 1.316 -0.891 0 CA-C-N 116.006 -0.543 . . . . 0.0 110.749 179.153 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 29.8 tp -74.88 -41.7 59.29 Favored 'General case' 0 N--CA 1.441 -0.912 0 N-CA-C 109.633 -0.506 . . . . 0.0 109.633 179.609 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 16' ' ' ARG . . . . . . . . . . . . . 78.3 mtp180 -64.49 -31.09 72.15 Favored 'General case' 0 C--N 1.321 -0.656 0 C-N-CA 123.699 0.8 . . . . 0.0 111.883 179.51 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 17' ' ' ASN . . . . . . . . . . . . . 30.6 m-80 -85.25 -42.77 14.36 Favored 'General case' 0 CA--C 1.511 -0.531 0 N-CA-C 112.454 0.539 . . . . 0.0 112.454 179.275 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . 130.55 -4.19 5.83 Favored Glycine 0 C--O 1.225 -0.461 0 C-N-CA 119.614 -1.279 . . . . 0.0 112.414 -179.334 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 19' ' ' ASP . . . . . . . . . . . . . 3.5 m-20 -61.79 -38.99 90.1 Favored 'General case' 0 N--CA 1.478 0.972 0 C-N-CA 123.614 0.766 . . . . 0.0 110.701 -177.336 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 20' ' ' CYS . . . . . . . . . . . . . 44.4 t -77.89 -11.21 59.87 Favored 'General case' 0 C--N 1.302 -1.497 0 CA-C-N 114.728 -1.124 . . . . 0.0 111.845 -173.741 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 21' ' ' ASP . . . . . . . . . . . . . 35.3 t70 -114.07 -6.61 13.1 Favored 'General case' 0 C--N 1.312 -1.036 0 CA-C-O 121.768 0.794 . . . . 0.0 110.612 -178.437 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 22' ' ' ASN . . . . . . . . . . . . . 19.1 t-20 -79.53 115.47 19.17 Favored 'General case' 0 C--N 1.309 -1.177 0 CA-C-N 115.378 -0.828 . . . . 0.0 109.681 -177.297 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 23' ' ' ASP . . . . . . . . . . . . . 13.2 t70 -55.02 -39.45 69.13 Favored 'General case' 0 N--CA 1.479 0.988 0 C-N-CA 123.972 0.909 . . . . 0.0 112.616 -175.849 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 6.0 m-20 -72.58 -12.93 61.26 Favored 'General case' 0 C--N 1.31 -1.151 0 N-CA-C 112.819 0.674 . . . . 0.0 112.819 -177.053 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 25' ' ' LYS . . . . . . . . . . . . . 43.7 mtpt -113.41 -2.08 14.04 Favored 'General case' 0 C--N 1.315 -0.934 0 CA-C-O 120.963 0.411 . . . . 0.0 110.432 179.655 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 26' ' ' LEU . . . . . . . . . . . . . 45.8 mt -55.54 -35.54 65.79 Favored 'General case' 0 C--N 1.318 -0.785 0 N-CA-C 115.44 1.644 . . . . 0.0 115.44 -177.632 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 27' ' ' LEU . . . . . . . . . . . . . 2.2 tm? -58.08 -50.96 71.67 Favored 'General case' 0 N--CA 1.441 -0.9 0 N-CA-C 107.672 -1.233 . . . . 0.0 107.672 179.071 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 28' ' ' GLU . . . . . 0.616 ' HA ' ' CZ ' ' A' ' 31' ' ' TYR . 40.0 tt0 -65.38 -32.62 74.35 Favored 'General case' 0 N--CA 1.437 -1.076 0 CA-C-N 114.63 -1.168 . . . . 0.0 110.449 179.753 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 29' ' ' MET . . . . . . . . . . . . . 78.5 mmm -80.51 -17.98 49.91 Favored 'General case' 0 C--O 1.208 -1.121 0 CA-C-N 115.901 -0.59 . . . . 0.0 112.081 -175.764 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 30' ' ' GLY . . . . . . . . . . . . . . . -77.06 -39.78 26.64 Favored Glycine 0 C--N 1.303 -1.284 0 C-N-CA 120.419 -0.896 . . . . 0.0 111.658 -179.604 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 31' ' ' TYR . . . . . 0.616 ' CZ ' ' HA ' ' A' ' 28' ' ' GLU . 25.0 p90 -79.44 -31.64 42.62 Favored 'General case' 0 CA--C 1.501 -0.931 0 C-N-CA 119.173 -1.011 . . . . 0.0 112.059 176.581 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 32' ' ' TYR . . . . . . . . . . . . . 17.8 m-85 -73.77 -54.85 7.11 Favored 'General case' 0 C--N 1.297 -1.689 0 N-CA-C 113.384 0.883 . . . . 0.0 113.384 174.913 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 33' ' ' CYS . . . . . . . . . . . . . 30.3 m -134.89 76.9 58.22 Favored Pre-proline 0 C--N 1.307 -1.281 0 C-N-CA 119.892 -0.723 . . . . 0.0 111.863 -175.99 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 34' ' ' PRO . . . . . 0.429 ' HD2' ' HA ' ' A' ' 5' ' ' ASP . 55.7 Cg_endo -68.79 -25.07 33.75 Favored 'Trans proline' 0 C--N 1.352 0.759 0 C-N-CA 122.261 1.974 . . . . 0.0 112.054 -179.266 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 35' ' ' VAL . . . . . 0.419 ' HB ' ' OD1' ' A' ' 5' ' ' ASP . 47.3 t -86.28 -51.65 12.91 Favored 'Isoleucine or valine' 0 C--N 1.306 -1.313 0 CA-C-N 116.261 -0.427 . . . . 0.0 110.491 -177.326 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 36' ' ' THR . . . . . . . . . . . . . 62.0 m -62.41 -37.6 86.42 Favored 'General case' 0 C--O 1.249 1.039 0 CA-C-N 116.159 -0.473 . . . . 0.0 111.958 -178.615 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 37' ' ' CYS . . . . . . . . . . . . . 72.2 m -84.62 6.53 23.59 Favored 'General case' 0 C--N 1.311 -1.091 0 N-CA-C 112.395 0.517 . . . . 0.0 112.395 -179.726 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 38' ' ' GLY . . . . . . . . . . . . . . . 70.09 46.49 50.87 Favored Glycine 0 N--CA 1.446 -0.676 0 N-CA-C 115.451 0.94 . . . . 0.0 115.451 172.238 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 39' ' ' PHE . . . . . . . . . . . . . 91.9 m-85 -87.87 -36.18 17.34 Favored 'General case' 0 C--N 1.302 -1.467 0 N-CA-C 108.766 -0.828 . . . . 0.0 108.766 174.145 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 40' ' ' CYS . . . . . . . . . . . . . 15.8 m . . . . . 0 C--N 1.315 -0.893 0 N-CA-C 109.178 -0.675 . . . . 0.0 109.178 178.889 . . . . . . . . 0 0 . 1 . 014 nuclear orig core ' A' A ' 4' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.433 -1.313 0 N-CA-C 108.419 -0.956 . . . . 0.0 108.419 . . . . . . . . . 0 0 . 1 . 014 nuclear orig core ' A' A ' 5' ' ' ASP . . . . . 0.591 ' HB3' ' SG ' ' A' ' 11' ' ' CYS . 31.3 m-20 -60.56 137.31 58.18 Favored 'General case' 0 C--N 1.312 -1.04 0 O-C-N 123.527 0.517 . . . . 0.0 111.41 -177.24 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 9.9 tp10 -69.27 127.48 33.2 Favored 'General case' 0 N--CA 1.427 -1.584 0 N-CA-C 109.466 -0.568 . . . . 0.0 109.466 177.534 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 7' ' ' LYS . . . . . . . . . . . . . 17.3 ptpt -85.25 -12.76 51.76 Favored 'General case' 0 C--N 1.306 -1.293 0 CA-C-O 121.576 0.703 . . . . 0.0 110.652 -178.687 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 8' ' ' ASN . . . . . . . . . . . . . 13.0 m120 -91.64 16.37 10.72 Favored 'General case' 0 C--N 1.315 -0.902 0 CA-C-O 121.91 0.862 . . . . 0.0 109.2 176.398 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 9' ' ' PHE . . . . . . . . . . . . . 29.6 t80 -136.4 155.98 49.27 Favored 'General case' 0 N--CA 1.427 -1.589 0 N-CA-C 106.748 -1.575 . . . . 0.0 106.748 -177.655 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 10' ' ' ASP . . . . . . . . . . . . . 9.1 t70 -104.49 95.74 6.13 Favored 'General case' 0 C--N 1.311 -1.076 0 N-CA-C 108.501 -0.926 . . . . 0.0 108.501 175.199 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 11' ' ' CYS . . . . . 0.591 ' SG ' ' HB3' ' A' ' 5' ' ' ASP . 81.4 m -67.88 -30.95 70.43 Favored 'General case' 0 C--N 1.301 -1.504 0 CA-C-N 115.61 -0.723 . . . . 0.0 111.727 -175.573 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 12' ' ' ARG . . . . . 0.414 ' O ' ' HG3' ' A' ' 16' ' ' ARG . 28.4 mmm180 -66.93 -43.49 83.11 Favored 'General case' 0 CA--C 1.503 -0.839 0 CA-C-N 116.324 -0.398 . . . . 0.0 110.359 179.496 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 60.7 ttp180 -58.24 -47.59 83.04 Favored 'General case' 0 C--N 1.316 -0.868 0 CA-C-N 115.865 -0.607 . . . . 0.0 110.705 179.333 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 14' ' ' SER . . . . . . . . . . . . . 57.0 m -66.66 -28.24 68.31 Favored 'General case' 0 C--N 1.319 -0.743 0 N-CA-C 112.028 0.381 . . . . 0.0 112.028 179.045 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 15' ' ' LEU . . . . . 0.402 HD13 ' SG ' ' A' ' 20' ' ' CYS . 42.3 tp -74.14 -45.2 50.29 Favored 'General case' 0 C--N 1.319 -0.743 0 CA-C-O 120.891 0.377 . . . . 0.0 110.141 177.527 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 16' ' ' ARG . . . . . 0.414 ' HG3' ' O ' ' A' ' 12' ' ' ARG . 48.2 mtm180 -66.5 -34.63 78.36 Favored 'General case' 0 C--N 1.316 -0.849 0 CA-C-N 115.99 -0.55 . . . . 0.0 111.131 179.781 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 17' ' ' ASN . . . . . . . . . . . . . 14.7 m-80 -70.85 -31.08 67.66 Favored 'General case' 0 CA--C 1.496 -1.108 0 CA-C-O 121.167 0.508 . . . . 0.0 111.079 176.318 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . 105.2 -1.66 40.55 Favored Glycine 0 N--CA 1.436 -1.331 0 CA-C-N 115.508 -0.769 . . . . 0.0 112.513 178.489 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 19' ' ' ASP . . . . . . . . . . . . . 18.6 m-20 -63.01 -33.01 74.51 Favored 'General case' 0 N--CA 1.484 1.228 0 CA-C-O 121.657 0.741 . . . . 0.0 109.852 -179.453 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 20' ' ' CYS . . . . . 0.429 ' HA ' ' HG3' ' A' ' 29' ' ' MET . 32.2 t -64.51 -24.14 67.51 Favored 'General case' 0 C--N 1.302 -1.484 0 CA-C-N 114.376 -1.283 . . . . 0.0 110.993 -179.987 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 21' ' ' ASP . . . . . . . . . . . . . 34.6 t70 -112.86 -4.88 13.9 Favored 'General case' 0 N--CA 1.468 0.462 0 CA-C-O 121.585 0.707 . . . . 0.0 110.694 -178.632 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 22' ' ' ASN . . . . . 0.423 ' O ' ' HG ' ' A' ' 26' ' ' LEU . 27.2 t-20 -77.77 126.19 30.48 Favored 'General case' 0 C--N 1.307 -1.246 0 CA-C-N 116.118 -0.492 . . . . 0.0 109.809 -178.602 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 23' ' ' ASP . . . . . 0.449 ' HA ' ' HG ' ' A' ' 26' ' ' LEU . 2.2 m-20 -56.92 -41.74 78.72 Favored 'General case' 0 N--CA 1.474 0.745 0 N-CA-C 113.809 1.04 . . . . 0.0 113.809 -176.333 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 21.9 t70 -67.97 -29.03 67.97 Favored 'General case' 0 C--N 1.314 -0.976 0 CA-C-O 121.408 0.623 . . . . 0.0 110.882 179.824 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 25' ' ' LYS . . . . . 0.4 ' HG2' ' OD1' ' A' ' 22' ' ' ASN . 47.0 mmtm -97.59 -0.63 45.44 Favored 'General case' 0 C--N 1.313 -1.007 0 CA-C-N 116.146 -0.479 . . . . 0.0 111.958 -177.521 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 26' ' ' LEU . . . . . 0.449 ' HG ' ' HA ' ' A' ' 23' ' ' ASP . 74.4 mt -58.46 -44.79 89.38 Favored 'General case' 0 N--CA 1.473 0.684 0 N-CA-C 113.22 0.822 . . . . 0.0 113.22 -177.33 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 27' ' ' LEU . . . . . . . . . . . . . 26.8 tp -60.24 -45.66 92.48 Favored 'General case' 0 N--CA 1.432 -1.346 0 CA-C-O 121.204 0.526 . . . . 0.0 109.747 178.776 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 28' ' ' GLU . . . . . . . . . . . . . 9.5 mm-40 -58.68 -36.67 74.55 Favored 'General case' 0 C--N 1.323 -0.582 0 CA-C-N 114.597 -1.183 . . . . 0.0 109.373 -179.323 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 29' ' ' MET . . . . . 0.46 ' HB3' ' SG ' ' A' ' 37' ' ' CYS . 76.9 mmm -89.29 -16.46 31.1 Favored 'General case' 0 C--N 1.296 -1.737 0 CA-C-N 114.536 -1.211 . . . . 0.0 112.525 -173.271 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 30' ' ' GLY . . . . . . . . . . . . . . . -72.07 -40.23 56.98 Favored Glycine 0 C--N 1.302 -1.307 0 N-CA-C 111.439 -0.665 . . . . 0.0 111.439 178.556 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 31' ' ' TYR . . . . . . . . . . . . . 17.5 p90 -82.66 -29.15 30.19 Favored 'General case' 0 CA--C 1.503 -0.83 0 C-N-CA 119.342 -0.943 . . . . 0.0 112.594 177.618 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 32' ' ' TYR . . . . . . . . . . . . . 15.3 m-85 -76.79 -62.07 1.76 Allowed 'General case' 0 C--N 1.298 -1.669 0 N-CA-C 113.764 1.024 . . . . 0.0 113.764 175.592 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 33' ' ' CYS . . . . . . . . . . . . . 56.2 m -131.79 73.4 78.85 Favored Pre-proline 0 C--N 1.309 -1.181 0 C-N-CA 120.294 -0.562 . . . . 0.0 111.445 -175.61 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 34' ' ' PRO . . . . . . . . . . . . . 54.3 Cg_endo -67.18 -24.42 44.35 Favored 'Trans proline' 0 C--N 1.351 0.685 0 C-N-CA 122.679 2.253 . . . . 0.0 112.433 -175.683 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 35' ' ' VAL . . . . . 0.415 ' HB ' ' OD2' ' A' ' 5' ' ' ASP . 45.8 t -86.84 -42.86 15.75 Favored 'Isoleucine or valine' 0 C--N 1.301 -1.534 0 CA-C-O 121.077 0.465 . . . . 0.0 110.523 -176.666 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 36' ' ' THR . . . . . . . . . . . . . 31.9 m -63.46 -39.58 94.83 Favored 'General case' 0 C--N 1.308 -1.196 0 CA-C-N 115.75 -0.659 . . . . 0.0 110.985 178.399 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 37' ' ' CYS . . . . . 0.46 ' SG ' ' HB3' ' A' ' 29' ' ' MET . 75.5 m -86.26 5.42 34.46 Favored 'General case' 0 C--N 1.316 -0.876 0 N-CA-C 113.223 0.824 . . . . 0.0 113.223 -178.749 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 38' ' ' GLY . . . . . . . . . . . . . . . 73.11 42.83 42.27 Favored Glycine 0 CA--C 1.52 0.367 0 N-CA-C 115.567 0.987 . . . . 0.0 115.567 173.864 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 39' ' ' PHE . . . . . . . . . . . . . 93.1 m-85 -103.8 -43.59 5.29 Favored 'General case' 0 C--N 1.304 -1.376 0 N-CA-C 107.766 -1.198 . . . . 0.0 107.766 173.316 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 40' ' ' CYS . . . . . . . . . . . . . 61.5 m . . . . . 0 C--N 1.306 -1.284 0 CA-C-N 114.566 -1.197 . . . . 0.0 109.275 -179.463 . . . . . . . . 0 0 . 1 . 015 nuclear orig core ' A' A ' 4' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.424 -1.748 0 N-CA-C 106.161 -1.792 . . . . 0.0 106.161 . . . . . . . . . 0 0 . 1 . 015 nuclear orig core ' A' A ' 5' ' ' ASP . . . . . 0.568 ' OD2' ' HB ' ' A' ' 35' ' ' VAL . 25.9 m-20 -61.56 137.52 58.25 Favored 'General case' 0 C--N 1.315 -0.907 0 O-C-N 123.343 0.402 . . . . 0.0 110.221 -179.506 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER -66.52 136.46 55.69 Favored 'General case' 0 C--N 1.321 -0.671 0 C-N-CA 123.68 0.792 . . . . 0.0 109.558 -175.653 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 7' ' ' LYS . . . . . . . . . . . . . 8.1 ptpp? -73.79 -27.73 61.29 Favored 'General case' 0 C--N 1.309 -1.176 0 N-CA-C 114.986 1.476 . . . . 0.0 114.986 -173.298 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 8' ' ' ASN . . . . . . . . . . . . . 16.2 m120 -98.58 -2.83 37.69 Favored 'General case' 0 C--N 1.285 -2.206 0 C-N-CA 120.436 -0.506 . . . . 0.0 110.933 -178.909 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 9' ' ' PHE . . . . . . . . . . . . . 18.8 t80 -100.7 143.66 30.6 Favored 'General case' 0 C--N 1.302 -1.482 0 N-CA-C 107.499 -1.297 . . . . 0.0 107.499 -179.75 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 10' ' ' ASP . . . . . . . . . . . . . 16.4 t70 -102.82 100.71 10.73 Favored 'General case' 0 C--N 1.307 -1.268 0 C-N-CA 119.064 -1.054 . . . . 0.0 110.788 -179.349 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 11' ' ' CYS . . . . . 0.502 ' SG ' ' HB3' ' A' ' 5' ' ' ASP . 60.1 m -68.32 -27.67 66.49 Favored 'General case' 0 C--N 1.289 -2.03 0 CA-C-N 115.034 -0.984 . . . . 0.0 112.022 -176.1 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 12' ' ' ARG . . . . . . . . . . . . . 38.9 mmt180 -62.2 -48.9 77.97 Favored 'General case' 0 C--O 1.237 0.445 0 N-CA-C 109.575 -0.528 . . . . 0.0 109.575 179.009 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 14.7 ttp180 -59.39 -51.62 69.14 Favored 'General case' 0 C--N 1.325 -0.484 0 CA-C-N 115.394 -0.821 . . . . 0.0 111.092 179.498 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 14' ' ' SER . . . . . . . . . . . . . 25.4 m -63.62 -34.63 78.26 Favored 'General case' 0 C--N 1.311 -1.069 0 N-CA-C 112.048 0.388 . . . . 0.0 112.048 -178.249 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 2.3 tm? -68.34 -43.48 77.43 Favored 'General case' 0 CA--C 1.535 0.386 0 N-CA-C 108.82 -0.807 . . . . 0.0 108.82 179.16 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 16' ' ' ARG . . . . . . . . . . . . . 71.3 mtp180 -70.23 -37.26 74.97 Favored 'General case' 0 C--N 1.319 -0.747 0 N-CA-C 112.824 0.676 . . . . 0.0 112.824 -179.533 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 17' ' ' ASN . . . . . . . . . . . . . 26.4 m-80 -69.99 -36.12 74.92 Favored 'General case' 0 CA--C 1.503 -0.841 0 N-CA-C 111.899 0.333 . . . . 0.0 111.899 178.639 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . 117.79 -1.32 17.71 Favored Glycine 0 N--CA 1.437 -1.283 0 C-N-CA 119.774 -1.203 . . . . 0.0 112.143 179.353 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 19' ' ' ASP . . . . . . . . . . . . . 8.2 m-20 -60.94 -30.46 70.23 Favored 'General case' 0 N--CA 1.482 1.162 0 CA-C-O 121.246 0.546 . . . . 0.0 111.038 -178.38 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 20' ' ' CYS . . . . . . . . . . . . . 52.1 t -82.03 -2.33 51.34 Favored 'General case' 0 C--N 1.304 -1.378 0 CA-C-N 115.411 -0.813 . . . . 0.0 111.001 -176.099 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 21' ' ' ASP . . . . . . . . . . . . . 31.4 t70 -124.32 -9.91 7.51 Favored 'General case' 0 N--CA 1.47 0.554 0 CA-C-O 121.781 0.801 . . . . 0.0 110.065 176.552 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 22' ' ' ASN . . . . . 0.473 ' O ' ' HG ' ' A' ' 26' ' ' LEU . 28.1 t-20 -82.2 121.24 26.37 Favored 'General case' 0 C--N 1.309 -1.153 0 CA-C-N 115.155 -0.93 . . . . 0.0 110.561 -177.041 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 23' ' ' ASP . . . . . . . . . . . . . 13.2 t70 -51.47 -43.32 62.11 Favored 'General case' 0 N--CA 1.483 1.2 0 C-N-CA 124.537 1.135 . . . . 0.0 111.841 -176.904 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 25.4 m-20 -70.2 -14.68 62.73 Favored 'General case' 0 C--N 1.311 -1.093 0 CA-C-N 115.123 -0.944 . . . . 0.0 112.76 -175.911 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 25' ' ' LYS . . . . . . . . . . . . . 14.1 mmmm -115.24 -7.96 12.36 Favored 'General case' 0 C--N 1.313 -1.009 0 N-CA-C 111.56 0.207 . . . . 0.0 111.56 178.894 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 26' ' ' LEU . . . . . 0.473 ' HG ' ' O ' ' A' ' 22' ' ' ASN . 52.3 mt -53.9 -44.55 70.6 Favored 'General case' 0 N--CA 1.473 0.675 0 N-CA-C 114.985 1.476 . . . . 0.0 114.985 -174.329 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 27' ' ' LEU . . . . . . . . . . . . . 26.4 tp -59.27 -46.76 87.66 Favored 'General case' 0 N--CA 1.437 -1.114 0 CA-C-O 121.175 0.512 . . . . 0.0 109.936 -179.309 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 28' ' ' GLU . . . . . 0.501 ' HA ' ' CZ ' ' A' ' 31' ' ' TYR . 46.1 mt-10 -66.14 -32.23 73.56 Favored 'General case' 0 CA--C 1.498 -1.057 0 CA-C-N 114.963 -1.017 . . . . 0.0 110.112 -179.31 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 29' ' ' MET . . . . . 0.421 ' HB3' ' SG ' ' A' ' 37' ' ' CYS . 79.3 mmm -81.51 -19.82 41.39 Favored 'General case' 0 C--N 1.299 -1.616 0 CA-C-N 115.357 -0.838 . . . . 0.0 110.718 -177.901 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 30' ' ' GLY . . . . . 0.466 ' O ' ' HB3' ' A' ' 34' ' ' PRO . . . -74.38 -26.52 67.82 Favored Glycine 0 N--CA 1.43 -1.717 0 CA-C-N 115.259 -0.882 . . . . 0.0 111.216 177.967 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 31' ' ' TYR . . . . . 0.501 ' CZ ' ' HA ' ' A' ' 28' ' ' GLU 0.254 22.2 p90 -98.51 -36.03 10.05 Favored 'General case' 0 N--CA 1.435 -1.194 0 C-N-CA 119.263 -0.975 . . . . 0.0 112.602 173.803 . . . . . . . . 3 3 . 1 . 015 nuclear orig core ' A' A ' 32' ' ' TYR . . . . . . . . . . . . . 19.3 m-85 -68.27 -51.71 41.96 Favored 'General case' 0 C--N 1.303 -1.438 0 N-CA-C 113.759 1.022 . . . . 0.0 113.759 176.747 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 33' ' ' CYS . . . . . . . . . . . . . 65.6 m -134.85 66.6 69.07 Favored Pre-proline 0 C--N 1.3 -1.581 0 C-N-CA 119.912 -0.715 . . . . 0.0 111.162 179.684 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 34' ' ' PRO . . . . . 0.466 ' HB3' ' O ' ' A' ' 30' ' ' GLY . 37.1 Cg_endo -64.68 -26.97 60.72 Favored 'Trans proline' 0 C--N 1.352 0.751 0 C-N-CA 122.733 2.289 . . . . 0.0 112.771 -176.566 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 35' ' ' VAL . . . . . 0.568 ' HB ' ' OD2' ' A' ' 5' ' ' ASP . 39.2 t -83.3 -43.38 18.23 Favored 'Isoleucine or valine' 0 C--N 1.307 -1.274 0 C-N-CA 119.796 -0.762 . . . . 0.0 109.617 -178.492 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 36' ' ' THR . . . . . . . . . . . . . 25.2 m -62.61 -40.05 95.72 Favored 'General case' 0 C--N 1.316 -0.851 0 CA-C-N 115.662 -0.699 . . . . 0.0 110.438 178.666 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 37' ' ' CYS . . . . . 0.421 ' SG ' ' HB3' ' A' ' 29' ' ' MET . 79.4 m -81.15 0.18 37.48 Favored 'General case' 0 C--N 1.318 -0.794 0 N-CA-C 112.847 0.684 . . . . 0.0 112.847 178.798 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 38' ' ' GLY . . . . . . . . . . . . . . . 74.21 49.0 13.33 Favored Glycine 0 C--O 1.219 -0.828 0 N-CA-C 115.452 0.941 . . . . 0.0 115.452 173.066 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 39' ' ' PHE . . . . . . . . . . . . . 94.2 m-85 -92.31 -9.58 41.44 Favored 'General case' 0 C--N 1.311 -1.067 0 CA-C-N 117.736 0.768 . . . . 0.0 111.501 175.973 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 40' ' ' CYS . . . . . . . . . . . . . 28.5 p . . . . . 0 C--N 1.31 -1.141 0 N-CA-C 108.304 -0.998 . . . . 0.0 108.304 173.704 . . . . . . . . 0 0 . 1 . 016 nuclear orig core ' A' A ' 4' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.448 -0.557 0 N-CA-C 108.489 -0.93 . . . . 0.0 108.489 . . . . . . . . . 0 0 . 1 . 016 nuclear orig core ' A' A ' 5' ' ' ASP . . . . . 0.706 ' OD1' ' HB ' ' A' ' 35' ' ' VAL . 11.0 m-20 -59.65 130.39 46.61 Favored 'General case' 0 C--N 1.311 -1.108 0 O-C-N 123.489 0.493 . . . . 0.0 111.844 -179.077 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 8.5 tp10 -66.53 127.12 31.1 Favored 'General case' 0 N--CA 1.44 -0.939 0 C-N-CA 124.015 0.926 . . . . 0.0 110.507 178.426 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 7' ' ' LYS . . . . . . . . . . . . . 10.1 ptpp? -77.09 -21.05 54.94 Favored 'General case' 0 C--N 1.315 -0.893 0 CA-C-N 115.366 -0.834 . . . . 0.0 110.83 -177.608 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 8' ' ' ASN . . . . . . . . . . . . . 15.5 t-20 -87.77 -7.97 56.6 Favored 'General case' 0 C--N 1.302 -1.499 0 CA-C-O 121.961 0.886 . . . . 0.0 109.758 -178.559 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 9' ' ' PHE . . . . . . . . . . . . . 23.2 t80 -108.18 151.23 26.2 Favored 'General case' 0 N--CA 1.43 -1.471 0 N-CA-C 106.983 -1.488 . . . . 0.0 106.983 -179.206 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 10' ' ' ASP . . . . . . . . . . . . . 9.8 t70 -102.55 100.12 10.18 Favored 'General case' 0 C--O 1.253 1.265 0 C-N-CA 118.944 -1.102 . . . . 0.0 109.281 177.483 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 11' ' ' CYS . . . . . 0.472 ' SG ' ' HB3' ' A' ' 5' ' ' ASP . 61.2 m -70.59 -29.3 65.68 Favored 'General case' 0 C--N 1.298 -1.665 0 CA-C-N 114.706 -1.134 . . . . 0.0 111.372 -176.488 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 12' ' ' ARG . . . . . 0.408 ' O ' ' HG3' ' A' ' 16' ' ' ARG . 34.1 mmt180 -71.29 -52.32 19.54 Favored 'General case' 0 CA--C 1.506 -0.744 0 CA-C-N 116.03 -0.532 . . . . 0.0 109.896 -175.853 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 38.4 ttm180 -58.31 -46.32 86.38 Favored 'General case' 0 C--N 1.32 -0.69 0 C-N-CA 123.346 0.659 . . . . 0.0 110.42 -179.688 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 14' ' ' SER . . . . . . . . . . . . . 25.9 m -59.83 -38.54 82.34 Favored 'General case' 0 C--O 1.256 1.398 0 CA-C-N 115.875 -0.602 . . . . 0.0 111.142 -178.797 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 41.1 tp -73.26 -46.97 46.88 Favored 'General case' 0 N--CA 1.438 -1.026 0 CA-C-N 116.062 -0.517 . . . . 0.0 110.385 178.016 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 16' ' ' ARG . . . . . 0.408 ' HG3' ' O ' ' A' ' 12' ' ' ARG . 97.8 mtt180 -54.28 -47.0 72.85 Favored 'General case' 0 N--CA 1.471 0.583 0 C-N-CA 123.18 0.592 . . . . 0.0 111.504 178.788 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 17' ' ' ASN . . . . . . . . . . . . . 11.0 m120 -65.75 -36.67 84.24 Favored 'General case' 0 CA--C 1.504 -0.789 0 CA-C-O 121.858 0.837 . . . . 0.0 109.576 179.833 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . 109.12 -1.36 31.38 Favored Glycine 0 N--CA 1.432 -1.606 0 CA-C-N 114.376 -1.284 . . . . 0.0 111.863 179.235 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 19' ' ' ASP . . . . . 0.422 ' O ' ' HB2' ' A' ' 25' ' ' LYS . 8.8 m-20 -70.29 -21.44 62.95 Favored 'General case' 0 CA--C 1.49 -1.338 0 N-CA-C 112.554 0.575 . . . . 0.0 112.554 -176.776 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 20' ' ' CYS . . . . . 0.536 ' HA ' ' HG3' ' A' ' 29' ' ' MET . 43.0 t -73.75 -26.38 60.64 Favored 'General case' 0 C--N 1.299 -1.619 0 C-N-CA 120.425 -0.51 . . . . 0.0 111.022 179.912 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 21' ' ' ASP . . . . . . . . . . . . . 33.8 t70 -100.32 -3.33 31.49 Favored 'General case' 0 C--N 1.327 -0.39 0 CA-C-O 122.488 1.137 . . . . 0.0 109.101 -179.814 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 22' ' ' ASN . . . . . . . . . . . . . 19.0 t30 -78.26 130.52 36.34 Favored 'General case' 0 C--N 1.309 -1.18 0 CA-C-N 114.139 -1.391 . . . . 0.0 109.35 178.619 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 23' ' ' ASP . . . . . 0.437 ' HA ' ' HG ' ' A' ' 26' ' ' LEU . 3.1 m-20 -52.9 -34.38 54.64 Favored 'General case' 0 CA--C 1.498 -1.021 0 C-N-CA 124.388 1.075 . . . . 0.0 112.043 -177.118 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 34.2 t70 -59.85 -31.81 70.1 Favored 'General case' 0 C--N 1.307 -1.245 0 CA-C-N 114.974 -1.012 . . . . 0.0 112.133 -179.501 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 25' ' ' LYS . . . . . 0.516 ' O ' ' HG2' ' A' ' 29' ' ' MET . 13.1 mptt -110.81 1.78 17.93 Favored 'General case' 0 C--O 1.204 -1.322 0 N-CA-C 113.624 0.972 . . . . 0.0 113.624 179.794 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 26' ' ' LEU . . . . . 0.437 ' HG ' ' HA ' ' A' ' 23' ' ' ASP . 70.1 mt -50.2 -52.78 32.89 Favored 'General case' 0 N--CA 1.49 1.53 0 N-CA-C 114.655 1.354 . . . . 0.0 114.655 -174.947 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 27' ' ' LEU . . . . . . . . . . . . . 20.0 tp -60.84 -44.62 96.72 Favored 'General case' 0 N--CA 1.44 -0.929 0 CA-C-O 121.17 0.51 . . . . 0.0 109.724 -179.645 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 28' ' ' GLU . . . . . . . . . . . . . 7.5 mm-40 -60.57 -37.12 80.27 Favored 'General case' 0 C--N 1.325 -0.5 0 CA-C-N 114.581 -1.19 . . . . 0.0 108.963 -178.295 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 29' ' ' MET . . . . . 0.536 ' HG3' ' HA ' ' A' ' 20' ' ' CYS . 74.8 mmm -81.14 -20.26 41.71 Favored 'General case' 0 CA--C 1.482 -1.656 0 CA-C-N 115.094 -0.957 . . . . 0.0 111.794 -174.041 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 30' ' ' GLY . . . . . . . . . . . . . . . -64.56 -27.04 71.3 Favored Glycine 0 N--CA 1.436 -1.341 0 O-C-N 124.194 0.934 . . . . 0.0 110.823 177.216 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 31' ' ' TYR . . . . . . . . . . . . . 38.7 p90 -106.16 -31.97 8.44 Favored 'General case' 0 N--CA 1.43 -1.443 0 N-CA-C 112.923 0.712 . . . . 0.0 112.923 176.166 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 32' ' ' TYR . . . . . . . . . . . . . 16.2 m-85 -68.15 -61.59 1.79 Allowed 'General case' 0 C--O 1.21 -1.0 0 N-CA-C 113.232 0.827 . . . . 0.0 113.232 177.482 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 33' ' ' CYS . . . . . . . . . . . . . 61.7 m -136.43 68.55 61.03 Favored Pre-proline 0 C--O 1.265 1.871 0 CA-C-O 121.749 0.785 . . . . 0.0 111.413 -176.846 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 34' ' ' PRO . . . . . 0.613 ' HA ' ' CD2' ' A' ' 39' ' ' PHE . 74.0 Cg_endo -73.09 -23.75 17.89 Favored 'Trans proline' 0 N--CA 1.444 -1.386 0 C-N-CA 122.964 2.443 . . . . 0.0 112.569 -174.955 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 35' ' ' VAL . . . . . 0.706 ' HB ' ' OD1' ' A' ' 5' ' ' ASP . 43.5 t -86.57 -44.48 16.48 Favored 'Isoleucine or valine' 0 C--N 1.289 -2.028 0 C-N-CA 119.51 -0.876 . . . . 0.0 109.506 -179.066 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 36' ' ' THR . . . . . . . . . . . . . 38.3 m -54.61 -51.88 63.94 Favored 'General case' 0 C--N 1.325 -0.472 0 CA-C-N 115.653 -0.703 . . . . 0.0 112.69 -178.49 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 37' ' ' CYS . . . . . . . . . . . . . 85.1 m -91.99 10.88 27.12 Favored 'General case' 0 C--N 1.315 -0.932 0 C-N-CA 118.964 -1.094 . . . . 0.0 113.288 -176.517 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 38' ' ' GLY . . . . . . . . . . . . . . . 78.19 44.14 12.1 Favored Glycine 0 N--CA 1.443 -0.834 0 N-CA-C 115.432 0.933 . . . . 0.0 115.432 171.881 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 39' ' ' PHE . . . . . 0.613 ' CD2' ' HA ' ' A' ' 34' ' ' PRO . 62.2 m-85 -86.19 -50.39 7.02 Favored 'General case' 0 C--N 1.302 -1.496 0 N-CA-C 106.782 -1.562 . . . . 0.0 106.782 174.113 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 40' ' ' CYS . . . . . 0.491 ' SG ' ' HB2' ' A' ' 34' ' ' PRO . 4.0 p . . . . . 0 C--N 1.31 -1.125 0 CA-C-N 114.453 -1.249 . . . . 0.0 109.87 -179.71 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 4' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.426 -1.626 0 N-CA-C 108.883 -0.784 . . . . 0.0 108.883 . . . . . . . . . 0 0 . 1 . 017 nuclear orig core ' A' A ' 5' ' ' ASP . . . . . 0.671 ' OD1' ' HB ' ' A' ' 35' ' ' VAL . 5.1 m-20 -58.29 132.5 53.82 Favored 'General case' 0 C--O 1.256 1.406 0 O-C-N 124.395 1.06 . . . . 0.0 109.517 -179.877 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 9.5 tp10 -64.1 131.7 48.31 Favored 'General case' 0 N--CA 1.436 -1.149 0 CA-C-N 115.589 -0.732 . . . . 0.0 110.761 -176.712 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 7' ' ' LYS . . . . . . . . . . . . . 21.1 ptmt -80.22 -13.01 59.56 Favored 'General case' 0 N--CA 1.437 -1.122 0 CA-C-N 115.883 -0.599 . . . . 0.0 112.045 -176.24 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 8' ' ' ASN . . . . . . . . . . . . . 55.7 m-20 -93.81 4.1 54.43 Favored 'General case' 0 C--N 1.313 -1.018 0 CA-C-O 121.657 0.741 . . . . 0.0 109.367 178.814 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 9' ' ' PHE . . . . . . . . . . . . . 26.8 t80 -128.49 149.52 50.55 Favored 'General case' 0 C--N 1.298 -1.665 0 N-CA-C 106.384 -1.71 . . . . 0.0 106.384 -175.53 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 10' ' ' ASP . . . . . . . . . . . . . 10.0 t70 -105.14 98.73 8.39 Favored 'General case' 0 C--N 1.302 -1.466 0 C-N-CA 119.378 -0.929 . . . . 0.0 108.899 177.172 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 11' ' ' CYS . . . . . 0.41 ' SG ' ' HB3' ' A' ' 5' ' ' ASP . 96.9 m -73.37 -25.08 60.43 Favored 'General case' 0 C--N 1.287 -2.137 0 N-CA-C 113.194 0.813 . . . . 0.0 113.194 -177.19 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 12' ' ' ARG . . . . . 0.446 ' O ' ' HG2' ' A' ' 16' ' ' ARG . 43.8 mmt-85 -69.83 -48.0 60.64 Favored 'General case' 0 C--N 1.32 -0.678 0 N-CA-C 109.502 -0.555 . . . . 0.0 109.502 179.108 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 58.3 ttp180 -64.17 -44.36 92.3 Favored 'General case' 0 C--N 1.311 -1.073 0 CA-C-N 115.54 -0.754 . . . . 0.0 110.355 178.474 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 14' ' ' SER . . . . . . . . . . . . . 25.3 m -60.53 -34.06 73.57 Favored 'General case' 0 C--O 1.25 1.129 0 CA-C-O 121.393 0.616 . . . . 0.0 110.949 179.432 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 65.3 tp -63.35 -46.57 85.94 Favored 'General case' 0 N--CA 1.439 -0.986 0 CA-C-N 115.611 -0.722 . . . . 0.0 109.306 174.956 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 16' ' ' ARG . . . . . 0.446 ' HG2' ' O ' ' A' ' 12' ' ' ARG . 31.0 mmt180 -71.75 -32.74 68.04 Favored 'General case' 0 C--N 1.315 -0.892 0 CA-C-N 115.957 -0.565 . . . . 0.0 112.236 -177.441 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 17' ' ' ASN . . . . . . . . . . . . . 77.0 m-20 -65.57 -35.53 81.12 Favored 'General case' 0 CA--C 1.494 -1.207 0 CA-C-O 121.301 0.572 . . . . 0.0 109.533 179.412 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . 110.77 11.81 18.09 Favored Glycine 0 N--CA 1.426 -1.999 0 CA-C-N 115.11 -0.95 . . . . 0.0 111.483 -178.805 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 19' ' ' ASP . . . . . . . . . . . . . 9.0 m-20 -67.49 -35.05 78.39 Favored 'General case' 0 CA--C 1.501 -0.934 0 N-CA-C 108.782 -0.821 . . . . 0.0 108.782 178.126 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 20' ' ' CYS . . . . . 0.426 ' HA ' ' HG3' ' A' ' 29' ' ' MET . 52.5 t -83.26 -4.48 58.47 Favored 'General case' 0 C--N 1.306 -1.306 0 CA-C-N 114.41 -1.268 . . . . 0.0 110.533 -179.934 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 21' ' ' ASP . . . . . . . . . . . . . 17.2 t70 -104.54 -11.85 16.78 Favored 'General case' 0 C--N 1.318 -0.77 0 CA-C-O 121.77 0.795 . . . . 0.0 109.887 -178.547 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 22' ' ' ASN . . . . . . . . . . . . . 54.1 t-20 -89.3 125.03 34.94 Favored 'General case' 0 C--N 1.311 -1.087 0 CA-C-N 115.127 -0.942 . . . . 0.0 109.243 -179.934 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 23' ' ' ASP . . . . . . . . . . . . . 5.3 p-10 -61.23 -34.34 74.96 Favored 'General case' 0 C--N 1.32 -0.708 0 O-C-N 123.434 0.459 . . . . 0.0 111.673 179.976 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 34.8 t70 -68.46 -28.76 67.33 Favored 'General case' 0 C--N 1.308 -1.209 0 CA-C-O 121.318 0.58 . . . . 0.0 111.67 -177.658 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 25' ' ' LYS . . . . . 0.403 ' O ' ' HG2' ' A' ' 29' ' ' MET . 92.3 mttt -97.18 -2.28 43.25 Favored 'General case' 0 C--N 1.309 -1.181 0 N-CA-C 112.532 0.568 . . . . 0.0 112.532 -177.462 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 26' ' ' LEU . . . . . . . . . . . . . 87.4 mt -55.84 -36.83 67.94 Favored 'General case' 0 C--N 1.312 -1.038 0 N-CA-C 113.269 0.841 . . . . 0.0 113.269 179.806 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 27' ' ' LEU . . . . . . . . . . . . . 1.3 tm? -62.71 -42.22 99.54 Favored 'General case' 0 N--CA 1.44 -0.957 0 N-CA-C 109.02 -0.734 . . . . 0.0 109.02 178.508 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 28' ' ' GLU . . . . . . . . . . . . . 8.3 mm-40 -60.74 -37.24 81.1 Favored 'General case' 0 CA--C 1.514 -0.407 0 N-CA-C 109.062 -0.718 . . . . 0.0 109.062 177.572 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 29' ' ' MET . . . . . 0.431 ' HE3' ' HA ' ' A' ' 29' ' ' MET . 22.1 mmt -75.68 -22.29 56.82 Favored 'General case' 0 C--O 1.204 -1.29 0 CA-C-N 114.95 -1.023 . . . . 0.0 109.827 -176.744 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 30' ' ' GLY . . . . . . . . . . . . . . . -64.31 -28.03 72.45 Favored Glycine 0 C--O 1.24 0.518 0 CA-C-N 116.227 -0.442 . . . . 0.0 112.338 179.931 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 31' ' ' TYR . . . . . . . . . . . . . 20.6 p90 -113.67 -36.24 4.94 Favored 'General case' 0 N--CA 1.433 -1.318 0 N-CA-C 113.033 0.753 . . . . 0.0 113.033 177.543 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 32' ' ' TYR . . . . . . . . . . . . . 33.4 m-85 -70.0 -47.38 62.41 Favored 'General case' 0 C--N 1.306 -1.307 0 N-CA-C 113.234 0.828 . . . . 0.0 113.234 176.808 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 33' ' ' CYS . . . . . . . . . . . . . 60.4 m -136.4 58.49 21.29 Favored Pre-proline 0 C--O 1.251 1.151 0 C-N-CA 121.053 -0.259 . . . . 0.0 111.678 -173.838 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 34' ' ' PRO . . . . . . . . . . . . . 57.3 Cg_endo -67.35 -27.95 39.94 Favored 'Trans proline' 0 C--N 1.359 1.105 0 C-N-CA 122.012 1.808 . . . . 0.0 112.523 -174.66 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 35' ' ' VAL . . . . . 0.671 ' HB ' ' OD1' ' A' ' 5' ' ' ASP . 43.8 t -87.27 -42.9 15.58 Favored 'Isoleucine or valine' 0 C--N 1.301 -1.536 0 C-N-CA 119.971 -0.692 . . . . 0.0 110.433 -177.224 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 36' ' ' THR . . . . . . . . . . . . . 28.0 m -61.24 -40.06 92.64 Favored 'General case' 0 C--N 1.316 -0.88 0 CA-C-N 115.999 -0.546 . . . . 0.0 111.211 179.066 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 37' ' ' CYS . . . . . . . . . . . . . 74.8 m -88.18 -1.45 58.02 Favored 'General case' 0 C--N 1.311 -1.082 0 N-CA-C 113.727 1.01 . . . . 0.0 113.727 -178.954 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 38' ' ' GLY . . . . . . . . . . . . . . . 78.13 43.72 13.05 Favored Glycine 0 CA--C 1.524 0.656 0 N-CA-C 115.325 0.89 . . . . 0.0 115.325 174.908 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 39' ' ' PHE . . . . . . . . . . . . . 74.6 m-85 -91.32 -31.4 16.1 Favored 'General case' 0 C--N 1.315 -0.92 0 N-CA-C 108.475 -0.935 . . . . 0.0 108.475 173.886 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 40' ' ' CYS . . . . . . . . . . . . . 58.3 m . . . . . 0 C--N 1.306 -1.299 0 CA-C-N 114.956 -1.02 . . . . 0.0 109.45 -178.42 . . . . . . . . 0 0 . 1 . 018 nuclear orig core ' A' A ' 4' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.438 -1.055 0 N-CA-C 107.835 -1.172 . . . . 0.0 107.835 . . . . . . . . . 0 0 . 1 . 018 nuclear orig core ' A' A ' 5' ' ' ASP . . . . . 0.412 ' HB3' ' SG ' ' A' ' 11' ' ' CYS . 56.2 m-20 -69.51 147.54 50.7 Favored 'General case' 0 C--N 1.31 -1.121 0 N-CA-C 109.311 -0.626 . . . . 0.0 109.311 178.705 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 9.3 tp10 -67.35 128.55 36.84 Favored 'General case' 0 C--N 1.311 -1.087 0 N-CA-C 109.069 -0.715 . . . . 0.0 109.069 177.744 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 7' ' ' LYS . . . . . . . . . . . . . 19.4 ptpt -77.24 -16.93 58.82 Favored 'General case' 0 C--N 1.307 -1.257 0 CA-C-N 116.348 -0.387 . . . . 0.0 112.008 -177.527 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 8' ' ' ASN . . . . . . . . . . . . . 38.7 m-80 -94.5 4.36 53.95 Favored 'General case' 0 C--N 1.302 -1.488 0 CA-C-O 121.352 0.596 . . . . 0.0 110.321 179.353 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 9' ' ' PHE . . . . . . . . . . . . . 41.5 t80 -123.45 144.32 49.59 Favored 'General case' 0 C--N 1.299 -1.623 0 N-CA-C 106.341 -1.726 . . . . 0.0 106.341 -178.53 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 10' ' ' ASP . . . . . . . . . . . . . 8.3 t70 -102.18 91.76 4.44 Favored 'General case' 0 C--N 1.304 -1.411 0 C-N-CA 118.705 -1.198 . . . . 0.0 109.544 179.859 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 11' ' ' CYS . . . . . 0.412 ' SG ' ' HB3' ' A' ' 5' ' ' ASP . 98.3 m -69.55 -19.93 63.68 Favored 'General case' 0 C--N 1.297 -1.701 0 CA-C-N 114.799 -1.091 . . . . 0.0 112.251 -177.095 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 12' ' ' ARG . . . . . . . . . . . . . 13.8 mmt180 -74.04 -43.5 57.63 Favored 'General case' 0 C--N 1.313 -1.0 0 N-CA-C 107.653 -1.24 . . . . 0.0 107.653 -177.734 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 39.4 ttm180 -59.48 -50.3 74.47 Favored 'General case' 0 C--O 1.238 0.462 0 CA-C-N 114.905 -1.043 . . . . 0.0 110.092 175.472 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 14' ' ' SER . . . . . . . . . . . . . 50.6 m -62.14 -30.82 71.3 Favored 'General case' 0 CA--C 1.546 0.822 0 CA-C-N 116.178 -0.464 . . . . 0.0 111.591 179.633 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 58.1 tp -67.29 -49.51 63.97 Favored 'General case' 0 N--CA 1.449 -0.522 0 N-CA-C 110.097 -0.334 . . . . 0.0 110.097 176.726 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 16' ' ' ARG . . . . . . . . . . . . . 65.7 mtp180 -62.67 -38.1 89.02 Favored 'General case' 0 C--N 1.321 -0.633 0 CA-C-N 115.434 -0.803 . . . . 0.0 112.228 -179.06 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 17' ' ' ASN . . . . . . . . . . . . . 42.0 m-80 -81.77 -14.56 56.26 Favored 'General case' 0 CA--C 1.506 -0.749 0 CA-C-O 121.017 0.437 . . . . 0.0 111.975 -178.502 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . 95.94 9.93 56.8 Favored Glycine 0 C--O 1.213 -1.201 0 C-N-CA 119.938 -1.125 . . . . 0.0 113.743 173.566 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 19' ' ' ASP . . . . . . . . . . . . . 2.6 m-20 -67.73 -34.65 77.27 Favored 'General case' 0 CA--C 1.498 -1.046 0 N-CA-C 108.072 -1.085 . . . . 0.0 108.072 178.225 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 20' ' ' CYS . . . . . . . . . . . . . 42.8 t -72.66 -9.46 58.63 Favored 'General case' 0 C--N 1.309 -1.193 0 CA-C-N 113.711 -1.586 . . . . 0.0 110.787 -179.046 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 21' ' ' ASP . . . . . . . . . . . . . 26.2 t70 -113.64 -10.02 13.15 Favored 'General case' 0 C--N 1.319 -0.742 0 CA-C-O 121.656 0.741 . . . . 0.0 109.672 -179.874 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 22' ' ' ASN . . . . . 0.485 ' OD1' ' HG2' ' A' ' 25' ' ' LYS . 23.5 t-20 -83.4 114.62 21.57 Favored 'General case' 0 C--N 1.298 -1.631 0 CA-C-N 115.713 -0.676 . . . . 0.0 109.958 -174.217 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 23' ' ' ASP . . . . . . . . . . . . . 18.1 t70 -49.66 -45.21 48.31 Favored 'General case' 0 N--CA 1.477 0.904 0 C-N-CA 124.231 1.012 . . . . 0.0 111.708 -176.065 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 24' ' ' ASP . . . . . 0.425 ' HB3' ' OD1' ' A' ' 22' ' ' ASN . 27.4 t70 -60.28 -32.91 71.64 Favored 'General case' 0 C--N 1.31 -1.143 0 CA-C-N 115.278 -0.874 . . . . 0.0 112.441 -178.897 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 25' ' ' LYS . . . . . 0.485 ' HG2' ' OD1' ' A' ' 22' ' ' ASN . 44.3 mmtm -94.63 -7.01 42.13 Favored 'General case' 0 C--N 1.312 -1.029 0 CA-C-N 116.301 -0.409 . . . . 0.0 111.063 -175.727 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 26' ' ' LEU . . . . . . . . . . . . . 64.8 mt -56.81 -34.79 68.04 Favored 'General case' 0 C--O 1.218 -0.553 0 N-CA-C 114.886 1.439 . . . . 0.0 114.886 -174.485 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 27' ' ' LEU . . . . . . . . . . . . . 1.3 tm? -57.52 -50.0 74.49 Favored 'General case' 0 N--CA 1.44 -0.945 0 N-CA-C 108.758 -0.83 . . . . 0.0 108.758 178.539 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 28' ' ' GLU . . . . . . . . . . . . . 1.5 mp0 -63.57 -33.81 76.42 Favored 'General case' 0 N--CA 1.449 -0.508 0 CA-C-N 115.175 -0.921 . . . . 0.0 110.424 178.583 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 29' ' ' MET . . . . . 0.439 ' HE3' ' HA ' ' A' ' 29' ' ' MET . 21.7 mmt -74.15 -25.32 59.68 Favored 'General case' 0 C--O 1.2 -1.527 0 CA-C-N 116.154 -0.476 . . . . 0.0 109.856 -177.341 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 30' ' ' GLY . . . . . . . . . . . . . . . -64.44 -34.78 90.83 Favored Glycine 0 N--CA 1.446 -0.664 0 C-N-CA 121.4 -0.429 . . . . 0.0 112.375 179.64 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 31' ' ' TYR . . . . . . . . . . . . . 33.0 p90 -99.03 -36.53 9.69 Favored 'General case' 0 N--CA 1.439 -1.003 0 N-CA-C 113.35 0.87 . . . . 0.0 113.35 178.042 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 32' ' ' TYR . . . . . . . . . . . . . 37.2 m-85 -70.86 -46.61 62.34 Favored 'General case' 0 C--N 1.309 -1.169 0 N-CA-C 112.859 0.689 . . . . 0.0 112.859 177.052 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 33' ' ' CYS . . . . . . . . . . . . . 47.7 m -136.45 61.03 35.72 Favored Pre-proline 0 C--O 1.254 1.335 0 N-CA-C 112.266 0.469 . . . . 0.0 112.266 -173.324 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 34' ' ' PRO . . . . . 0.467 ' HB2' ' SG ' ' A' ' 40' ' ' CYS . 46.0 Cg_endo -65.35 -25.67 56.43 Favored 'Trans proline' 0 C--N 1.359 1.126 0 C-N-CA 121.825 1.683 . . . . 0.0 111.948 -178.567 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 35' ' ' VAL . . . . . . . . . . . . . 61.7 t -86.41 -49.64 14.89 Favored 'Isoleucine or valine' 0 C--N 1.299 -1.607 0 C-N-CA 120.573 -0.451 . . . . 0.0 111.134 -177.725 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 36' ' ' THR . . . . . . . . . . . . . 56.5 m -59.78 -42.22 92.85 Favored 'General case' 0 C--N 1.316 -0.879 0 CA-C-O 121.049 0.452 . . . . 0.0 111.615 -178.945 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 37' ' ' CYS . . . . . . . . . . . . . 77.4 m -85.02 1.57 47.04 Favored 'General case' 0 C--N 1.309 -1.183 0 N-CA-C 113.12 0.785 . . . . 0.0 113.12 -178.072 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 38' ' ' GLY . . . . . . . . . . . . . . . 74.26 45.38 25.08 Favored Glycine 0 CA--C 1.521 0.419 0 C-N-CA 120.546 -0.835 . . . . 0.0 114.879 174.913 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 39' ' ' PHE . . . . . 0.461 ' CD1' ' HA ' ' A' ' 34' ' ' PRO . 95.4 m-85 -94.11 -16.87 23.37 Favored 'General case' 0 C--N 1.309 -1.155 0 N-CA-C 108.581 -0.896 . . . . 0.0 108.581 174.07 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 40' ' ' CYS . . . . . 0.467 ' SG ' ' HB2' ' A' ' 34' ' ' PRO . 40.0 m . . . . . 0 C--N 1.313 -1.001 0 CA-C-N 115.048 -0.978 . . . . 0.0 110.132 -176.803 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 4' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.427 -1.617 0 N-CA-C 108.2 -1.037 . . . . 0.0 108.2 . . . . . . . . . 0 0 . 1 . 019 nuclear orig core ' A' A ' 5' ' ' ASP . . . . . 0.634 ' HB3' ' SG ' ' A' ' 11' ' ' CYS . 18.5 m-20 -55.91 131.33 46.82 Favored 'General case' 0 C--N 1.309 -1.155 0 O-C-N 123.96 0.787 . . . . 0.0 109.764 178.633 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 9.6 tp10 -61.71 139.39 58.31 Favored 'General case' 0 C--N 1.312 -1.049 0 C-N-CA 123.654 0.782 . . . . 0.0 110.854 -177.545 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 7' ' ' LYS . . . . . . . . . . . . . 18.6 ptpt -85.18 -26.56 26.71 Favored 'General case' 0 C--N 1.309 -1.162 0 N-CA-C 112.932 0.715 . . . . 0.0 112.932 -174.215 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 8' ' ' ASN . . . . . . . . . . . . . 10.5 p30 -92.62 7.38 43.62 Favored 'General case' 0 C--N 1.306 -1.305 0 CA-C-O 121.745 0.783 . . . . 0.0 110.415 178.453 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 9' ' ' PHE . . . . . . . . . . . . . 47.6 t80 -118.57 139.45 51.45 Favored 'General case' 0 N--CA 1.43 -1.464 0 N-CA-C 106.594 -1.632 . . . . 0.0 106.594 178.168 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 10' ' ' ASP . . . . . . . . . . . . . 10.2 t70 -96.96 105.05 17.11 Favored 'General case' 0 C--N 1.301 -1.519 0 C-N-CA 119.369 -0.932 . . . . 0.0 109.534 178.945 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 11' ' ' CYS . . . . . 0.634 ' SG ' ' HB3' ' A' ' 5' ' ' ASP . 73.9 m -74.94 -29.22 60.89 Favored 'General case' 0 C--N 1.292 -1.926 0 CA-C-N 115.642 -0.708 . . . . 0.0 112.866 -177.502 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 12' ' ' ARG . . . . . . . . . . . . . 20.0 mmm180 -72.07 -46.19 57.8 Favored 'General case' 0 CA--C 1.511 -0.536 0 C-N-CA 120.305 -0.558 . . . . 0.0 109.519 -176.09 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 41.0 ttp180 -59.08 -52.15 66.96 Favored 'General case' 0 C--O 1.205 -1.281 0 CA-C-N 114.851 -1.068 . . . . 0.0 109.421 177.996 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 14' ' ' SER . . . . . . . . . . . . . 40.6 m -58.33 -36.27 73.16 Favored 'General case' 0 C--N 1.32 -0.715 0 CA-C-N 116.066 -0.516 . . . . 0.0 111.742 -177.839 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 41.9 tp -69.73 -45.98 66.96 Favored 'General case' 0 N--CA 1.442 -0.846 0 CA-C-O 121.059 0.457 . . . . 0.0 110.065 178.987 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 16' ' ' ARG . . . . . 0.407 ' O ' ' HD2' ' A' ' 16' ' ' ARG . 2.4 tmm_? -68.54 -37.3 79.85 Favored 'General case' 0 N--CA 1.437 -1.095 0 CA-C-N 115.815 -0.63 . . . . 0.0 110.275 -179.349 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 17' ' ' ASN . . . . . . . . . . . . . 0.9 OUTLIER -68.37 -40.55 81.39 Favored 'General case' 0 CA--C 1.501 -0.92 0 CA-C-N 116.125 -0.488 . . . . 0.0 111.405 -178.535 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . 120.78 8.99 7.84 Favored Glycine 0 N--CA 1.435 -1.414 0 C-N-CA 119.869 -1.158 . . . . 0.0 112.252 -179.874 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 19' ' ' ASP . . . . . . . . . . . . . 3.5 m-20 -65.97 -29.1 69.44 Favored 'General case' 0 C--N 1.32 -0.715 0 CA-C-O 121.064 0.459 . . . . 0.0 110.811 -179.808 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 20' ' ' CYS . . . . . . . . . . . . . 45.6 t -92.69 0.28 57.4 Favored 'General case' 0 C--N 1.31 -1.121 0 CA-C-O 121.447 0.641 . . . . 0.0 110.331 -178.535 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 21' ' ' ASP . . . . . . . . . . . . . 31.8 t70 -113.09 -11.07 13.38 Favored 'General case' 0 C--N 1.317 -0.83 0 CA-C-O 122.036 0.922 . . . . 0.0 109.238 177.638 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 22' ' ' ASN . . . . . . . . . . . . . 8.6 t30 -87.98 117.33 26.77 Favored 'General case' 0 C--N 1.301 -1.539 0 CA-C-N 114.919 -1.037 . . . . 0.0 109.784 -178.382 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 23' ' ' ASP . . . . . . . . . . . . . 18.1 t70 -50.98 -45.55 61.01 Favored 'General case' 0 N--CA 1.477 0.888 0 N-CA-C 114.073 1.138 . . . . 0.0 114.073 -172.105 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 3.8 p30 -72.22 -10.02 59.23 Favored 'General case' 0 C--N 1.315 -0.915 0 N-CA-C 113.371 0.878 . . . . 0.0 113.371 -176.468 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 25' ' ' LYS . . . . . . . . . . . . . 87.8 mttt -107.67 -7.04 16.55 Favored 'General case' 0 C--N 1.322 -0.602 0 O-C-N 122.039 -0.413 . . . . 0.0 111.683 178.954 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 26' ' ' LEU . . . . . . . . . . . . . 92.8 mt -52.85 -51.89 59.26 Favored 'General case' 0 N--CA 1.472 0.633 0 N-CA-C 113.858 1.059 . . . . 0.0 113.858 -175.271 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 27' ' ' LEU . . . . . . . . . . . . . 2.3 tm? -58.5 -41.78 86.14 Favored 'General case' 0 N--CA 1.436 -1.149 0 C-N-CA 122.688 0.395 . . . . 0.0 109.965 -179.306 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 28' ' ' GLU . . . . . 0.579 ' HA ' ' CZ ' ' A' ' 31' ' ' TYR . 80.8 mt-10 -62.96 -37.16 85.99 Favored 'General case' 0 CA--C 1.511 -0.526 0 CA-C-N 116.021 -0.536 . . . . 0.0 110.038 179.309 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 29' ' ' MET . . . . . . . . . . . . . 81.3 mmm -72.94 -24.84 60.86 Favored 'General case' 0 C--N 1.309 -1.186 0 CA-C-N 115.252 -0.885 . . . . 0.0 110.765 -178.22 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 30' ' ' GLY . . . . . 0.449 ' HA2' ' CE1' ' A' ' 39' ' ' PHE . . . -68.74 -24.84 75.42 Favored Glycine 0 C--N 1.312 -0.787 0 CA-C-N 115.365 -0.834 . . . . 0.0 112.55 178.182 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 31' ' ' TYR . . . . . 0.579 ' CZ ' ' HA ' ' A' ' 28' ' ' GLU 0.255 22.5 p90 -101.52 -37.67 8.3 Favored 'General case' 0 CA--C 1.5 -0.942 0 C-N-CA 119.628 -0.829 . . . . 0.0 112.787 174.883 . . . . . . . . 3 3 . 1 . 019 nuclear orig core ' A' A ' 32' ' ' TYR . . . . . . . . . . . . . 28.2 m-85 -65.38 -49.28 69.91 Favored 'General case' 0 C--N 1.308 -1.226 0 N-CA-C 112.959 0.725 . . . . 0.0 112.959 176.61 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 33' ' ' CYS . . . . . . . . . . . . . 36.7 m -135.25 72.6 65.83 Favored Pre-proline 0 C--N 1.308 -1.222 0 C-N-CA 119.938 -0.705 . . . . 0.0 111.1 -177.074 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 34' ' ' PRO . . . . . . . . . . . . . 60.1 Cg_endo -69.26 -24.17 32.24 Favored 'Trans proline' 0 N--CA 1.45 -1.031 0 C-N-CA 122.261 1.974 . . . . 0.0 112.053 -177.436 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 35' ' ' VAL . . . . . 0.572 ' HB ' ' OD1' ' A' ' 5' ' ' ASP . 49.6 t -87.2 -46.13 16.21 Favored 'Isoleucine or valine' 0 C--N 1.301 -1.528 0 C-N-CA 119.907 -0.717 . . . . 0.0 110.571 -178.432 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 36' ' ' THR . . . . . . . . . . . . . 21.1 m -62.37 -37.18 84.73 Favored 'General case' 0 C--N 1.314 -0.955 0 CA-C-N 115.58 -0.737 . . . . 0.0 111.295 179.424 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 37' ' ' CYS . . . . . . . . . . . . . 84.4 m -92.37 11.18 26.89 Favored 'General case' 0 C--N 1.313 -0.98 0 N-CA-C 112.921 0.712 . . . . 0.0 112.921 -179.831 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 38' ' ' GLY . . . . . . . . . . . . . . . 68.85 45.5 64.02 Favored Glycine 0 CA--C 1.519 0.337 0 N-CA-C 116.002 1.161 . . . . 0.0 116.002 171.827 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 39' ' ' PHE . . . . . 0.449 ' CE1' ' HA2' ' A' ' 30' ' ' GLY . 96.8 m-85 -100.24 -30.98 11.6 Favored 'General case' 0 C--N 1.302 -1.488 0 N-CA-C 108.825 -0.805 . . . . 0.0 108.825 174.051 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 40' ' ' CYS . . . . . . . . . . . . . 75.6 m . . . . . 0 C--N 1.311 -1.095 0 CA-C-N 115.339 -0.846 . . . . 0.0 109.366 178.601 . . . . . . . . 0 0 . 1 . 020 nuclear orig core ' A' A ' 4' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.44 -0.934 0 N-CA-C 108.361 -0.977 . . . . 0.0 108.361 . . . . . . . . . 0 0 . 1 . 020 nuclear orig core ' A' A ' 5' ' ' ASP . . . . . 0.554 ' OD2' ' HB ' ' A' ' 35' ' ' VAL . 7.7 m-20 -70.11 148.68 48.45 Favored 'General case' 0 C--N 1.316 -0.859 0 N-CA-C 109.189 -0.671 . . . . 0.0 109.189 179.82 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 0.6 OUTLIER -72.52 152.08 42.09 Favored 'General case' 0 C--N 1.307 -1.259 0 N-CA-C 108.28 -1.007 . . . . 0.0 108.28 -179.095 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 7' ' ' LYS . . . . . . . . . . . . . 9.1 ptpp? -82.03 -35.32 28.94 Favored 'General case' 0 C--N 1.316 -0.879 0 N-CA-C 112.723 0.638 . . . . 0.0 112.723 -172.786 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 8' ' ' ASN . . . . . . . . . . . . . 30.7 m-80 -84.64 -31.21 24.32 Favored 'General case' 0 CA--C 1.486 -1.487 0 N-CA-C 109.29 -0.633 . . . . 0.0 109.29 -175.727 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 9' ' ' PHE . . . . . . . . . . . . . 26.6 t80 -75.12 129.05 36.9 Favored 'General case' 0 N--CA 1.424 -1.758 0 CA-C-N 114.901 -1.045 . . . . 0.0 108.744 -178.76 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 10' ' ' ASP . . . . . . . . . . . . . 9.1 t70 -89.43 102.65 15.32 Favored 'General case' 0 C--N 1.304 -1.385 0 N-CA-C 108.97 -0.752 . . . . 0.0 108.97 -179.461 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 11' ' ' CYS . . . . . 0.456 ' SG ' ' HB3' ' A' ' 5' ' ' ASP . 83.8 m -77.87 -28.55 50.04 Favored 'General case' 0 C--N 1.29 -2.018 0 CA-C-N 115.972 -0.558 . . . . 0.0 111.261 -177.299 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 12' ' ' ARG . . . . . . . . . . . . . 37.5 mmt180 -61.95 -50.27 72.82 Favored 'General case' 0 C--O 1.24 0.579 0 CA-C-O 120.998 0.428 . . . . 0.0 110.074 179.229 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 34.3 ttm180 -59.64 -55.11 38.55 Favored 'General case' 0 C--O 1.208 -1.107 0 CA-C-N 115.026 -0.988 . . . . 0.0 109.236 178.074 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 14' ' ' SER . . . . . . . . . . . . . 18.5 m -60.48 -36.61 78.71 Favored 'General case' 0 C--N 1.307 -1.26 0 CA-C-N 115.599 -0.728 . . . . 0.0 112.747 -174.094 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 45.8 tp -68.86 -47.77 65.1 Favored 'General case' 0 C--N 1.32 -0.68 0 C-N-CA 120.406 -0.517 . . . . 0.0 110.101 178.161 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 16' ' ' ARG . . . . . . . . . . . . . 60.7 mtp180 -71.78 -31.16 66.32 Favored 'General case' 0 C--N 1.324 -0.511 0 CA-C-N 115.923 -0.581 . . . . 0.0 112.008 -177.395 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 17' ' ' ASN . . . . . . . . . . . . . 0.9 OUTLIER -71.73 -33.2 68.51 Favored 'General case' 0 CA--C 1.494 -1.173 0 CA-C-N 116.424 -0.353 . . . . 0.0 111.467 -179.72 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . 116.81 10.2 10.31 Favored Glycine 0 N--CA 1.431 -1.671 0 C-N-CA 119.587 -1.292 . . . . 0.0 112.393 178.75 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 19' ' ' ASP . . . . . . . . . . . . . 4.1 m-20 -65.83 -35.5 80.84 Favored 'General case' 0 CA--C 1.494 -1.183 0 CA-C-O 121.156 0.503 . . . . 0.0 110.769 -179.018 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 20' ' ' CYS . . . . . . . . . . . . . 39.1 t -79.93 -12.45 59.73 Favored 'General case' 0 C--N 1.301 -1.513 0 CA-C-N 115.729 -0.668 . . . . 0.0 110.253 -176.758 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 21' ' ' ASP . . . . . . . . . . . . . 38.3 t70 -107.58 -0.36 22.08 Favored 'General case' 0 C--N 1.318 -0.797 0 CA-C-O 122.249 1.023 . . . . 0.0 109.146 177.108 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 22' ' ' ASN . . . . . . . . . . . . . 47.8 t-20 -87.83 118.77 27.58 Favored 'General case' 0 C--N 1.304 -1.379 0 CA-C-N 115.286 -0.87 . . . . 0.0 108.657 -179.509 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 23' ' ' ASP . . . . . 0.437 ' HA ' ' HG ' ' A' ' 26' ' ' LEU . 2.7 m-20 -53.08 -44.09 67.25 Favored 'General case' 0 C--N 1.32 -0.702 0 C-N-CA 123.694 0.798 . . . . 0.0 112.499 -177.566 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 23.0 t70 -64.69 -31.48 72.73 Favored 'General case' 0 C--N 1.318 -0.779 0 N-CA-C 112.122 0.416 . . . . 0.0 112.122 -178.737 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 25' ' ' LYS . . . . . . . . . . . . . 88.8 mttt -98.31 -5.29 33.25 Favored 'General case' 0 C--N 1.305 -1.326 0 N-CA-C 112.917 0.71 . . . . 0.0 112.917 -176.024 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 26' ' ' LEU . . . . . 0.437 ' HG ' ' HA ' ' A' ' 23' ' ' ASP . 83.9 mt -49.2 -54.36 16.92 Favored 'General case' 0 N--CA 1.482 1.172 0 N-CA-C 113.651 0.982 . . . . 0.0 113.651 -176.941 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 27' ' ' LEU . . . . . . . . . . . . . 2.2 tm? -57.71 -45.46 85.7 Favored 'General case' 0 N--CA 1.434 -1.251 0 N-CA-C 109.736 -0.468 . . . . 0.0 109.736 -177.503 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 28' ' ' GLU . . . . . . . . . . . . . 13.2 mm-40 -61.76 -37.66 85.14 Favored 'General case' 0 C--N 1.327 -0.402 0 CA-C-N 115.4 -0.818 . . . . 0.0 110.277 -178.047 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 29' ' ' MET . . . . . . . . . . . . . 80.2 mmm -73.76 -26.18 60.53 Favored 'General case' 0 C--N 1.307 -1.252 0 CA-C-N 114.907 -1.042 . . . . 0.0 111.609 -174.342 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 30' ' ' GLY . . . . . 0.449 ' HA2' ' CE2' ' A' ' 39' ' ' PHE . . . -68.07 -33.21 78.28 Favored Glycine 0 N--CA 1.439 -1.138 0 CA-C-N 115.46 -0.791 . . . . 0.0 112.758 -179.678 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 31' ' ' TYR . . . . . . . . . . . . . 44.8 p90 -96.98 -33.32 11.61 Favored 'General case' 0 CA--C 1.498 -1.028 0 C-N-CA 118.86 -1.136 . . . . 0.0 113.207 178.46 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 32' ' ' TYR . . . . . . . . . . . . . 36.5 m-85 -69.13 -42.99 75.27 Favored 'General case' 0 C--N 1.304 -1.413 0 N-CA-C 112.717 0.636 . . . . 0.0 112.717 175.96 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 33' ' ' CYS . . . . . . . . . . . . . 44.8 m -135.45 68.35 67.5 Favored Pre-proline 0 C--O 1.246 0.917 0 C-N-CA 120.194 -0.602 . . . . 0.0 112.007 -179.165 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 34' ' ' PRO . . . . . 0.449 ' HD2' ' HA ' ' A' ' 5' ' ' ASP . 58.4 Cg_endo -69.72 -23.65 30.73 Favored 'Trans proline' 0 C--N 1.355 0.889 0 C-N-CA 122.026 1.818 . . . . 0.0 111.931 -178.777 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 35' ' ' VAL . . . . . 0.554 ' HB ' ' OD2' ' A' ' 5' ' ' ASP . 66.1 t -86.54 -52.36 11.95 Favored 'Isoleucine or valine' 0 C--N 1.295 -1.797 0 C-N-CA 120.144 -0.622 . . . . 0.0 110.544 -178.086 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 36' ' ' THR . . . . . . . . . . . . . 23.3 m -60.41 -27.11 67.2 Favored 'General case' 0 CA--C 1.556 1.176 0 C-N-CA 123.188 0.595 . . . . 0.0 111.887 -178.195 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 37' ' ' CYS . . . . . . . . . . . . . 67.4 m -99.73 5.39 45.69 Favored 'General case' 0 C--N 1.319 -0.719 0 N-CA-C 113.792 1.034 . . . . 0.0 113.792 179.736 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 38' ' ' GLY . . . . . . . . . . . . . . . 76.93 34.72 41.57 Favored Glycine 0 CA--C 1.525 0.683 0 N-CA-C 115.426 0.931 . . . . 0.0 115.426 174.624 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 39' ' ' PHE . . . . . 0.449 ' CE2' ' HA2' ' A' ' 30' ' ' GLY . 90.2 m-85 -88.89 -44.37 10.51 Favored 'General case' 0 C--N 1.311 -1.079 0 N-CA-C 108.252 -1.018 . . . . 0.0 108.252 175.102 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 40' ' ' CYS . . . . . . . . . . . . . 57.9 m . . . . . 0 C--N 1.305 -1.359 0 CA-C-N 114.737 -1.119 . . . . 0.0 109.024 -179.266 . . . . . . . . 0 0 . 1 . 001 nuclear orig full ' A' A ' 1' ' ' GLU . . . . . . . . . . . . . 9.7 tp10 . . . . . 0 N--CA 1.445 -0.696 0 N-CA-C 109.368 -0.604 . . . . 0.0 109.368 . . . . . . . . . 0 0 . 1 . 001 nuclear orig full ' A' A ' 2' ' ' HIS . . . . . . . . . . . . . 40.0 m80 -84.92 112.29 20.44 Favored 'General case' 0 C--N 1.315 -0.911 0 N-CA-C 107.463 -1.31 . . . . 0.0 107.463 174.98 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 3' ' ' CYS . . . . . . . . . . . . . 23.6 p -85.04 146.76 27.01 Favored 'General case' 0 C--N 1.29 -2.01 0 CA-C-N 115.05 -0.977 . . . . 0.0 112.06 -171.702 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 4' ' ' ALA . . . . . . . . . . . . . . . -152.01 132.11 13.5 Favored 'General case' 0 C--N 1.306 -1.325 0 N-CA-C 108.353 -0.98 . . . . 0.0 108.353 177.65 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 5' ' ' ASP . . . . . 0.688 ' OD2' ' HB ' ' A' ' 35' ' ' VAL . 16.6 m-20 -59.85 141.56 55.16 Favored 'General case' 0 C--O 1.253 1.265 0 O-C-N 123.728 0.643 . . . . 0.0 110.068 177.001 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 0.2 OUTLIER -69.22 152.02 45.59 Favored 'General case' 0 C--N 1.307 -1.277 0 CA-C-N 115.678 -0.692 . . . . 0.0 109.63 -178.394 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 7' ' ' LYS . . . . . . . . . . . . . 8.6 ptpp? -85.61 -34.49 21.39 Favored 'General case' 0 C--N 1.31 -1.132 0 C-N-CA 123.659 0.784 . . . . 0.0 112.845 -175.875 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 8' ' ' ASN . . . . . . . . . . . . . 90.2 m-20 -94.33 -21.05 19.23 Favored 'General case' 0 C--N 1.299 -1.587 0 CA-C-N 115.978 -0.555 . . . . 0.0 111.108 -175.803 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 9' ' ' PHE . . . . . 0.58 ' HD2' ' SG ' ' A' ' 33' ' ' CYS . 37.3 t80 -83.55 129.42 34.97 Favored 'General case' 0 C--N 1.301 -1.507 0 N-CA-C 107.013 -1.477 . . . . 0.0 107.013 175.953 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 10' ' ' ASP . . . . . . . . . . . . . 12.5 t70 -86.76 107.05 18.09 Favored 'General case' 0 C--N 1.307 -1.28 0 C-N-CA 118.762 -1.175 . . . . 0.0 110.111 -179.831 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 11' ' ' CYS . . . . . 0.517 ' SG ' ' HB3' ' A' ' 5' ' ' ASP . 50.9 m -73.58 -27.34 61.26 Favored 'General case' 0 C--N 1.297 -1.706 0 CA-C-N 114.901 -1.045 . . . . 0.0 111.822 -176.406 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 12' ' ' ARG . . . . . . . . . . . . . 34.4 mmt180 -76.66 -45.88 28.01 Favored 'General case' 0 CA--C 1.506 -0.735 0 CA-C-O 120.859 0.362 . . . . 0.0 110.304 -175.217 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 37.2 ttm180 -61.26 -49.66 76.17 Favored 'General case' 0 C--N 1.31 -1.152 0 CA-C-N 115.384 -0.825 . . . . 0.0 109.239 178.616 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 14' ' ' SER . . . . . . . . . . . . . 23.7 m -59.86 -35.19 74.28 Favored 'General case' 0 CA--C 1.547 0.837 0 O-C-N 123.678 0.611 . . . . 0.0 111.629 -178.752 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 47.6 tp -71.69 -41.48 68.59 Favored 'General case' 0 C--N 1.322 -0.616 0 N-CA-C 109.643 -0.502 . . . . 0.0 109.643 178.316 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 16' ' ' ARG . . . . . . . . . . . . . 21.0 tpp180 -67.46 -35.06 78.46 Favored 'General case' 0 N--CA 1.427 -1.604 0 C-N-CA 123.9 0.88 . . . . 0.0 111.47 179.908 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 17' ' ' ASN . . . . . . . . . . . . . 86.0 m-20 -67.96 -47.4 68.75 Favored 'General case' 0 CA--C 1.5 -0.95 0 N-CA-C 108.611 -0.885 . . . . 0.0 108.611 178.266 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . 113.23 19.26 6.79 Favored Glycine 0 N--CA 1.421 -2.311 0 CA-C-N 114.426 -1.261 . . . . 0.0 110.518 -176.056 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 19' ' ' ASP . . . . . . . . . . . . . 10.4 m-20 -58.33 -38.99 78.26 Favored 'General case' 0 CA--C 1.5 -0.971 0 CA-C-O 121.276 0.56 . . . . 0.0 110.055 179.666 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 20' ' ' CYS . . . . . 0.406 ' HA ' ' HG3' ' A' ' 29' ' ' MET . 34.8 t -78.43 -4.01 46.24 Favored 'General case' 0 C--N 1.306 -1.296 0 CA-C-N 115.623 -0.717 . . . . 0.0 111.977 -176.395 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 21' ' ' ASP . . . . . . . . . . . . . 12.3 t70 -99.35 -9.72 23.18 Favored 'General case' 0 C--N 1.315 -0.923 0 CA-C-O 122.233 1.015 . . . . 0.0 108.469 178.402 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 22' ' ' ASN . . . . . . . . . . . . . 25.0 t-20 -84.3 122.59 29.12 Favored 'General case' 0 C--N 1.315 -0.915 0 CA-C-N 114.765 -1.107 . . . . 0.0 108.19 178.902 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 23' ' ' ASP . . . . . . . . . . . . . 20.1 t70 -55.2 -41.47 72.03 Favored 'General case' 0 C--N 1.318 -0.765 0 N-CA-C 113.266 0.839 . . . . 0.0 113.266 -176.368 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 14.4 m-20 -78.44 -16.33 57.69 Favored 'General case' 0 C--N 1.311 -1.073 0 CA-C-O 121.51 0.671 . . . . 0.0 111.405 -176.345 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 25' ' ' LYS . . . . . . . . . . . . . 34.9 mttm -95.06 -7.46 39.49 Favored 'General case' 0 C--N 1.303 -1.445 0 CA-C-N 115.87 -0.605 . . . . 0.0 111.74 176.588 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 26' ' ' LEU . . . . . . . . . . . . . 85.7 mt -55.74 -43.92 77.06 Favored 'General case' 0 C--N 1.314 -0.951 0 O-C-N 123.141 0.275 . . . . 0.0 111.043 176.881 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 27' ' ' LEU . . . . . . . . . . . . . 24.1 tp -57.21 -49.49 75.83 Favored 'General case' 0 N--CA 1.436 -1.162 0 CA-C-O 121.327 0.584 . . . . 0.0 109.498 176.987 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 28' ' ' GLU . . . . . . . . . . . . . 40.3 tt0 -58.19 -36.94 73.82 Favored 'General case' 0 C--N 1.325 -0.464 0 CA-C-N 114.559 -1.201 . . . . 0.0 109.977 -179.266 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 29' ' ' MET . . . . . 0.406 ' HG3' ' HA ' ' A' ' 20' ' ' CYS . 82.7 mmm -83.89 -23.23 31.33 Favored 'General case' 0 C--N 1.3 -1.554 0 CA-C-N 115.173 -0.921 . . . . 0.0 111.658 -174.825 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 30' ' ' GLY . . . . . . . . . . . . . . . -66.77 -28.46 73.78 Favored Glycine 0 C--N 1.308 -1.027 0 CA-C-N 115.192 -0.913 . . . . 0.0 112.234 179.638 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 31' ' ' TYR . . . . . . . . . . . . . 30.0 p90 -105.0 -34.01 8.14 Favored 'General case' 0 N--CA 1.435 -1.221 0 N-CA-C 113.404 0.89 . . . . 0.0 113.404 177.06 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 32' ' ' TYR . . . . . 0.421 ' HB3' ' CD2' ' A' ' 9' ' ' PHE . 19.2 m-85 -71.44 -62.05 1.55 Allowed 'General case' 0 C--N 1.308 -1.229 0 N-CA-C 113.623 0.971 . . . . 0.0 113.623 178.33 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 33' ' ' CYS . . . . . 0.58 ' SG ' ' HD2' ' A' ' 9' ' ' PHE . 62.6 m -134.31 70.3 73.17 Favored Pre-proline 0 C--N 1.299 -1.63 0 C-N-CA 119.896 -0.721 . . . . 0.0 110.988 -177.31 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 34' ' ' PRO . . . . . . . . . . . . . 71.7 Cg_endo -75.87 -23.77 12.11 Favored 'Trans proline' 0 N--CA 1.445 -1.331 0 C-N-CA 122.154 1.903 . . . . 0.0 112.438 -175.408 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 35' ' ' VAL . . . . . 0.688 ' HB ' ' OD2' ' A' ' 5' ' ' ASP . 39.3 t -82.73 -36.72 13.52 Favored 'Isoleucine or valine' 0 N--CA 1.424 -1.751 0 N-CA-C 108.826 -0.805 . . . . 0.0 108.826 -177.145 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 36' ' ' THR . . . . . . . . . . . . . 48.2 m -64.12 -34.86 79.01 Favored 'General case' 0 CA--C 1.546 0.804 0 CA-C-N 115.305 -0.861 . . . . 0.0 110.635 175.362 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 37' ' ' CYS . . . . . . . . . . . . . 90.9 m -84.79 2.11 43.71 Favored 'General case' 0 C--N 1.322 -0.59 0 CA-C-O 121.087 0.47 . . . . 0.0 112.243 177.767 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 38' ' ' GLY . . . . . . . . . . . . . . . 69.58 26.58 74.33 Favored Glycine 0 N--CA 1.445 -0.744 0 CA-C-N 116.124 -0.489 . . . . 0.0 114.224 176.086 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 39' ' ' PHE . . . . . . . . . . . . . 26.8 m-85 -75.05 -34.66 61.87 Favored 'General case' 0 CA--C 1.507 -0.687 0 N-CA-C 108.464 -0.939 . . . . 0.0 108.464 178.402 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 40' ' ' CYS . . . . . . . . . . . . . 3.3 p -159.55 86.28 0.79 Allowed 'General case' 0 C--N 1.306 -1.285 0 CA-C-N 114.537 -1.211 . . . . 0.0 109.989 -179.488 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 41' ' ' NH2 . . . . . . . . . . . . . . . . . . . . 0 C--N 1.307 -1.248 0 CA-C-N 116.11 -0.495 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 002 nuclear orig full ' A' A ' 1' ' ' GLU . . . . . . . . . . . . . 11.3 pt-20 . . . . . 0 C--O 1.236 0.375 0 N-CA-C 109.262 -0.644 . . . . 0.0 109.262 . . . . . . . . . 0 0 . 1 . 002 nuclear orig full ' A' A ' 2' ' ' HIS . . . . . . . . . . . . . 69.1 m-70 -107.1 112.18 24.98 Favored 'General case' 0 C--N 1.304 -1.39 0 N-CA-C 109.107 -0.701 . . . . 0.0 109.107 177.464 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 3' ' ' CYS . . . . . . . . . . . . . 26.3 p -71.58 102.59 2.77 Favored 'General case' 0 N--CA 1.438 -1.064 0 N-CA-C 108.501 -0.925 . . . . 0.0 108.501 176.073 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 4' ' ' ALA . . . . . . . . . . . . . . . -147.61 145.43 28.99 Favored 'General case' 0 C--N 1.305 -1.328 0 CA-C-N 115.685 -0.688 . . . . 0.0 109.571 -176.435 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 5' ' ' ASP . . . . . 0.62 ' OD2' ' HB ' ' A' ' 35' ' ' VAL . 4.2 m-20 -65.55 160.79 21.61 Favored 'General case' 0 C--N 1.307 -1.244 0 O-C-N 123.779 0.674 . . . . 0.0 109.803 179.381 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 0.6 OUTLIER -71.25 139.87 50.19 Favored 'General case' 0 C--N 1.309 -1.179 0 N-CA-C 106.537 -1.653 . . . . 0.0 106.537 179.147 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 7' ' ' LYS . . . . . . . . . . . . . 19.5 ptmt -82.19 -26.56 33.25 Favored 'General case' 0 C--N 1.303 -1.421 0 N-CA-C 113.691 0.997 . . . . 0.0 113.691 -171.098 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 8' ' ' ASN . . . . . . . . . . . . . 37.8 m-80 -89.86 -31.22 17.43 Favored 'General case' 0 C--N 1.294 -1.809 0 CA-C-O 121.451 0.644 . . . . 0.0 109.4 -179.23 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 9' ' ' PHE . . . . . 0.452 ' CD2' ' HB3' ' A' ' 32' ' ' TYR . 32.9 t80 -76.55 119.37 20.29 Favored 'General case' 0 N--CA 1.424 -1.771 0 N-CA-C 107.751 -1.203 . . . . 0.0 107.751 176.691 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 10' ' ' ASP . . . . . . . . . . . . . 15.4 t70 -88.39 96.14 10.48 Favored 'General case' 0 C--N 1.294 -1.828 0 N-CA-C 109.002 -0.74 . . . . 0.0 109.002 -179.905 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 11' ' ' CYS . . . . . . . . . . . . . 96.1 m -70.35 -19.53 63.04 Favored 'General case' 0 C--N 1.312 -1.036 0 CA-C-N 115.387 -0.824 . . . . 0.0 111.902 -178.441 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 12' ' ' ARG . . . . . . . . . . . . . 36.3 mmt180 -66.8 -43.36 84.06 Favored 'General case' 0 C--N 1.319 -0.746 0 N-CA-C 108.805 -0.813 . . . . 0.0 108.805 178.287 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 58.6 ttp180 -64.01 -50.08 69.91 Favored 'General case' 0 C--O 1.211 -0.953 0 CA-C-N 115.327 -0.851 . . . . 0.0 109.511 175.52 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 14' ' ' SER . . . . . . . . . . . . . 11.7 m -57.4 -40.07 77.46 Favored 'General case' 0 C--O 1.252 1.194 0 C-N-CA 122.909 0.483 . . . . 0.0 112.087 -178.621 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 46.0 tp -64.77 -41.14 96.1 Favored 'General case' 0 C--N 1.327 -0.388 0 CA-C-O 121.306 0.574 . . . . 0.0 110.259 179.686 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 16' ' ' ARG . . . . . . . . . . . . . 60.5 mtm180 -77.82 -28.2 50.2 Favored 'General case' 0 C--N 1.305 -1.342 0 CA-C-N 116.036 -0.529 . . . . 0.0 111.475 179.523 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 17' ' ' ASN . . . . . . . . . . . . . 0.9 OUTLIER -69.1 -25.93 64.67 Favored 'General case' 0 N--CA 1.477 0.899 0 CA-C-N 115.811 -0.631 . . . . 0.0 111.226 178.277 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . 102.89 6.4 46.11 Favored Glycine 0 N--CA 1.439 -1.101 0 C-N-CA 120.527 -0.844 . . . . 0.0 112.273 178.024 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 19' ' ' ASP . . . . . . . . . . . . . 15.6 m-20 -73.13 -27.25 61.57 Favored 'General case' 0 CA--C 1.504 -0.805 0 CA-C-O 120.937 0.398 . . . . 0.0 111.53 -178.631 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 20' ' ' CYS . . . . . . . . . . . . . 46.6 t -81.29 -9.91 59.67 Favored 'General case' 0 C--N 1.306 -1.303 0 CA-C-O 121.669 0.747 . . . . 0.0 110.051 179.92 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 21' ' ' ASP . . . . . . . . . . . . . 28.3 t70 -101.67 -8.9 21.37 Favored 'General case' 0 C--N 1.318 -0.791 0 CA-C-O 121.998 0.904 . . . . 0.0 108.946 177.509 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 22' ' ' ASN . . . . . . . . . . . . . 52.5 t-20 -88.09 123.06 32.38 Favored 'General case' 0 C--N 1.305 -1.368 0 CA-C-N 115.453 -0.794 . . . . 0.0 109.215 -178.896 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 23' ' ' ASP . . . . . . . . . . . . . 6.9 m-20 -59.38 -35.34 73.75 Favored 'General case' 0 CA--C 1.507 -0.688 0 C-N-CA 123.61 0.764 . . . . 0.0 111.466 179.857 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 11.8 t70 -66.6 -32.6 74.03 Favored 'General case' 0 C--N 1.311 -1.104 0 C-N-CA 123.59 0.756 . . . . 0.0 111.802 -179.207 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 25' ' ' LYS . . . . . 0.511 ' O ' ' HG2' ' A' ' 29' ' ' MET . 33.8 mmtp -94.01 -2.44 53.01 Favored 'General case' 0 C--N 1.31 -1.117 0 CA-C-N 116.124 -0.489 . . . . 0.0 112.234 -177.358 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 26' ' ' LEU . . . . . . . . . . . . . 88.6 mt -58.89 -38.6 79.22 Favored 'General case' 0 N--CA 1.469 0.504 0 N-CA-C 112.834 0.679 . . . . 0.0 112.834 -176.95 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 27' ' ' LEU . . . . . . . . . . . . . 24.4 tp -55.28 -49.89 70.93 Favored 'General case' 0 N--CA 1.437 -1.092 0 N-CA-C 109.436 -0.579 . . . . 0.0 109.436 176.376 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 28' ' ' GLU . . . . . . . . . . . . . 5.7 mm-40 -61.86 -36.78 82.26 Favored 'General case' 0 C--N 1.324 -0.518 0 CA-C-N 114.603 -1.18 . . . . 0.0 109.141 -179.22 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 29' ' ' MET . . . . . 0.511 ' HG2' ' O ' ' A' ' 25' ' ' LYS . 22.3 mmt -70.94 -27.45 63.77 Favored 'General case' 0 C--O 1.203 -1.384 0 CA-C-N 115.203 -0.908 . . . . 0.0 110.885 -175.324 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 30' ' ' GLY . . . . . . . . . . . . . . . -68.42 -34.4 79.49 Favored Glycine 0 C--N 1.312 -0.777 0 C-N-CA 120.186 -1.007 . . . . 0.0 112.768 -178.321 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 31' ' ' TYR . . . . . . . . . . . . . 36.3 p90 -103.15 -27.6 12.44 Favored 'General case' 0 N--CA 1.441 -0.883 0 N-CA-C 113.663 0.986 . . . . 0.0 113.663 179.913 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 32' ' ' TYR . . . . . 0.452 ' HB3' ' CD2' ' A' ' 9' ' ' PHE . 23.0 m-85 -83.35 -36.83 24.06 Favored 'General case' 0 C--N 1.29 -2.018 0 N-CA-C 112.626 0.602 . . . . 0.0 112.626 175.852 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 33' ' ' CYS . . . . . . . . . . . . . 61.0 m -134.71 49.86 4.26 Favored Pre-proline 0 CA--C 1.565 1.528 0 N-CA-C 113.369 0.878 . . . . 0.0 113.369 -174.893 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 34' ' ' PRO . . . . . 0.52 ' HD2' ' HA ' ' A' ' 5' ' ' ASP . 21.7 Cg_endo -57.33 -32.3 93.43 Favored 'Trans proline' 0 C--N 1.38 2.21 0 C-N-CA 122.733 2.289 . . . . 0.0 113.591 -178.916 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 35' ' ' VAL . . . . . 0.62 ' HB ' ' OD2' ' A' ' 5' ' ' ASP . 45.3 t -87.07 -46.76 16.21 Favored 'Isoleucine or valine' 0 C--N 1.299 -1.629 0 C-N-CA 119.917 -0.713 . . . . 0.0 110.892 -177.46 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 36' ' ' THR . . . . . . . . . . . . . 19.5 m -61.56 -40.95 96.56 Favored 'General case' 0 C--N 1.312 -1.053 0 CA-C-N 115.972 -0.558 . . . . 0.0 111.769 -177.336 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 37' ' ' CYS . . . . . . . . . . . . . 94.4 m -91.95 10.91 26.92 Favored 'General case' 0 C--N 1.312 -1.058 0 N-CA-C 113.173 0.805 . . . . 0.0 113.173 -179.163 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 38' ' ' GLY . . . . . . . . . . . . . . . 69.87 48.61 40.33 Favored Glycine 0 CA--C 1.524 0.645 0 N-CA-C 115.761 1.064 . . . . 0.0 115.761 172.908 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 39' ' ' PHE . . . . . 0.468 ' CD2' ' HA ' ' A' ' 34' ' ' PRO . 93.1 m-85 -96.32 -40.1 9.3 Favored 'General case' 0 C--N 1.303 -1.424 0 N-CA-C 107.749 -1.204 . . . . 0.0 107.749 173.183 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 40' ' ' CYS . . . . . . . . . . . . . 49.8 t -148.9 89.41 1.67 Allowed 'General case' 0 C--N 1.309 -1.156 0 N-CA-C 107.878 -1.156 . . . . 0.0 107.878 179.868 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 41' ' ' NH2 . . . . . . . . . . . . . . . . . . . . 0 C--N 1.302 -1.479 0 CA-C-N 116.657 -0.247 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 003 nuclear orig full ' A' A ' 1' ' ' GLU . . . . . . . . . . . . . 9.7 tp10 . . . . . 0 C--O 1.241 0.624 0 N-CA-C 108.46 -0.941 . . . . 0.0 108.46 . . . . . . . . . 0 0 . 1 . 003 nuclear orig full ' A' A ' 2' ' ' HIS . . . . . . . . . . . . . 40.4 m80 -96.42 110.36 22.73 Favored 'General case' 0 N--CA 1.432 -1.344 0 N-CA-C 108.711 -0.848 . . . . 0.0 108.711 178.728 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 3' ' ' CYS . . . . . 0.454 ' HB3' ' O ' ' A' ' 40' ' ' CYS . 60.7 m -87.46 84.9 7.09 Favored 'General case' 0 C--N 1.297 -1.705 0 CA-C-N 115.876 -0.602 . . . . 0.0 110.903 179.571 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 4' ' ' ALA . . . . . . . . . . . . . . . -152.5 133.68 14.28 Favored 'General case' 0 C--N 1.302 -1.486 0 N-CA-C 108.64 -0.874 . . . . 0.0 108.64 178.847 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 5' ' ' ASP . . . . . 0.573 ' HB3' ' SG ' ' A' ' 11' ' ' CYS . 44.4 m-20 -60.69 141.62 56.63 Favored 'General case' 0 C--N 1.317 -0.825 0 O-C-N 123.733 0.645 . . . . 0.0 110.2 178.945 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 13.3 tp10 -64.11 140.39 58.86 Favored 'General case' 0 N--CA 1.443 -0.825 0 C-N-CA 123.682 0.793 . . . . 0.0 111.543 -178.95 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 7' ' ' LYS . . . . . . . . . . . . . 10.3 ptpp? -85.18 -29.97 24.3 Favored 'General case' 0 N--CA 1.441 -0.905 0 C-N-CA 124.353 1.061 . . . . 0.0 111.227 -176.498 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 8' ' ' ASN . . . . . . . . . . . . . 44.9 m-80 -86.74 -9.17 56.52 Favored 'General case' 0 C--N 1.308 -1.208 0 CA-C-O 121.817 0.818 . . . . 0.0 110.83 -178.497 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 9' ' ' PHE . . . . . . . . . . . . . 36.5 t80 -112.16 144.96 40.68 Favored 'General case' 0 C--N 1.287 -2.12 0 N-CA-C 105.524 -2.028 . . . . 0.0 105.524 -178.834 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 10' ' ' ASP . . . . . . . . . . . . . 15.3 t70 -104.49 98.77 8.49 Favored 'General case' 0 C--N 1.304 -1.403 0 C-N-CA 117.779 -1.568 . . . . 0.0 110.417 179.274 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 11' ' ' CYS . . . . . 0.573 ' SG ' ' HB3' ' A' ' 5' ' ' ASP . 76.1 m -68.33 -20.34 64.72 Favored 'General case' 0 C--N 1.304 -1.393 0 CA-C-N 114.51 -1.223 . . . . 0.0 112.274 -177.924 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 12' ' ' ARG . . . . . . . . . . . . . 7.3 mmt180 -76.6 -46.58 25.51 Favored 'General case' 0 C--N 1.315 -0.899 0 N-CA-C 107.628 -1.249 . . . . 0.0 107.628 -176.793 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 54.9 ttp180 -61.91 -40.95 97.25 Favored 'General case' 0 C--O 1.213 -0.846 0 CA-C-N 115.501 -0.772 . . . . 0.0 109.504 175.51 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 14' ' ' SER . . . . . . . . . . . . . 23.4 m -65.84 -28.02 68.67 Favored 'General case' 0 C--N 1.318 -0.773 0 CA-C-O 121.18 0.515 . . . . 0.0 111.252 179.01 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 2.3 tm? -77.56 -39.36 46.04 Favored 'General case' 0 C--N 1.316 -0.87 0 N-CA-C 107.803 -1.184 . . . . 0.0 107.803 177.267 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 16' ' ' ARG . . . . . . . . . . . . . 23.7 mtp180 -68.24 -44.89 74.65 Favored 'General case' 0 C--N 1.323 -0.548 0 CA-C-N 115.633 -0.712 . . . . 0.0 111.817 179.326 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 17' ' ' ASN . . . . . . . . . . . . . 85.3 m-20 -64.96 -37.95 89.35 Favored 'General case' 0 CA--C 1.496 -1.131 0 CA-C-O 121.67 0.747 . . . . 0.0 109.111 177.164 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . 107.74 5.45 33.63 Favored Glycine 0 N--CA 1.416 -2.657 0 CA-C-N 114.652 -1.158 . . . . 0.0 111.5 -179.122 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 19' ' ' ASP . . . . . . . . . . . . . 30.5 m-20 -57.9 -38.22 75.44 Favored 'General case' 0 N--CA 1.494 1.775 0 CA-C-O 121.618 0.723 . . . . 0.0 109.299 179.345 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 20' ' ' CYS . . . . . . . . . . . . . 44.5 t -61.45 -25.55 67.3 Favored 'General case' 0 C--N 1.31 -1.144 0 CA-C-N 114.198 -1.365 . . . . 0.0 111.982 -178.117 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 21' ' ' ASP . . . . . . . . . . . . . 28.5 t70 -111.28 -9.25 14.3 Favored 'General case' 0 C--N 1.319 -0.725 0 CA-C-O 121.646 0.736 . . . . 0.0 110.248 -179.194 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 22' ' ' ASN . . . . . . . . . . . . . 51.8 t-20 -75.54 119.51 19.7 Favored 'General case' 0 C--N 1.313 -0.996 0 CA-C-N 115.317 -0.856 . . . . 0.0 108.904 -177.272 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 23' ' ' ASP . . . . . . . . . . . . . 6.1 m-20 -54.06 -36.71 63.4 Favored 'General case' 0 CA--C 1.501 -0.914 0 C-N-CA 123.545 0.738 . . . . 0.0 112.505 -177.906 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 35.8 m-20 -72.62 -21.41 61.11 Favored 'General case' 0 C--N 1.308 -1.205 0 CA-C-N 115.969 -0.56 . . . . 0.0 111.504 -175.549 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 25' ' ' LYS . . . . . 0.525 ' O ' ' HG2' ' A' ' 29' ' ' MET . 13.3 mptt -104.6 -5.19 21.69 Favored 'General case' 0 C--N 1.311 -1.08 0 N-CA-C 112.1 0.407 . . . . 0.0 112.1 178.29 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 26' ' ' LEU . . . . . . . . . . . . . 62.8 mt -52.07 -38.88 58.63 Favored 'General case' 0 N--CA 1.479 0.981 0 N-CA-C 114.657 1.354 . . . . 0.0 114.657 -175.162 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 27' ' ' LEU . . . . . . . . . . . . . 29.6 tp -54.81 -52.72 61.82 Favored 'General case' 0 N--CA 1.44 -0.953 0 CA-C-O 121.048 0.451 . . . . 0.0 109.935 178.059 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 28' ' ' GLU . . . . . 0.492 ' HA ' ' CE2' ' A' ' 31' ' ' TYR . 43.6 mt-10 -65.2 -33.2 75.43 Favored 'General case' 0 N--CA 1.442 -0.829 0 CA-C-N 115.296 -0.865 . . . . 0.0 109.685 -178.197 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 29' ' ' MET . . . . . 0.525 ' HG2' ' O ' ' A' ' 25' ' ' LYS . 72.7 mmm -75.75 -26.54 57.5 Favored 'General case' 0 C--N 1.31 -1.151 0 CA-C-N 115.263 -0.88 . . . . 0.0 111.003 -174.71 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 30' ' ' GLY . . . . . 0.457 ' HA2' ' CE2' ' A' ' 39' ' ' PHE . . . -65.63 -37.31 93.45 Favored Glycine 0 CA--C 1.494 -1.232 0 O-C-N 123.944 0.778 . . . . 0.0 112.174 -178.955 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 31' ' ' TYR . . . . . 0.492 ' CE2' ' HA ' ' A' ' 28' ' ' GLU . 52.3 p90 -96.72 -34.74 11.24 Favored 'General case' 0 N--CA 1.433 -1.307 0 C-N-CA 119.697 -0.801 . . . . 0.0 112.755 178.901 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 32' ' ' TYR . . . . . . . . . . . . . 27.5 m-85 -69.71 -50.42 43.79 Favored 'General case' 0 C--N 1.312 -1.024 0 N-CA-C 112.954 0.724 . . . . 0.0 112.954 177.403 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 33' ' ' CYS . . . . . . . . . . . . . 29.8 m -130.45 69.58 82.16 Favored Pre-proline 0 C--O 1.259 1.574 0 C-N-CA 120.128 -0.629 . . . . 0.0 111.388 -175.836 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 34' ' ' PRO . . . . . . . . . . . . . 38.2 Cg_endo -65.28 -26.54 56.37 Favored 'Trans proline' 0 C--N 1.362 1.268 0 C-N-CA 122.429 2.086 . . . . 0.0 112.067 -177.944 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 35' ' ' VAL . . . . . . . . . . . . . 33.5 t -86.78 -49.89 14.52 Favored 'Isoleucine or valine' 0 N--CA 1.433 -1.302 0 CA-C-N 116.091 -0.504 . . . . 0.0 110.966 -176.198 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 36' ' ' THR . . . . . 0.475 ' HG1' ' CG ' ' A' ' 5' ' ' ASP . 29.0 m -55.68 -52.14 64.87 Favored 'General case' 0 C--N 1.316 -0.875 0 C-N-CA 123.28 0.632 . . . . 0.0 112.644 -177.685 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 37' ' ' CYS . . . . . 0.565 ' HB2' ' CE2' ' A' ' 39' ' ' PHE . 59.6 m -76.83 -11.43 59.83 Favored 'General case' 0 C--N 1.305 -1.333 0 N-CA-C 112.659 0.614 . . . . 0.0 112.659 -176.886 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 38' ' ' GLY . . . . . . . . . . . . . . . 88.97 46.78 4.38 Favored Glycine 0 N--CA 1.442 -0.96 0 C-N-CA 120.391 -0.909 . . . . 0.0 113.724 176.827 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 39' ' ' PHE . . . . . 0.565 ' CE2' ' HB2' ' A' ' 37' ' ' CYS . 98.1 m-85 -98.31 -59.88 1.66 Allowed 'General case' 0 C--N 1.308 -1.225 0 N-CA-C 108.51 -0.922 . . . . 0.0 108.51 176.374 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 40' ' ' CYS . . . . . 0.454 ' O ' ' HB3' ' A' ' 3' ' ' CYS . 42.2 t -147.72 101.69 3.35 Favored 'General case' 0 C--N 1.307 -1.271 0 N-CA-C 108.05 -1.093 . . . . 0.0 108.05 -177.065 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 41' ' ' NH2 . . . . . . . . . . . . . . . . . . . . 0 C--N 1.303 -1.417 0 O-C-N 122.369 -0.207 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 004 nuclear orig full ' A' A ' 1' ' ' GLU . . . . . . . . . . . . . 7.1 tp10 . . . . . 0 N--CA 1.452 -0.326 0 N-CA-C 109.084 -0.71 . . . . 0.0 109.084 . . . . . . . . . 0 0 . 1 . 004 nuclear orig full ' A' A ' 2' ' ' HIS . . . . . . . . . . . . . 21.5 p80 -87.7 116.95 26.19 Favored 'General case' 0 C--N 1.313 -0.99 0 C-N-CA 119.696 -0.802 . . . . 0.0 108.975 176.006 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 3' ' ' CYS . . . . . . . . . . . . . 22.5 p -81.8 112.39 18.9 Favored 'General case' 0 C--N 1.302 -1.469 0 CA-C-N 115.93 -0.577 . . . . 0.0 110.184 -177.296 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 4' ' ' ALA . . . . . . . . . . . . . . . -143.7 135.7 26.59 Favored 'General case' 0 C--N 1.309 -1.175 0 N-CA-C 109.879 -0.415 . . . . 0.0 109.879 -179.861 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 5' ' ' ASP . . . . . 0.426 ' HA ' ' HD2' ' A' ' 34' ' ' PRO . 61.4 m-20 -66.24 149.8 49.79 Favored 'General case' 0 C--O 1.256 1.414 0 N-CA-C 109.174 -0.676 . . . . 0.0 109.174 176.182 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 10.4 tp10 -65.81 144.64 56.72 Favored 'General case' 0 C--N 1.302 -1.484 0 C-N-CA 123.665 0.786 . . . . 0.0 110.679 -179.243 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 7' ' ' LYS . . . . . . . . . . . . . 11.3 ptpp? -85.45 -25.78 26.72 Favored 'General case' 0 C--N 1.321 -0.631 0 CA-C-O 121.047 0.451 . . . . 0.0 111.927 -174.76 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 8' ' ' ASN . . . . . . . . . . . . . 10.7 p30 -98.05 5.33 48.83 Favored 'General case' 0 C--N 1.313 -0.992 0 CA-C-O 121.471 0.653 . . . . 0.0 111.11 -179.361 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 9' ' ' PHE . . . . . . . . . . . . . 39.2 t80 -120.99 141.01 51.11 Favored 'General case' 0 C--N 1.298 -1.659 0 N-CA-C 107.21 -1.404 . . . . 0.0 107.21 -178.731 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 10' ' ' ASP . . . . . . . . . . . . . 14.1 t70 -104.53 107.78 18.88 Favored 'General case' 0 N--CA 1.434 -1.231 0 C-N-CA 118.792 -1.163 . . . . 0.0 110.295 179.026 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 11' ' ' CYS . . . . . . . . . . . . . 72.1 m -78.01 -22.75 48.8 Favored 'General case' 0 C--N 1.278 -2.535 0 CA-C-N 114.748 -1.114 . . . . 0.0 112.997 -177.499 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 12' ' ' ARG . . . . . 0.438 ' O ' ' HG3' ' A' ' 16' ' ' ARG . 18.9 mmm180 -68.84 -45.25 71.62 Favored 'General case' 0 C--N 1.323 -0.545 0 N-CA-C 108.86 -0.793 . . . . 0.0 108.86 177.633 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 39.4 ttm180 -57.45 -48.77 78.29 Favored 'General case' 0 C--N 1.312 -1.037 0 CA-C-N 115.19 -0.914 . . . . 0.0 110.236 176.441 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 14' ' ' SER . . . . . . . . . . . . . 24.0 m -59.96 -35.09 74.21 Favored 'General case' 0 C--N 1.313 -1.0 0 CA-C-N 115.455 -0.793 . . . . 0.0 110.995 178.981 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 15' ' ' LEU . . . . . 0.406 ' HA ' ' HB3' ' A' ' 20' ' ' CYS . 35.0 tp -72.66 -40.87 65.98 Favored 'General case' 0 C--N 1.32 -0.699 0 CA-C-N 116.113 -0.494 . . . . 0.0 110.306 178.769 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 16' ' ' ARG . . . . . 0.438 ' HG3' ' O ' ' A' ' 12' ' ' ARG . 97.8 mtt180 -68.29 -31.45 70.89 Favored 'General case' 0 C--N 1.316 -0.867 0 N-CA-C 112.44 0.533 . . . . 0.0 112.44 -179.889 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 17' ' ' ASN . . . . . . . . . . . . . 40.4 m-80 -88.7 -24.16 22.79 Favored 'General case' 0 CA--C 1.497 -1.088 0 N-CA-C 113.353 0.871 . . . . 0.0 113.353 -177.384 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . 110.42 5.11 28.39 Favored Glycine 0 C--N 1.301 -1.365 0 C-N-CA 119.044 -1.55 . . . . 0.0 112.834 178.654 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 19' ' ' ASP . . . . . . . . . . . . . 21.5 m-20 -70.23 -32.64 70.6 Favored 'General case' 0 CA--C 1.498 -1.025 0 CA-C-O 121.429 0.633 . . . . 0.0 109.564 -179.697 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 20' ' ' CYS . . . . . 0.406 ' HB3' ' HA ' ' A' ' 15' ' ' LEU . 45.4 t -78.5 -11.91 59.98 Favored 'General case' 0 C--N 1.304 -1.388 0 CA-C-N 114.624 -1.171 . . . . 0.0 110.419 -178.694 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 21' ' ' ASP . . . . . . . . . . . . . 26.5 t70 -106.33 -10.26 16.44 Favored 'General case' 0 C--N 1.319 -0.741 0 CA-C-O 121.651 0.739 . . . . 0.0 110.167 -179.531 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 22' ' ' ASN . . . . . 0.402 ' O ' ' HG ' ' A' ' 26' ' ' LEU . 25.9 t-20 -86.13 121.62 28.99 Favored 'General case' 0 C--N 1.302 -1.483 0 CA-C-N 115.237 -0.892 . . . . 0.0 109.984 -175.332 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 23' ' ' ASP . . . . . . . . . . . . . 24.7 t70 -61.18 -38.47 86.62 Favored 'General case' 0 C--N 1.32 -0.704 0 O-C-N 123.576 0.548 . . . . 0.0 112.453 -174.757 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 13.8 m-20 -64.8 -32.67 74.46 Favored 'General case' 0 N--CA 1.482 1.164 0 CA-C-O 121.466 0.651 . . . . 0.0 110.814 179.235 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 25' ' ' LYS . . . . . 0.457 ' O ' ' HG2' ' A' ' 29' ' ' MET . 13.5 mmmm -88.11 -11.49 46.86 Favored 'General case' 0 C--N 1.311 -1.073 0 CA-C-N 115.671 -0.695 . . . . 0.0 111.605 -177.162 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 26' ' ' LEU . . . . . 0.402 ' HG ' ' O ' ' A' ' 22' ' ' ASN . 60.1 mt -58.1 -31.25 66.95 Favored 'General case' 0 C--O 1.221 -0.422 0 N-CA-C 114.132 1.16 . . . . 0.0 114.132 -176.421 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 27' ' ' LEU . . . . . . . . . . . . . 34.3 tp -56.35 -52.03 66.07 Favored 'General case' 0 N--CA 1.44 -0.955 0 CA-C-O 121.441 0.639 . . . . 0.0 109.356 176.445 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 28' ' ' GLU . . . . . 0.539 ' HA ' ' CE2' ' A' ' 31' ' ' TYR . 44.5 mt-10 -65.93 -31.83 72.98 Favored 'General case' 0 N--CA 1.434 -1.246 0 CA-C-N 114.679 -1.146 . . . . 0.0 109.606 179.884 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 29' ' ' MET . . . . . 0.457 ' HG2' ' O ' ' A' ' 25' ' ' LYS . 22.2 mmt -74.21 -24.77 59.38 Favored 'General case' 0 C--O 1.196 -1.754 0 CA-C-N 115.924 -0.58 . . . . 0.0 110.193 -176.623 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 30' ' ' GLY . . . . . . . . . . . . . . . -71.01 -25.47 75.71 Favored Glycine 0 N--CA 1.448 -0.501 0 C-N-CA 120.501 -0.857 . . . . 0.0 112.046 -179.489 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 31' ' ' TYR . . . . . 0.539 ' CE2' ' HA ' ' A' ' 28' ' ' GLU . 52.7 p90 -105.33 -34.65 7.79 Favored 'General case' 0 N--CA 1.429 -1.482 0 C-N-CA 119.342 -0.943 . . . . 0.0 113.142 176.921 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 32' ' ' TYR . . . . . . . . . . . . . 32.8 m-85 -74.11 -43.56 57.12 Favored 'General case' 0 C--N 1.302 -1.49 0 C-N-CA 120.8 -0.36 . . . . 0.0 111.964 176.075 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 33' ' ' CYS . . . . . . . . . . . . . 39.9 m -135.44 57.61 20.92 Favored Pre-proline 0 C--O 1.253 1.243 0 N-CA-C 112.889 0.7 . . . . 0.0 112.889 -172.799 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 34' ' ' PRO . . . . . 0.459 ' HA ' ' CD2' ' A' ' 39' ' ' PHE . 37.5 Cg_endo -64.19 -27.08 64.59 Favored 'Trans proline' 0 C--N 1.364 1.345 0 C-N-CA 121.874 1.716 . . . . 0.0 111.798 -179.041 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 35' ' ' VAL . . . . . . . . . . . . . 44.4 t -86.95 -56.48 5.24 Favored 'Isoleucine or valine' 0 N--CA 1.43 -1.448 0 CA-C-N 115.794 -0.639 . . . . 0.0 110.945 -177.197 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 36' ' ' THR . . . . . . . . . . . . . 97.4 m -59.27 -39.82 84.13 Favored 'General case' 0 CA--C 1.549 0.907 0 N-CA-C 112.738 0.644 . . . . 0.0 112.738 -177.217 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 37' ' ' CYS . . . . . . . . . . . . . 90.4 m -81.16 2.2 28.61 Favored 'General case' 0 C--N 1.31 -1.11 0 N-CA-C 113.235 0.828 . . . . 0.0 113.235 -179.843 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 38' ' ' GLY . . . . . . . . . . . . . . . 77.12 23.39 68.86 Favored Glycine 0 N--CA 1.447 -0.584 0 N-CA-C 114.901 0.721 . . . . 0.0 114.901 174.123 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 39' ' ' PHE . . . . . 0.459 ' CD2' ' HA ' ' A' ' 34' ' ' PRO . 97.9 m-85 -72.45 -51.17 21.43 Favored 'General case' 0 C--N 1.317 -0.828 0 N-CA-C 106.917 -1.512 . . . . 0.0 106.917 175.273 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 40' ' ' CYS . . . . . . . . . . . . . 51.3 t -127.07 91.52 3.35 Favored 'General case' 0 N--CA 1.43 -1.467 0 CA-C-N 114.168 -1.378 . . . . 0.0 108.028 178.433 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 41' ' ' NH2 . . . . . . . . . . . . . . . . . . . . 0 C--N 1.302 -1.468 0 CA-C-N 116.48 -0.327 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 005 nuclear orig full ' A' A ' 1' ' ' GLU . . . . . . . . . . . . . 41.4 tt0 . . . . . 0 CA--C 1.503 -0.849 0 N-CA-C 109.788 -0.449 . . . . 0.0 109.788 . . . . . . . . . 0 0 . 1 . 005 nuclear orig full ' A' A ' 2' ' ' HIS . . . . . . . . . . . . . 4.0 p80 -106.92 116.9 32.73 Favored 'General case' 0 C--N 1.293 -1.851 0 N-CA-C 108.269 -1.012 . . . . 0.0 108.269 173.817 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 3' ' ' CYS . . . . . . . . . . . . . 69.1 m -79.34 83.51 5.36 Favored 'General case' 0 C--N 1.294 -1.81 0 CA-C-O 121.966 0.889 . . . . 0.0 111.409 -178.935 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 4' ' ' ALA . . . . . . . . . . . . . . . -152.24 115.52 4.72 Favored 'General case' 0 N--CA 1.427 -1.585 0 CA-C-N 114.164 -1.38 . . . . 0.0 108.107 177.809 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 5' ' ' ASP . . . . . 0.627 ' OD2' ' HB ' ' A' ' 35' ' ' VAL . 11.0 m-20 -60.89 146.21 47.4 Favored 'General case' 0 C--N 1.316 -0.857 0 N-CA-C 109.407 -0.59 . . . . 0.0 109.407 175.124 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 9.7 tp10 -72.15 142.03 49.1 Favored 'General case' 0 C--N 1.31 -1.15 0 C-N-CA 123.077 0.551 . . . . 0.0 111.006 -178.781 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 7' ' ' LYS . . . . . . . . . . . . . 18.3 ptmt -85.72 -27.87 25.0 Favored 'General case' 0 C--N 1.326 -0.416 0 CA-C-O 122.32 1.057 . . . . 0.0 110.812 179.663 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 8' ' ' ASN . . . . . . . . . . . . . 19.5 m120 -88.06 15.76 6.96 Favored 'General case' 0 C--N 1.305 -1.365 0 CA-C-N 114.819 -1.082 . . . . 0.0 110.616 -178.713 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 9' ' ' PHE . . . . . . . . . . . . . 40.3 t80 -142.17 143.24 32.87 Favored 'General case' 0 N--CA 1.414 -2.255 0 N-CA-C 104.59 -2.374 . . . . 0.0 104.59 179.275 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 10' ' ' ASP . . . . . 0.411 ' OD1' ' HD3' ' A' ' 12' ' ' ARG . 20.1 t70 -104.7 104.0 13.72 Favored 'General case' 0 C--N 1.302 -1.458 0 C-N-CA 118.144 -1.422 . . . . 0.0 111.009 179.062 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 11' ' ' CYS . . . . . 0.493 ' SG ' ' HB3' ' A' ' 5' ' ' ASP . 71.7 m -71.32 -16.2 62.44 Favored 'General case' 0 C--N 1.301 -1.511 0 CA-C-N 115.073 -0.967 . . . . 0.0 113.562 -177.885 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 12' ' ' ARG . . . . . 0.412 ' O ' ' HG3' ' A' ' 16' ' ' ARG . 3.9 mpt_? -70.5 -51.22 30.44 Favored 'General case' 0 CA--C 1.493 -1.215 0 N-CA-C 106.62 -1.622 . . . . 0.0 106.62 178.533 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 41.3 ttm180 -49.77 -53.01 27.67 Favored 'General case' 0 C--N 1.319 -0.725 0 CA-C-N 114.168 -1.378 . . . . 0.0 110.513 175.905 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 14' ' ' SER . . . . . . . . . . . . . 12.2 m -55.18 -38.76 68.75 Favored 'General case' 0 C--O 1.253 1.283 0 CA-C-N 115.923 -0.581 . . . . 0.0 111.691 179.748 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 15' ' ' LEU . . . . . 0.409 ' HA ' ' HB3' ' A' ' 20' ' ' CYS . 30.6 tp -79.03 -36.94 40.28 Favored 'General case' 0 C--N 1.327 -0.393 0 CA-C-N 116.436 -0.347 . . . . 0.0 111.008 -178.323 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 16' ' ' ARG . . . . . 0.412 ' HG3' ' O ' ' A' ' 12' ' ' ARG . 98.4 mtt180 -65.92 -37.23 85.54 Favored 'General case' 0 C--N 1.315 -0.895 0 CA-C-O 121.296 0.569 . . . . 0.0 110.707 177.966 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 17' ' ' ASN . . . . . . . . . . . . . 91.9 m-20 -76.0 -43.32 44.84 Favored 'General case' 0 CA--C 1.494 -1.201 0 CA-C-N 115.771 -0.649 . . . . 0.0 110.531 179.152 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . 112.94 7.36 21.76 Favored Glycine 0 C--N 1.297 -1.635 0 C-N-CA 119.882 -1.151 . . . . 0.0 111.783 177.794 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 19' ' ' ASP . . . . . . . . . . . . . 12.7 m-20 -68.87 -31.81 71.02 Favored 'General case' 0 C--O 1.212 -0.906 0 N-CA-C 108.267 -1.012 . . . . 0.0 108.267 177.918 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 20' ' ' CYS . . . . . 0.409 ' HB3' ' HA ' ' A' ' 15' ' ' LEU . 45.3 t -69.84 -10.06 57.04 Favored 'General case' 0 C--N 1.309 -1.179 0 CA-C-N 114.076 -1.42 . . . . 0.0 111.272 -179.264 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 21' ' ' ASP . . . . . . . . . . . . . 35.1 t70 -116.69 -8.92 11.38 Favored 'General case' 0 N--CA 1.468 0.43 0 CA-C-O 121.446 0.641 . . . . 0.0 110.388 -179.597 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 22' ' ' ASN . . . . . 0.481 ' O ' ' HG ' ' A' ' 26' ' ' LEU . 34.5 t30 -87.83 128.9 35.34 Favored 'General case' 0 C--N 1.324 -0.541 0 CA-C-N 115.575 -0.739 . . . . 0.0 111.706 -175.925 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 23' ' ' ASP . . . . . . . . . . . . . 5.6 p-10 -52.05 -43.94 64.04 Favored 'General case' 0 C--O 1.241 0.622 0 C-N-CA 124.84 1.256 . . . . 0.0 113.826 -176.057 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 2.8 p30 -74.17 -13.86 60.87 Favored 'General case' 0 N--CA 1.473 0.714 0 C-N-CA 120.331 -0.548 . . . . 0.0 112.404 -176.272 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 25' ' ' LYS . . . . . 0.464 ' O ' ' HG2' ' A' ' 29' ' ' MET . 46.5 mmtm -100.05 -13.35 19.07 Favored 'General case' 0 C--N 1.309 -1.17 0 C-N-CA 120.916 -0.314 . . . . 0.0 110.898 179.795 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 26' ' ' LEU . . . . . 0.481 ' HG ' ' O ' ' A' ' 22' ' ' ASN . 84.6 mt -56.67 -40.96 76.46 Favored 'General case' 0 C--O 1.2 -1.528 0 N-CA-C 115.4 1.63 . . . . 0.0 115.4 -171.707 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 27' ' ' LEU . . . . . . . . . . . . . 20.1 tp -61.01 -44.83 96.84 Favored 'General case' 0 N--CA 1.442 -0.851 0 CA-C-N 119.042 0.837 . . . . 0.0 110.007 -179.377 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 28' ' ' GLU . . . . . 0.493 ' HA ' ' CE1' ' A' ' 31' ' ' TYR . 40.1 tt0 -65.6 -34.27 77.84 Favored 'General case' 0 C--O 1.242 0.695 0 CA-C-N 115.431 -0.804 . . . . 0.0 108.969 178.945 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 29' ' ' MET . . . . . 0.464 ' HG2' ' O ' ' A' ' 25' ' ' LYS . 25.0 mmt -75.22 -23.58 57.6 Favored 'General case' 0 C--O 1.202 -1.434 0 CA-C-N 114.844 -1.071 . . . . 0.0 109.488 -178.365 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 30' ' ' GLY . . . . . . . . . . . . . . . -62.45 -40.75 99.48 Favored Glycine 0 N--CA 1.436 -1.325 0 CA-C-N 116.165 -0.471 . . . . 0.0 111.947 -179.678 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 31' ' ' TYR . . . . . 0.493 ' CE1' ' HA ' ' A' ' 28' ' ' GLU . 29.7 p90 -93.29 -35.8 12.89 Favored 'General case' 0 C--N 1.305 -1.367 0 C-N-CA 119.704 -0.799 . . . . 0.0 112.859 179.03 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 32' ' ' TYR . . . . . . . . . . . . . 24.8 m-85 -73.12 -44.54 60.09 Favored 'General case' 0 C--N 1.309 -1.156 0 N-CA-C 114.173 1.175 . . . . 0.0 114.173 178.076 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 33' ' ' CYS . . . . . . . . . . . . . 62.3 m -138.19 60.72 23.42 Favored Pre-proline 0 C--N 1.308 -1.214 0 N-CA-C 111.596 0.221 . . . . 0.0 111.596 -175.602 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 34' ' ' PRO . . . . . 0.437 ' HD2' ' HA ' ' A' ' 5' ' ' ASP . 32.1 Cg_endo -63.22 -29.57 73.61 Favored 'Trans proline' 0 C--N 1.363 1.305 0 C-N-CA 122.008 1.805 . . . . 0.0 112.279 -176.927 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 35' ' ' VAL . . . . . 0.627 ' HB ' ' OD2' ' A' ' 5' ' ' ASP . 43.3 t -87.35 -46.36 16.13 Favored 'Isoleucine or valine' 0 N--CA 1.428 -1.549 0 CA-C-N 116.149 -0.478 . . . . 0.0 111.656 -175.835 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 36' ' ' THR . . . . . . . . . . . . . 22.1 m -65.23 -38.6 90.91 Favored 'General case' 0 C--N 1.315 -0.892 0 CA-C-N 116.119 -0.491 . . . . 0.0 111.228 -178.8 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 37' ' ' CYS . . . . . 0.417 ' SG ' ' HB3' ' A' ' 29' ' ' MET . 76.4 m -84.73 0.99 48.59 Favored 'General case' 0 C--N 1.316 -0.88 0 N-CA-C 112.845 0.683 . . . . 0.0 112.845 -178.978 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 38' ' ' GLY . . . . . . . . . . . . . . . 81.61 21.31 62.16 Favored Glycine 0 N--CA 1.448 -0.533 0 N-CA-C 116.028 1.171 . . . . 0.0 116.028 172.777 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 39' ' ' PHE . . . . . . . . . . . . . 97.4 m-85 -73.53 -44.64 57.11 Favored 'General case' 0 CA--C 1.501 -0.904 0 N-CA-C 107.481 -1.303 . . . . 0.0 107.481 175.021 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 40' ' ' CYS . . . . . . . . . . . . . 61.5 m -106.63 97.74 7.5 Favored 'General case' 0 C--N 1.295 -1.765 0 CA-C-N 114.237 -1.347 . . . . 0.0 108.088 176.591 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 41' ' ' NH2 . . . . . . . . . . . . . . . . . . . . 0 C--N 1.31 -1.111 0 CA-C-N 116.755 -0.202 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 006 nuclear orig full ' A' A ' 1' ' ' GLU . . . . . . . . . . . . . 9.7 pt-20 . . . . . 0 CA--C 1.509 -0.619 0 N-CA-C 109.522 -0.547 . . . . 0.0 109.522 . . . . . . . . . 0 0 . 1 . 006 nuclear orig full ' A' A ' 2' ' ' HIS . . . . . . . . . . . . . 46.9 t-80 -94.58 118.64 32.0 Favored 'General case' 0 C--N 1.307 -1.274 0 N-CA-C 107.779 -1.193 . . . . 0.0 107.779 175.219 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 3' ' ' CYS . . . . . . . . . . . . . 24.6 p -76.58 112.04 12.69 Favored 'General case' 0 C--N 1.303 -1.45 0 CA-C-O 121.518 0.675 . . . . 0.0 111.445 -178.481 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 4' ' ' ALA . . . . . . . . . . . . . . . -141.41 154.54 45.66 Favored 'General case' 0 N--CA 1.429 -1.501 0 N-CA-C 107.487 -1.301 . . . . 0.0 107.487 178.677 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 5' ' ' ASP . . . . . 0.521 ' OD2' ' HB ' ' A' ' 35' ' ' VAL . 11.7 m-20 -65.15 155.63 34.28 Favored 'General case' 0 C--N 1.313 -1.021 0 O-C-N 123.517 0.511 . . . . 0.0 110.476 -179.654 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 0.5 OUTLIER -84.39 151.12 24.89 Favored 'General case' 0 C--N 1.306 -1.317 0 N-CA-C 108.278 -1.008 . . . . 0.0 108.278 179.824 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 7' ' ' LYS . . . . . . . . . . . . . 7.2 ptpp? -85.4 -36.31 20.77 Favored 'General case' 0 C--N 1.316 -0.852 0 N-CA-C 112.89 0.7 . . . . 0.0 112.89 -174.141 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 8' ' ' ASN . . . . . . . . . . . . . 92.3 m-20 -87.12 -29.37 21.88 Favored 'General case' 0 C--N 1.294 -1.825 0 N-CA-C 109.493 -0.558 . . . . 0.0 109.493 -176.58 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 9' ' ' PHE . . . . . . . . . . . . . 29.0 t80 -69.55 137.45 52.43 Favored 'General case' 0 N--CA 1.434 -1.249 0 N-CA-C 108.163 -1.051 . . . . 0.0 108.163 176.861 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 10' ' ' ASP . . . . . . . . . . . . . 45.7 t0 -91.62 92.97 8.71 Favored 'General case' 0 C--N 1.304 -1.394 0 CA-C-O 121.55 0.69 . . . . 0.0 110.082 -178.259 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 11' ' ' CYS . . . . . . . . . . . . . 66.3 m -73.08 -34.44 66.23 Favored 'General case' 0 C--N 1.302 -1.491 0 CA-C-N 115.283 -0.871 . . . . 0.0 111.114 -179.108 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 12' ' ' ARG . . . . . . . . . . . . . 21.9 mmt180 -69.03 -49.69 55.37 Favored 'General case' 0 CA--C 1.516 -0.364 0 CA-C-O 120.88 0.371 . . . . 0.0 111.045 -175.761 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 8.7 ttp180 -66.36 -41.26 89.75 Favored 'General case' 0 C--N 1.309 -1.176 0 CA-C-N 116.12 -0.491 . . . . 0.0 110.971 179.637 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 14' ' ' SER . . . . . . . . . . . . . 50.2 m -60.92 -36.46 79.37 Favored 'General case' 0 C--O 1.251 1.156 0 CA-C-O 121.538 0.685 . . . . 0.0 110.594 177.429 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 54.8 tp -66.27 -43.55 86.09 Favored 'General case' 0 C--N 1.325 -0.488 0 CA-C-N 115.478 -0.783 . . . . 0.0 109.975 177.568 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 16' ' ' ARG . . . . . . . . . . . . . 81.7 mtp180 -69.63 -32.99 71.99 Favored 'General case' 0 C--N 1.315 -0.926 0 CA-C-N 116.175 -0.466 . . . . 0.0 112.239 178.965 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 17' ' ' ASN . . . . . . . . . . . . . 88.0 m-20 -68.43 -47.4 67.3 Favored 'General case' 0 CA--C 1.501 -0.911 0 CA-C-O 121.663 0.744 . . . . 0.0 110.547 -179.394 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . 123.66 11.89 4.79 Favored Glycine 0 N--CA 1.429 -1.788 0 N-CA-C 110.67 -0.972 . . . . 0.0 110.67 -174.655 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 19' ' ' ASP . . . . . . . . . . . . . 32.4 m-20 -71.09 -33.0 69.77 Favored 'General case' 0 CA--C 1.505 -0.786 0 N-CA-C 108.861 -0.792 . . . . 0.0 108.861 179.512 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 20' ' ' CYS . . . . . . . . . . . . . 53.4 t -82.81 0.24 44.77 Favored 'General case' 0 C--N 1.31 -1.12 0 CA-C-N 114.589 -1.187 . . . . 0.0 110.345 -178.084 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 21' ' ' ASP . . . . . . . . . . . . . 20.9 t70 -115.85 -10.49 11.68 Favored 'General case' 0 C--N 1.315 -0.932 0 CA-C-N 115.716 -0.674 . . . . 0.0 109.604 178.502 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 22' ' ' ASN . . . . . 0.449 ' O ' ' HG ' ' A' ' 26' ' ' LEU . 37.3 t-20 -87.8 121.78 30.64 Favored 'General case' 0 C--N 1.319 -0.758 0 CA-C-N 115.832 -0.622 . . . . 0.0 110.408 -177.057 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 23' ' ' ASP . . . . . . . . . . . . . 28.6 t70 -50.77 -46.67 59.59 Favored 'General case' 0 C--N 1.317 -0.806 0 C-N-CA 124.821 1.248 . . . . 0.0 113.379 -177.726 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 48.6 m-20 -64.66 -36.13 83.26 Favored 'General case' 0 N--CA 1.476 0.839 0 CA-C-O 121.365 0.602 . . . . 0.0 110.485 -177.927 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 25' ' ' LYS . . . . . . . . . . . . . 13.7 mptt -84.65 -12.38 54.05 Favored 'General case' 0 C--N 1.311 -1.078 0 CA-C-N 115.334 -0.848 . . . . 0.0 112.663 -175.946 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 26' ' ' LEU . . . . . 0.449 ' HG ' ' O ' ' A' ' 22' ' ' ASN . 74.7 mt -58.04 -36.08 72.23 Favored 'General case' 0 C--O 1.22 -0.496 0 N-CA-C 112.264 0.468 . . . . 0.0 112.264 -178.206 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 27' ' ' LEU . . . . . . . . . . . . . 26.2 tp -57.09 -50.64 72.15 Favored 'General case' 0 N--CA 1.437 -1.119 0 N-CA-C 109.906 -0.405 . . . . 0.0 109.906 176.899 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 28' ' ' GLU . . . . . 0.517 ' HA ' ' CE1' ' A' ' 31' ' ' TYR . 43.8 tt0 -64.48 -31.6 72.88 Favored 'General case' 0 C--O 1.244 0.781 0 CA-C-N 115.483 -0.781 . . . . 0.0 109.824 -179.742 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 29' ' ' MET . . . . . 0.4 ' HE3' ' HA ' ' A' ' 29' ' ' MET . 0.3 OUTLIER -73.4 -30.68 63.42 Favored 'General case' 0 C--O 1.207 -1.14 0 CA-C-N 115.009 -0.996 . . . . 0.0 109.84 -177.752 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' A' A ' 30' ' ' GLY . . . . . . . . . . . . . . . -65.15 -29.35 75.11 Favored Glycine 0 N--CA 1.444 -0.779 0 O-C-N 123.621 0.576 . . . . 0.0 112.886 -179.262 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 31' ' ' TYR . . . . . 0.517 ' CE1' ' HA ' ' A' ' 28' ' ' GLU 0.266 39.9 p90 -100.09 -37.51 8.93 Favored 'General case' 0 N--CA 1.438 -1.074 0 N-CA-C 113.791 1.034 . . . . 0.0 113.791 178.432 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' A' A ' 32' ' ' TYR . . . . . . . . . . . . . 29.2 m-85 -74.26 -48.56 27.84 Favored 'General case' 0 C--N 1.303 -1.415 0 N-CA-C 113.765 1.024 . . . . 0.0 113.765 177.472 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 33' ' ' CYS . . . . . . . . . . . . . 36.3 m -135.52 66.78 65.4 Favored Pre-proline 0 C--N 1.308 -1.234 0 C-N-CA 120.436 -0.505 . . . . 0.0 110.871 -177.024 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 34' ' ' PRO . . . . . 0.413 ' HD2' ' HA ' ' A' ' 5' ' ' ASP . 46.7 Cg_endo -65.99 -24.77 52.48 Favored 'Trans proline' 0 C--N 1.362 1.285 0 C-N-CA 122.404 2.07 . . . . 0.0 112.135 -176.624 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 35' ' ' VAL . . . . . 0.521 ' HB ' ' OD2' ' A' ' 5' ' ' ASP . 54.7 t -86.59 -46.87 16.45 Favored 'Isoleucine or valine' 0 C--N 1.302 -1.494 0 C-N-CA 120.479 -0.489 . . . . 0.0 110.787 -177.16 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 36' ' ' THR . . . . . . . . . . . . . 30.8 m -56.75 -39.57 74.23 Favored 'General case' 0 CA--C 1.55 0.946 0 CA-C-O 121.343 0.592 . . . . 0.0 111.587 179.986 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 37' ' ' CYS . . . . . . . . . . . . . 94.7 m -88.73 4.35 47.7 Favored 'General case' 0 C--N 1.309 -1.156 0 N-CA-C 113.251 0.834 . . . . 0.0 113.251 179.239 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 38' ' ' GLY . . . . . . . . . . . . . . . 72.12 35.89 60.64 Favored Glycine 0 C--O 1.222 -0.596 0 N-CA-C 115.599 0.999 . . . . 0.0 115.599 174.375 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 39' ' ' PHE . . . . . . . . . . . . . 98.4 m-85 -86.77 -37.59 17.7 Favored 'General case' 0 C--N 1.311 -1.108 0 N-CA-C 107.713 -1.218 . . . . 0.0 107.713 174.361 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 40' ' ' CYS . . . . . . . . . . . . . 69.3 m -117.95 89.58 3.15 Favored 'General case' 0 C--N 1.304 -1.407 0 CA-C-N 114.167 -1.378 . . . . 0.0 108.775 179.762 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 41' ' ' NH2 . . . . . . . . . . . . . . . . . . . . 0 C--N 1.307 -1.27 0 CA-C-N 116.689 -0.232 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 007 nuclear orig full ' A' A ' 1' ' ' GLU . . . . . . . . . . . . . 10.4 tp10 . . . . . 0 CA--C 1.513 -0.452 0 CA-C-O 119.629 -0.224 . . . . 0.0 110.756 . . . . . . . . . 0 0 . 1 . 007 nuclear orig full ' A' A ' 2' ' ' HIS . . . . . . . . . . . . . 21.9 t-80 -49.98 111.09 0.46 Allowed 'General case' 0 C--O 1.246 0.898 0 CA-C-O 121.635 0.731 . . . . 0.0 111.523 -175.537 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 3' ' ' CYS . . . . . . . . . . . . . 10.3 p -75.42 136.3 40.72 Favored 'General case' 0 C--N 1.301 -1.541 0 CA-C-N 114.347 -1.297 . . . . 0.0 110.747 179.424 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 4' ' ' ALA . . . . . . . . . . . . . . . -143.03 145.91 33.35 Favored 'General case' 0 C--N 1.31 -1.125 0 N-CA-C 109.595 -0.52 . . . . 0.0 109.595 -179.157 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 5' ' ' ASP . . . . . 0.522 ' HB3' ' SG ' ' A' ' 11' ' ' CYS . 23.7 m-20 -58.83 143.18 48.24 Favored 'General case' 0 C--N 1.314 -0.971 0 O-C-N 124.05 0.843 . . . . 0.0 111.81 178.461 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 10.0 tp10 -70.59 135.67 48.64 Favored 'General case' 0 N--CA 1.443 -0.818 0 C-N-CA 123.495 0.718 . . . . 0.0 110.312 178.004 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 7' ' ' LYS . . . . . . . . . . . . . 9.9 ptpp? -85.71 -20.66 29.01 Favored 'General case' 0 C--N 1.314 -0.977 0 CA-C-O 121.386 0.612 . . . . 0.0 111.041 -178.741 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 8' ' ' ASN . . . . . . . . . . . . . 13.7 m120 -86.71 16.83 4.38 Favored 'General case' 0 C--N 1.311 -1.07 0 CA-C-O 121.789 0.804 . . . . 0.0 110.157 -179.193 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 9' ' ' PHE . . . . . 0.455 ' HD1' ' SG ' ' A' ' 33' ' ' CYS . 36.8 t80 -144.87 144.09 30.93 Favored 'General case' 0 N--CA 1.418 -2.03 0 N-CA-C 105.633 -1.988 . . . . 0.0 105.633 -178.425 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 10' ' ' ASP . . . . . . . . . . . . . 19.7 t70 -100.51 102.62 13.84 Favored 'General case' 0 C--N 1.313 -0.986 0 C-N-CA 118.941 -1.104 . . . . 0.0 110.603 178.088 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 11' ' ' CYS . . . . . 0.522 ' SG ' ' HB3' ' A' ' 5' ' ' ASP . 60.8 m -66.09 -31.79 72.86 Favored 'General case' 0 C--N 1.294 -1.814 0 CA-C-N 114.083 -1.417 . . . . 0.0 112.776 -175.711 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 12' ' ' ARG . . . . . . . . . . . . . 37.6 mmt180 -66.0 -50.46 64.18 Favored 'General case' 0 CA--C 1.514 -0.416 0 N-CA-C 109.711 -0.477 . . . . 0.0 109.711 179.684 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 38.6 ttm180 -53.51 -56.45 16.9 Favored 'General case' 0 C--N 1.322 -0.622 0 C-N-CA 124.741 1.216 . . . . 0.0 111.775 -178.24 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 14' ' ' SER . . . . . . . . . . . . . 20.1 m -61.22 -35.15 76.44 Favored 'General case' 0 C--O 1.249 1.066 0 CA-C-O 120.948 0.404 . . . . 0.0 111.818 -178.101 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 1.3 tm? -68.65 -41.42 79.37 Favored 'General case' 0 CA--C 1.544 0.72 0 N-CA-C 108.098 -1.075 . . . . 0.0 108.098 179.439 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 16' ' ' ARG . . . . . . . . . . . . . 73.8 mtp180 -64.19 -45.99 85.94 Favored 'General case' 0 N--CA 1.467 0.416 0 CA-C-N 115.546 -0.752 . . . . 0.0 111.702 178.593 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 17' ' ' ASN . . . . . . . . . . . . . 73.3 m-20 -61.09 -33.63 73.66 Favored 'General case' 0 N--CA 1.485 1.305 0 CA-C-O 121.652 0.739 . . . . 0.0 110.942 -178.734 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . 103.29 19.07 13.03 Favored Glycine 0 N--CA 1.429 -1.824 0 N-CA-C 110.027 -1.229 . . . . 0.0 110.027 -178.06 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 19' ' ' ASP . . . . . . . . . . . . . 52.6 m-20 -70.04 -28.59 65.59 Favored 'General case' 0 C--O 1.213 -0.827 0 CA-C-O 120.85 0.357 . . . . 0.0 110.549 -178.403 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 20' ' ' CYS . . . . . . . . . . . . . 23.8 t -84.26 -5.28 59.24 Favored 'General case' 0 C--N 1.317 -0.835 0 CA-C-O 121.578 0.704 . . . . 0.0 109.697 -179.173 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 21' ' ' ASP . . . . . . . . . . . . . 29.7 t70 -98.55 -11.24 22.39 Favored 'General case' 0 C--N 1.314 -0.964 0 N-CA-C 108.686 -0.857 . . . . 0.0 108.686 175.016 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 22' ' ' ASN . . . . . . . . . . . . . 35.5 t30 -88.54 123.64 33.24 Favored 'General case' 0 C--N 1.316 -0.856 0 CA-C-N 115.241 -0.89 . . . . 0.0 110.042 179.242 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 23' ' ' ASP . . . . . 0.432 ' HA ' ' HG ' ' A' ' 26' ' ' LEU . 21.7 t70 -58.68 -36.72 74.66 Favored 'General case' 0 C--N 1.323 -0.581 0 C-N-CA 122.969 0.507 . . . . 0.0 111.957 -178.163 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 27.2 t70 -62.97 -24.81 68.07 Favored 'General case' 0 N--CA 1.475 0.799 0 CA-C-N 115.969 -0.559 . . . . 0.0 111.732 179.5 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 25' ' ' LYS . . . . . . . . . . . . . 69.3 mmtt -111.96 10.24 20.54 Favored 'General case' 0 N--CA 1.442 -0.852 0 N-CA-C 113.101 0.778 . . . . 0.0 113.101 -177.807 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 26' ' ' LEU . . . . . 0.432 ' HG ' ' HA ' ' A' ' 23' ' ' ASP . 65.9 mt -62.76 -46.56 87.49 Favored 'General case' 0 C--N 1.314 -0.941 0 N-CA-C 112.886 0.698 . . . . 0.0 112.886 -179.929 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 27' ' ' LEU . . . . . . . . . . . . . 2.7 mm? -65.13 -42.69 93.64 Favored 'General case' 0 CA--C 1.48 -1.714 0 N-CA-C 108.508 -0.923 . . . . 0.0 108.508 -179.237 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 28' ' ' GLU . . . . . 0.53 ' HA ' ' CE1' ' A' ' 31' ' ' TYR . 38.6 tt0 -58.45 -36.97 74.49 Favored 'General case' 0 N--CA 1.442 -0.848 0 O-C-N 124.346 1.029 . . . . 0.0 109.932 -179.492 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 29' ' ' MET . . . . . . . . . . . . . 78.2 mmm -80.33 -27.6 38.33 Favored 'General case' 0 N--CA 1.429 -1.512 0 CA-C-N 115.936 -0.575 . . . . 0.0 111.216 -178.204 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 30' ' ' GLY . . . . . . . . . . . . . . . -75.33 -44.64 21.62 Favored Glycine 0 N--CA 1.43 -1.708 0 CA-C-N 115.526 -0.761 . . . . 0.0 111.673 178.065 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 31' ' ' TYR . . . . . 0.53 ' CE1' ' HA ' ' A' ' 28' ' ' GLU 0.265 12.9 p90 -77.58 -32.33 53.62 Favored 'General case' 0 N--CA 1.436 -1.153 0 C-N-CA 119.592 -0.843 . . . . 0.0 113.166 -179.346 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' A' A ' 32' ' ' TYR . . . . . . . . . . . . . 22.6 m-85 -79.07 -54.36 6.09 Favored 'General case' 0 C--N 1.301 -1.505 0 N-CA-C 113.223 0.823 . . . . 0.0 113.223 175.409 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 33' ' ' CYS . . . . . 0.455 ' SG ' ' HD1' ' A' ' 9' ' ' PHE . 53.4 m -129.11 71.68 81.99 Favored Pre-proline 0 C--O 1.264 1.839 0 C-N-CA 120.152 -0.619 . . . . 0.0 111.956 -174.45 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 34' ' ' PRO . . . . . 0.467 ' HB2' ' SG ' ' A' ' 40' ' ' CYS . 48.7 Cg_endo -66.52 -25.91 47.58 Favored 'Trans proline' 0 C--N 1.362 1.285 0 C-N-CA 122.69 2.26 . . . . 0.0 112.163 -176.201 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 35' ' ' VAL . . . . . 0.495 ' HB ' ' OD1' ' A' ' 5' ' ' ASP . 22.0 t -87.04 -40.79 14.24 Favored 'Isoleucine or valine' 0 N--CA 1.425 -1.712 0 CA-C-N 116.162 -0.472 . . . . 0.0 110.844 -176.822 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 36' ' ' THR . . . . . . . . . . . . . 58.9 m -58.1 -43.65 87.21 Favored 'General case' 0 C--N 1.321 -0.662 0 C-N-CA 123.3 0.64 . . . . 0.0 112.097 -179.618 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 37' ' ' CYS . . . . . 0.524 ' HB2' ' CE2' ' A' ' 39' ' ' PHE . 88.7 m -87.51 6.76 32.56 Favored 'General case' 0 C--N 1.313 -0.991 0 C-N-CA 119.696 -0.802 . . . . 0.0 112.007 179.433 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 38' ' ' GLY . . . . . . . . . . . . . . . 64.43 45.91 91.92 Favored Glycine 0 N--CA 1.439 -1.158 0 CA-C-N 116.32 -0.4 . . . . 0.0 114.068 177.045 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 39' ' ' PHE . . . . . 0.524 ' CE2' ' HB2' ' A' ' 37' ' ' CYS . 98.2 m-85 -85.68 -49.89 7.62 Favored 'General case' 0 CA--C 1.498 -1.022 0 N-CA-C 107.247 -1.39 . . . . 0.0 107.247 173.805 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 40' ' ' CYS . . . . . 0.467 ' SG ' ' HB2' ' A' ' 34' ' ' PRO . 25.3 p -136.32 87.93 2.34 Favored 'General case' 0 N--CA 1.424 -1.744 0 CA-C-N 114.771 -1.104 . . . . 0.0 109.528 177.013 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 41' ' ' NH2 . . . . . . . . . . . . . . . . . . . . 0 C--N 1.309 -1.153 0 CA-C-N 116.194 -0.457 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 008 nuclear orig full ' A' A ' 1' ' ' GLU . . . . . . . . . . . . . 44.8 tt0 . . . . . 0 N--CA 1.455 -0.206 0 N-CA-C 108.545 -0.909 . . . . 0.0 108.545 . . . . . . . . . 0 0 . 1 . 008 nuclear orig full ' A' A ' 2' ' ' HIS . . . . . . . . . . . . . 81.4 m-70 -106.33 126.06 51.77 Favored 'General case' 0 CA--C 1.502 -0.892 0 N-CA-C 109.48 -0.563 . . . . 0.0 109.48 174.299 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 3' ' ' CYS . . . . . . . . . . . . . 21.6 p -86.3 150.9 24.02 Favored 'General case' 0 C--N 1.288 -2.106 0 CA-C-N 116.306 -0.406 . . . . 0.0 110.565 177.478 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 4' ' ' ALA . . . . . . . . . . . . . . . -149.32 137.4 20.6 Favored 'General case' 0 C--N 1.313 -0.983 0 N-CA-C 109.497 -0.557 . . . . 0.0 109.497 178.299 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 5' ' ' ASP . . . . . 0.546 ' HB3' ' SG ' ' A' ' 11' ' ' CYS . 24.0 m-20 -65.49 149.56 49.83 Favored 'General case' 0 C--O 1.248 1.02 0 N-CA-C 108.887 -0.783 . . . . 0.0 108.887 174.683 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 10.8 tp10 -70.03 130.7 42.87 Favored 'General case' 0 C--N 1.301 -1.538 0 N-CA-C 109.409 -0.589 . . . . 0.0 109.409 178.734 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 7' ' ' LYS . . . . . . . . . . . . . 10.8 ptpp? -85.51 -20.02 30.32 Favored 'General case' 0 C--N 1.321 -0.653 0 CA-C-O 121.097 0.475 . . . . 0.0 110.895 -176.845 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 8' ' ' ASN . . . . . . . . . . . . . 89.2 m-20 -84.49 2.64 40.05 Favored 'General case' 0 C--N 1.316 -0.859 0 CA-C-N 115.465 -0.789 . . . . 0.0 110.053 179.16 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 9' ' ' PHE . . . . . . . . . . . . . 45.4 t80 -127.95 154.25 45.78 Favored 'General case' 0 C--N 1.303 -1.433 0 N-CA-C 107.773 -1.195 . . . . 0.0 107.773 -174.986 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 10' ' ' ASP . . . . . . . . . . . . . 9.3 t70 -104.9 101.26 10.85 Favored 'General case' 0 CA--C 1.493 -1.234 0 C-N-CA 118.624 -1.23 . . . . 0.0 110.647 178.195 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 11' ' ' CYS . . . . . 0.546 ' SG ' ' HB3' ' A' ' 5' ' ' ASP . 92.4 m -72.8 -25.52 61.18 Favored 'General case' 0 C--N 1.286 -2.163 0 CA-C-N 115.34 -0.845 . . . . 0.0 112.615 -178.286 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 12' ' ' ARG . . . . . 0.542 ' O ' ' HG2' ' A' ' 16' ' ' ARG . 28.0 mmm180 -70.07 -53.41 17.58 Favored 'General case' 0 C--N 1.318 -0.803 0 N-CA-C 110.045 -0.354 . . . . 0.0 110.045 -178.406 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 43.9 ttp180 -63.13 -37.49 87.4 Favored 'General case' 0 C--N 1.309 -1.166 0 CA-C-N 115.951 -0.568 . . . . 0.0 110.133 179.464 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 14' ' ' SER . . . . . . . . . . . . . 49.6 m -63.61 -32.79 74.37 Favored 'General case' 0 C--O 1.246 0.905 0 CA-C-O 121.261 0.553 . . . . 0.0 110.977 177.258 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 53.6 tp -70.94 -40.73 71.88 Favored 'General case' 0 N--CA 1.442 -0.845 0 N-CA-C 109.177 -0.675 . . . . 0.0 109.177 177.611 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 16' ' ' ARG . . . . . 0.542 ' HG2' ' O ' ' A' ' 12' ' ' ARG . 31.4 mmm180 -70.04 -33.76 72.38 Favored 'General case' 0 C--N 1.314 -0.971 0 CA-C-N 115.546 -0.752 . . . . 0.0 111.193 -178.942 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 17' ' ' ASN . . . . . . . . . . . . . 89.6 m-20 -71.05 -39.14 72.43 Favored 'General case' 0 CA--C 1.489 -1.376 0 CA-C-O 121.522 0.677 . . . . 0.0 110.428 -179.864 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . 114.02 8.61 17.39 Favored Glycine 0 N--CA 1.426 -1.973 0 CA-C-N 114.833 -1.076 . . . . 0.0 111.016 -177.178 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 19' ' ' ASP . . . . . . . . . . . . . 59.9 m-20 -66.92 -38.13 85.63 Favored 'General case' 0 CA--C 1.502 -0.883 0 CA-C-O 121.235 0.541 . . . . 0.0 109.893 -179.406 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 20' ' ' CYS . . . . . . . . . . . . . 42.7 t -73.32 -13.42 61.11 Favored 'General case' 0 C--N 1.311 -1.068 0 CA-C-N 114.997 -1.001 . . . . 0.0 110.752 -178.945 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 21' ' ' ASP . . . . . . . . . . . . . 27.6 t70 -109.78 -4.48 16.04 Favored 'General case' 0 C--N 1.313 -1.019 0 CA-C-O 121.893 0.854 . . . . 0.0 110.46 179.043 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 22' ' ' ASN . . . . . . . . . . . . . 39.8 t-20 -77.64 116.33 18.11 Favored 'General case' 0 C--N 1.314 -0.946 0 N-CA-C 109.2 -0.667 . . . . 0.0 109.2 -178.363 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 23' ' ' ASP . . . . . . . . . . . . . 17.6 m-20 -56.99 -43.82 82.09 Favored 'General case' 0 C--N 1.321 -0.642 0 CA-C-N 115.088 -0.96 . . . . 0.0 112.202 -174.611 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 33.7 t70 -66.33 -31.35 72.09 Favored 'General case' 0 C--N 1.324 -0.529 0 CA-C-O 121.023 0.439 . . . . 0.0 111.085 -178.156 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 25' ' ' LYS . . . . . 0.425 ' O ' ' HG2' ' A' ' 29' ' ' MET . 54.3 mtpt -95.89 -4.45 43.54 Favored 'General case' 0 C--O 1.209 -1.048 0 N-CA-C 112.386 0.513 . . . . 0.0 112.386 -177.555 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 26' ' ' LEU . . . . . . . . . . . . . 55.6 mt -48.3 -46.83 36.65 Favored 'General case' 0 N--CA 1.483 1.219 0 N-CA-C 114.705 1.372 . . . . 0.0 114.705 -178.602 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 27' ' ' LEU . . . . . . . . . . . . . 22.3 tp -59.17 -45.31 91.33 Favored 'General case' 0 N--CA 1.446 -0.67 0 CA-C-O 121.286 0.565 . . . . 0.0 110.018 178.954 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 28' ' ' GLU . . . . . 0.618 ' HA ' ' CE1' ' A' ' 31' ' ' TYR . 35.2 tt0 -64.04 -35.47 80.82 Favored 'General case' 0 N--CA 1.444 -0.743 0 CA-C-N 114.791 -1.095 . . . . 0.0 109.55 179.696 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 29' ' ' MET . . . . . 0.425 ' HG2' ' O ' ' A' ' 25' ' ' LYS . 79.6 mmm -78.31 -19.42 53.59 Favored 'General case' 0 C--N 1.302 -1.486 0 CA-C-N 114.803 -1.09 . . . . 0.0 110.205 -177.626 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 30' ' ' GLY . . . . . 0.419 ' HA2' ' CE1' ' A' ' 39' ' ' PHE . . . -71.46 -22.27 78.62 Favored Glycine 0 N--CA 1.436 -1.367 0 CA-C-N 115.01 -0.995 . . . . 0.0 111.996 177.762 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 31' ' ' TYR . . . . . 0.618 ' CE1' ' HA ' ' A' ' 28' ' ' GLU . 27.6 p90 -104.54 -34.67 8.13 Favored 'General case' 0 N--CA 1.436 -1.152 0 C-N-CA 119.609 -0.836 . . . . 0.0 112.383 174.82 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 32' ' ' TYR . . . . . . . . . . . . . 37.4 m-85 -67.34 -47.99 68.85 Favored 'General case' 0 C--N 1.309 -1.186 0 CA-C-N 115.918 -0.583 . . . . 0.0 112.179 174.379 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 33' ' ' CYS . . . . . 0.42 ' HB3' ' HB ' ' A' ' 36' ' ' THR . 35.3 m -140.39 64.7 25.4 Favored Pre-proline 0 C--N 1.306 -1.313 0 C-N-CA 120.355 -0.538 . . . . 0.0 111.667 -177.356 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 34' ' ' PRO . . . . . 0.442 ' HD2' ' HA ' ' A' ' 5' ' ' ASP . 31.1 Cg_endo -63.21 -27.63 72.68 Favored 'Trans proline' 0 C--N 1.366 1.489 0 C-N-CA 122.562 2.174 . . . . 0.0 111.817 -178.92 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 35' ' ' VAL . . . . . 0.415 ' HB ' ' OD2' ' A' ' 5' ' ' ASP . 57.8 t -84.9 -47.25 17.22 Favored 'Isoleucine or valine' 0 N--CA 1.419 -1.977 0 CA-C-N 115.473 -0.785 . . . . 0.0 110.255 -176.178 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 36' ' ' THR . . . . . 0.42 ' HB ' ' HB3' ' A' ' 33' ' ' CYS . 23.8 m -59.9 -42.9 94.85 Favored 'General case' 0 C--N 1.317 -0.843 0 CA-C-N 115.859 -0.61 . . . . 0.0 111.248 179.71 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 37' ' ' CYS . . . . . . . . . . . . . 77.9 m -79.05 -8.13 58.69 Favored 'General case' 0 C--N 1.319 -0.749 0 N-CA-C 112.222 0.453 . . . . 0.0 112.222 179.661 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 38' ' ' GLY . . . . . . . . . . . . . . . 77.49 40.08 24.11 Favored Glycine 0 N--CA 1.445 -0.736 0 N-CA-C 114.985 0.754 . . . . 0.0 114.985 174.54 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 39' ' ' PHE . . . . . 0.419 ' CE1' ' HA2' ' A' ' 30' ' ' GLY . 87.3 m-85 -78.35 -32.14 48.94 Favored 'General case' 0 C--N 1.317 -0.843 0 N-CA-C 108.519 -0.919 . . . . 0.0 108.519 175.245 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 40' ' ' CYS . . . . . . . . . . . . . 1.5 p -150.14 89.16 1.57 Allowed 'General case' 0 C--N 1.303 -1.451 0 CA-C-N 114.224 -1.353 . . . . 0.0 109.658 -178.592 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 41' ' ' NH2 . . . . . . . . . . . . . . . . . . . . 0 C--N 1.309 -1.186 0 CA-C-N 116.193 -0.458 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 009 nuclear orig full ' A' A ' 1' ' ' GLU . . . . . . . . . . . . . 11.2 pt-20 . . . . . 0 CA--C 1.504 -0.826 0 N-CA-C 109.26 -0.644 . . . . 0.0 109.26 . . . . . . . . . 0 0 . 1 . 009 nuclear orig full ' A' A ' 2' ' ' HIS . . . . . . . . . . . . . 18.6 t-80 -88.85 112.36 23.16 Favored 'General case' 0 N--CA 1.432 -1.359 0 N-CA-C 108.818 -0.808 . . . . 0.0 108.818 176.504 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 3' ' ' CYS . . . . . . . . . . . . . 25.7 p -71.8 104.78 3.54 Favored 'General case' 0 C--N 1.299 -1.61 0 CA-C-O 121.517 0.675 . . . . 0.0 110.631 178.803 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 4' ' ' ALA . . . . . . . . . . . . . . . -140.87 143.25 34.6 Favored 'General case' 0 N--CA 1.432 -1.357 0 CA-C-N 116.035 -0.53 . . . . 0.0 109.72 -179.86 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 5' ' ' ASP . . . . . 0.669 ' HB3' ' SG ' ' A' ' 11' ' ' CYS . 43.9 m-20 -64.32 141.44 58.77 Favored 'General case' 0 C--O 1.25 1.106 0 N-CA-C 108.761 -0.829 . . . . 0.0 108.761 175.777 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -70.44 150.0 46.66 Favored 'General case' 0 C--N 1.307 -1.269 0 CA-C-O 121.497 0.665 . . . . 0.0 110.796 -176.992 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 7' ' ' LYS . . . . . . . . . . . . . 9.2 ptpp? -85.51 -25.36 26.87 Favored 'General case' 0 C--N 1.307 -1.244 0 CA-C-N 115.133 -0.94 . . . . 0.0 111.997 -177.222 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 8' ' ' ASN . . . . . . . . . . . . . 42.5 m-80 -95.12 1.99 55.02 Favored 'General case' 0 C--N 1.31 -1.143 0 CA-C-N 115.849 -0.614 . . . . 0.0 110.592 -178.101 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 9' ' ' PHE . . . . . 0.422 ' CD2' ' HB3' ' A' ' 32' ' ' TYR . 34.1 t80 -121.75 137.32 54.81 Favored 'General case' 0 C--N 1.291 -1.966 0 N-CA-C 107.099 -1.445 . . . . 0.0 107.099 -178.731 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 10' ' ' ASP . . . . . . . . . . . . . 8.8 t70 -94.24 103.09 15.12 Favored 'General case' 0 C--N 1.309 -1.177 0 C-N-CA 119.678 -0.809 . . . . 0.0 109.914 -177.884 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 11' ' ' CYS . . . . . 0.669 ' SG ' ' HB3' ' A' ' 5' ' ' ASP . 73.8 m -75.03 -28.71 60.57 Favored 'General case' 0 C--N 1.293 -1.886 0 CA-C-N 115.312 -0.858 . . . . 0.0 112.985 -175.51 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 12' ' ' ARG . . . . . . . . . . . . . 28.2 mmt180 -73.86 -44.44 55.49 Favored 'General case' 0 C--N 1.317 -0.822 0 N-CA-C 109.069 -0.715 . . . . 0.0 109.069 -178.186 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 38.3 ttm180 -60.89 -46.83 89.07 Favored 'General case' 0 C--N 1.318 -0.761 0 CA-C-N 115.238 -0.892 . . . . 0.0 109.874 178.242 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 14' ' ' SER . . . . . . . . . . . . . 44.7 m -61.37 -34.6 75.59 Favored 'General case' 0 C--N 1.319 -0.752 0 CA-C-N 115.746 -0.661 . . . . 0.0 111.48 179.953 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 50.2 tp -72.72 -44.38 61.78 Favored 'General case' 0 C--N 1.312 -1.059 0 C-N-CA 120.688 -0.405 . . . . 0.0 110.968 179.611 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 16' ' ' ARG . . . . . . . . . . . . . 21.9 mtm180 -70.17 -35.56 74.07 Favored 'General case' 0 C--N 1.314 -0.953 0 CA-C-N 116.006 -0.543 . . . . 0.0 112.449 -177.848 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 17' ' ' ASN . . . . . . . . . . . . . 35.5 m-80 -77.1 -26.04 52.91 Favored 'General case' 0 CA--C 1.498 -1.038 0 CA-C-O 121.056 0.455 . . . . 0.0 111.612 178.68 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . 104.56 7.03 40.34 Favored Glycine 0 N--CA 1.433 -1.56 0 C-N-CA 119.685 -1.245 . . . . 0.0 112.469 178.448 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 19' ' ' ASP . . . . . . . . . . . . . 6.0 m-20 -64.65 -35.97 82.74 Favored 'General case' 0 CA--C 1.499 -1.0 0 N-CA-C 108.779 -0.823 . . . . 0.0 108.779 178.15 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 20' ' ' CYS . . . . . 0.405 ' HA ' ' HG3' ' A' ' 29' ' ' MET . 39.3 t -57.04 -31.16 64.88 Favored 'General case' 0 C--N 1.315 -0.897 0 CA-C-N 114.667 -1.152 . . . . 0.0 111.606 178.904 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 21' ' ' ASP . . . . . . . . . . . . . 17.8 t70 -106.37 -9.3 16.81 Favored 'General case' 0 C--N 1.316 -0.889 0 CA-C-N 115.812 -0.631 . . . . 0.0 111.388 -176.49 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 22' ' ' ASN . . . . . . . . . . . . . 54.7 t30 -77.17 131.35 38.23 Favored 'General case' 0 C--N 1.311 -1.067 0 O-C-N 122.237 -0.289 . . . . 0.0 110.989 -174.535 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 23' ' ' ASP . . . . . . . . . . . . . 26.7 t70 -51.76 -48.14 63.82 Favored 'General case' 0 N--CA 1.473 0.705 0 C-N-CA 123.958 0.903 . . . . 0.0 113.065 -174.233 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 32.4 t70 -61.79 -22.76 65.72 Favored 'General case' 0 N--CA 1.48 1.046 0 N-CA-C 112.304 0.483 . . . . 0.0 112.304 -179.823 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 25' ' ' LYS . . . . . 0.547 ' O ' ' HG2' ' A' ' 29' ' ' MET . 69.8 mmtt -101.58 -16.27 16.81 Favored 'General case' 0 C--N 1.305 -1.369 0 C-N-CA 120.475 -0.49 . . . . 0.0 111.614 -174.174 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 26' ' ' LEU . . . . . . . . . . . . . 83.3 mt -48.18 -50.32 29.44 Favored 'General case' 0 N--CA 1.475 0.785 0 N-CA-C 115.699 1.74 . . . . 0.0 115.699 -172.395 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 27' ' ' LEU . . . . . . . . . . . . . 1.6 tm? -60.51 -43.5 97.01 Favored 'General case' 0 N--CA 1.448 -0.574 0 N-CA-C 109.026 -0.731 . . . . 0.0 109.026 -178.239 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 28' ' ' GLU . . . . . 0.439 ' HA ' ' CZ ' ' A' ' 31' ' ' TYR . 1.2 mp0 -65.05 -34.88 79.48 Favored 'General case' 0 CA--C 1.503 -0.864 0 CA-C-N 114.926 -1.034 . . . . 0.0 110.442 178.988 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 29' ' ' MET . . . . . 0.547 ' HG2' ' O ' ' A' ' 25' ' ' LYS . 70.9 mmm -70.5 -25.64 63.23 Favored 'General case' 0 C--N 1.316 -0.888 0 CA-C-N 116.107 -0.497 . . . . 0.0 110.552 -177.269 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 30' ' ' GLY . . . . . . . . . . . . . . . -68.3 -25.98 74.41 Favored Glycine 0 N--CA 1.448 -0.538 0 CA-C-N 115.586 -0.734 . . . . 0.0 112.36 -179.851 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 31' ' ' TYR . . . . . 0.439 ' CZ ' ' HA ' ' A' ' 28' ' ' GLU . 25.9 p90 -109.48 -33.79 6.7 Favored 'General case' 0 N--CA 1.441 -0.885 0 N-CA-C 113.354 0.872 . . . . 0.0 113.354 177.655 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 32' ' ' TYR . . . . . 0.422 ' HB3' ' CD2' ' A' ' 9' ' ' PHE . 21.3 m-85 -69.74 -48.04 60.86 Favored 'General case' 0 C--N 1.304 -1.382 0 N-CA-C 112.317 0.488 . . . . 0.0 112.317 176.679 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 33' ' ' CYS . . . . . . . . . . . . . 34.8 m -136.57 69.73 60.06 Favored Pre-proline 0 C--N 1.306 -1.305 0 C-N-CA 119.436 -0.905 . . . . 0.0 111.35 -177.55 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 34' ' ' PRO . . . . . 0.404 ' HD2' ' HA ' ' A' ' 5' ' ' ASP . 56.2 Cg_endo -69.96 -23.5 29.83 Favored 'Trans proline' 0 N--CA 1.448 -1.18 0 C-N-CA 121.977 1.785 . . . . 0.0 111.487 -178.416 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 35' ' ' VAL . . . . . . . . . . . . . 41.7 t -87.49 -52.45 11.5 Favored 'Isoleucine or valine' 0 C--N 1.296 -1.758 0 CA-C-N 115.696 -0.684 . . . . 0.0 111.015 -177.966 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 36' ' ' THR . . . . . 0.417 ' HG1' ' CG ' ' A' ' 5' ' ' ASP . 58.4 m -61.95 -35.38 78.28 Favored 'General case' 0 CA--C 1.55 0.973 0 N-CA-C 112.224 0.453 . . . . 0.0 112.224 -178.203 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 37' ' ' CYS . . . . . . . . . . . . . 92.5 m -90.94 2.99 55.81 Favored 'General case' 0 C--N 1.308 -1.196 0 N-CA-C 113.337 0.866 . . . . 0.0 113.337 179.603 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 38' ' ' GLY . . . . . . . . . . . . . . . 72.25 46.49 34.21 Favored Glycine 0 CA--C 1.525 0.701 0 N-CA-C 115.062 0.785 . . . . 0.0 115.062 175.259 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 39' ' ' PHE . . . . . 0.402 ' CD1' ' HA ' ' A' ' 34' ' ' PRO . 96.4 m-85 -95.09 -43.08 8.28 Favored 'General case' 0 C--N 1.306 -1.313 0 N-CA-C 107.864 -1.162 . . . . 0.0 107.864 173.756 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 40' ' ' CYS . . . . . . . . . . . . . 49.5 t -139.11 97.3 3.27 Favored 'General case' 0 N--CA 1.429 -1.505 0 CA-C-N 114.449 -1.25 . . . . 0.0 108.33 -178.613 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 41' ' ' NH2 . . . . . . . . . . . . . . . . . . . . 0 C--N 1.302 -1.483 0 CA-C-N 116.51 -0.313 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 010 nuclear orig full ' A' A ' 1' ' ' GLU . . . . . . . . . . . . . 9.5 tp10 . . . . . 0 N--CA 1.453 -0.314 0 N-CA-C 108.686 -0.857 . . . . 0.0 108.686 . . . . . . . . . 0 0 . 1 . 010 nuclear orig full ' A' A ' 2' ' ' HIS . . . . . . . . . . . . . 7.6 p80 -103.26 121.51 42.86 Favored 'General case' 0 C--N 1.312 -1.035 0 C-N-CA 119.578 -0.849 . . . . 0.0 108.852 178.234 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 3' ' ' CYS . . . . . . . . . . . . . 27.9 p -62.11 122.6 15.96 Favored 'General case' 0 C--N 1.309 -1.188 0 N-CA-C 108.886 -0.783 . . . . 0.0 108.886 176.0 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 4' ' ' ALA . . . . . . . . . . . . . . . -138.93 141.79 38.48 Favored 'General case' 0 C--N 1.303 -1.448 0 CA-C-N 116.686 -0.233 . . . . 0.0 110.627 -175.507 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 5' ' ' ASP . . . . . . . . . . . . . 69.6 m-20 -60.83 147.27 43.34 Favored 'General case' 0 C--N 1.315 -0.916 0 O-C-N 124.009 0.818 . . . . 0.0 110.623 176.773 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 10.7 tp10 -69.02 133.21 47.83 Favored 'General case' 0 C--N 1.308 -1.235 0 CA-C-N 115.922 -0.581 . . . . 0.0 110.058 178.92 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 7' ' ' LYS . . . . . . . . . . . . . 8.8 ptpp? -81.62 -23.55 36.94 Favored 'General case' 0 CA--C 1.512 -0.515 0 CA-C-O 121.298 0.571 . . . . 0.0 110.979 -178.04 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 8' ' ' ASN . . . . . . . . . . . . . 12.7 m120 -86.55 16.8 4.29 Favored 'General case' 0 C--N 1.308 -1.196 0 CA-C-N 115.004 -0.998 . . . . 0.0 110.317 178.594 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 9' ' ' PHE . . . . . . . . . . . . . 0.3 OUTLIER -139.6 138.22 36.0 Favored 'General case' 0 N--CA 1.422 -1.865 0 N-CA-C 105.819 -1.919 . . . . 0.0 105.819 -176.927 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 10' ' ' ASP . . . . . . . . . . . . . 12.3 t70 -104.75 88.71 2.98 Favored 'General case' 0 C--N 1.303 -1.451 0 N-CA-C 108.274 -1.009 . . . . 0.0 108.274 174.518 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 11' ' ' CYS . . . . . . . . . . . . . 95.4 m -79.63 -6.17 56.55 Favored 'General case' 0 C--N 1.301 -1.502 0 N-CA-C 112.732 0.641 . . . . 0.0 112.732 -177.316 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 12' ' ' ARG . . . . . 0.46 ' O ' ' HG2' ' A' ' 16' ' ' ARG . 6.4 mmp_? -65.54 -51.11 62.28 Favored 'General case' 0 N--CA 1.444 -0.753 0 N-CA-C 107.198 -1.408 . . . . 0.0 107.198 173.034 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 58.3 ttp180 -62.0 -44.7 96.18 Favored 'General case' 0 CA--C 1.519 -0.223 0 CA-C-N 115.592 -0.731 . . . . 0.0 110.352 177.135 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 14' ' ' SER . . . . . . . . . . . . . 14.9 m -58.95 -31.73 68.97 Favored 'General case' 0 CA--C 1.543 0.704 0 CA-C-O 120.849 0.357 . . . . 0.0 111.159 178.789 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 38.8 tp -80.12 -40.14 28.07 Favored 'General case' 0 C--N 1.318 -0.772 0 N-CA-C 110.418 -0.216 . . . . 0.0 110.418 178.921 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 16' ' ' ARG . . . . . 0.46 ' HG2' ' O ' ' A' ' 12' ' ' ARG . 38.8 mmt180 -61.95 -37.9 86.47 Favored 'General case' 0 C--O 1.22 -0.467 0 CA-C-N 115.929 -0.578 . . . . 0.0 110.342 177.121 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 17' ' ' ASN . . . . . . . . . . . . . 0.9 OUTLIER -77.78 -49.97 13.29 Favored 'General case' 0 C--N 1.316 -0.86 0 CA-C-N 115.665 -0.698 . . . . 0.0 111.562 179.884 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . 129.79 -2.05 5.98 Favored Glycine 0 N--CA 1.446 -0.65 0 C-N-CA 120.03 -1.081 . . . . 0.0 112.751 -179.312 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 19' ' ' ASP . . . . . . . . . . . . . 6.2 m-20 -63.11 -37.86 88.87 Favored 'General case' 0 N--CA 1.477 0.897 0 CA-C-O 121.557 0.694 . . . . 0.0 110.237 -179.956 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 20' ' ' CYS . . . . . . . . . . . . . 43.8 t -71.3 -9.07 57.53 Favored 'General case' 0 C--N 1.311 -1.071 0 CA-C-N 114.789 -1.096 . . . . 0.0 111.526 -178.699 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 21' ' ' ASP . . . . . . . . . . . . . 32.6 t70 -116.58 -7.67 11.58 Favored 'General case' 0 C--N 1.32 -0.702 0 CA-C-O 121.478 0.656 . . . . 0.0 110.432 -179.768 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 22' ' ' ASN . . . . . . . . . . . . . 33.6 t30 -74.9 118.93 18.41 Favored 'General case' 0 C--N 1.308 -1.201 0 CA-C-N 115.801 -0.636 . . . . 0.0 110.722 -176.563 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 23' ' ' ASP . . . . . . . . . . . . . 11.4 m-20 -52.25 -40.06 61.17 Favored 'General case' 0 N--CA 1.479 0.978 0 C-N-CA 124.396 1.078 . . . . 0.0 111.836 -176.225 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 33.8 t70 -59.29 -38.75 80.95 Favored 'General case' 0 C--N 1.321 -0.652 0 CA-C-N 116.0 -0.546 . . . . 0.0 112.002 -178.692 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 25' ' ' LYS . . . . . 0.458 ' O ' ' HG2' ' A' ' 29' ' ' MET . 72.1 mmtt -100.47 2.11 41.8 Favored 'General case' 0 C--N 1.308 -1.214 0 N-CA-C 112.827 0.677 . . . . 0.0 112.827 -175.659 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 26' ' ' LEU . . . . . . . . . . . . . 55.9 mt -58.3 -35.49 71.92 Favored 'General case' 0 C--O 1.219 -0.525 0 N-CA-C 113.741 1.015 . . . . 0.0 113.741 -176.877 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 27' ' ' LEU . . . . . . . . . . . . . 1.5 tm? -55.31 -51.09 67.82 Favored 'General case' 0 N--CA 1.439 -0.982 0 N-CA-C 108.933 -0.765 . . . . 0.0 108.933 178.748 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 28' ' ' GLU . . . . . 0.542 ' HA ' ' CE2' ' A' ' 31' ' ' TYR . 43.9 mt-10 -64.87 -34.46 78.44 Favored 'General case' 0 CA--C 1.505 -0.752 0 CA-C-N 115.515 -0.766 . . . . 0.0 110.385 -179.704 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 29' ' ' MET . . . . . 0.458 ' HG2' ' O ' ' A' ' 25' ' ' LYS . 72.2 mmm -76.02 -21.82 56.44 Favored 'General case' 0 C--N 1.311 -1.07 0 CA-C-N 115.565 -0.743 . . . . 0.0 111.541 -174.653 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 30' ' ' GLY . . . . . . . . . . . . . . . -68.53 -37.69 85.6 Favored Glycine 0 CA--C 1.5 -0.862 0 C-N-CA 121.008 -0.615 . . . . 0.0 111.728 -179.892 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 31' ' ' TYR . . . . . 0.542 ' CE2' ' HA ' ' A' ' 28' ' ' GLU . 40.2 p90 -91.25 -36.84 13.67 Favored 'General case' 0 N--CA 1.433 -1.304 0 C-N-CA 119.77 -0.772 . . . . 0.0 112.005 177.775 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 32' ' ' TYR . . . . . . . . . . . . . 22.5 m-85 -65.72 -57.77 7.26 Favored 'General case' 0 C--N 1.316 -0.89 0 N-CA-C 113.259 0.837 . . . . 0.0 113.259 177.42 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 33' ' ' CYS . . . . . . . . . . . . . 98.5 m -135.05 80.62 47.48 Favored Pre-proline 0 C--N 1.305 -1.362 0 CA-C-O 121.376 0.608 . . . . 0.0 112.429 -177.694 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 34' ' ' PRO . . . . . 0.433 ' HA ' ' CD1' ' A' ' 39' ' ' PHE . 73.5 Cg_endo -72.59 -20.38 23.45 Favored 'Trans proline' 0 N--CA 1.45 -1.083 0 C-N-CA 122.576 2.184 . . . . 0.0 111.616 -178.404 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 35' ' ' VAL . . . . . . . . . . . . . 21.7 t -86.34 -55.93 5.99 Favored 'Isoleucine or valine' 0 C--N 1.295 -1.794 0 C-N-CA 120.431 -0.508 . . . . 0.0 110.178 -177.852 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 36' ' ' THR . . . . . . . . . . . . . 55.4 m -59.98 -40.12 88.04 Favored 'General case' 0 C--N 1.318 -0.79 0 N-CA-C 112.706 0.632 . . . . 0.0 112.706 -179.201 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 37' ' ' CYS . . . . . 0.402 ' SG ' ' HB3' ' A' ' 29' ' ' MET . 71.9 m -86.1 11.2 12.29 Favored 'General case' 0 C--N 1.307 -1.274 0 N-CA-C 113.212 0.819 . . . . 0.0 113.212 -177.429 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 38' ' ' GLY . . . . . . . . . . . . . . . 73.81 40.18 45.62 Favored Glycine 0 C--N 1.33 0.21 0 N-CA-C 115.332 0.893 . . . . 0.0 115.332 172.102 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 39' ' ' PHE . . . . . 0.433 ' CD1' ' HA ' ' A' ' 34' ' ' PRO . 95.5 m-85 -96.43 -37.9 10.25 Favored 'General case' 0 C--N 1.299 -1.62 0 N-CA-C 108.294 -1.002 . . . . 0.0 108.294 174.36 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 40' ' ' CYS . . . . . 0.411 ' SG ' ' HB2' ' A' ' 34' ' ' PRO . 6.5 p -163.04 -101.24 0.02 OUTLIER 'General case' 0 C--N 1.314 -0.972 0 CA-C-N 114.93 -1.032 . . . . 0.0 109.855 178.352 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 41' ' ' NH2 . . . . . . . . . . . . . . . . . . . . 0 C--N 1.315 -0.916 0 O-C-N 121.425 -0.797 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 011 nuclear orig full ' A' A ' 1' ' ' GLU . . . . . . . . . . . . . 15.1 pt-20 . . . . . 0 CA--C 1.495 -1.173 0 N-CA-C 109.497 -0.557 . . . . 0.0 109.497 . . . . . . . . . 0 0 . 1 . 011 nuclear orig full ' A' A ' 2' ' ' HIS . . . . . . . . . . . . . 69.2 m80 -91.14 130.8 36.99 Favored 'General case' 0 C--N 1.294 -1.841 0 N-CA-C 106.822 -1.547 . . . . 0.0 106.822 173.049 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 3' ' ' CYS . . . . . . . . . . . . . 8.3 p -57.8 114.12 2.16 Favored 'General case' 0 C--N 1.309 -1.17 0 O-C-N 123.696 0.623 . . . . 0.0 110.082 178.194 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 4' ' ' ALA . . . . . . . . . . . . . . . -133.32 156.06 48.28 Favored 'General case' 0 N--CA 1.43 -1.435 0 CA-C-N 115.734 -0.666 . . . . 0.0 109.627 -176.214 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 5' ' ' ASP . . . . . 0.554 ' HB3' ' SG ' ' A' ' 11' ' ' CYS . 14.6 m-20 -63.23 145.43 55.53 Favored 'General case' 0 C--N 1.308 -1.207 0 O-C-N 123.9 0.75 . . . . 0.0 110.654 179.8 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 6' ' ' GLU . . . . . 0.409 ' OE2' ' HB2' ' A' ' 8' ' ' ASN . 0.3 OUTLIER -70.21 124.18 23.48 Favored 'General case' 0 C--N 1.306 -1.283 0 N-CA-C 105.495 -2.039 . . . . 0.0 105.495 176.239 . . . . . . . . 3 3 . 1 . 011 nuclear orig full ' A' A ' 7' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -79.19 -21.37 46.47 Favored 'General case' 0 C--N 1.321 -0.639 0 N-CA-C 113.597 0.962 . . . . 0.0 113.597 -170.687 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 8' ' ' ASN . . . . . 0.409 ' HB2' ' OE2' ' A' ' 6' ' ' GLU . 32.7 m-80 -81.7 -23.03 37.05 Favored 'General case' 0 C--N 1.304 -1.407 0 N-CA-C 108.873 -0.788 . . . . 0.0 108.873 -178.964 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 9' ' ' PHE . . . . . . . . . . . . . 28.7 t80 -81.67 142.32 32.82 Favored 'General case' 0 N--CA 1.428 -1.54 0 CA-C-N 114.593 -1.185 . . . . 0.0 108.362 178.524 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 10' ' ' ASP . . . . . . . . . . . . . 8.9 t70 -92.18 97.14 10.72 Favored 'General case' 0 C--N 1.305 -1.346 0 C-N-CA 118.856 -1.137 . . . . 0.0 109.018 178.759 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 11' ' ' CYS . . . . . 0.554 ' SG ' ' HB3' ' A' ' 5' ' ' ASP . 72.8 m -73.83 -23.06 59.59 Favored 'General case' 0 C--N 1.297 -1.682 0 CA-C-N 115.231 -0.895 . . . . 0.0 111.546 -177.23 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 12' ' ' ARG . . . . . . . . . . . . . 19.9 mmm180 -74.19 -44.56 52.9 Favored 'General case' 0 C--N 1.325 -0.473 0 N-CA-C 109.354 -0.61 . . . . 0.0 109.354 -177.235 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 58.2 ttp180 -56.32 -49.12 75.24 Favored 'General case' 0 C--N 1.321 -0.66 0 C-N-CA 124.253 1.021 . . . . 0.0 108.597 176.083 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 14' ' ' SER . . . . . . . . . . . . . 20.7 m -60.38 -32.73 71.58 Favored 'General case' 0 C--N 1.313 -1.008 0 CA-C-N 114.794 -1.093 . . . . 0.0 111.911 -179.35 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 15' ' ' LEU . . . . . 0.437 ' HA ' ' HB3' ' A' ' 20' ' ' CYS . 29.9 tp -78.08 -39.32 41.93 Favored 'General case' 0 C--N 1.309 -1.174 0 O-C-N 121.973 -0.455 . . . . 0.0 110.559 179.765 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 16' ' ' ARG . . . . . . . . . . . . . 66.6 mtt180 -70.04 -35.93 74.66 Favored 'General case' 0 C--N 1.316 -0.873 0 CA-C-N 115.874 -0.603 . . . . 0.0 111.88 179.663 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 17' ' ' ASN . . . . . . . . . . . . . 95.0 m-20 -70.86 -44.13 67.03 Favored 'General case' 0 CA--C 1.495 -1.136 0 CA-C-O 121.662 0.744 . . . . 0.0 109.533 178.688 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . 118.82 2.65 14.25 Favored Glycine 0 N--CA 1.424 -2.13 0 CA-C-N 114.556 -1.202 . . . . 0.0 110.948 -177.144 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 19' ' ' ASP . . . . . . . . . . . . . 28.0 m-20 -60.16 -41.65 93.27 Favored 'General case' 0 N--CA 1.484 1.256 0 CA-C-O 122.354 1.073 . . . . 0.0 108.518 -179.893 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 20' ' ' CYS . . . . . 0.437 ' HB3' ' HA ' ' A' ' 15' ' ' LEU . 43.2 t -79.6 -3.18 45.9 Favored 'General case' 0 C--N 1.302 -1.46 0 CA-C-N 113.689 -1.596 . . . . 0.0 111.056 -176.548 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 21' ' ' ASP . . . . . . . . . . . . . 32.1 t70 -121.93 -9.75 8.73 Favored 'General case' 0 C--N 1.312 -1.06 0 CA-C-O 121.445 0.641 . . . . 0.0 110.626 -176.275 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 22' ' ' ASN . . . . . 0.424 ' O ' ' HG ' ' A' ' 26' ' ' LEU . 55.0 t-20 -87.26 125.04 33.96 Favored 'General case' 0 C--N 1.31 -1.13 0 N-CA-C 108.909 -0.775 . . . . 0.0 108.909 -177.542 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 23' ' ' ASP . . . . . . . . . . . . . 28.8 t70 -55.22 -36.77 66.33 Favored 'General case' 0 C--N 1.318 -0.767 0 C-N-CA 124.165 0.986 . . . . 0.0 111.782 -179.658 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 31.6 t70 -68.45 -29.51 68.17 Favored 'General case' 0 C--N 1.316 -0.877 0 CA-C-N 115.951 -0.568 . . . . 0.0 111.516 -178.368 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 25' ' ' LYS . . . . . . . . . . . . . 13.2 mptt -100.02 1.55 42.57 Favored 'General case' 0 C--N 1.316 -0.89 0 CA-C-N 116.079 -0.509 . . . . 0.0 112.336 -178.018 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 26' ' ' LEU . . . . . 0.424 ' HG ' ' O ' ' A' ' 22' ' ' ASN . 59.3 mt -62.89 -38.36 90.62 Favored 'General case' 0 C--O 1.214 -0.787 0 N-CA-C 114.737 1.384 . . . . 0.0 114.737 -175.262 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 27' ' ' LEU . . . . . . . . . . . . . 2.0 tm? -59.95 -47.24 86.62 Favored 'General case' 0 N--CA 1.441 -0.921 0 N-CA-C 108.607 -0.886 . . . . 0.0 108.607 -179.285 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 28' ' ' GLU . . . . . 0.565 ' HA ' ' CZ ' ' A' ' 31' ' ' TYR . 34.0 tt0 -64.81 -35.63 81.71 Favored 'General case' 0 C--N 1.311 -1.105 0 CA-C-N 115.401 -0.818 . . . . 0.0 110.139 179.708 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 29' ' ' MET . . . . . 0.503 ' HB3' ' SG ' ' A' ' 37' ' ' CYS . 76.1 mmm -82.64 -12.17 57.84 Favored 'General case' 0 C--N 1.3 -1.563 0 CA-C-N 115.477 -0.783 . . . . 0.0 111.897 -175.03 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 30' ' ' GLY . . . . . . . . . . . . . . . -75.35 -36.96 43.09 Favored Glycine 0 C--N 1.307 -1.037 0 N-CA-C 111.113 -0.795 . . . . 0.0 111.113 177.77 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 31' ' ' TYR . . . . . 0.565 ' CZ ' ' HA ' ' A' ' 28' ' ' GLU . 24.8 p90 -84.78 -27.98 26.5 Favored 'General case' 0 N--CA 1.441 -0.914 0 C-N-CA 119.681 -0.808 . . . . 0.0 112.24 176.408 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 32' ' ' TYR . . . . . . . . . . . . . 30.6 m-85 -77.43 -61.38 2.01 Favored 'General case' 0 C--N 1.295 -1.799 0 N-CA-C 113.737 1.014 . . . . 0.0 113.737 174.961 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 33' ' ' CYS . . . . . . . . . . . . . 31.4 m -132.58 72.86 77.38 Favored Pre-proline 0 C--N 1.303 -1.441 0 C-N-CA 119.734 -0.786 . . . . 0.0 111.466 -175.308 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 34' ' ' PRO . . . . . 0.487 ' HD2' ' HA ' ' A' ' 5' ' ' ASP . 34.6 Cg_endo -62.48 -26.86 76.58 Favored 'Trans proline' 0 C--N 1.363 1.304 0 C-N-CA 122.703 2.269 . . . . 0.0 112.323 -178.549 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 35' ' ' VAL . . . . . . . . . . . . . 38.5 t -85.92 -49.68 15.06 Favored 'Isoleucine or valine' 0 C--N 1.296 -1.754 0 C-N-CA 120.133 -0.627 . . . . 0.0 110.472 -177.45 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 36' ' ' THR . . . . . . . . . . . . . 20.9 m -58.94 -38.51 79.16 Favored 'General case' 0 C--N 1.32 -0.685 0 C-N-CA 123.072 0.549 . . . . 0.0 111.279 -178.917 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 37' ' ' CYS . . . . . 0.503 ' SG ' ' HB3' ' A' ' 29' ' ' MET . 64.6 m -87.91 10.8 17.52 Favored 'General case' 0 C--N 1.312 -1.061 0 CA-C-N 115.9 -0.591 . . . . 0.0 112.246 -178.488 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 38' ' ' GLY . . . . . . . . . . . . . . . 74.73 19.84 79.74 Favored Glycine 0 CA--C 1.522 0.489 0 N-CA-C 116.197 1.239 . . . . 0.0 116.197 172.145 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 39' ' ' PHE . . . . . . . . . . . . . 97.3 m-85 -79.15 -43.01 24.85 Favored 'General case' 0 C--N 1.317 -0.828 0 CA-C-N 118.153 0.976 . . . . 0.0 108.419 176.908 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 40' ' ' CYS . . . . . . . . . . . . . 61.1 m -112.67 86.48 2.37 Favored 'General case' 0 C--N 1.303 -1.424 0 CA-C-N 114.728 -1.124 . . . . 0.0 108.618 178.44 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 41' ' ' NH2 . . . . . . . . . . . . . . . . . . . . 0 C--N 1.307 -1.26 0 CA-C-N 116.586 -0.279 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 012 nuclear orig full ' A' A ' 1' ' ' GLU . . . . . . . . . . . . . 6.7 pt-20 . . . . . 0 CA--C 1.508 -0.65 0 CA-C-O 121.084 0.468 . . . . 0.0 110.192 . . . . . . . . . 0 0 . 1 . 012 nuclear orig full ' A' A ' 2' ' ' HIS . . . . . . . . . . . . . 76.6 m-70 -102.36 111.98 24.49 Favored 'General case' 0 N--CA 1.428 -1.527 0 N-CA-C 106.864 -1.532 . . . . 0.0 106.864 173.26 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 3' ' ' CYS . . . . . . . . . . . . . 45.2 t -84.32 95.7 8.8 Favored 'General case' 0 C--N 1.3 -1.571 0 CA-C-O 121.899 0.856 . . . . 0.0 109.961 -175.955 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 4' ' ' ALA . . . . . . . . . . . . . . . -149.6 145.7 26.92 Favored 'General case' 0 C--N 1.283 -2.31 0 CA-C-N 114.233 -1.349 . . . . 0.0 108.701 -178.928 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 5' ' ' ASP . . . . . 0.468 ' HB3' ' SG ' ' A' ' 11' ' ' CYS . 24.5 m-20 -56.95 148.83 20.15 Favored 'General case' 0 C--O 1.25 1.129 0 O-C-N 124.095 0.872 . . . . 0.0 110.056 179.907 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 6' ' ' GLU . . . . . 0.464 ' OE1' ' HG2' ' A' ' 7' ' ' LYS . 9.4 tp10 -72.54 145.68 47.28 Favored 'General case' 0 N--CA 1.423 -1.818 0 CA-C-O 121.387 0.613 . . . . 0.0 111.226 -176.562 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 7' ' ' LYS . . . . . 0.464 ' HG2' ' OE1' ' A' ' 6' ' ' GLU . 8.0 ptpp? -84.27 -25.2 29.55 Favored 'General case' 0 C--N 1.315 -0.925 0 CA-C-N 115.085 -0.961 . . . . 0.0 110.885 -175.609 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 8' ' ' ASN . . . . . . . . . . . . . 15.0 m120 -87.64 4.89 42.16 Favored 'General case' 0 C--N 1.309 -1.187 0 CA-C-N 115.086 -0.961 . . . . 0.0 110.047 -178.001 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 9' ' ' PHE . . . . . . . . . . . . . 20.6 t80 -129.72 143.83 51.0 Favored 'General case' 0 N--CA 1.417 -2.111 0 N-CA-C 107.354 -1.351 . . . . 0.0 107.354 -176.704 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 10' ' ' ASP . . . . . . . . . . . . . 12.1 t70 -103.04 100.9 10.86 Favored 'General case' 0 C--N 1.303 -1.432 0 N-CA-C 108.447 -0.946 . . . . 0.0 108.447 179.617 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 11' ' ' CYS . . . . . 0.468 ' SG ' ' HB3' ' A' ' 5' ' ' ASP . 74.1 m -72.57 -26.38 61.7 Favored 'General case' 0 C--N 1.284 -2.263 0 N-CA-C 113.375 0.88 . . . . 0.0 113.375 -175.004 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 12' ' ' ARG . . . . . . . . . . . . . 37.1 mmt180 -73.17 -49.05 30.28 Favored 'General case' 0 C--N 1.319 -0.728 0 C-N-CA 120.549 -0.461 . . . . 0.0 110.004 -179.792 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 55.2 ttp180 -61.17 -42.72 99.06 Favored 'General case' 0 C--N 1.324 -0.525 0 CA-C-N 115.993 -0.549 . . . . 0.0 110.69 -179.919 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 14' ' ' SER . . . . . . . . . . . . . 16.8 m -66.3 -40.9 90.31 Favored 'General case' 0 C--N 1.312 -1.038 0 CA-C-O 121.185 0.517 . . . . 0.0 110.51 -178.756 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 61.7 tp -63.69 -44.55 93.35 Favored 'General case' 0 C--O 1.238 0.473 0 CA-C-N 115.946 -0.57 . . . . 0.0 110.717 178.704 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 16' ' ' ARG . . . . . . . . . . . . . 78.1 mtp180 -71.56 -28.59 63.96 Favored 'General case' 0 C--N 1.316 -0.89 0 CA-C-N 115.6 -0.727 . . . . 0.0 112.3 -178.786 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 17' ' ' ASN . . . . . . . . . . . . . 13.1 m-80 -77.82 -33.39 52.4 Favored 'General case' 0 CA--C 1.493 -1.22 0 CA-C-O 120.97 0.414 . . . . 0.0 111.89 177.522 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . 116.4 17.19 6.23 Favored Glycine 0 C--N 1.295 -1.728 0 C-N-CA 119.72 -1.228 . . . . 0.0 112.804 177.612 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 19' ' ' ASP . . . . . . . . . . . . . 4.4 m-20 -63.8 -35.45 80.65 Favored 'General case' 0 CA--C 1.505 -0.753 0 CA-C-O 120.99 0.424 . . . . 0.0 111.929 179.203 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 20' ' ' CYS . . . . . . . . . . . . . 11.1 t -85.63 -2.97 58.72 Favored 'General case' 0 C--N 1.309 -1.178 0 CA-C-O 121.851 0.834 . . . . 0.0 109.389 -176.335 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 21' ' ' ASP . . . . . . . . . . . . . 31.2 t70 -105.83 -9.33 17.25 Favored 'General case' 0 C--N 1.319 -0.755 0 CA-C-O 122.404 1.097 . . . . 0.0 108.717 176.692 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 22' ' ' ASN . . . . . . . . . . . . . 49.4 t-20 -87.45 115.07 24.61 Favored 'General case' 0 C--N 1.304 -1.391 0 CA-C-N 114.505 -1.225 . . . . 0.0 108.427 -176.978 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 23' ' ' ASP . . . . . 0.454 ' HA ' ' HG ' ' A' ' 26' ' ' LEU . 7.7 m-20 -56.91 -37.65 71.73 Favored 'General case' 0 N--CA 1.475 0.776 0 N-CA-C 112.607 0.595 . . . . 0.0 112.607 -178.252 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 29.5 m-20 -69.12 -24.15 64.07 Favored 'General case' 0 C--N 1.321 -0.657 0 CA-C-N 116.375 -0.375 . . . . 0.0 111.465 -179.227 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 25' ' ' LYS . . . . . . . . . . . . . 14.0 mptt -107.17 8.7 30.22 Favored 'General case' 0 C--N 1.313 -1.006 0 N-CA-C 113.044 0.757 . . . . 0.0 113.044 -178.825 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 26' ' ' LEU . . . . . 0.454 ' HG ' ' HA ' ' A' ' 23' ' ' ASP . 73.7 mt -59.09 -48.32 82.05 Favored 'General case' 0 N--CA 1.472 0.646 0 N-CA-C 113.502 0.927 . . . . 0.0 113.502 -177.908 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 27' ' ' LEU . . . . . . . . . . . . . 22.1 tp -59.67 -48.52 81.34 Favored 'General case' 0 N--CA 1.44 -0.971 0 N-CA-C 108.952 -0.759 . . . . 0.0 108.952 178.894 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 28' ' ' GLU . . . . . . . . . . . . . 4.7 tp10 -55.74 -37.89 69.06 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 114.055 -1.429 . . . . 0.0 108.935 -177.679 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 29' ' ' MET . . . . . . . . . . . . . 78.5 mmm -84.47 -28.22 26.95 Favored 'General case' 0 C--N 1.309 -1.167 0 CA-C-N 114.997 -1.001 . . . . 0.0 112.4 -173.834 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 30' ' ' GLY . . . . . . . . . . . . . . . -72.69 -32.44 61.54 Favored Glycine 0 N--CA 1.431 -1.638 0 C-N-CA 120.567 -0.825 . . . . 0.0 112.461 -177.76 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 31' ' ' TYR . . . . . . . . . . . . . 47.2 p90 -90.61 -34.79 15.33 Favored 'General case' 0 CA--C 1.5 -0.948 0 C-N-CA 117.935 -1.506 . . . . 0.0 112.349 177.514 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 32' ' ' TYR . . . . . . . . . . . . . 31.4 m-85 -68.69 -41.92 78.51 Favored 'General case' 0 C--N 1.312 -1.022 0 C-N-CA 120.212 -0.595 . . . . 0.0 112.328 176.326 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 33' ' ' CYS . . . . . . . . . . . . . 54.9 m -132.59 64.75 72.64 Favored Pre-proline 0 C--O 1.259 1.553 0 N-CA-C 112.421 0.526 . . . . 0.0 112.421 -176.346 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 34' ' ' PRO . . . . . . . . . . . . . 38.6 Cg_endo -67.1 -29.87 39.28 Favored 'Trans proline' 0 N--CA 1.453 -0.908 0 C-N-CA 122.011 1.807 . . . . 0.0 111.718 -178.674 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 35' ' ' VAL . . . . . . . . . . . . . 47.3 t -87.38 -50.08 14.13 Favored 'Isoleucine or valine' 0 N--CA 1.43 -1.455 0 CA-C-N 115.7 -0.682 . . . . 0.0 111.653 -175.379 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 36' ' ' THR . . . . . . . . . . . . . 95.6 m -58.39 -37.69 75.79 Favored 'General case' 0 CA--C 1.545 0.772 0 N-CA-C 112.552 0.575 . . . . 0.0 112.552 -178.683 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 37' ' ' CYS . . . . . . . . . . . . . 85.7 m -78.21 -23.62 47.42 Favored 'General case' 0 C--N 1.322 -0.59 0 C-N-CA 119.233 -0.987 . . . . 0.0 111.897 177.668 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 38' ' ' GLY . . . . . . . . . . . . . . . 96.49 41.12 3.73 Favored Glycine 0 N--CA 1.445 -0.727 0 C-N-CA 119.998 -1.096 . . . . 0.0 113.193 179.154 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 39' ' ' PHE . . . . . . . . . . . . . 91.4 m-85 -97.47 -38.9 9.41 Favored 'General case' 0 C--N 1.314 -0.943 0 N-CA-C 107.777 -1.194 . . . . 0.0 107.777 174.276 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 40' ' ' CYS . . . . . . . . . . . . . 41.9 t -107.08 94.6 5.18 Favored 'General case' 0 C--N 1.299 -1.591 0 CA-C-N 113.97 -1.468 . . . . 0.0 108.723 -176.416 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 41' ' ' NH2 . . . . . . . . . . . . . . . . . . . . 0 C--N 1.305 -1.334 0 CA-C-N 116.6 -0.273 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 013 nuclear orig full ' A' A ' 1' ' ' GLU . . . . . . . . . . . . . 10.2 pt-20 . . . . . 0 C--O 1.236 0.343 0 CA-C-O 119.417 -0.325 . . . . 0.0 111.295 . . . . . . . . . 0 0 . 1 . 013 nuclear orig full ' A' A ' 2' ' ' HIS . . . . . . . . . . . . . 20.8 m-70 -60.76 111.5 1.66 Allowed 'General case' 0 CA--C 1.484 -1.559 0 CA-C-O 121.572 0.701 . . . . 0.0 111.197 -172.209 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 3' ' ' CYS . . . . . 0.422 ' SG ' ' HB2' ' A' ' 34' ' ' PRO . 16.0 t -81.66 98.03 8.18 Favored 'General case' 0 C--N 1.279 -2.493 0 CA-C-N 114.486 -1.234 . . . . 0.0 109.307 -178.883 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 4' ' ' ALA . . . . . . . . . . . . . . . -152.03 136.45 16.8 Favored 'General case' 0 C--N 1.292 -1.924 0 CA-C-N 114.479 -1.237 . . . . 0.0 108.781 179.875 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 5' ' ' ASP . . . . . 0.585 ' HB3' ' SG ' ' A' ' 11' ' ' CYS . 54.3 m-20 -67.44 143.25 56.35 Favored 'General case' 0 C--O 1.248 0.995 0 O-C-N 123.473 0.483 . . . . 0.0 111.122 179.04 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 9.8 tp10 -66.86 140.88 57.81 Favored 'General case' 0 C--N 1.316 -0.869 0 C-N-CA 124.054 0.942 . . . . 0.0 109.741 177.563 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 7' ' ' LYS . . . . . . . . . . . . . 20.8 ptmt -85.44 -23.36 27.9 Favored 'General case' 0 N--CA 1.441 -0.89 0 CA-C-O 121.464 0.649 . . . . 0.0 111.101 -178.652 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 8' ' ' ASN . . . . . . . . . . . . . 38.1 m-80 -86.91 14.66 6.92 Favored 'General case' 0 N--CA 1.48 1.057 0 CA-C-N 114.953 -1.021 . . . . 0.0 110.673 -178.565 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 9' ' ' PHE . . . . . . . . . . . . . 15.3 t80 -141.34 132.95 27.07 Favored 'General case' 0 N--CA 1.41 -2.469 0 N-CA-C 105.232 -2.136 . . . . 0.0 105.232 -178.774 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 10' ' ' ASP . . . . . . . . . . . . . 9.1 t70 -91.78 96.79 10.61 Favored 'General case' 0 C--N 1.297 -1.7 0 C-N-CA 118.63 -1.228 . . . . 0.0 108.774 -179.713 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 11' ' ' CYS . . . . . 0.585 ' SG ' ' HB3' ' A' ' 5' ' ' ASP . 60.0 m -68.33 -30.21 69.14 Favored 'General case' 0 C--N 1.3 -1.546 0 CA-C-N 115.706 -0.679 . . . . 0.0 112.215 -175.574 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 12' ' ' ARG . . . . . . . . . . . . . 30.6 mmt180 -69.36 -47.46 64.25 Favored 'General case' 0 CA--C 1.508 -0.635 0 N-CA-C 110.008 -0.368 . . . . 0.0 110.008 179.468 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 54.6 ttp180 -58.71 -42.25 88.21 Favored 'General case' 0 C--N 1.315 -0.894 0 C-N-CA 122.967 0.507 . . . . 0.0 109.918 176.865 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 14' ' ' SER . . . . . . . . . . . . . 26.2 m -64.51 -33.42 75.84 Favored 'General case' 0 C--N 1.316 -0.891 0 CA-C-N 116.006 -0.543 . . . . 0.0 110.749 179.153 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 29.8 tp -74.88 -41.7 59.29 Favored 'General case' 0 N--CA 1.441 -0.912 0 N-CA-C 109.633 -0.506 . . . . 0.0 109.633 179.609 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 16' ' ' ARG . . . . . . . . . . . . . 78.3 mtp180 -64.49 -31.09 72.15 Favored 'General case' 0 C--N 1.321 -0.656 0 C-N-CA 123.699 0.8 . . . . 0.0 111.883 179.51 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 17' ' ' ASN . . . . . . . . . . . . . 30.6 m-80 -85.25 -42.77 14.36 Favored 'General case' 0 CA--C 1.511 -0.531 0 N-CA-C 112.454 0.539 . . . . 0.0 112.454 179.275 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . 130.55 -4.19 5.83 Favored Glycine 0 C--O 1.225 -0.461 0 C-N-CA 119.614 -1.279 . . . . 0.0 112.414 -179.334 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 19' ' ' ASP . . . . . . . . . . . . . 3.5 m-20 -61.79 -38.99 90.1 Favored 'General case' 0 N--CA 1.478 0.972 0 C-N-CA 123.614 0.766 . . . . 0.0 110.701 -177.336 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 20' ' ' CYS . . . . . . . . . . . . . 44.4 t -77.89 -11.21 59.87 Favored 'General case' 0 C--N 1.302 -1.497 0 CA-C-N 114.728 -1.124 . . . . 0.0 111.845 -173.741 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 21' ' ' ASP . . . . . . . . . . . . . 35.3 t70 -114.07 -6.61 13.1 Favored 'General case' 0 C--N 1.312 -1.036 0 CA-C-O 121.768 0.794 . . . . 0.0 110.612 -178.437 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 22' ' ' ASN . . . . . . . . . . . . . 19.1 t-20 -79.53 115.47 19.17 Favored 'General case' 0 C--N 1.309 -1.177 0 CA-C-N 115.378 -0.828 . . . . 0.0 109.681 -177.297 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 23' ' ' ASP . . . . . . . . . . . . . 13.2 t70 -55.02 -39.45 69.13 Favored 'General case' 0 N--CA 1.479 0.988 0 C-N-CA 123.972 0.909 . . . . 0.0 112.616 -175.849 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 6.0 m-20 -72.58 -12.93 61.26 Favored 'General case' 0 C--N 1.31 -1.151 0 N-CA-C 112.819 0.674 . . . . 0.0 112.819 -177.053 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 25' ' ' LYS . . . . . . . . . . . . . 43.7 mtpt -113.41 -2.08 14.04 Favored 'General case' 0 C--N 1.315 -0.934 0 CA-C-O 120.963 0.411 . . . . 0.0 110.432 179.655 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 26' ' ' LEU . . . . . . . . . . . . . 45.8 mt -55.54 -35.54 65.79 Favored 'General case' 0 C--N 1.318 -0.785 0 N-CA-C 115.44 1.644 . . . . 0.0 115.44 -177.632 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 27' ' ' LEU . . . . . . . . . . . . . 2.2 tm? -58.08 -50.96 71.67 Favored 'General case' 0 N--CA 1.441 -0.9 0 N-CA-C 107.672 -1.233 . . . . 0.0 107.672 179.071 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 28' ' ' GLU . . . . . 0.616 ' HA ' ' CZ ' ' A' ' 31' ' ' TYR . 40.0 tt0 -65.38 -32.62 74.35 Favored 'General case' 0 N--CA 1.437 -1.076 0 CA-C-N 114.63 -1.168 . . . . 0.0 110.449 179.753 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 29' ' ' MET . . . . . . . . . . . . . 78.5 mmm -80.51 -17.98 49.91 Favored 'General case' 0 C--O 1.208 -1.121 0 CA-C-N 115.901 -0.59 . . . . 0.0 112.081 -175.764 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 30' ' ' GLY . . . . . . . . . . . . . . . -77.06 -39.78 26.64 Favored Glycine 0 C--N 1.303 -1.284 0 C-N-CA 120.419 -0.896 . . . . 0.0 111.658 -179.604 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 31' ' ' TYR . . . . . 0.616 ' CZ ' ' HA ' ' A' ' 28' ' ' GLU . 25.0 p90 -79.44 -31.64 42.62 Favored 'General case' 0 CA--C 1.501 -0.931 0 C-N-CA 119.173 -1.011 . . . . 0.0 112.059 176.581 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 32' ' ' TYR . . . . . . . . . . . . . 17.8 m-85 -73.77 -54.85 7.11 Favored 'General case' 0 C--N 1.297 -1.689 0 N-CA-C 113.384 0.883 . . . . 0.0 113.384 174.913 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 33' ' ' CYS . . . . . . . . . . . . . 30.3 m -134.89 76.9 58.22 Favored Pre-proline 0 C--N 1.307 -1.281 0 C-N-CA 119.892 -0.723 . . . . 0.0 111.863 -175.99 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 34' ' ' PRO . . . . . 0.429 ' HD2' ' HA ' ' A' ' 5' ' ' ASP . 55.7 Cg_endo -68.79 -25.07 33.75 Favored 'Trans proline' 0 C--N 1.352 0.759 0 C-N-CA 122.261 1.974 . . . . 0.0 112.054 -179.266 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 35' ' ' VAL . . . . . 0.419 ' HB ' ' OD1' ' A' ' 5' ' ' ASP . 47.3 t -86.28 -51.65 12.91 Favored 'Isoleucine or valine' 0 C--N 1.306 -1.313 0 CA-C-N 116.261 -0.427 . . . . 0.0 110.491 -177.326 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 36' ' ' THR . . . . . . . . . . . . . 62.0 m -62.41 -37.6 86.42 Favored 'General case' 0 C--O 1.249 1.039 0 CA-C-N 116.159 -0.473 . . . . 0.0 111.958 -178.615 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 37' ' ' CYS . . . . . . . . . . . . . 72.2 m -84.62 6.53 23.59 Favored 'General case' 0 C--N 1.311 -1.091 0 N-CA-C 112.395 0.517 . . . . 0.0 112.395 -179.726 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 38' ' ' GLY . . . . . . . . . . . . . . . 70.09 46.49 50.87 Favored Glycine 0 N--CA 1.446 -0.676 0 N-CA-C 115.451 0.94 . . . . 0.0 115.451 172.238 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 39' ' ' PHE . . . . . . . . . . . . . 91.9 m-85 -87.87 -36.18 17.34 Favored 'General case' 0 C--N 1.302 -1.467 0 N-CA-C 108.766 -0.828 . . . . 0.0 108.766 174.145 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 40' ' ' CYS . . . . . . . . . . . . . 15.8 m -116.51 73.6 0.86 Allowed 'General case' 0 C--N 1.315 -0.893 0 N-CA-C 109.178 -0.675 . . . . 0.0 109.178 178.889 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 41' ' ' NH2 . . . . . . . . . . . . . . . . . . . . 0 C--N 1.314 -0.96 0 CA-C-N 116.738 -0.21 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 014 nuclear orig full ' A' A ' 1' ' ' GLU . . . . . . . . . . . . . 10.8 pt-20 . . . . . 0 C--O 1.243 0.762 0 CA-C-O 119.739 -0.172 . . . . 0.0 110.901 . . . . . . . . . 0 0 . 1 . 014 nuclear orig full ' A' A ' 2' ' ' HIS . . . . . . . . . . . . . 21.7 t-80 -65.4 110.63 2.72 Favored 'General case' 0 N--CA 1.441 -0.887 0 N-CA-C 108.964 -0.754 . . . . 0.0 108.964 -178.562 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 3' ' ' CYS . . . . . . . . . . . . . 26.2 p -86.21 109.71 19.1 Favored 'General case' 0 C--N 1.297 -1.702 0 CA-C-N 115.47 -0.786 . . . . 0.0 110.702 -179.875 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 4' ' ' ALA . . . . . . . . . . . . . . . -142.12 156.01 45.36 Favored 'General case' 0 N--CA 1.433 -1.313 0 N-CA-C 108.419 -0.956 . . . . 0.0 108.419 179.538 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 5' ' ' ASP . . . . . 0.591 ' HB3' ' SG ' ' A' ' 11' ' ' CYS . 31.3 m-20 -60.56 137.31 58.18 Favored 'General case' 0 C--N 1.312 -1.04 0 O-C-N 123.527 0.517 . . . . 0.0 111.41 -177.24 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 9.9 tp10 -69.27 127.48 33.2 Favored 'General case' 0 N--CA 1.427 -1.584 0 N-CA-C 109.466 -0.568 . . . . 0.0 109.466 177.534 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 7' ' ' LYS . . . . . . . . . . . . . 17.3 ptpt -85.25 -12.76 51.76 Favored 'General case' 0 C--N 1.306 -1.293 0 CA-C-O 121.576 0.703 . . . . 0.0 110.652 -178.687 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 8' ' ' ASN . . . . . . . . . . . . . 13.0 m120 -91.64 16.37 10.72 Favored 'General case' 0 C--N 1.315 -0.902 0 CA-C-O 121.91 0.862 . . . . 0.0 109.2 176.398 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 9' ' ' PHE . . . . . . . . . . . . . 29.6 t80 -136.4 155.98 49.27 Favored 'General case' 0 N--CA 1.427 -1.589 0 N-CA-C 106.748 -1.575 . . . . 0.0 106.748 -177.655 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 10' ' ' ASP . . . . . . . . . . . . . 9.1 t70 -104.49 95.74 6.13 Favored 'General case' 0 C--N 1.311 -1.076 0 N-CA-C 108.501 -0.926 . . . . 0.0 108.501 175.199 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 11' ' ' CYS . . . . . 0.591 ' SG ' ' HB3' ' A' ' 5' ' ' ASP . 81.4 m -67.88 -30.95 70.43 Favored 'General case' 0 C--N 1.301 -1.504 0 CA-C-N 115.61 -0.723 . . . . 0.0 111.727 -175.573 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 12' ' ' ARG . . . . . 0.414 ' O ' ' HG3' ' A' ' 16' ' ' ARG . 28.4 mmm180 -66.93 -43.49 83.11 Favored 'General case' 0 CA--C 1.503 -0.839 0 CA-C-N 116.324 -0.398 . . . . 0.0 110.359 179.496 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 60.7 ttp180 -58.24 -47.59 83.04 Favored 'General case' 0 C--N 1.316 -0.868 0 CA-C-N 115.865 -0.607 . . . . 0.0 110.705 179.333 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 14' ' ' SER . . . . . . . . . . . . . 57.0 m -66.66 -28.24 68.31 Favored 'General case' 0 C--N 1.319 -0.743 0 N-CA-C 112.028 0.381 . . . . 0.0 112.028 179.045 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 15' ' ' LEU . . . . . 0.402 HD13 ' SG ' ' A' ' 20' ' ' CYS . 42.3 tp -74.14 -45.2 50.29 Favored 'General case' 0 C--N 1.319 -0.743 0 CA-C-O 120.891 0.377 . . . . 0.0 110.141 177.527 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 16' ' ' ARG . . . . . 0.414 ' HG3' ' O ' ' A' ' 12' ' ' ARG . 48.2 mtm180 -66.5 -34.63 78.36 Favored 'General case' 0 C--N 1.316 -0.849 0 CA-C-N 115.99 -0.55 . . . . 0.0 111.131 179.781 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 17' ' ' ASN . . . . . . . . . . . . . 14.7 m-80 -70.85 -31.08 67.66 Favored 'General case' 0 CA--C 1.496 -1.108 0 CA-C-O 121.167 0.508 . . . . 0.0 111.079 176.318 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . 105.2 -1.66 40.55 Favored Glycine 0 N--CA 1.436 -1.331 0 CA-C-N 115.508 -0.769 . . . . 0.0 112.513 178.489 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 19' ' ' ASP . . . . . . . . . . . . . 18.6 m-20 -63.01 -33.01 74.51 Favored 'General case' 0 N--CA 1.484 1.228 0 CA-C-O 121.657 0.741 . . . . 0.0 109.852 -179.453 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 20' ' ' CYS . . . . . 0.429 ' HA ' ' HG3' ' A' ' 29' ' ' MET . 32.2 t -64.51 -24.14 67.51 Favored 'General case' 0 C--N 1.302 -1.484 0 CA-C-N 114.376 -1.283 . . . . 0.0 110.993 -179.987 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 21' ' ' ASP . . . . . . . . . . . . . 34.6 t70 -112.86 -4.88 13.9 Favored 'General case' 0 N--CA 1.468 0.462 0 CA-C-O 121.585 0.707 . . . . 0.0 110.694 -178.632 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 22' ' ' ASN . . . . . 0.423 ' O ' ' HG ' ' A' ' 26' ' ' LEU . 27.2 t-20 -77.77 126.19 30.48 Favored 'General case' 0 C--N 1.307 -1.246 0 CA-C-N 116.118 -0.492 . . . . 0.0 109.809 -178.602 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 23' ' ' ASP . . . . . 0.449 ' HA ' ' HG ' ' A' ' 26' ' ' LEU . 2.2 m-20 -56.92 -41.74 78.72 Favored 'General case' 0 N--CA 1.474 0.745 0 N-CA-C 113.809 1.04 . . . . 0.0 113.809 -176.333 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 21.9 t70 -67.97 -29.03 67.97 Favored 'General case' 0 C--N 1.314 -0.976 0 CA-C-O 121.408 0.623 . . . . 0.0 110.882 179.824 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 25' ' ' LYS . . . . . 0.4 ' HG2' ' OD1' ' A' ' 22' ' ' ASN . 47.0 mmtm -97.59 -0.63 45.44 Favored 'General case' 0 C--N 1.313 -1.007 0 CA-C-N 116.146 -0.479 . . . . 0.0 111.958 -177.521 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 26' ' ' LEU . . . . . 0.449 ' HG ' ' HA ' ' A' ' 23' ' ' ASP . 74.4 mt -58.46 -44.79 89.38 Favored 'General case' 0 N--CA 1.473 0.684 0 N-CA-C 113.22 0.822 . . . . 0.0 113.22 -177.33 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 27' ' ' LEU . . . . . . . . . . . . . 26.8 tp -60.24 -45.66 92.48 Favored 'General case' 0 N--CA 1.432 -1.346 0 CA-C-O 121.204 0.526 . . . . 0.0 109.747 178.776 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 28' ' ' GLU . . . . . . . . . . . . . 9.5 mm-40 -58.68 -36.67 74.55 Favored 'General case' 0 C--N 1.323 -0.582 0 CA-C-N 114.597 -1.183 . . . . 0.0 109.373 -179.323 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 29' ' ' MET . . . . . 0.46 ' HB3' ' SG ' ' A' ' 37' ' ' CYS . 76.9 mmm -89.29 -16.46 31.1 Favored 'General case' 0 C--N 1.296 -1.737 0 CA-C-N 114.536 -1.211 . . . . 0.0 112.525 -173.271 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 30' ' ' GLY . . . . . . . . . . . . . . . -72.07 -40.23 56.98 Favored Glycine 0 C--N 1.302 -1.307 0 N-CA-C 111.439 -0.665 . . . . 0.0 111.439 178.556 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 31' ' ' TYR . . . . . . . . . . . . . 17.5 p90 -82.66 -29.15 30.19 Favored 'General case' 0 CA--C 1.503 -0.83 0 C-N-CA 119.342 -0.943 . . . . 0.0 112.594 177.618 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 32' ' ' TYR . . . . . . . . . . . . . 15.3 m-85 -76.79 -62.07 1.76 Allowed 'General case' 0 C--N 1.298 -1.669 0 N-CA-C 113.764 1.024 . . . . 0.0 113.764 175.592 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 33' ' ' CYS . . . . . . . . . . . . . 56.2 m -131.79 73.4 78.85 Favored Pre-proline 0 C--N 1.309 -1.181 0 C-N-CA 120.294 -0.562 . . . . 0.0 111.445 -175.61 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 34' ' ' PRO . . . . . . . . . . . . . 54.3 Cg_endo -67.18 -24.42 44.35 Favored 'Trans proline' 0 C--N 1.351 0.685 0 C-N-CA 122.679 2.253 . . . . 0.0 112.433 -175.683 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 35' ' ' VAL . . . . . 0.415 ' HB ' ' OD2' ' A' ' 5' ' ' ASP . 45.8 t -86.84 -42.86 15.75 Favored 'Isoleucine or valine' 0 C--N 1.301 -1.534 0 CA-C-O 121.077 0.465 . . . . 0.0 110.523 -176.666 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 36' ' ' THR . . . . . . . . . . . . . 31.9 m -63.46 -39.58 94.83 Favored 'General case' 0 C--N 1.308 -1.196 0 CA-C-N 115.75 -0.659 . . . . 0.0 110.985 178.399 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 37' ' ' CYS . . . . . 0.46 ' SG ' ' HB3' ' A' ' 29' ' ' MET . 75.5 m -86.26 5.42 34.46 Favored 'General case' 0 C--N 1.316 -0.876 0 N-CA-C 113.223 0.824 . . . . 0.0 113.223 -178.749 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 38' ' ' GLY . . . . . . . . . . . . . . . 73.11 42.83 42.27 Favored Glycine 0 CA--C 1.52 0.367 0 N-CA-C 115.567 0.987 . . . . 0.0 115.567 173.864 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 39' ' ' PHE . . . . . . . . . . . . . 93.1 m-85 -103.8 -43.59 5.29 Favored 'General case' 0 C--N 1.304 -1.376 0 N-CA-C 107.766 -1.198 . . . . 0.0 107.766 173.316 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 40' ' ' CYS . . . . . . . . . . . . . 61.5 m -113.13 101.95 9.93 Favored 'General case' 0 C--N 1.306 -1.284 0 CA-C-N 114.566 -1.197 . . . . 0.0 109.275 -179.463 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 41' ' ' NH2 . . . . . . . . . . . . . . . . . . . . 0 C--N 1.305 -1.335 0 CA-C-N 116.41 -0.359 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 015 nuclear orig full ' A' A ' 1' ' ' GLU . . . . . . . . . . . . . 34.3 tt0 . . . . . 0 CA--C 1.493 -1.235 0 CA-C-O 120.352 0.12 . . . . 0.0 110.769 . . . . . . . . . 0 0 . 1 . 015 nuclear orig full ' A' A ' 2' ' ' HIS . . . . . . . . . . . . . 49.6 m80 -61.83 111.18 1.77 Allowed 'General case' 0 CA--C 1.481 -1.682 0 N-CA-C 107.703 -1.221 . . . . 0.0 107.703 -178.488 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 3' ' ' CYS . . . . . . . . . . . . . 29.5 p -59.3 88.98 0.01 OUTLIER 'General case' 0 C--N 1.293 -1.851 0 N-CA-C 114.074 1.139 . . . . 0.0 114.074 -178.446 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 4' ' ' ALA . . . . . . . . . . . . . . . -145.86 122.28 10.99 Favored 'General case' 0 N--CA 1.424 -1.748 0 N-CA-C 106.161 -1.792 . . . . 0.0 106.161 174.607 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 5' ' ' ASP . . . . . 0.568 ' OD2' ' HB ' ' A' ' 35' ' ' VAL . 25.9 m-20 -61.56 137.52 58.25 Favored 'General case' 0 C--N 1.315 -0.907 0 O-C-N 123.343 0.402 . . . . 0.0 110.221 -179.506 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER -66.52 136.46 55.69 Favored 'General case' 0 C--N 1.321 -0.671 0 C-N-CA 123.68 0.792 . . . . 0.0 109.558 -175.653 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 7' ' ' LYS . . . . . . . . . . . . . 8.1 ptpp? -73.79 -27.73 61.29 Favored 'General case' 0 C--N 1.309 -1.176 0 N-CA-C 114.986 1.476 . . . . 0.0 114.986 -173.298 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 8' ' ' ASN . . . . . . . . . . . . . 16.2 m120 -98.58 -2.83 37.69 Favored 'General case' 0 C--N 1.285 -2.206 0 C-N-CA 120.436 -0.506 . . . . 0.0 110.933 -178.909 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 9' ' ' PHE . . . . . . . . . . . . . 18.8 t80 -100.7 143.66 30.6 Favored 'General case' 0 C--N 1.302 -1.482 0 N-CA-C 107.499 -1.297 . . . . 0.0 107.499 -179.75 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 10' ' ' ASP . . . . . . . . . . . . . 16.4 t70 -102.82 100.71 10.73 Favored 'General case' 0 C--N 1.307 -1.268 0 C-N-CA 119.064 -1.054 . . . . 0.0 110.788 -179.349 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 11' ' ' CYS . . . . . 0.502 ' SG ' ' HB3' ' A' ' 5' ' ' ASP . 60.1 m -68.32 -27.67 66.49 Favored 'General case' 0 C--N 1.289 -2.03 0 CA-C-N 115.034 -0.984 . . . . 0.0 112.022 -176.1 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 12' ' ' ARG . . . . . . . . . . . . . 38.9 mmt180 -62.2 -48.9 77.97 Favored 'General case' 0 C--O 1.237 0.445 0 N-CA-C 109.575 -0.528 . . . . 0.0 109.575 179.009 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 14.7 ttp180 -59.39 -51.62 69.14 Favored 'General case' 0 C--N 1.325 -0.484 0 CA-C-N 115.394 -0.821 . . . . 0.0 111.092 179.498 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 14' ' ' SER . . . . . . . . . . . . . 25.4 m -63.62 -34.63 78.26 Favored 'General case' 0 C--N 1.311 -1.069 0 N-CA-C 112.048 0.388 . . . . 0.0 112.048 -178.249 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 2.3 tm? -68.34 -43.48 77.43 Favored 'General case' 0 CA--C 1.535 0.386 0 N-CA-C 108.82 -0.807 . . . . 0.0 108.82 179.16 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 16' ' ' ARG . . . . . . . . . . . . . 71.3 mtp180 -70.23 -37.26 74.97 Favored 'General case' 0 C--N 1.319 -0.747 0 N-CA-C 112.824 0.676 . . . . 0.0 112.824 -179.533 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 17' ' ' ASN . . . . . . . . . . . . . 26.4 m-80 -69.99 -36.12 74.92 Favored 'General case' 0 CA--C 1.503 -0.841 0 N-CA-C 111.899 0.333 . . . . 0.0 111.899 178.639 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . 117.79 -1.32 17.71 Favored Glycine 0 N--CA 1.437 -1.283 0 C-N-CA 119.774 -1.203 . . . . 0.0 112.143 179.353 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 19' ' ' ASP . . . . . . . . . . . . . 8.2 m-20 -60.94 -30.46 70.23 Favored 'General case' 0 N--CA 1.482 1.162 0 CA-C-O 121.246 0.546 . . . . 0.0 111.038 -178.38 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 20' ' ' CYS . . . . . . . . . . . . . 52.1 t -82.03 -2.33 51.34 Favored 'General case' 0 C--N 1.304 -1.378 0 CA-C-N 115.411 -0.813 . . . . 0.0 111.001 -176.099 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 21' ' ' ASP . . . . . . . . . . . . . 31.4 t70 -124.32 -9.91 7.51 Favored 'General case' 0 N--CA 1.47 0.554 0 CA-C-O 121.781 0.801 . . . . 0.0 110.065 176.552 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 22' ' ' ASN . . . . . 0.473 ' O ' ' HG ' ' A' ' 26' ' ' LEU . 28.1 t-20 -82.2 121.24 26.37 Favored 'General case' 0 C--N 1.309 -1.153 0 CA-C-N 115.155 -0.93 . . . . 0.0 110.561 -177.041 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 23' ' ' ASP . . . . . . . . . . . . . 13.2 t70 -51.47 -43.32 62.11 Favored 'General case' 0 N--CA 1.483 1.2 0 C-N-CA 124.537 1.135 . . . . 0.0 111.841 -176.904 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 25.4 m-20 -70.2 -14.68 62.73 Favored 'General case' 0 C--N 1.311 -1.093 0 CA-C-N 115.123 -0.944 . . . . 0.0 112.76 -175.911 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 25' ' ' LYS . . . . . . . . . . . . . 14.1 mmmm -115.24 -7.96 12.36 Favored 'General case' 0 C--N 1.313 -1.009 0 N-CA-C 111.56 0.207 . . . . 0.0 111.56 178.894 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 26' ' ' LEU . . . . . 0.473 ' HG ' ' O ' ' A' ' 22' ' ' ASN . 52.3 mt -53.9 -44.55 70.6 Favored 'General case' 0 N--CA 1.473 0.675 0 N-CA-C 114.985 1.476 . . . . 0.0 114.985 -174.329 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 27' ' ' LEU . . . . . . . . . . . . . 26.4 tp -59.27 -46.76 87.66 Favored 'General case' 0 N--CA 1.437 -1.114 0 CA-C-O 121.175 0.512 . . . . 0.0 109.936 -179.309 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 28' ' ' GLU . . . . . 0.501 ' HA ' ' CZ ' ' A' ' 31' ' ' TYR . 46.1 mt-10 -66.14 -32.23 73.56 Favored 'General case' 0 CA--C 1.498 -1.057 0 CA-C-N 114.963 -1.017 . . . . 0.0 110.112 -179.31 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 29' ' ' MET . . . . . 0.421 ' HB3' ' SG ' ' A' ' 37' ' ' CYS . 79.3 mmm -81.51 -19.82 41.39 Favored 'General case' 0 C--N 1.299 -1.616 0 CA-C-N 115.357 -0.838 . . . . 0.0 110.718 -177.901 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 30' ' ' GLY . . . . . 0.466 ' O ' ' HB3' ' A' ' 34' ' ' PRO . . . -74.38 -26.52 67.82 Favored Glycine 0 N--CA 1.43 -1.717 0 CA-C-N 115.259 -0.882 . . . . 0.0 111.216 177.967 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 31' ' ' TYR . . . . . 0.501 ' CZ ' ' HA ' ' A' ' 28' ' ' GLU 0.254 22.2 p90 -98.51 -36.03 10.05 Favored 'General case' 0 N--CA 1.435 -1.194 0 C-N-CA 119.263 -0.975 . . . . 0.0 112.602 173.803 . . . . . . . . 3 3 . 1 . 015 nuclear orig full ' A' A ' 32' ' ' TYR . . . . . . . . . . . . . 19.3 m-85 -68.27 -51.71 41.96 Favored 'General case' 0 C--N 1.303 -1.438 0 N-CA-C 113.759 1.022 . . . . 0.0 113.759 176.747 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 33' ' ' CYS . . . . . . . . . . . . . 65.6 m -134.85 66.6 69.07 Favored Pre-proline 0 C--N 1.3 -1.581 0 C-N-CA 119.912 -0.715 . . . . 0.0 111.162 179.684 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 34' ' ' PRO . . . . . 0.466 ' HB3' ' O ' ' A' ' 30' ' ' GLY . 37.1 Cg_endo -64.68 -26.97 60.72 Favored 'Trans proline' 0 C--N 1.352 0.751 0 C-N-CA 122.733 2.289 . . . . 0.0 112.771 -176.566 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 35' ' ' VAL . . . . . 0.568 ' HB ' ' OD2' ' A' ' 5' ' ' ASP . 39.2 t -83.3 -43.38 18.23 Favored 'Isoleucine or valine' 0 C--N 1.307 -1.274 0 C-N-CA 119.796 -0.762 . . . . 0.0 109.617 -178.492 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 36' ' ' THR . . . . . . . . . . . . . 25.2 m -62.61 -40.05 95.72 Favored 'General case' 0 C--N 1.316 -0.851 0 CA-C-N 115.662 -0.699 . . . . 0.0 110.438 178.666 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 37' ' ' CYS . . . . . 0.421 ' SG ' ' HB3' ' A' ' 29' ' ' MET . 79.4 m -81.15 0.18 37.48 Favored 'General case' 0 C--N 1.318 -0.794 0 N-CA-C 112.847 0.684 . . . . 0.0 112.847 178.798 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 38' ' ' GLY . . . . . . . . . . . . . . . 74.21 49.0 13.33 Favored Glycine 0 C--O 1.219 -0.828 0 N-CA-C 115.452 0.941 . . . . 0.0 115.452 173.066 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 39' ' ' PHE . . . . . . . . . . . . . 94.2 m-85 -92.31 -9.58 41.44 Favored 'General case' 0 C--N 1.311 -1.067 0 CA-C-N 117.736 0.768 . . . . 0.0 111.501 175.973 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 40' ' ' CYS . . . . . . . . . . . . . 28.5 p -153.01 104.7 2.85 Favored 'General case' 0 C--N 1.31 -1.141 0 N-CA-C 108.304 -0.998 . . . . 0.0 108.304 173.704 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 41' ' ' NH2 . . . . . . . . . . . . . . . . . . . . 0 C--N 1.306 -1.283 0 O-C-N 122.045 -0.41 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 016 nuclear orig full ' A' A ' 1' ' ' GLU . . . . . . . . . . . . . 9.5 tp10 . . . . . 0 N--CA 1.453 -0.312 0 N-CA-C 109.159 -0.682 . . . . 0.0 109.159 . . . . . . . . . 0 0 . 1 . 016 nuclear orig full ' A' A ' 2' ' ' HIS . . . . . . . . . . . . . 84.8 m-70 -106.75 112.47 25.46 Favored 'General case' 0 C--N 1.314 -0.965 0 N-CA-C 107.75 -1.204 . . . . 0.0 107.75 177.616 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 3' ' ' CYS . . . . . . . . . . . . . 29.4 p -83.73 117.01 22.95 Favored 'General case' 0 C--N 1.297 -1.715 0 CA-C-O 121.431 0.634 . . . . 0.0 112.683 -173.008 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 4' ' ' ALA . . . . . . . . . . . . . . . -146.48 137.33 24.16 Favored 'General case' 0 C--N 1.32 -0.686 0 N-CA-C 108.489 -0.93 . . . . 0.0 108.489 178.503 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 5' ' ' ASP . . . . . 0.706 ' OD1' ' HB ' ' A' ' 35' ' ' VAL . 11.0 m-20 -59.65 130.39 46.61 Favored 'General case' 0 C--N 1.311 -1.108 0 O-C-N 123.489 0.493 . . . . 0.0 111.844 -179.077 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 8.5 tp10 -66.53 127.12 31.1 Favored 'General case' 0 N--CA 1.44 -0.939 0 C-N-CA 124.015 0.926 . . . . 0.0 110.507 178.426 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 7' ' ' LYS . . . . . . . . . . . . . 10.1 ptpp? -77.09 -21.05 54.94 Favored 'General case' 0 C--N 1.315 -0.893 0 CA-C-N 115.366 -0.834 . . . . 0.0 110.83 -177.608 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 8' ' ' ASN . . . . . . . . . . . . . 15.5 t-20 -87.77 -7.97 56.6 Favored 'General case' 0 C--N 1.302 -1.499 0 CA-C-O 121.961 0.886 . . . . 0.0 109.758 -178.559 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 9' ' ' PHE . . . . . . . . . . . . . 23.2 t80 -108.18 151.23 26.2 Favored 'General case' 0 N--CA 1.43 -1.471 0 N-CA-C 106.983 -1.488 . . . . 0.0 106.983 -179.206 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 10' ' ' ASP . . . . . . . . . . . . . 9.8 t70 -102.55 100.12 10.18 Favored 'General case' 0 C--O 1.253 1.265 0 C-N-CA 118.944 -1.102 . . . . 0.0 109.281 177.483 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 11' ' ' CYS . . . . . 0.472 ' SG ' ' HB3' ' A' ' 5' ' ' ASP . 61.2 m -70.59 -29.3 65.68 Favored 'General case' 0 C--N 1.298 -1.665 0 CA-C-N 114.706 -1.134 . . . . 0.0 111.372 -176.488 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 12' ' ' ARG . . . . . 0.408 ' O ' ' HG3' ' A' ' 16' ' ' ARG . 34.1 mmt180 -71.29 -52.32 19.54 Favored 'General case' 0 CA--C 1.506 -0.744 0 CA-C-N 116.03 -0.532 . . . . 0.0 109.896 -175.853 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 38.4 ttm180 -58.31 -46.32 86.38 Favored 'General case' 0 C--N 1.32 -0.69 0 C-N-CA 123.346 0.659 . . . . 0.0 110.42 -179.688 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 14' ' ' SER . . . . . . . . . . . . . 25.9 m -59.83 -38.54 82.34 Favored 'General case' 0 C--O 1.256 1.398 0 CA-C-N 115.875 -0.602 . . . . 0.0 111.142 -178.797 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 41.1 tp -73.26 -46.97 46.88 Favored 'General case' 0 N--CA 1.438 -1.026 0 CA-C-N 116.062 -0.517 . . . . 0.0 110.385 178.016 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 16' ' ' ARG . . . . . 0.408 ' HG3' ' O ' ' A' ' 12' ' ' ARG . 97.8 mtt180 -54.28 -47.0 72.85 Favored 'General case' 0 N--CA 1.471 0.583 0 C-N-CA 123.18 0.592 . . . . 0.0 111.504 178.788 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 17' ' ' ASN . . . . . . . . . . . . . 11.0 m120 -65.75 -36.67 84.24 Favored 'General case' 0 CA--C 1.504 -0.789 0 CA-C-O 121.858 0.837 . . . . 0.0 109.576 179.833 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . 109.12 -1.36 31.38 Favored Glycine 0 N--CA 1.432 -1.606 0 CA-C-N 114.376 -1.284 . . . . 0.0 111.863 179.235 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 19' ' ' ASP . . . . . 0.422 ' O ' ' HB2' ' A' ' 25' ' ' LYS . 8.8 m-20 -70.29 -21.44 62.95 Favored 'General case' 0 CA--C 1.49 -1.338 0 N-CA-C 112.554 0.575 . . . . 0.0 112.554 -176.776 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 20' ' ' CYS . . . . . 0.536 ' HA ' ' HG3' ' A' ' 29' ' ' MET . 43.0 t -73.75 -26.38 60.64 Favored 'General case' 0 C--N 1.299 -1.619 0 C-N-CA 120.425 -0.51 . . . . 0.0 111.022 179.912 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 21' ' ' ASP . . . . . . . . . . . . . 33.8 t70 -100.32 -3.33 31.49 Favored 'General case' 0 C--N 1.327 -0.39 0 CA-C-O 122.488 1.137 . . . . 0.0 109.101 -179.814 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 22' ' ' ASN . . . . . . . . . . . . . 19.0 t30 -78.26 130.52 36.34 Favored 'General case' 0 C--N 1.309 -1.18 0 CA-C-N 114.139 -1.391 . . . . 0.0 109.35 178.619 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 23' ' ' ASP . . . . . 0.437 ' HA ' ' HG ' ' A' ' 26' ' ' LEU . 3.1 m-20 -52.9 -34.38 54.64 Favored 'General case' 0 CA--C 1.498 -1.021 0 C-N-CA 124.388 1.075 . . . . 0.0 112.043 -177.118 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 34.2 t70 -59.85 -31.81 70.1 Favored 'General case' 0 C--N 1.307 -1.245 0 CA-C-N 114.974 -1.012 . . . . 0.0 112.133 -179.501 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 25' ' ' LYS . . . . . 0.516 ' O ' ' HG2' ' A' ' 29' ' ' MET . 13.1 mptt -110.81 1.78 17.93 Favored 'General case' 0 C--O 1.204 -1.322 0 N-CA-C 113.624 0.972 . . . . 0.0 113.624 179.794 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 26' ' ' LEU . . . . . 0.437 ' HG ' ' HA ' ' A' ' 23' ' ' ASP . 70.1 mt -50.2 -52.78 32.89 Favored 'General case' 0 N--CA 1.49 1.53 0 N-CA-C 114.655 1.354 . . . . 0.0 114.655 -174.947 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 27' ' ' LEU . . . . . . . . . . . . . 20.0 tp -60.84 -44.62 96.72 Favored 'General case' 0 N--CA 1.44 -0.929 0 CA-C-O 121.17 0.51 . . . . 0.0 109.724 -179.645 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 28' ' ' GLU . . . . . . . . . . . . . 7.5 mm-40 -60.57 -37.12 80.27 Favored 'General case' 0 C--N 1.325 -0.5 0 CA-C-N 114.581 -1.19 . . . . 0.0 108.963 -178.295 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 29' ' ' MET . . . . . 0.536 ' HG3' ' HA ' ' A' ' 20' ' ' CYS . 74.8 mmm -81.14 -20.26 41.71 Favored 'General case' 0 CA--C 1.482 -1.656 0 CA-C-N 115.094 -0.957 . . . . 0.0 111.794 -174.041 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 30' ' ' GLY . . . . . . . . . . . . . . . -64.56 -27.04 71.3 Favored Glycine 0 N--CA 1.436 -1.341 0 O-C-N 124.194 0.934 . . . . 0.0 110.823 177.216 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 31' ' ' TYR . . . . . . . . . . . . . 38.7 p90 -106.16 -31.97 8.44 Favored 'General case' 0 N--CA 1.43 -1.443 0 N-CA-C 112.923 0.712 . . . . 0.0 112.923 176.166 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 32' ' ' TYR . . . . . . . . . . . . . 16.2 m-85 -68.15 -61.59 1.79 Allowed 'General case' 0 C--O 1.21 -1.0 0 N-CA-C 113.232 0.827 . . . . 0.0 113.232 177.482 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 33' ' ' CYS . . . . . . . . . . . . . 61.7 m -136.43 68.55 61.03 Favored Pre-proline 0 C--O 1.265 1.871 0 CA-C-O 121.749 0.785 . . . . 0.0 111.413 -176.846 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 34' ' ' PRO . . . . . 0.613 ' HA ' ' CD2' ' A' ' 39' ' ' PHE . 74.0 Cg_endo -73.09 -23.75 17.89 Favored 'Trans proline' 0 N--CA 1.444 -1.386 0 C-N-CA 122.964 2.443 . . . . 0.0 112.569 -174.955 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 35' ' ' VAL . . . . . 0.706 ' HB ' ' OD1' ' A' ' 5' ' ' ASP . 43.5 t -86.57 -44.48 16.48 Favored 'Isoleucine or valine' 0 C--N 1.289 -2.028 0 C-N-CA 119.51 -0.876 . . . . 0.0 109.506 -179.066 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 36' ' ' THR . . . . . . . . . . . . . 38.3 m -54.61 -51.88 63.94 Favored 'General case' 0 C--N 1.325 -0.472 0 CA-C-N 115.653 -0.703 . . . . 0.0 112.69 -178.49 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 37' ' ' CYS . . . . . . . . . . . . . 85.1 m -91.99 10.88 27.12 Favored 'General case' 0 C--N 1.315 -0.932 0 C-N-CA 118.964 -1.094 . . . . 0.0 113.288 -176.517 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 38' ' ' GLY . . . . . . . . . . . . . . . 78.19 44.14 12.1 Favored Glycine 0 N--CA 1.443 -0.834 0 N-CA-C 115.432 0.933 . . . . 0.0 115.432 171.881 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 39' ' ' PHE . . . . . 0.613 ' CD2' ' HA ' ' A' ' 34' ' ' PRO . 62.2 m-85 -86.19 -50.39 7.02 Favored 'General case' 0 C--N 1.302 -1.496 0 N-CA-C 106.782 -1.562 . . . . 0.0 106.782 174.113 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 40' ' ' CYS . . . . . 0.491 ' SG ' ' HB2' ' A' ' 34' ' ' PRO . 4.0 p -153.82 87.29 1.21 Allowed 'General case' 0 C--N 1.31 -1.125 0 CA-C-N 114.453 -1.249 . . . . 0.0 109.87 -179.71 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 41' ' ' NH2 . . . . . . . . . . . . . . . . . . . . 0 C--N 1.309 -1.158 0 O-C-N 122.049 -0.407 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 017 nuclear orig full ' A' A ' 1' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER . . . . . 0 N--CA 1.452 -0.373 0 N-CA-C 108.424 -0.954 . . . . 0.0 108.424 . . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 2' ' ' HIS . . . . . . . . . . . . . 34.4 m80 -91.23 111.96 23.66 Favored 'General case' 0 C--N 1.294 -1.843 0 N-CA-C 106.82 -1.548 . . . . 0.0 106.82 174.656 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 3' ' ' CYS . . . . . . . . . . . . . 30.3 p -82.1 103.92 12.07 Favored 'General case' 0 C--N 1.303 -1.427 0 C-N-CA 118.84 -1.144 . . . . 0.0 108.987 176.617 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 4' ' ' ALA . . . . . . . . . . . . . . . -145.98 142.08 28.32 Favored 'General case' 0 N--CA 1.426 -1.626 0 CA-C-N 115.438 -0.801 . . . . 0.0 108.883 -177.499 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 5' ' ' ASP . . . . . 0.671 ' OD1' ' HB ' ' A' ' 35' ' ' VAL . 5.1 m-20 -58.29 132.5 53.82 Favored 'General case' 0 C--O 1.256 1.406 0 O-C-N 124.395 1.06 . . . . 0.0 109.517 -179.877 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 9.5 tp10 -64.1 131.7 48.31 Favored 'General case' 0 N--CA 1.436 -1.149 0 CA-C-N 115.589 -0.732 . . . . 0.0 110.761 -176.712 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 7' ' ' LYS . . . . . . . . . . . . . 21.1 ptmt -80.22 -13.01 59.56 Favored 'General case' 0 N--CA 1.437 -1.122 0 CA-C-N 115.883 -0.599 . . . . 0.0 112.045 -176.24 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 8' ' ' ASN . . . . . . . . . . . . . 55.7 m-20 -93.81 4.1 54.43 Favored 'General case' 0 C--N 1.313 -1.018 0 CA-C-O 121.657 0.741 . . . . 0.0 109.367 178.814 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 9' ' ' PHE . . . . . . . . . . . . . 26.8 t80 -128.49 149.52 50.55 Favored 'General case' 0 C--N 1.298 -1.665 0 N-CA-C 106.384 -1.71 . . . . 0.0 106.384 -175.53 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 10' ' ' ASP . . . . . . . . . . . . . 10.0 t70 -105.14 98.73 8.39 Favored 'General case' 0 C--N 1.302 -1.466 0 C-N-CA 119.378 -0.929 . . . . 0.0 108.899 177.172 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 11' ' ' CYS . . . . . 0.41 ' SG ' ' HB3' ' A' ' 5' ' ' ASP . 96.9 m -73.37 -25.08 60.43 Favored 'General case' 0 C--N 1.287 -2.137 0 N-CA-C 113.194 0.813 . . . . 0.0 113.194 -177.19 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 12' ' ' ARG . . . . . 0.446 ' O ' ' HG2' ' A' ' 16' ' ' ARG . 43.8 mmt-85 -69.83 -48.0 60.64 Favored 'General case' 0 C--N 1.32 -0.678 0 N-CA-C 109.502 -0.555 . . . . 0.0 109.502 179.108 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 58.3 ttp180 -64.17 -44.36 92.3 Favored 'General case' 0 C--N 1.311 -1.073 0 CA-C-N 115.54 -0.754 . . . . 0.0 110.355 178.474 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 14' ' ' SER . . . . . . . . . . . . . 25.3 m -60.53 -34.06 73.57 Favored 'General case' 0 C--O 1.25 1.129 0 CA-C-O 121.393 0.616 . . . . 0.0 110.949 179.432 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 65.3 tp -63.35 -46.57 85.94 Favored 'General case' 0 N--CA 1.439 -0.986 0 CA-C-N 115.611 -0.722 . . . . 0.0 109.306 174.956 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 16' ' ' ARG . . . . . 0.446 ' HG2' ' O ' ' A' ' 12' ' ' ARG . 31.0 mmt180 -71.75 -32.74 68.04 Favored 'General case' 0 C--N 1.315 -0.892 0 CA-C-N 115.957 -0.565 . . . . 0.0 112.236 -177.441 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 17' ' ' ASN . . . . . . . . . . . . . 77.0 m-20 -65.57 -35.53 81.12 Favored 'General case' 0 CA--C 1.494 -1.207 0 CA-C-O 121.301 0.572 . . . . 0.0 109.533 179.412 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . 110.77 11.81 18.09 Favored Glycine 0 N--CA 1.426 -1.999 0 CA-C-N 115.11 -0.95 . . . . 0.0 111.483 -178.805 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 19' ' ' ASP . . . . . . . . . . . . . 9.0 m-20 -67.49 -35.05 78.39 Favored 'General case' 0 CA--C 1.501 -0.934 0 N-CA-C 108.782 -0.821 . . . . 0.0 108.782 178.126 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 20' ' ' CYS . . . . . 0.426 ' HA ' ' HG3' ' A' ' 29' ' ' MET . 52.5 t -83.26 -4.48 58.47 Favored 'General case' 0 C--N 1.306 -1.306 0 CA-C-N 114.41 -1.268 . . . . 0.0 110.533 -179.934 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 21' ' ' ASP . . . . . . . . . . . . . 17.2 t70 -104.54 -11.85 16.78 Favored 'General case' 0 C--N 1.318 -0.77 0 CA-C-O 121.77 0.795 . . . . 0.0 109.887 -178.547 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 22' ' ' ASN . . . . . . . . . . . . . 54.1 t-20 -89.3 125.03 34.94 Favored 'General case' 0 C--N 1.311 -1.087 0 CA-C-N 115.127 -0.942 . . . . 0.0 109.243 -179.934 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 23' ' ' ASP . . . . . . . . . . . . . 5.3 p-10 -61.23 -34.34 74.96 Favored 'General case' 0 C--N 1.32 -0.708 0 O-C-N 123.434 0.459 . . . . 0.0 111.673 179.976 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 34.8 t70 -68.46 -28.76 67.33 Favored 'General case' 0 C--N 1.308 -1.209 0 CA-C-O 121.318 0.58 . . . . 0.0 111.67 -177.658 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 25' ' ' LYS . . . . . 0.403 ' O ' ' HG2' ' A' ' 29' ' ' MET . 92.3 mttt -97.18 -2.28 43.25 Favored 'General case' 0 C--N 1.309 -1.181 0 N-CA-C 112.532 0.568 . . . . 0.0 112.532 -177.462 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 26' ' ' LEU . . . . . . . . . . . . . 87.4 mt -55.84 -36.83 67.94 Favored 'General case' 0 C--N 1.312 -1.038 0 N-CA-C 113.269 0.841 . . . . 0.0 113.269 179.806 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 27' ' ' LEU . . . . . . . . . . . . . 1.3 tm? -62.71 -42.22 99.54 Favored 'General case' 0 N--CA 1.44 -0.957 0 N-CA-C 109.02 -0.734 . . . . 0.0 109.02 178.508 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 28' ' ' GLU . . . . . . . . . . . . . 8.3 mm-40 -60.74 -37.24 81.1 Favored 'General case' 0 CA--C 1.514 -0.407 0 N-CA-C 109.062 -0.718 . . . . 0.0 109.062 177.572 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 29' ' ' MET . . . . . 0.431 ' HE3' ' HA ' ' A' ' 29' ' ' MET . 22.1 mmt -75.68 -22.29 56.82 Favored 'General case' 0 C--O 1.204 -1.29 0 CA-C-N 114.95 -1.023 . . . . 0.0 109.827 -176.744 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 30' ' ' GLY . . . . . . . . . . . . . . . -64.31 -28.03 72.45 Favored Glycine 0 C--O 1.24 0.518 0 CA-C-N 116.227 -0.442 . . . . 0.0 112.338 179.931 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 31' ' ' TYR . . . . . . . . . . . . . 20.6 p90 -113.67 -36.24 4.94 Favored 'General case' 0 N--CA 1.433 -1.318 0 N-CA-C 113.033 0.753 . . . . 0.0 113.033 177.543 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 32' ' ' TYR . . . . . . . . . . . . . 33.4 m-85 -70.0 -47.38 62.41 Favored 'General case' 0 C--N 1.306 -1.307 0 N-CA-C 113.234 0.828 . . . . 0.0 113.234 176.808 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 33' ' ' CYS . . . . . . . . . . . . . 60.4 m -136.4 58.49 21.29 Favored Pre-proline 0 C--O 1.251 1.151 0 C-N-CA 121.053 -0.259 . . . . 0.0 111.678 -173.838 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 34' ' ' PRO . . . . . . . . . . . . . 57.3 Cg_endo -67.35 -27.95 39.94 Favored 'Trans proline' 0 C--N 1.359 1.105 0 C-N-CA 122.012 1.808 . . . . 0.0 112.523 -174.66 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 35' ' ' VAL . . . . . 0.671 ' HB ' ' OD1' ' A' ' 5' ' ' ASP . 43.8 t -87.27 -42.9 15.58 Favored 'Isoleucine or valine' 0 C--N 1.301 -1.536 0 C-N-CA 119.971 -0.692 . . . . 0.0 110.433 -177.224 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 36' ' ' THR . . . . . . . . . . . . . 28.0 m -61.24 -40.06 92.64 Favored 'General case' 0 C--N 1.316 -0.88 0 CA-C-N 115.999 -0.546 . . . . 0.0 111.211 179.066 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 37' ' ' CYS . . . . . . . . . . . . . 74.8 m -88.18 -1.45 58.02 Favored 'General case' 0 C--N 1.311 -1.082 0 N-CA-C 113.727 1.01 . . . . 0.0 113.727 -178.954 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 38' ' ' GLY . . . . . . . . . . . . . . . 78.13 43.72 13.05 Favored Glycine 0 CA--C 1.524 0.656 0 N-CA-C 115.325 0.89 . . . . 0.0 115.325 174.908 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 39' ' ' PHE . . . . . . . . . . . . . 74.6 m-85 -91.32 -31.4 16.1 Favored 'General case' 0 C--N 1.315 -0.92 0 N-CA-C 108.475 -0.935 . . . . 0.0 108.475 173.886 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 40' ' ' CYS . . . . . . . . . . . . . 58.3 m -117.27 102.62 9.42 Favored 'General case' 0 C--N 1.306 -1.299 0 CA-C-N 114.956 -1.02 . . . . 0.0 109.45 -178.42 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 41' ' ' NH2 . . . . . . . . . . . . . . . . . . . . 0 C--N 1.31 -1.127 0 CA-C-N 116.402 -0.363 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 018 nuclear orig full ' A' A ' 1' ' ' GLU . . . . . . . . . . . . . 35.7 tt0 . . . . . 0 CA--C 1.506 -0.733 0 N-CA-C 110.046 -0.353 . . . . 0.0 110.046 . . . . . . . . . 0 0 . 1 . 018 nuclear orig full ' A' A ' 2' ' ' HIS . . . . . . . . . . . . . 16.7 t60 -101.47 111.56 23.84 Favored 'General case' 0 N--CA 1.429 -1.512 0 N-CA-C 106.319 -1.734 . . . . 0.0 106.319 172.652 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 3' ' ' CYS . . . . . . . . . . . . . 16.0 p -87.1 125.35 34.08 Favored 'General case' 0 C--N 1.285 -2.21 0 N-CA-C 109.962 -0.385 . . . . 0.0 109.962 179.26 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 4' ' ' ALA . . . . . . . . . . . . . . . -144.05 158.09 43.93 Favored 'General case' 0 C--N 1.304 -1.371 0 N-CA-C 107.835 -1.172 . . . . 0.0 107.835 178.832 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 5' ' ' ASP . . . . . 0.412 ' HB3' ' SG ' ' A' ' 11' ' ' CYS . 56.2 m-20 -69.51 147.54 50.7 Favored 'General case' 0 C--N 1.31 -1.121 0 N-CA-C 109.311 -0.626 . . . . 0.0 109.311 178.705 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 9.3 tp10 -67.35 128.55 36.84 Favored 'General case' 0 C--N 1.311 -1.087 0 N-CA-C 109.069 -0.715 . . . . 0.0 109.069 177.744 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 7' ' ' LYS . . . . . . . . . . . . . 19.4 ptpt -77.24 -16.93 58.82 Favored 'General case' 0 C--N 1.307 -1.257 0 CA-C-N 116.348 -0.387 . . . . 0.0 112.008 -177.527 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 8' ' ' ASN . . . . . . . . . . . . . 38.7 m-80 -94.5 4.36 53.95 Favored 'General case' 0 C--N 1.302 -1.488 0 CA-C-O 121.352 0.596 . . . . 0.0 110.321 179.353 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 9' ' ' PHE . . . . . . . . . . . . . 41.5 t80 -123.45 144.32 49.59 Favored 'General case' 0 C--N 1.299 -1.623 0 N-CA-C 106.341 -1.726 . . . . 0.0 106.341 -178.53 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 10' ' ' ASP . . . . . . . . . . . . . 8.3 t70 -102.18 91.76 4.44 Favored 'General case' 0 C--N 1.304 -1.411 0 C-N-CA 118.705 -1.198 . . . . 0.0 109.544 179.859 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 11' ' ' CYS . . . . . 0.412 ' SG ' ' HB3' ' A' ' 5' ' ' ASP . 98.3 m -69.55 -19.93 63.68 Favored 'General case' 0 C--N 1.297 -1.701 0 CA-C-N 114.799 -1.091 . . . . 0.0 112.251 -177.095 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 12' ' ' ARG . . . . . . . . . . . . . 13.8 mmt180 -74.04 -43.5 57.63 Favored 'General case' 0 C--N 1.313 -1.0 0 N-CA-C 107.653 -1.24 . . . . 0.0 107.653 -177.734 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 39.4 ttm180 -59.48 -50.3 74.47 Favored 'General case' 0 C--O 1.238 0.462 0 CA-C-N 114.905 -1.043 . . . . 0.0 110.092 175.472 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 14' ' ' SER . . . . . . . . . . . . . 50.6 m -62.14 -30.82 71.3 Favored 'General case' 0 CA--C 1.546 0.822 0 CA-C-N 116.178 -0.464 . . . . 0.0 111.591 179.633 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 58.1 tp -67.29 -49.51 63.97 Favored 'General case' 0 N--CA 1.449 -0.522 0 N-CA-C 110.097 -0.334 . . . . 0.0 110.097 176.726 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 16' ' ' ARG . . . . . . . . . . . . . 65.7 mtp180 -62.67 -38.1 89.02 Favored 'General case' 0 C--N 1.321 -0.633 0 CA-C-N 115.434 -0.803 . . . . 0.0 112.228 -179.06 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 17' ' ' ASN . . . . . . . . . . . . . 42.0 m-80 -81.77 -14.56 56.26 Favored 'General case' 0 CA--C 1.506 -0.749 0 CA-C-O 121.017 0.437 . . . . 0.0 111.975 -178.502 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . 95.94 9.93 56.8 Favored Glycine 0 C--O 1.213 -1.201 0 C-N-CA 119.938 -1.125 . . . . 0.0 113.743 173.566 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 19' ' ' ASP . . . . . . . . . . . . . 2.6 m-20 -67.73 -34.65 77.27 Favored 'General case' 0 CA--C 1.498 -1.046 0 N-CA-C 108.072 -1.085 . . . . 0.0 108.072 178.225 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 20' ' ' CYS . . . . . . . . . . . . . 42.8 t -72.66 -9.46 58.63 Favored 'General case' 0 C--N 1.309 -1.193 0 CA-C-N 113.711 -1.586 . . . . 0.0 110.787 -179.046 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 21' ' ' ASP . . . . . . . . . . . . . 26.2 t70 -113.64 -10.02 13.15 Favored 'General case' 0 C--N 1.319 -0.742 0 CA-C-O 121.656 0.741 . . . . 0.0 109.672 -179.874 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 22' ' ' ASN . . . . . 0.485 ' OD1' ' HG2' ' A' ' 25' ' ' LYS . 23.5 t-20 -83.4 114.62 21.57 Favored 'General case' 0 C--N 1.298 -1.631 0 CA-C-N 115.713 -0.676 . . . . 0.0 109.958 -174.217 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 23' ' ' ASP . . . . . . . . . . . . . 18.1 t70 -49.66 -45.21 48.31 Favored 'General case' 0 N--CA 1.477 0.904 0 C-N-CA 124.231 1.012 . . . . 0.0 111.708 -176.065 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 24' ' ' ASP . . . . . 0.425 ' HB3' ' OD1' ' A' ' 22' ' ' ASN . 27.4 t70 -60.28 -32.91 71.64 Favored 'General case' 0 C--N 1.31 -1.143 0 CA-C-N 115.278 -0.874 . . . . 0.0 112.441 -178.897 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 25' ' ' LYS . . . . . 0.485 ' HG2' ' OD1' ' A' ' 22' ' ' ASN . 44.3 mmtm -94.63 -7.01 42.13 Favored 'General case' 0 C--N 1.312 -1.029 0 CA-C-N 116.301 -0.409 . . . . 0.0 111.063 -175.727 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 26' ' ' LEU . . . . . . . . . . . . . 64.8 mt -56.81 -34.79 68.04 Favored 'General case' 0 C--O 1.218 -0.553 0 N-CA-C 114.886 1.439 . . . . 0.0 114.886 -174.485 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 27' ' ' LEU . . . . . . . . . . . . . 1.3 tm? -57.52 -50.0 74.49 Favored 'General case' 0 N--CA 1.44 -0.945 0 N-CA-C 108.758 -0.83 . . . . 0.0 108.758 178.539 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 28' ' ' GLU . . . . . . . . . . . . . 1.5 mp0 -63.57 -33.81 76.42 Favored 'General case' 0 N--CA 1.449 -0.508 0 CA-C-N 115.175 -0.921 . . . . 0.0 110.424 178.583 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 29' ' ' MET . . . . . 0.439 ' HE3' ' HA ' ' A' ' 29' ' ' MET . 21.7 mmt -74.15 -25.32 59.68 Favored 'General case' 0 C--O 1.2 -1.527 0 CA-C-N 116.154 -0.476 . . . . 0.0 109.856 -177.341 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 30' ' ' GLY . . . . . . . . . . . . . . . -64.44 -34.78 90.83 Favored Glycine 0 N--CA 1.446 -0.664 0 C-N-CA 121.4 -0.429 . . . . 0.0 112.375 179.64 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 31' ' ' TYR . . . . . . . . . . . . . 33.0 p90 -99.03 -36.53 9.69 Favored 'General case' 0 N--CA 1.439 -1.003 0 N-CA-C 113.35 0.87 . . . . 0.0 113.35 178.042 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 32' ' ' TYR . . . . . . . . . . . . . 37.2 m-85 -70.86 -46.61 62.34 Favored 'General case' 0 C--N 1.309 -1.169 0 N-CA-C 112.859 0.689 . . . . 0.0 112.859 177.052 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 33' ' ' CYS . . . . . . . . . . . . . 47.7 m -136.45 61.03 35.72 Favored Pre-proline 0 C--O 1.254 1.335 0 N-CA-C 112.266 0.469 . . . . 0.0 112.266 -173.324 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 34' ' ' PRO . . . . . 0.467 ' HB2' ' SG ' ' A' ' 40' ' ' CYS . 46.0 Cg_endo -65.35 -25.67 56.43 Favored 'Trans proline' 0 C--N 1.359 1.126 0 C-N-CA 121.825 1.683 . . . . 0.0 111.948 -178.567 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 35' ' ' VAL . . . . . . . . . . . . . 61.7 t -86.41 -49.64 14.89 Favored 'Isoleucine or valine' 0 C--N 1.299 -1.607 0 C-N-CA 120.573 -0.451 . . . . 0.0 111.134 -177.725 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 36' ' ' THR . . . . . . . . . . . . . 56.5 m -59.78 -42.22 92.85 Favored 'General case' 0 C--N 1.316 -0.879 0 CA-C-O 121.049 0.452 . . . . 0.0 111.615 -178.945 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 37' ' ' CYS . . . . . . . . . . . . . 77.4 m -85.02 1.57 47.04 Favored 'General case' 0 C--N 1.309 -1.183 0 N-CA-C 113.12 0.785 . . . . 0.0 113.12 -178.072 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 38' ' ' GLY . . . . . . . . . . . . . . . 74.26 45.38 25.08 Favored Glycine 0 CA--C 1.521 0.419 0 C-N-CA 120.546 -0.835 . . . . 0.0 114.879 174.913 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 39' ' ' PHE . . . . . 0.461 ' CD1' ' HA ' ' A' ' 34' ' ' PRO . 95.4 m-85 -94.11 -16.87 23.37 Favored 'General case' 0 C--N 1.309 -1.155 0 N-CA-C 108.581 -0.896 . . . . 0.0 108.581 174.07 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 40' ' ' CYS . . . . . 0.467 ' SG ' ' HB2' ' A' ' 34' ' ' PRO . 40.0 m -124.21 89.41 3.07 Favored 'General case' 0 C--N 1.313 -1.001 0 CA-C-N 115.048 -0.978 . . . . 0.0 110.132 -176.803 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 41' ' ' NH2 . . . . . . . . . . . . . . . . . . . . 0 C--N 1.306 -1.31 0 CA-C-N 116.633 -0.258 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 019 nuclear orig full ' A' A ' 1' ' ' GLU . . . . . . . . . . . . . 9.2 tp10 . . . . . 0 CA--C 1.505 -0.788 0 N-CA-C 109.008 -0.738 . . . . 0.0 109.008 . . . . . . . . . 0 0 . 1 . 019 nuclear orig full ' A' A ' 2' ' ' HIS . . . . . . . . . . . . . 61.1 m-70 -94.24 111.92 23.69 Favored 'General case' 0 N--CA 1.432 -1.332 0 N-CA-C 107.312 -1.366 . . . . 0.0 107.312 177.248 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 3' ' ' CYS . . . . . . . . . . . . . 16.5 p -83.75 100.87 11.18 Favored 'General case' 0 C--N 1.295 -1.779 0 CA-C-O 121.627 0.727 . . . . 0.0 111.812 -174.631 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 4' ' ' ALA . . . . . . . . . . . . . . . -135.67 141.56 44.99 Favored 'General case' 0 N--CA 1.427 -1.617 0 N-CA-C 108.2 -1.037 . . . . 0.0 108.2 179.415 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 5' ' ' ASP . . . . . 0.634 ' HB3' ' SG ' ' A' ' 11' ' ' CYS . 18.5 m-20 -55.91 131.33 46.82 Favored 'General case' 0 C--N 1.309 -1.155 0 O-C-N 123.96 0.787 . . . . 0.0 109.764 178.633 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 9.6 tp10 -61.71 139.39 58.31 Favored 'General case' 0 C--N 1.312 -1.049 0 C-N-CA 123.654 0.782 . . . . 0.0 110.854 -177.545 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 7' ' ' LYS . . . . . . . . . . . . . 18.6 ptpt -85.18 -26.56 26.71 Favored 'General case' 0 C--N 1.309 -1.162 0 N-CA-C 112.932 0.715 . . . . 0.0 112.932 -174.215 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 8' ' ' ASN . . . . . . . . . . . . . 10.5 p30 -92.62 7.38 43.62 Favored 'General case' 0 C--N 1.306 -1.305 0 CA-C-O 121.745 0.783 . . . . 0.0 110.415 178.453 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 9' ' ' PHE . . . . . . . . . . . . . 47.6 t80 -118.57 139.45 51.45 Favored 'General case' 0 N--CA 1.43 -1.464 0 N-CA-C 106.594 -1.632 . . . . 0.0 106.594 178.168 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 10' ' ' ASP . . . . . . . . . . . . . 10.2 t70 -96.96 105.05 17.11 Favored 'General case' 0 C--N 1.301 -1.519 0 C-N-CA 119.369 -0.932 . . . . 0.0 109.534 178.945 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 11' ' ' CYS . . . . . 0.634 ' SG ' ' HB3' ' A' ' 5' ' ' ASP . 73.9 m -74.94 -29.22 60.89 Favored 'General case' 0 C--N 1.292 -1.926 0 CA-C-N 115.642 -0.708 . . . . 0.0 112.866 -177.502 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 12' ' ' ARG . . . . . . . . . . . . . 20.0 mmm180 -72.07 -46.19 57.8 Favored 'General case' 0 CA--C 1.511 -0.536 0 C-N-CA 120.305 -0.558 . . . . 0.0 109.519 -176.09 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 41.0 ttp180 -59.08 -52.15 66.96 Favored 'General case' 0 C--O 1.205 -1.281 0 CA-C-N 114.851 -1.068 . . . . 0.0 109.421 177.996 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 14' ' ' SER . . . . . . . . . . . . . 40.6 m -58.33 -36.27 73.16 Favored 'General case' 0 C--N 1.32 -0.715 0 CA-C-N 116.066 -0.516 . . . . 0.0 111.742 -177.839 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 41.9 tp -69.73 -45.98 66.96 Favored 'General case' 0 N--CA 1.442 -0.846 0 CA-C-O 121.059 0.457 . . . . 0.0 110.065 178.987 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 16' ' ' ARG . . . . . 0.407 ' O ' ' HD2' ' A' ' 16' ' ' ARG . 2.4 tmm_? -68.54 -37.3 79.85 Favored 'General case' 0 N--CA 1.437 -1.095 0 CA-C-N 115.815 -0.63 . . . . 0.0 110.275 -179.349 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 17' ' ' ASN . . . . . . . . . . . . . 0.9 OUTLIER -68.37 -40.55 81.39 Favored 'General case' 0 CA--C 1.501 -0.92 0 CA-C-N 116.125 -0.488 . . . . 0.0 111.405 -178.535 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . 120.78 8.99 7.84 Favored Glycine 0 N--CA 1.435 -1.414 0 C-N-CA 119.869 -1.158 . . . . 0.0 112.252 -179.874 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 19' ' ' ASP . . . . . . . . . . . . . 3.5 m-20 -65.97 -29.1 69.44 Favored 'General case' 0 C--N 1.32 -0.715 0 CA-C-O 121.064 0.459 . . . . 0.0 110.811 -179.808 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 20' ' ' CYS . . . . . . . . . . . . . 45.6 t -92.69 0.28 57.4 Favored 'General case' 0 C--N 1.31 -1.121 0 CA-C-O 121.447 0.641 . . . . 0.0 110.331 -178.535 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 21' ' ' ASP . . . . . . . . . . . . . 31.8 t70 -113.09 -11.07 13.38 Favored 'General case' 0 C--N 1.317 -0.83 0 CA-C-O 122.036 0.922 . . . . 0.0 109.238 177.638 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 22' ' ' ASN . . . . . . . . . . . . . 8.6 t30 -87.98 117.33 26.77 Favored 'General case' 0 C--N 1.301 -1.539 0 CA-C-N 114.919 -1.037 . . . . 0.0 109.784 -178.382 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 23' ' ' ASP . . . . . . . . . . . . . 18.1 t70 -50.98 -45.55 61.01 Favored 'General case' 0 N--CA 1.477 0.888 0 N-CA-C 114.073 1.138 . . . . 0.0 114.073 -172.105 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 3.8 p30 -72.22 -10.02 59.23 Favored 'General case' 0 C--N 1.315 -0.915 0 N-CA-C 113.371 0.878 . . . . 0.0 113.371 -176.468 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 25' ' ' LYS . . . . . . . . . . . . . 87.8 mttt -107.67 -7.04 16.55 Favored 'General case' 0 C--N 1.322 -0.602 0 O-C-N 122.039 -0.413 . . . . 0.0 111.683 178.954 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 26' ' ' LEU . . . . . . . . . . . . . 92.8 mt -52.85 -51.89 59.26 Favored 'General case' 0 N--CA 1.472 0.633 0 N-CA-C 113.858 1.059 . . . . 0.0 113.858 -175.271 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 27' ' ' LEU . . . . . . . . . . . . . 2.3 tm? -58.5 -41.78 86.14 Favored 'General case' 0 N--CA 1.436 -1.149 0 C-N-CA 122.688 0.395 . . . . 0.0 109.965 -179.306 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 28' ' ' GLU . . . . . 0.579 ' HA ' ' CZ ' ' A' ' 31' ' ' TYR . 80.8 mt-10 -62.96 -37.16 85.99 Favored 'General case' 0 CA--C 1.511 -0.526 0 CA-C-N 116.021 -0.536 . . . . 0.0 110.038 179.309 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 29' ' ' MET . . . . . . . . . . . . . 81.3 mmm -72.94 -24.84 60.86 Favored 'General case' 0 C--N 1.309 -1.186 0 CA-C-N 115.252 -0.885 . . . . 0.0 110.765 -178.22 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 30' ' ' GLY . . . . . 0.449 ' HA2' ' CE1' ' A' ' 39' ' ' PHE . . . -68.74 -24.84 75.42 Favored Glycine 0 C--N 1.312 -0.787 0 CA-C-N 115.365 -0.834 . . . . 0.0 112.55 178.182 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 31' ' ' TYR . . . . . 0.579 ' CZ ' ' HA ' ' A' ' 28' ' ' GLU 0.255 22.5 p90 -101.52 -37.67 8.3 Favored 'General case' 0 CA--C 1.5 -0.942 0 C-N-CA 119.628 -0.829 . . . . 0.0 112.787 174.883 . . . . . . . . 3 3 . 1 . 019 nuclear orig full ' A' A ' 32' ' ' TYR . . . . . . . . . . . . . 28.2 m-85 -65.38 -49.28 69.91 Favored 'General case' 0 C--N 1.308 -1.226 0 N-CA-C 112.959 0.725 . . . . 0.0 112.959 176.61 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 33' ' ' CYS . . . . . . . . . . . . . 36.7 m -135.25 72.6 65.83 Favored Pre-proline 0 C--N 1.308 -1.222 0 C-N-CA 119.938 -0.705 . . . . 0.0 111.1 -177.074 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 34' ' ' PRO . . . . . . . . . . . . . 60.1 Cg_endo -69.26 -24.17 32.24 Favored 'Trans proline' 0 N--CA 1.45 -1.031 0 C-N-CA 122.261 1.974 . . . . 0.0 112.053 -177.436 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 35' ' ' VAL . . . . . 0.572 ' HB ' ' OD1' ' A' ' 5' ' ' ASP . 49.6 t -87.2 -46.13 16.21 Favored 'Isoleucine or valine' 0 C--N 1.301 -1.528 0 C-N-CA 119.907 -0.717 . . . . 0.0 110.571 -178.432 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 36' ' ' THR . . . . . . . . . . . . . 21.1 m -62.37 -37.18 84.73 Favored 'General case' 0 C--N 1.314 -0.955 0 CA-C-N 115.58 -0.737 . . . . 0.0 111.295 179.424 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 37' ' ' CYS . . . . . . . . . . . . . 84.4 m -92.37 11.18 26.89 Favored 'General case' 0 C--N 1.313 -0.98 0 N-CA-C 112.921 0.712 . . . . 0.0 112.921 -179.831 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 38' ' ' GLY . . . . . . . . . . . . . . . 68.85 45.5 64.02 Favored Glycine 0 CA--C 1.519 0.337 0 N-CA-C 116.002 1.161 . . . . 0.0 116.002 171.827 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 39' ' ' PHE . . . . . 0.449 ' CE1' ' HA2' ' A' ' 30' ' ' GLY . 96.8 m-85 -100.24 -30.98 11.6 Favored 'General case' 0 C--N 1.302 -1.488 0 N-CA-C 108.825 -0.805 . . . . 0.0 108.825 174.051 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 40' ' ' CYS . . . . . . . . . . . . . 75.6 m -127.83 88.29 2.75 Favored 'General case' 0 C--N 1.311 -1.095 0 CA-C-N 115.339 -0.846 . . . . 0.0 109.366 178.601 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 41' ' ' NH2 . . . . . . . . . . . . . . . . . . . . 0 C--N 1.306 -1.287 0 CA-C-N 116.373 -0.376 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 020 nuclear orig full ' A' A ' 1' ' ' GLU . . . . . . . . . . . . . 9.8 tp10 . . . . . 0 CA--C 1.506 -0.747 0 N-CA-C 110.409 -0.219 . . . . 0.0 110.409 . . . . . . . . . 0 0 . 1 . 020 nuclear orig full ' A' A ' 2' ' ' HIS . . . . . . . . . . . . . 20.7 t60 -51.46 111.43 0.58 Allowed 'General case' 0 C--O 1.242 0.668 0 O-C-N 124.525 1.141 . . . . 0.0 111.435 -173.368 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 3' ' ' CYS . . . . . . . . . . . . . 7.1 p -74.93 110.69 9.43 Favored 'General case' 0 C--N 1.288 -2.106 0 CA-C-N 114.173 -1.376 . . . . 0.0 111.75 179.649 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 4' ' ' ALA . . . . . . . . . . . . . . . -133.26 161.18 35.15 Favored 'General case' 0 N--CA 1.44 -0.934 0 N-CA-C 108.361 -0.977 . . . . 0.0 108.361 -179.907 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 5' ' ' ASP . . . . . 0.554 ' OD2' ' HB ' ' A' ' 35' ' ' VAL . 7.7 m-20 -70.11 148.68 48.45 Favored 'General case' 0 C--N 1.316 -0.859 0 N-CA-C 109.189 -0.671 . . . . 0.0 109.189 179.82 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 0.6 OUTLIER -72.52 152.08 42.09 Favored 'General case' 0 C--N 1.307 -1.259 0 N-CA-C 108.28 -1.007 . . . . 0.0 108.28 -179.095 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 7' ' ' LYS . . . . . . . . . . . . . 9.1 ptpp? -82.03 -35.32 28.94 Favored 'General case' 0 C--N 1.316 -0.879 0 N-CA-C 112.723 0.638 . . . . 0.0 112.723 -172.786 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 8' ' ' ASN . . . . . . . . . . . . . 30.7 m-80 -84.64 -31.21 24.32 Favored 'General case' 0 CA--C 1.486 -1.487 0 N-CA-C 109.29 -0.633 . . . . 0.0 109.29 -175.727 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 9' ' ' PHE . . . . . . . . . . . . . 26.6 t80 -75.12 129.05 36.9 Favored 'General case' 0 N--CA 1.424 -1.758 0 CA-C-N 114.901 -1.045 . . . . 0.0 108.744 -178.76 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 10' ' ' ASP . . . . . . . . . . . . . 9.1 t70 -89.43 102.65 15.32 Favored 'General case' 0 C--N 1.304 -1.385 0 N-CA-C 108.97 -0.752 . . . . 0.0 108.97 -179.461 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 11' ' ' CYS . . . . . 0.456 ' SG ' ' HB3' ' A' ' 5' ' ' ASP . 83.8 m -77.87 -28.55 50.04 Favored 'General case' 0 C--N 1.29 -2.018 0 CA-C-N 115.972 -0.558 . . . . 0.0 111.261 -177.299 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 12' ' ' ARG . . . . . . . . . . . . . 37.5 mmt180 -61.95 -50.27 72.82 Favored 'General case' 0 C--O 1.24 0.579 0 CA-C-O 120.998 0.428 . . . . 0.0 110.074 179.229 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 34.3 ttm180 -59.64 -55.11 38.55 Favored 'General case' 0 C--O 1.208 -1.107 0 CA-C-N 115.026 -0.988 . . . . 0.0 109.236 178.074 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 14' ' ' SER . . . . . . . . . . . . . 18.5 m -60.48 -36.61 78.71 Favored 'General case' 0 C--N 1.307 -1.26 0 CA-C-N 115.599 -0.728 . . . . 0.0 112.747 -174.094 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 45.8 tp -68.86 -47.77 65.1 Favored 'General case' 0 C--N 1.32 -0.68 0 C-N-CA 120.406 -0.517 . . . . 0.0 110.101 178.161 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 16' ' ' ARG . . . . . . . . . . . . . 60.7 mtp180 -71.78 -31.16 66.32 Favored 'General case' 0 C--N 1.324 -0.511 0 CA-C-N 115.923 -0.581 . . . . 0.0 112.008 -177.395 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 17' ' ' ASN . . . . . . . . . . . . . 0.9 OUTLIER -71.73 -33.2 68.51 Favored 'General case' 0 CA--C 1.494 -1.173 0 CA-C-N 116.424 -0.353 . . . . 0.0 111.467 -179.72 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . 116.81 10.2 10.31 Favored Glycine 0 N--CA 1.431 -1.671 0 C-N-CA 119.587 -1.292 . . . . 0.0 112.393 178.75 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 19' ' ' ASP . . . . . . . . . . . . . 4.1 m-20 -65.83 -35.5 80.84 Favored 'General case' 0 CA--C 1.494 -1.183 0 CA-C-O 121.156 0.503 . . . . 0.0 110.769 -179.018 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 20' ' ' CYS . . . . . . . . . . . . . 39.1 t -79.93 -12.45 59.73 Favored 'General case' 0 C--N 1.301 -1.513 0 CA-C-N 115.729 -0.668 . . . . 0.0 110.253 -176.758 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 21' ' ' ASP . . . . . . . . . . . . . 38.3 t70 -107.58 -0.36 22.08 Favored 'General case' 0 C--N 1.318 -0.797 0 CA-C-O 122.249 1.023 . . . . 0.0 109.146 177.108 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 22' ' ' ASN . . . . . . . . . . . . . 47.8 t-20 -87.83 118.77 27.58 Favored 'General case' 0 C--N 1.304 -1.379 0 CA-C-N 115.286 -0.87 . . . . 0.0 108.657 -179.509 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 23' ' ' ASP . . . . . 0.437 ' HA ' ' HG ' ' A' ' 26' ' ' LEU . 2.7 m-20 -53.08 -44.09 67.25 Favored 'General case' 0 C--N 1.32 -0.702 0 C-N-CA 123.694 0.798 . . . . 0.0 112.499 -177.566 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 23.0 t70 -64.69 -31.48 72.73 Favored 'General case' 0 C--N 1.318 -0.779 0 N-CA-C 112.122 0.416 . . . . 0.0 112.122 -178.737 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 25' ' ' LYS . . . . . . . . . . . . . 88.8 mttt -98.31 -5.29 33.25 Favored 'General case' 0 C--N 1.305 -1.326 0 N-CA-C 112.917 0.71 . . . . 0.0 112.917 -176.024 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 26' ' ' LEU . . . . . 0.437 ' HG ' ' HA ' ' A' ' 23' ' ' ASP . 83.9 mt -49.2 -54.36 16.92 Favored 'General case' 0 N--CA 1.482 1.172 0 N-CA-C 113.651 0.982 . . . . 0.0 113.651 -176.941 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 27' ' ' LEU . . . . . . . . . . . . . 2.2 tm? -57.71 -45.46 85.7 Favored 'General case' 0 N--CA 1.434 -1.251 0 N-CA-C 109.736 -0.468 . . . . 0.0 109.736 -177.503 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 28' ' ' GLU . . . . . . . . . . . . . 13.2 mm-40 -61.76 -37.66 85.14 Favored 'General case' 0 C--N 1.327 -0.402 0 CA-C-N 115.4 -0.818 . . . . 0.0 110.277 -178.047 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 29' ' ' MET . . . . . . . . . . . . . 80.2 mmm -73.76 -26.18 60.53 Favored 'General case' 0 C--N 1.307 -1.252 0 CA-C-N 114.907 -1.042 . . . . 0.0 111.609 -174.342 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 30' ' ' GLY . . . . . 0.449 ' HA2' ' CE2' ' A' ' 39' ' ' PHE . . . -68.07 -33.21 78.28 Favored Glycine 0 N--CA 1.439 -1.138 0 CA-C-N 115.46 -0.791 . . . . 0.0 112.758 -179.678 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 31' ' ' TYR . . . . . . . . . . . . . 44.8 p90 -96.98 -33.32 11.61 Favored 'General case' 0 CA--C 1.498 -1.028 0 C-N-CA 118.86 -1.136 . . . . 0.0 113.207 178.46 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 32' ' ' TYR . . . . . . . . . . . . . 36.5 m-85 -69.13 -42.99 75.27 Favored 'General case' 0 C--N 1.304 -1.413 0 N-CA-C 112.717 0.636 . . . . 0.0 112.717 175.96 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 33' ' ' CYS . . . . . . . . . . . . . 44.8 m -135.45 68.35 67.5 Favored Pre-proline 0 C--O 1.246 0.917 0 C-N-CA 120.194 -0.602 . . . . 0.0 112.007 -179.165 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 34' ' ' PRO . . . . . 0.449 ' HD2' ' HA ' ' A' ' 5' ' ' ASP . 58.4 Cg_endo -69.72 -23.65 30.73 Favored 'Trans proline' 0 C--N 1.355 0.889 0 C-N-CA 122.026 1.818 . . . . 0.0 111.931 -178.777 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 35' ' ' VAL . . . . . 0.554 ' HB ' ' OD2' ' A' ' 5' ' ' ASP . 66.1 t -86.54 -52.36 11.95 Favored 'Isoleucine or valine' 0 C--N 1.295 -1.797 0 C-N-CA 120.144 -0.622 . . . . 0.0 110.544 -178.086 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 36' ' ' THR . . . . . . . . . . . . . 23.3 m -60.41 -27.11 67.2 Favored 'General case' 0 CA--C 1.556 1.176 0 C-N-CA 123.188 0.595 . . . . 0.0 111.887 -178.195 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 37' ' ' CYS . . . . . . . . . . . . . 67.4 m -99.73 5.39 45.69 Favored 'General case' 0 C--N 1.319 -0.719 0 N-CA-C 113.792 1.034 . . . . 0.0 113.792 179.736 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 38' ' ' GLY . . . . . . . . . . . . . . . 76.93 34.72 41.57 Favored Glycine 0 CA--C 1.525 0.683 0 N-CA-C 115.426 0.931 . . . . 0.0 115.426 174.624 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 39' ' ' PHE . . . . . 0.449 ' CE2' ' HA2' ' A' ' 30' ' ' GLY . 90.2 m-85 -88.89 -44.37 10.51 Favored 'General case' 0 C--N 1.311 -1.079 0 N-CA-C 108.252 -1.018 . . . . 0.0 108.252 175.102 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 40' ' ' CYS . . . . . . . . . . . . . 57.9 m -117.99 95.63 5.0 Favored 'General case' 0 C--N 1.305 -1.359 0 CA-C-N 114.737 -1.119 . . . . 0.0 109.024 -179.266 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 41' ' ' NH2 . . . . . . . . . . . . . . . . . . . . 0 C--N 1.307 -1.266 0 CA-C-N 116.412 -0.358 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 001 nuclear build core ' A' A ' 4' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.436 -1.142 0 N-CA-C 108.353 -0.98 . . . . 0.0 108.353 . . . . . . . . . 0 0 . 1 . 001 nuclear build core ' A' A ' 5' ' ' ASP . . . . . 0.693 ' OD2' ' HB ' ' A' ' 35' ' ' VAL . 16.6 m-20 -59.85 141.56 55.16 Favored 'General case' 0 C--O 1.253 1.265 0 O-C-N 123.728 0.643 . . . . 0.0 110.068 177.001 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 0.2 OUTLIER -69.22 152.02 45.59 Favored 'General case' 0 C--N 1.307 -1.277 0 CA-C-N 115.678 -0.692 . . . . 0.0 109.63 -178.394 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 7' ' ' LYS . . . . . . . . . . . . . 8.6 ptpp? -85.61 -34.49 21.39 Favored 'General case' 0 C--N 1.31 -1.132 0 C-N-CA 123.659 0.784 . . . . 0.0 112.845 -175.875 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 8' ' ' ASN . . . . . . . . . . . . . 90.2 m-20 -94.33 -21.05 19.23 Favored 'General case' 0 C--N 1.299 -1.587 0 CA-C-N 115.978 -0.555 . . . . 0.0 111.108 -175.803 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 9' ' ' PHE . . . . . 0.583 ' HD2' ' SG ' ' A' ' 33' ' ' CYS . 37.3 t80 -83.55 129.42 34.97 Favored 'General case' 0 C--N 1.301 -1.507 0 N-CA-C 107.013 -1.477 . . . . 0.0 107.013 175.953 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 10' ' ' ASP . . . . . . . . . . . . . 12.5 t70 -86.76 107.05 18.09 Favored 'General case' 0 C--N 1.307 -1.28 0 C-N-CA 118.762 -1.175 . . . . 0.0 110.111 -179.831 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 11' ' ' CYS . . . . . 0.527 ' SG ' ' HB3' ' A' ' 5' ' ' ASP . 50.9 m -73.58 -27.34 61.26 Favored 'General case' 0 C--N 1.297 -1.706 0 CA-C-N 114.901 -1.045 . . . . 0.0 111.822 -176.406 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 12' ' ' ARG . . . . . . . . . . . . . 34.4 mmt180 -76.66 -45.88 28.01 Favored 'General case' 0 CA--C 1.506 -0.735 0 CA-C-O 120.859 0.362 . . . . 0.0 110.304 -175.217 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 37.2 ttm180 -61.26 -49.66 76.17 Favored 'General case' 0 C--N 1.31 -1.152 0 CA-C-N 115.384 -0.825 . . . . 0.0 109.239 178.616 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 14' ' ' SER . . . . . . . . . . . . . 23.7 m -59.86 -35.19 74.28 Favored 'General case' 0 CA--C 1.547 0.837 0 O-C-N 123.678 0.611 . . . . 0.0 111.629 -178.752 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 47.6 tp -71.69 -41.48 68.59 Favored 'General case' 0 C--N 1.322 -0.616 0 N-CA-C 109.643 -0.502 . . . . 0.0 109.643 178.316 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 16' ' ' ARG . . . . . . . . . . . . . 21.0 tpp180 -67.46 -35.06 78.46 Favored 'General case' 0 N--CA 1.427 -1.604 0 C-N-CA 123.9 0.88 . . . . 0.0 111.47 179.908 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 17' ' ' ASN . . . . . . . . . . . . . 86.0 m-20 -67.96 -47.4 68.75 Favored 'General case' 0 CA--C 1.5 -0.95 0 N-CA-C 108.611 -0.885 . . . . 0.0 108.611 178.266 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . 113.23 19.26 6.79 Favored Glycine 0 N--CA 1.421 -2.311 0 CA-C-N 114.426 -1.261 . . . . 0.0 110.518 -176.056 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 19' ' ' ASP . . . . . . . . . . . . . 10.4 m-20 -58.33 -38.99 78.26 Favored 'General case' 0 CA--C 1.5 -0.971 0 CA-C-O 121.276 0.56 . . . . 0.0 110.055 179.666 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 20' ' ' CYS . . . . . 0.436 ' HA ' ' HG3' ' A' ' 29' ' ' MET . 34.8 t -78.43 -4.01 46.24 Favored 'General case' 0 C--N 1.306 -1.296 0 CA-C-N 115.623 -0.717 . . . . 0.0 111.977 -176.395 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 21' ' ' ASP . . . . . . . . . . . . . 12.3 t70 -99.35 -9.72 23.18 Favored 'General case' 0 C--N 1.315 -0.923 0 CA-C-O 122.233 1.015 . . . . 0.0 108.469 178.402 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 22' ' ' ASN . . . . . . . . . . . . . 25.0 t-20 -84.3 122.59 29.12 Favored 'General case' 0 C--N 1.315 -0.915 0 CA-C-N 114.765 -1.107 . . . . 0.0 108.19 178.902 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 23' ' ' ASP . . . . . . . . . . . . . 20.1 t70 -55.2 -41.47 72.03 Favored 'General case' 0 C--N 1.318 -0.765 0 N-CA-C 113.266 0.839 . . . . 0.0 113.266 -176.368 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 14.4 m-20 -78.44 -16.33 57.69 Favored 'General case' 0 C--N 1.311 -1.073 0 CA-C-O 121.51 0.671 . . . . 0.0 111.405 -176.345 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 25' ' ' LYS . . . . . . . . . . . . . 34.9 mttm -95.06 -7.46 39.49 Favored 'General case' 0 C--N 1.303 -1.445 0 CA-C-N 115.87 -0.605 . . . . 0.0 111.74 176.588 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 26' ' ' LEU . . . . . . . . . . . . . 85.7 mt -55.74 -43.92 77.06 Favored 'General case' 0 C--N 1.314 -0.951 0 O-C-N 123.141 0.275 . . . . 0.0 111.043 176.881 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 27' ' ' LEU . . . . . . . . . . . . . 24.1 tp -57.21 -49.49 75.83 Favored 'General case' 0 N--CA 1.436 -1.162 0 CA-C-O 121.327 0.584 . . . . 0.0 109.498 176.987 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 28' ' ' GLU . . . . . . . . . . . . . 40.3 tt0 -58.19 -36.94 73.82 Favored 'General case' 0 C--N 1.325 -0.464 0 CA-C-N 114.559 -1.201 . . . . 0.0 109.977 -179.266 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 29' ' ' MET . . . . . 0.436 ' HG3' ' HA ' ' A' ' 20' ' ' CYS . 82.7 mmm -83.89 -23.23 31.33 Favored 'General case' 0 C--N 1.3 -1.554 0 CA-C-N 115.173 -0.921 . . . . 0.0 111.658 -174.825 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 30' ' ' GLY . . . . . . . . . . . . . . . -66.77 -28.46 73.78 Favored Glycine 0 C--N 1.308 -1.027 0 CA-C-N 115.192 -0.913 . . . . 0.0 112.234 179.638 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 31' ' ' TYR . . . . . . . . . . . . . 30.0 p90 -105.0 -34.01 8.14 Favored 'General case' 0 N--CA 1.435 -1.221 0 N-CA-C 113.404 0.89 . . . . 0.0 113.404 177.06 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 32' ' ' TYR . . . . . 0.422 ' HB3' ' CD2' ' A' ' 9' ' ' PHE . 19.2 m-85 -71.44 -62.05 1.55 Allowed 'General case' 0 C--N 1.308 -1.229 0 N-CA-C 113.623 0.971 . . . . 0.0 113.623 178.33 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 33' ' ' CYS . . . . . 0.583 ' SG ' ' HD2' ' A' ' 9' ' ' PHE . 62.6 m -134.31 70.3 73.17 Favored Pre-proline 0 C--N 1.299 -1.63 0 C-N-CA 119.896 -0.721 . . . . 0.0 110.988 -177.31 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 34' ' ' PRO . . . . . . . . . . . . . 71.7 Cg_endo -75.87 -23.77 12.11 Favored 'Trans proline' 0 N--CA 1.445 -1.331 0 C-N-CA 122.154 1.903 . . . . 0.0 112.438 -175.408 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 35' ' ' VAL . . . . . 0.693 ' HB ' ' OD2' ' A' ' 5' ' ' ASP . 39.3 t -82.73 -36.72 13.52 Favored 'Isoleucine or valine' 0 N--CA 1.424 -1.751 0 N-CA-C 108.826 -0.805 . . . . 0.0 108.826 -177.145 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 36' ' ' THR . . . . . . . . . . . . . 48.2 m -64.12 -34.86 79.01 Favored 'General case' 0 CA--C 1.546 0.804 0 CA-C-N 115.305 -0.861 . . . . 0.0 110.635 175.362 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 37' ' ' CYS . . . . . . . . . . . . . 90.9 m -84.79 2.11 43.71 Favored 'General case' 0 C--N 1.322 -0.59 0 CA-C-O 121.087 0.47 . . . . 0.0 112.243 177.767 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 38' ' ' GLY . . . . . . . . . . . . . . . 69.58 26.58 74.33 Favored Glycine 0 N--CA 1.445 -0.744 0 CA-C-N 116.124 -0.489 . . . . 0.0 114.224 176.086 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 39' ' ' PHE . . . . . . . . . . . . . 26.8 m-85 -75.05 -34.66 61.87 Favored 'General case' 0 CA--C 1.507 -0.687 0 N-CA-C 108.464 -0.939 . . . . 0.0 108.464 178.402 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 40' ' ' CYS . . . . . . . . . . . . . 3.3 p . . . . . 0 C--N 1.306 -1.285 0 CA-C-N 114.537 -1.211 . . . . 0.0 109.989 -179.488 . . . . . . . . 0 0 . 1 . 002 nuclear build core ' A' A ' 4' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.433 -1.325 0 N-CA-C 109.571 -0.529 . . . . 0.0 109.571 . . . . . . . . . 0 0 . 1 . 002 nuclear build core ' A' A ' 5' ' ' ASP . . . . . 0.626 ' OD2' ' HB ' ' A' ' 35' ' ' VAL . 4.2 m-20 -65.55 160.79 21.61 Favored 'General case' 0 C--N 1.307 -1.244 0 O-C-N 123.779 0.674 . . . . 0.0 109.803 179.381 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 6' ' ' GLU . . . . . 0.448 ' HB3' ' HB3' ' A' ' 9' ' ' PHE . 0.6 OUTLIER -71.25 139.87 50.19 Favored 'General case' 0 C--N 1.309 -1.179 0 N-CA-C 106.537 -1.653 . . . . 0.0 106.537 179.147 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' A' A ' 7' ' ' LYS . . . . . . . . . . . . . 19.5 ptmt -82.19 -26.56 33.25 Favored 'General case' 0 C--N 1.303 -1.421 0 N-CA-C 113.691 0.997 . . . . 0.0 113.691 -171.098 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 8' ' ' ASN . . . . . . . . . . . . . 37.8 m-80 -89.86 -31.22 17.43 Favored 'General case' 0 C--N 1.294 -1.809 0 CA-C-O 121.451 0.644 . . . . 0.0 109.4 -179.23 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 9' ' ' PHE . . . . . 0.457 ' CD2' ' HB3' ' A' ' 32' ' ' TYR . 32.9 t80 -76.55 119.37 20.29 Favored 'General case' 0 N--CA 1.424 -1.771 0 N-CA-C 107.751 -1.203 . . . . 0.0 107.751 176.691 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 10' ' ' ASP . . . . . . . . . . . . . 15.4 t70 -88.39 96.14 10.48 Favored 'General case' 0 C--N 1.294 -1.828 0 N-CA-C 109.002 -0.74 . . . . 0.0 109.002 -179.905 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 11' ' ' CYS . . . . . . . . . . . . . 96.1 m -70.35 -19.53 63.04 Favored 'General case' 0 C--N 1.312 -1.036 0 CA-C-N 115.387 -0.824 . . . . 0.0 111.902 -178.441 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 12' ' ' ARG . . . . . . . . . . . . . 36.3 mmt180 -66.8 -43.36 84.06 Favored 'General case' 0 C--N 1.319 -0.746 0 N-CA-C 108.805 -0.813 . . . . 0.0 108.805 178.287 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 58.6 ttp180 -64.01 -50.08 69.91 Favored 'General case' 0 C--O 1.211 -0.953 0 CA-C-N 115.327 -0.851 . . . . 0.0 109.511 175.52 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 14' ' ' SER . . . . . . . . . . . . . 11.7 m -57.4 -40.07 77.46 Favored 'General case' 0 C--O 1.252 1.194 0 C-N-CA 122.909 0.483 . . . . 0.0 112.087 -178.621 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 46.0 tp -64.77 -41.14 96.1 Favored 'General case' 0 C--N 1.327 -0.388 0 CA-C-O 121.306 0.574 . . . . 0.0 110.259 179.686 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 16' ' ' ARG . . . . . . . . . . . . . 60.5 mtm180 -77.82 -28.2 50.2 Favored 'General case' 0 C--N 1.305 -1.342 0 CA-C-N 116.036 -0.529 . . . . 0.0 111.475 179.523 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 17' ' ' ASN . . . . . . . . . . . . . 7.2 m-20 -69.1 -25.93 64.67 Favored 'General case' 0 N--CA 1.477 0.899 0 CA-C-N 115.811 -0.631 . . . . 0.0 111.226 178.277 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . 102.89 6.4 46.11 Favored Glycine 0 N--CA 1.439 -1.101 0 C-N-CA 120.527 -0.844 . . . . 0.0 112.273 178.024 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 19' ' ' ASP . . . . . . . . . . . . . 15.6 m-20 -73.13 -27.25 61.57 Favored 'General case' 0 CA--C 1.504 -0.805 0 CA-C-O 120.937 0.398 . . . . 0.0 111.53 -178.631 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 20' ' ' CYS . . . . . 0.44 ' HA ' ' HG3' ' A' ' 29' ' ' MET . 46.6 t -81.29 -9.91 59.67 Favored 'General case' 0 C--N 1.306 -1.303 0 CA-C-O 121.669 0.747 . . . . 0.0 110.051 179.92 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 21' ' ' ASP . . . . . . . . . . . . . 28.3 t70 -101.67 -8.9 21.37 Favored 'General case' 0 C--N 1.318 -0.791 0 CA-C-O 121.998 0.904 . . . . 0.0 108.946 177.509 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 22' ' ' ASN . . . . . . . . . . . . . 52.5 t-20 -88.09 123.06 32.38 Favored 'General case' 0 C--N 1.305 -1.368 0 CA-C-N 115.453 -0.794 . . . . 0.0 109.215 -178.896 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 23' ' ' ASP . . . . . 0.407 ' HA ' ' HG ' ' A' ' 26' ' ' LEU . 6.9 m-20 -59.38 -35.34 73.75 Favored 'General case' 0 CA--C 1.507 -0.688 0 C-N-CA 123.61 0.764 . . . . 0.0 111.466 179.857 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 11.8 t70 -66.6 -32.6 74.03 Favored 'General case' 0 C--N 1.311 -1.104 0 C-N-CA 123.59 0.756 . . . . 0.0 111.802 -179.207 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 25' ' ' LYS . . . . . 0.519 ' O ' ' HG2' ' A' ' 29' ' ' MET . 33.8 mmtp -94.01 -2.44 53.01 Favored 'General case' 0 C--N 1.31 -1.117 0 CA-C-N 116.124 -0.489 . . . . 0.0 112.234 -177.358 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 26' ' ' LEU . . . . . 0.407 ' HG ' ' HA ' ' A' ' 23' ' ' ASP . 88.6 mt -58.89 -38.6 79.22 Favored 'General case' 0 N--CA 1.469 0.504 0 N-CA-C 112.834 0.679 . . . . 0.0 112.834 -176.95 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 27' ' ' LEU . . . . . . . . . . . . . 24.4 tp -55.28 -49.89 70.93 Favored 'General case' 0 N--CA 1.437 -1.092 0 N-CA-C 109.436 -0.579 . . . . 0.0 109.436 176.376 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 28' ' ' GLU . . . . . . . . . . . . . 5.7 mm-40 -61.86 -36.78 82.26 Favored 'General case' 0 C--N 1.324 -0.518 0 CA-C-N 114.603 -1.18 . . . . 0.0 109.141 -179.22 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 29' ' ' MET . . . . . 0.519 ' HG2' ' O ' ' A' ' 25' ' ' LYS . 22.3 mmt -70.94 -27.45 63.77 Favored 'General case' 0 C--O 1.203 -1.384 0 CA-C-N 115.203 -0.908 . . . . 0.0 110.885 -175.324 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 30' ' ' GLY . . . . . . . . . . . . . . . -68.42 -34.4 79.49 Favored Glycine 0 C--N 1.312 -0.777 0 C-N-CA 120.186 -1.007 . . . . 0.0 112.768 -178.321 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 31' ' ' TYR . . . . . . . . . . . . . 36.3 p90 -103.15 -27.6 12.44 Favored 'General case' 0 N--CA 1.441 -0.883 0 N-CA-C 113.663 0.986 . . . . 0.0 113.663 179.913 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 32' ' ' TYR . . . . . 0.457 ' HB3' ' CD2' ' A' ' 9' ' ' PHE . 23.0 m-85 -83.35 -36.83 24.06 Favored 'General case' 0 C--N 1.29 -2.018 0 N-CA-C 112.626 0.602 . . . . 0.0 112.626 175.852 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 33' ' ' CYS . . . . . . . . . . . . . 61.0 m -134.71 49.86 4.26 Favored Pre-proline 0 CA--C 1.565 1.528 0 N-CA-C 113.369 0.878 . . . . 0.0 113.369 -174.893 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 34' ' ' PRO . . . . . 0.563 ' HD2' ' HA ' ' A' ' 5' ' ' ASP . 21.7 Cg_endo -57.33 -32.3 93.43 Favored 'Trans proline' 0 C--N 1.38 2.21 0 C-N-CA 122.733 2.289 . . . . 0.0 113.591 -178.916 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 35' ' ' VAL . . . . . 0.626 ' HB ' ' OD2' ' A' ' 5' ' ' ASP . 45.3 t -87.07 -46.76 16.21 Favored 'Isoleucine or valine' 0 C--N 1.299 -1.629 0 C-N-CA 119.917 -0.713 . . . . 0.0 110.892 -177.46 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 36' ' ' THR . . . . . . . . . . . . . 19.5 m -61.56 -40.95 96.56 Favored 'General case' 0 C--N 1.312 -1.053 0 CA-C-N 115.972 -0.558 . . . . 0.0 111.769 -177.336 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 37' ' ' CYS . . . . . . . . . . . . . 94.4 m -91.95 10.91 26.92 Favored 'General case' 0 C--N 1.312 -1.058 0 N-CA-C 113.173 0.805 . . . . 0.0 113.173 -179.163 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 38' ' ' GLY . . . . . . . . . . . . . . . 69.87 48.61 40.33 Favored Glycine 0 CA--C 1.524 0.645 0 N-CA-C 115.761 1.064 . . . . 0.0 115.761 172.908 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 39' ' ' PHE . . . . . 0.522 ' CD2' ' HA ' ' A' ' 34' ' ' PRO . 93.1 m-85 -96.32 -40.1 9.3 Favored 'General case' 0 C--N 1.303 -1.424 0 N-CA-C 107.749 -1.204 . . . . 0.0 107.749 173.183 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 40' ' ' CYS . . . . . . . . . . . . . 49.8 t . . . . . 0 C--N 1.309 -1.156 0 N-CA-C 107.878 -1.156 . . . . 0.0 107.878 179.868 . . . . . . . . 0 0 . 1 . 003 nuclear build core ' A' A ' 4' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.501 -0.905 0 N-CA-C 108.64 -0.874 . . . . 0.0 108.64 . . . . . . . . . 0 0 . 1 . 003 nuclear build core ' A' A ' 5' ' ' ASP . . . . . 0.582 ' HB3' ' SG ' ' A' ' 11' ' ' CYS . 44.4 m-20 -60.69 141.62 56.63 Favored 'General case' 0 C--N 1.317 -0.825 0 O-C-N 123.733 0.645 . . . . 0.0 110.2 178.945 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 13.3 tp10 -64.11 140.39 58.86 Favored 'General case' 0 N--CA 1.443 -0.825 0 C-N-CA 123.682 0.793 . . . . 0.0 111.543 -178.95 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 7' ' ' LYS . . . . . . . . . . . . . 10.3 ptpp? -85.18 -29.97 24.3 Favored 'General case' 0 N--CA 1.441 -0.905 0 C-N-CA 124.353 1.061 . . . . 0.0 111.227 -176.498 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 8' ' ' ASN . . . . . . . . . . . . . 44.9 m-80 -86.74 -9.17 56.52 Favored 'General case' 0 C--N 1.308 -1.208 0 CA-C-O 121.817 0.818 . . . . 0.0 110.83 -178.497 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 9' ' ' PHE . . . . . . . . . . . . . 36.5 t80 -112.16 144.96 40.68 Favored 'General case' 0 C--N 1.287 -2.12 0 N-CA-C 105.524 -2.028 . . . . 0.0 105.524 -178.834 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 10' ' ' ASP . . . . . . . . . . . . . 15.3 t70 -104.49 98.77 8.49 Favored 'General case' 0 C--N 1.304 -1.403 0 C-N-CA 117.779 -1.568 . . . . 0.0 110.417 179.274 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 11' ' ' CYS . . . . . 0.582 ' SG ' ' HB3' ' A' ' 5' ' ' ASP . 76.1 m -68.33 -20.34 64.72 Favored 'General case' 0 C--N 1.304 -1.393 0 CA-C-N 114.51 -1.223 . . . . 0.0 112.274 -177.924 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 12' ' ' ARG . . . . . . . . . . . . . 7.3 mmt180 -76.6 -46.58 25.51 Favored 'General case' 0 C--N 1.315 -0.899 0 N-CA-C 107.628 -1.249 . . . . 0.0 107.628 -176.793 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 54.9 ttp180 -61.91 -40.95 97.25 Favored 'General case' 0 C--O 1.213 -0.846 0 CA-C-N 115.501 -0.772 . . . . 0.0 109.504 175.51 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 14' ' ' SER . . . . . . . . . . . . . 23.4 m -65.84 -28.02 68.67 Favored 'General case' 0 C--N 1.318 -0.773 0 CA-C-O 121.18 0.515 . . . . 0.0 111.252 179.01 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 2.3 tm? -77.56 -39.36 46.04 Favored 'General case' 0 C--N 1.316 -0.87 0 N-CA-C 107.803 -1.184 . . . . 0.0 107.803 177.267 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 16' ' ' ARG . . . . . . . . . . . . . 23.7 mtp180 -68.24 -44.89 74.65 Favored 'General case' 0 C--N 1.323 -0.548 0 CA-C-N 115.633 -0.712 . . . . 0.0 111.817 179.326 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 17' ' ' ASN . . . . . . . . . . . . . 85.3 m-20 -64.96 -37.95 89.35 Favored 'General case' 0 CA--C 1.496 -1.131 0 CA-C-O 121.67 0.747 . . . . 0.0 109.111 177.164 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . 107.74 5.45 33.63 Favored Glycine 0 N--CA 1.416 -2.657 0 CA-C-N 114.652 -1.158 . . . . 0.0 111.5 -179.122 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 19' ' ' ASP . . . . . . . . . . . . . 30.5 m-20 -57.9 -38.22 75.44 Favored 'General case' 0 N--CA 1.494 1.775 0 CA-C-O 121.618 0.723 . . . . 0.0 109.299 179.345 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 20' ' ' CYS . . . . . . . . . . . . . 44.5 t -61.45 -25.55 67.3 Favored 'General case' 0 C--N 1.31 -1.144 0 CA-C-N 114.198 -1.365 . . . . 0.0 111.982 -178.117 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 21' ' ' ASP . . . . . . . . . . . . . 28.5 t70 -111.28 -9.25 14.3 Favored 'General case' 0 C--N 1.319 -0.725 0 CA-C-O 121.646 0.736 . . . . 0.0 110.248 -179.194 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 22' ' ' ASN . . . . . . . . . . . . . 51.8 t-20 -75.54 119.51 19.7 Favored 'General case' 0 C--N 1.313 -0.996 0 CA-C-N 115.317 -0.856 . . . . 0.0 108.904 -177.272 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 23' ' ' ASP . . . . . 0.44 ' HA ' ' HG ' ' A' ' 26' ' ' LEU . 6.1 m-20 -54.06 -36.71 63.4 Favored 'General case' 0 CA--C 1.501 -0.914 0 C-N-CA 123.545 0.738 . . . . 0.0 112.505 -177.906 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 35.8 m-20 -72.62 -21.41 61.11 Favored 'General case' 0 C--N 1.308 -1.205 0 CA-C-N 115.969 -0.56 . . . . 0.0 111.504 -175.549 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 25' ' ' LYS . . . . . 0.525 ' O ' ' HG2' ' A' ' 29' ' ' MET . 13.3 mptt -104.6 -5.19 21.69 Favored 'General case' 0 C--N 1.311 -1.08 0 N-CA-C 112.1 0.407 . . . . 0.0 112.1 178.29 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 26' ' ' LEU . . . . . 0.44 ' HG ' ' HA ' ' A' ' 23' ' ' ASP . 62.8 mt -52.07 -38.88 58.63 Favored 'General case' 0 N--CA 1.479 0.981 0 N-CA-C 114.657 1.354 . . . . 0.0 114.657 -175.162 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 27' ' ' LEU . . . . . . . . . . . . . 29.6 tp -54.81 -52.72 61.82 Favored 'General case' 0 N--CA 1.44 -0.953 0 CA-C-O 121.048 0.451 . . . . 0.0 109.935 178.059 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 28' ' ' GLU . . . . . 0.5 ' HA ' ' CE2' ' A' ' 31' ' ' TYR . 43.6 mt-10 -65.2 -33.2 75.43 Favored 'General case' 0 N--CA 1.442 -0.829 0 CA-C-N 115.296 -0.865 . . . . 0.0 109.685 -178.197 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 29' ' ' MET . . . . . 0.525 ' HG2' ' O ' ' A' ' 25' ' ' LYS . 72.7 mmm -75.75 -26.54 57.5 Favored 'General case' 0 C--N 1.31 -1.151 0 CA-C-N 115.263 -0.88 . . . . 0.0 111.003 -174.71 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 30' ' ' GLY . . . . . 0.458 ' HA2' ' CE2' ' A' ' 39' ' ' PHE . . . -65.63 -37.31 93.45 Favored Glycine 0 CA--C 1.494 -1.232 0 O-C-N 123.944 0.778 . . . . 0.0 112.174 -178.955 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 31' ' ' TYR . . . . . 0.5 ' CE2' ' HA ' ' A' ' 28' ' ' GLU . 52.3 p90 -96.72 -34.74 11.24 Favored 'General case' 0 N--CA 1.433 -1.307 0 C-N-CA 119.697 -0.801 . . . . 0.0 112.755 178.901 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 32' ' ' TYR . . . . . . . . . . . . . 27.5 m-85 -69.71 -50.42 43.79 Favored 'General case' 0 C--N 1.312 -1.024 0 N-CA-C 112.954 0.724 . . . . 0.0 112.954 177.403 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 33' ' ' CYS . . . . . . . . . . . . . 29.8 m -130.45 69.58 82.16 Favored Pre-proline 0 C--O 1.259 1.574 0 C-N-CA 120.128 -0.629 . . . . 0.0 111.388 -175.836 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 34' ' ' PRO . . . . . 0.434 ' HA ' ' HD2' ' A' ' 39' ' ' PHE . 38.2 Cg_endo -65.28 -26.54 56.37 Favored 'Trans proline' 0 C--N 1.362 1.268 0 C-N-CA 122.429 2.086 . . . . 0.0 112.067 -177.944 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 35' ' ' VAL . . . . . . . . . . . . . 33.5 t -86.78 -49.89 14.52 Favored 'Isoleucine or valine' 0 N--CA 1.433 -1.302 0 CA-C-N 116.091 -0.504 . . . . 0.0 110.966 -176.198 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 36' ' ' THR . . . . . . . . . . . . . 29.0 m -55.68 -52.14 64.87 Favored 'General case' 0 C--N 1.316 -0.875 0 C-N-CA 123.28 0.632 . . . . 0.0 112.644 -177.685 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 37' ' ' CYS . . . . . 0.604 ' HB2' ' CE2' ' A' ' 39' ' ' PHE . 59.6 m -76.83 -11.43 59.83 Favored 'General case' 0 C--N 1.305 -1.333 0 N-CA-C 112.659 0.614 . . . . 0.0 112.659 -176.886 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 38' ' ' GLY . . . . . . . . . . . . . . . 88.97 46.78 4.38 Favored Glycine 0 N--CA 1.442 -0.96 0 C-N-CA 120.391 -0.909 . . . . 0.0 113.724 176.827 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 39' ' ' PHE . . . . . 0.604 ' CE2' ' HB2' ' A' ' 37' ' ' CYS . 98.1 m-85 -98.31 -59.88 1.66 Allowed 'General case' 0 C--N 1.308 -1.225 0 N-CA-C 108.51 -0.922 . . . . 0.0 108.51 176.374 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 40' ' ' CYS . . . . . . . . . . . . . 42.2 t . . . . . 0 C--N 1.307 -1.271 0 N-CA-C 108.05 -1.093 . . . . 0.0 108.05 -177.065 . . . . . . . . 0 0 . 1 . 004 nuclear build core ' A' A ' 4' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.439 -1.015 0 N-CA-C 109.879 -0.415 . . . . 0.0 109.879 . . . . . . . . . 0 0 . 1 . 004 nuclear build core ' A' A ' 5' ' ' ASP . . . . . 0.458 ' HA ' ' HD2' ' A' ' 34' ' ' PRO . 61.4 m-20 -66.24 149.8 49.79 Favored 'General case' 0 C--O 1.256 1.414 0 N-CA-C 109.174 -0.676 . . . . 0.0 109.174 176.182 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 6' ' ' GLU . . . . . 0.408 ' HB3' ' HB3' ' A' ' 9' ' ' PHE . 10.4 tp10 -65.81 144.64 56.72 Favored 'General case' 0 C--N 1.302 -1.484 0 C-N-CA 123.665 0.786 . . . . 0.0 110.679 -179.243 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 7' ' ' LYS . . . . . . . . . . . . . 11.3 ptpp? -85.45 -25.78 26.72 Favored 'General case' 0 C--N 1.321 -0.631 0 CA-C-O 121.047 0.451 . . . . 0.0 111.927 -174.76 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 8' ' ' ASN . . . . . . . . . . . . . 10.7 p30 -98.05 5.33 48.83 Favored 'General case' 0 C--N 1.313 -0.992 0 CA-C-O 121.471 0.653 . . . . 0.0 111.11 -179.361 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 9' ' ' PHE . . . . . 0.408 ' HB3' ' HB3' ' A' ' 6' ' ' GLU . 39.2 t80 -120.99 141.01 51.11 Favored 'General case' 0 C--N 1.298 -1.659 0 N-CA-C 107.21 -1.404 . . . . 0.0 107.21 -178.731 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 10' ' ' ASP . . . . . . . . . . . . . 14.1 t70 -104.53 107.78 18.88 Favored 'General case' 0 N--CA 1.434 -1.231 0 C-N-CA 118.792 -1.163 . . . . 0.0 110.295 179.026 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 11' ' ' CYS . . . . . . . . . . . . . 72.1 m -78.01 -22.75 48.8 Favored 'General case' 0 C--N 1.278 -2.535 0 CA-C-N 114.748 -1.114 . . . . 0.0 112.997 -177.499 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 12' ' ' ARG . . . . . 0.432 ' O ' ' HG3' ' A' ' 16' ' ' ARG . 18.9 mmm180 -68.84 -45.25 71.62 Favored 'General case' 0 C--N 1.323 -0.545 0 N-CA-C 108.86 -0.793 . . . . 0.0 108.86 177.633 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 39.4 ttm180 -57.45 -48.77 78.29 Favored 'General case' 0 C--N 1.312 -1.037 0 CA-C-N 115.19 -0.914 . . . . 0.0 110.236 176.441 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 14' ' ' SER . . . . . . . . . . . . . 24.0 m -59.96 -35.09 74.21 Favored 'General case' 0 C--N 1.313 -1.0 0 CA-C-N 115.455 -0.793 . . . . 0.0 110.995 178.981 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 15' ' ' LEU . . . . . 0.452 ' HA ' ' HB3' ' A' ' 20' ' ' CYS . 35.0 tp -72.66 -40.87 65.98 Favored 'General case' 0 C--N 1.32 -0.699 0 CA-C-N 116.113 -0.494 . . . . 0.0 110.306 178.769 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 16' ' ' ARG . . . . . 0.432 ' HG3' ' O ' ' A' ' 12' ' ' ARG . 97.8 mtt180 -68.29 -31.45 70.89 Favored 'General case' 0 C--N 1.316 -0.867 0 N-CA-C 112.44 0.533 . . . . 0.0 112.44 -179.889 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 17' ' ' ASN . . . . . . . . . . . . . 40.4 m-80 -88.7 -24.16 22.79 Favored 'General case' 0 CA--C 1.497 -1.088 0 N-CA-C 113.353 0.871 . . . . 0.0 113.353 -177.384 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . 110.42 5.11 28.39 Favored Glycine 0 C--N 1.301 -1.365 0 C-N-CA 119.044 -1.55 . . . . 0.0 112.834 178.654 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 19' ' ' ASP . . . . . . . . . . . . . 21.5 m-20 -70.23 -32.64 70.6 Favored 'General case' 0 CA--C 1.498 -1.025 0 CA-C-O 121.429 0.633 . . . . 0.0 109.564 -179.697 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 20' ' ' CYS . . . . . 0.452 ' HB3' ' HA ' ' A' ' 15' ' ' LEU . 45.4 t -78.5 -11.91 59.98 Favored 'General case' 0 C--N 1.304 -1.388 0 CA-C-N 114.624 -1.171 . . . . 0.0 110.419 -178.694 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 21' ' ' ASP . . . . . . . . . . . . . 26.5 t70 -106.33 -10.26 16.44 Favored 'General case' 0 C--N 1.319 -0.741 0 CA-C-O 121.651 0.739 . . . . 0.0 110.167 -179.531 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 22' ' ' ASN . . . . . 0.414 ' O ' ' HG ' ' A' ' 26' ' ' LEU . 25.9 t-20 -86.13 121.62 28.99 Favored 'General case' 0 C--N 1.302 -1.483 0 CA-C-N 115.237 -0.892 . . . . 0.0 109.984 -175.332 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 23' ' ' ASP . . . . . . . . . . . . . 24.7 t70 -61.18 -38.47 86.62 Favored 'General case' 0 C--N 1.32 -0.704 0 O-C-N 123.576 0.548 . . . . 0.0 112.453 -174.757 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 13.8 m-20 -64.8 -32.67 74.46 Favored 'General case' 0 N--CA 1.482 1.164 0 CA-C-O 121.466 0.651 . . . . 0.0 110.814 179.235 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 25' ' ' LYS . . . . . 0.469 ' O ' ' HG2' ' A' ' 29' ' ' MET . 13.5 mmmm -88.11 -11.49 46.86 Favored 'General case' 0 C--N 1.311 -1.073 0 CA-C-N 115.671 -0.695 . . . . 0.0 111.605 -177.162 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 26' ' ' LEU . . . . . 0.414 ' HG ' ' O ' ' A' ' 22' ' ' ASN . 60.1 mt -58.1 -31.25 66.95 Favored 'General case' 0 C--O 1.221 -0.422 0 N-CA-C 114.132 1.16 . . . . 0.0 114.132 -176.421 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 27' ' ' LEU . . . . . . . . . . . . . 34.3 tp -56.35 -52.03 66.07 Favored 'General case' 0 N--CA 1.44 -0.955 0 CA-C-O 121.441 0.639 . . . . 0.0 109.356 176.445 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 28' ' ' GLU . . . . . 0.544 ' HA ' ' CE2' ' A' ' 31' ' ' TYR . 44.5 mt-10 -65.93 -31.83 72.98 Favored 'General case' 0 N--CA 1.434 -1.246 0 CA-C-N 114.679 -1.146 . . . . 0.0 109.606 179.884 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 29' ' ' MET . . . . . 0.469 ' HG2' ' O ' ' A' ' 25' ' ' LYS . 22.2 mmt -74.21 -24.77 59.38 Favored 'General case' 0 C--O 1.196 -1.754 0 CA-C-N 115.924 -0.58 . . . . 0.0 110.193 -176.623 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 30' ' ' GLY . . . . . . . . . . . . . . . -71.01 -25.47 75.71 Favored Glycine 0 N--CA 1.448 -0.501 0 C-N-CA 120.501 -0.857 . . . . 0.0 112.046 -179.489 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 31' ' ' TYR . . . . . 0.544 ' CE2' ' HA ' ' A' ' 28' ' ' GLU . 52.7 p90 -105.33 -34.65 7.79 Favored 'General case' 0 N--CA 1.429 -1.482 0 C-N-CA 119.342 -0.943 . . . . 0.0 113.142 176.921 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 32' ' ' TYR . . . . . . . . . . . . . 32.8 m-85 -74.11 -43.56 57.12 Favored 'General case' 0 C--N 1.302 -1.49 0 C-N-CA 120.8 -0.36 . . . . 0.0 111.964 176.075 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 33' ' ' CYS . . . . . . . . . . . . . 39.9 m -135.44 57.61 20.92 Favored Pre-proline 0 C--O 1.253 1.243 0 N-CA-C 112.889 0.7 . . . . 0.0 112.889 -172.799 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 34' ' ' PRO . . . . . 0.512 ' HA ' ' CD2' ' A' ' 39' ' ' PHE . 37.5 Cg_endo -64.19 -27.08 64.59 Favored 'Trans proline' 0 C--N 1.364 1.345 0 C-N-CA 121.874 1.716 . . . . 0.0 111.798 -179.041 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 35' ' ' VAL . . . . . . . . . . . . . 44.4 t -86.95 -56.48 5.24 Favored 'Isoleucine or valine' 0 N--CA 1.43 -1.448 0 CA-C-N 115.794 -0.639 . . . . 0.0 110.945 -177.197 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 36' ' ' THR . . . . . . . . . . . . . 97.4 m -59.27 -39.82 84.13 Favored 'General case' 0 CA--C 1.549 0.907 0 N-CA-C 112.738 0.644 . . . . 0.0 112.738 -177.217 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 37' ' ' CYS . . . . . 0.436 ' HB2' ' CE2' ' A' ' 39' ' ' PHE . 90.4 m -81.16 2.2 28.61 Favored 'General case' 0 C--N 1.31 -1.11 0 N-CA-C 113.235 0.828 . . . . 0.0 113.235 -179.843 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 38' ' ' GLY . . . . . . . . . . . . . . . 77.12 23.39 68.86 Favored Glycine 0 N--CA 1.447 -0.584 0 N-CA-C 114.901 0.721 . . . . 0.0 114.901 174.123 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 39' ' ' PHE . . . . . 0.512 ' CD2' ' HA ' ' A' ' 34' ' ' PRO . 97.9 m-85 -72.45 -51.17 21.43 Favored 'General case' 0 C--N 1.317 -0.828 0 N-CA-C 106.917 -1.512 . . . . 0.0 106.917 175.273 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 40' ' ' CYS . . . . . . . . . . . . . 51.3 t . . . . . 0 N--CA 1.43 -1.467 0 CA-C-N 114.168 -1.378 . . . . 0.0 108.028 178.433 . . . . . . . . 0 0 . 1 . 005 nuclear build core ' A' A ' 4' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.427 -1.585 0 N-CA-C 108.107 -1.071 . . . . 0.0 108.107 . . . . . . . . . 0 0 . 1 . 005 nuclear build core ' A' A ' 5' ' ' ASP . . . . . 0.637 ' OD2' ' HB ' ' A' ' 35' ' ' VAL . 11.0 m-20 -60.89 146.21 47.4 Favored 'General case' 0 C--N 1.316 -0.857 0 N-CA-C 109.407 -0.59 . . . . 0.0 109.407 175.124 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 9.7 tp10 -72.15 142.03 49.1 Favored 'General case' 0 C--N 1.31 -1.15 0 C-N-CA 123.077 0.551 . . . . 0.0 111.006 -178.781 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 7' ' ' LYS . . . . . . . . . . . . . 18.3 ptmt -85.72 -27.87 25.0 Favored 'General case' 0 C--N 1.326 -0.416 0 CA-C-O 122.32 1.057 . . . . 0.0 110.812 179.663 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 8' ' ' ASN . . . . . . . . . . . . . 19.5 m120 -88.06 15.76 6.96 Favored 'General case' 0 C--N 1.305 -1.365 0 CA-C-N 114.819 -1.082 . . . . 0.0 110.616 -178.713 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 9' ' ' PHE . . . . . . . . . . . . . 40.3 t80 -142.17 143.24 32.87 Favored 'General case' 0 N--CA 1.414 -2.255 0 N-CA-C 104.59 -2.374 . . . . 0.0 104.59 179.275 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 10' ' ' ASP . . . . . 0.424 ' OD1' ' HD3' ' A' ' 12' ' ' ARG . 20.1 t70 -104.7 104.0 13.72 Favored 'General case' 0 C--N 1.302 -1.458 0 C-N-CA 118.144 -1.422 . . . . 0.0 111.009 179.062 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 11' ' ' CYS . . . . . 0.503 ' SG ' ' HB3' ' A' ' 5' ' ' ASP . 71.7 m -71.32 -16.2 62.44 Favored 'General case' 0 C--N 1.301 -1.511 0 CA-C-N 115.073 -0.967 . . . . 0.0 113.562 -177.885 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 12' ' ' ARG . . . . . 0.424 ' HD3' ' OD1' ' A' ' 10' ' ' ASP . 3.9 mpt_? -70.5 -51.22 30.44 Favored 'General case' 0 CA--C 1.493 -1.215 0 N-CA-C 106.62 -1.622 . . . . 0.0 106.62 178.533 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 41.3 ttm180 -49.77 -53.01 27.67 Favored 'General case' 0 C--N 1.319 -0.725 0 CA-C-N 114.168 -1.378 . . . . 0.0 110.513 175.905 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 14' ' ' SER . . . . . . . . . . . . . 12.2 m -55.18 -38.76 68.75 Favored 'General case' 0 C--O 1.253 1.283 0 CA-C-N 115.923 -0.581 . . . . 0.0 111.691 179.748 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 15' ' ' LEU . . . . . 0.456 ' HA ' ' HB3' ' A' ' 20' ' ' CYS . 30.6 tp -79.03 -36.94 40.28 Favored 'General case' 0 C--N 1.327 -0.393 0 CA-C-N 116.436 -0.347 . . . . 0.0 111.008 -178.323 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 16' ' ' ARG . . . . . . . . . . . . . 98.4 mtt180 -65.92 -37.23 85.54 Favored 'General case' 0 C--N 1.315 -0.895 0 CA-C-O 121.296 0.569 . . . . 0.0 110.707 177.966 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 17' ' ' ASN . . . . . . . . . . . . . 91.9 m-20 -76.0 -43.32 44.84 Favored 'General case' 0 CA--C 1.494 -1.201 0 CA-C-N 115.771 -0.649 . . . . 0.0 110.531 179.152 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . 112.94 7.36 21.76 Favored Glycine 0 C--N 1.297 -1.635 0 C-N-CA 119.882 -1.151 . . . . 0.0 111.783 177.794 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 19' ' ' ASP . . . . . . . . . . . . . 12.7 m-20 -68.87 -31.81 71.02 Favored 'General case' 0 C--O 1.212 -0.906 0 N-CA-C 108.267 -1.012 . . . . 0.0 108.267 177.918 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 20' ' ' CYS . . . . . 0.456 ' HB3' ' HA ' ' A' ' 15' ' ' LEU . 45.3 t -69.84 -10.06 57.04 Favored 'General case' 0 C--N 1.309 -1.179 0 CA-C-N 114.076 -1.42 . . . . 0.0 111.272 -179.264 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 21' ' ' ASP . . . . . . . . . . . . . 35.1 t70 -116.69 -8.92 11.38 Favored 'General case' 0 N--CA 1.468 0.43 0 CA-C-O 121.446 0.641 . . . . 0.0 110.388 -179.597 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 22' ' ' ASN . . . . . 0.495 ' O ' ' HG ' ' A' ' 26' ' ' LEU . 34.5 t30 -87.83 128.9 35.34 Favored 'General case' 0 C--N 1.324 -0.541 0 CA-C-N 115.575 -0.739 . . . . 0.0 111.706 -175.925 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 23' ' ' ASP . . . . . . . . . . . . . 5.6 p-10 -52.05 -43.94 64.04 Favored 'General case' 0 C--O 1.241 0.622 0 C-N-CA 124.84 1.256 . . . . 0.0 113.826 -176.057 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 2.8 p30 -74.17 -13.86 60.87 Favored 'General case' 0 N--CA 1.473 0.714 0 C-N-CA 120.331 -0.548 . . . . 0.0 112.404 -176.272 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 25' ' ' LYS . . . . . 0.476 ' O ' ' HG2' ' A' ' 29' ' ' MET . 46.5 mmtm -100.05 -13.35 19.07 Favored 'General case' 0 C--N 1.309 -1.17 0 C-N-CA 120.916 -0.314 . . . . 0.0 110.898 179.795 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 26' ' ' LEU . . . . . 0.495 ' HG ' ' O ' ' A' ' 22' ' ' ASN . 84.6 mt -56.67 -40.96 76.46 Favored 'General case' 0 C--O 1.2 -1.528 0 N-CA-C 115.4 1.63 . . . . 0.0 115.4 -171.707 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 27' ' ' LEU . . . . . . . . . . . . . 20.1 tp -61.01 -44.83 96.84 Favored 'General case' 0 N--CA 1.442 -0.851 0 CA-C-N 119.042 0.837 . . . . 0.0 110.007 -179.377 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 28' ' ' GLU . . . . . 0.494 ' HA ' ' CE1' ' A' ' 31' ' ' TYR . 40.1 tt0 -65.6 -34.27 77.84 Favored 'General case' 0 C--O 1.242 0.695 0 CA-C-N 115.431 -0.804 . . . . 0.0 108.969 178.945 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 29' ' ' MET . . . . . 0.476 ' HG2' ' O ' ' A' ' 25' ' ' LYS . 25.0 mmt -75.22 -23.58 57.6 Favored 'General case' 0 C--O 1.202 -1.434 0 CA-C-N 114.844 -1.071 . . . . 0.0 109.488 -178.365 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 30' ' ' GLY . . . . . . . . . . . . . . . -62.45 -40.75 99.48 Favored Glycine 0 N--CA 1.436 -1.325 0 CA-C-N 116.165 -0.471 . . . . 0.0 111.947 -179.678 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 31' ' ' TYR . . . . . 0.494 ' CE1' ' HA ' ' A' ' 28' ' ' GLU . 29.7 p90 -93.29 -35.8 12.89 Favored 'General case' 0 C--N 1.305 -1.367 0 C-N-CA 119.704 -0.799 . . . . 0.0 112.859 179.03 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 32' ' ' TYR . . . . . . . . . . . . . 24.8 m-85 -73.12 -44.54 60.09 Favored 'General case' 0 C--N 1.309 -1.156 0 N-CA-C 114.173 1.175 . . . . 0.0 114.173 178.076 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 33' ' ' CYS . . . . . . . . . . . . . 62.3 m -138.19 60.72 23.42 Favored Pre-proline 0 C--N 1.308 -1.214 0 N-CA-C 111.596 0.221 . . . . 0.0 111.596 -175.602 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 34' ' ' PRO . . . . . 0.477 ' HD2' ' HA ' ' A' ' 5' ' ' ASP . 32.1 Cg_endo -63.22 -29.57 73.61 Favored 'Trans proline' 0 C--N 1.363 1.305 0 C-N-CA 122.008 1.805 . . . . 0.0 112.279 -176.927 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 35' ' ' VAL . . . . . 0.637 ' HB ' ' OD2' ' A' ' 5' ' ' ASP . 43.3 t -87.35 -46.36 16.13 Favored 'Isoleucine or valine' 0 N--CA 1.428 -1.549 0 CA-C-N 116.149 -0.478 . . . . 0.0 111.656 -175.835 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 36' ' ' THR . . . . . . . . . . . . . 22.1 m -65.23 -38.6 90.91 Favored 'General case' 0 C--N 1.315 -0.892 0 CA-C-N 116.119 -0.491 . . . . 0.0 111.228 -178.8 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 37' ' ' CYS . . . . . 0.428 ' SG ' ' HB3' ' A' ' 29' ' ' MET . 76.4 m -84.73 0.99 48.59 Favored 'General case' 0 C--N 1.316 -0.88 0 N-CA-C 112.845 0.683 . . . . 0.0 112.845 -178.978 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 38' ' ' GLY . . . . . . . . . . . . . . . 81.61 21.31 62.16 Favored Glycine 0 N--CA 1.448 -0.533 0 N-CA-C 116.028 1.171 . . . . 0.0 116.028 172.777 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 39' ' ' PHE . . . . . 0.426 ' CD2' ' HA ' ' A' ' 34' ' ' PRO . 97.4 m-85 -73.53 -44.64 57.11 Favored 'General case' 0 CA--C 1.501 -0.904 0 N-CA-C 107.481 -1.303 . . . . 0.0 107.481 175.021 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 40' ' ' CYS . . . . . . . . . . . . . 61.5 m . . . . . 0 C--N 1.295 -1.765 0 CA-C-N 114.237 -1.347 . . . . 0.0 108.088 176.591 . . . . . . . . 0 0 . 1 . 006 nuclear build core ' A' A ' 4' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.429 -1.501 0 N-CA-C 107.487 -1.301 . . . . 0.0 107.487 . . . . . . . . . 0 0 . 1 . 006 nuclear build core ' A' A ' 5' ' ' ASP . . . . . 0.529 ' OD2' ' HB ' ' A' ' 35' ' ' VAL . 11.7 m-20 -65.15 155.63 34.28 Favored 'General case' 0 C--N 1.313 -1.021 0 O-C-N 123.517 0.511 . . . . 0.0 110.476 -179.654 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 0.5 OUTLIER -84.39 151.12 24.89 Favored 'General case' 0 C--N 1.306 -1.317 0 N-CA-C 108.278 -1.008 . . . . 0.0 108.278 179.824 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 7' ' ' LYS . . . . . . . . . . . . . 7.2 ptpp? -85.4 -36.31 20.77 Favored 'General case' 0 C--N 1.316 -0.852 0 N-CA-C 112.89 0.7 . . . . 0.0 112.89 -174.141 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 8' ' ' ASN . . . . . . . . . . . . . 92.3 m-20 -87.12 -29.37 21.88 Favored 'General case' 0 C--N 1.294 -1.825 0 N-CA-C 109.493 -0.558 . . . . 0.0 109.493 -176.58 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 9' ' ' PHE . . . . . . . . . . . . . 29.0 t80 -69.55 137.45 52.43 Favored 'General case' 0 N--CA 1.434 -1.249 0 N-CA-C 108.163 -1.051 . . . . 0.0 108.163 176.861 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 10' ' ' ASP . . . . . . . . . . . . . 45.7 t0 -91.62 92.97 8.71 Favored 'General case' 0 C--N 1.304 -1.394 0 CA-C-O 121.55 0.69 . . . . 0.0 110.082 -178.259 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 11' ' ' CYS . . . . . 0.4 ' SG ' ' HB3' ' A' ' 5' ' ' ASP . 66.3 m -73.08 -34.44 66.23 Favored 'General case' 0 C--N 1.302 -1.491 0 CA-C-N 115.283 -0.871 . . . . 0.0 111.114 -179.108 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 12' ' ' ARG . . . . . . . . . . . . . 21.9 mmt180 -69.03 -49.69 55.37 Favored 'General case' 0 CA--C 1.516 -0.364 0 CA-C-O 120.88 0.371 . . . . 0.0 111.045 -175.761 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 8.7 ttp180 -66.36 -41.26 89.75 Favored 'General case' 0 C--N 1.309 -1.176 0 CA-C-N 116.12 -0.491 . . . . 0.0 110.971 179.637 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 14' ' ' SER . . . . . . . . . . . . . 50.2 m -60.92 -36.46 79.37 Favored 'General case' 0 C--O 1.251 1.156 0 CA-C-O 121.538 0.685 . . . . 0.0 110.594 177.429 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 54.8 tp -66.27 -43.55 86.09 Favored 'General case' 0 C--N 1.325 -0.488 0 CA-C-N 115.478 -0.783 . . . . 0.0 109.975 177.568 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 16' ' ' ARG . . . . . . . . . . . . . 81.7 mtp180 -69.63 -32.99 71.99 Favored 'General case' 0 C--N 1.315 -0.926 0 CA-C-N 116.175 -0.466 . . . . 0.0 112.239 178.965 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 17' ' ' ASN . . . . . . . . . . . . . 88.0 m-20 -68.43 -47.4 67.3 Favored 'General case' 0 CA--C 1.501 -0.911 0 CA-C-O 121.663 0.744 . . . . 0.0 110.547 -179.394 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . 123.66 11.89 4.79 Favored Glycine 0 N--CA 1.429 -1.788 0 N-CA-C 110.67 -0.972 . . . . 0.0 110.67 -174.655 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 19' ' ' ASP . . . . . . . . . . . . . 32.4 m-20 -71.09 -33.0 69.77 Favored 'General case' 0 CA--C 1.505 -0.786 0 N-CA-C 108.861 -0.792 . . . . 0.0 108.861 179.512 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 20' ' ' CYS . . . . . . . . . . . . . 53.4 t -82.81 0.24 44.77 Favored 'General case' 0 C--N 1.31 -1.12 0 CA-C-N 114.589 -1.187 . . . . 0.0 110.345 -178.084 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 21' ' ' ASP . . . . . . . . . . . . . 20.9 t70 -115.85 -10.49 11.68 Favored 'General case' 0 C--N 1.315 -0.932 0 CA-C-N 115.716 -0.674 . . . . 0.0 109.604 178.502 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 22' ' ' ASN . . . . . 0.459 ' O ' ' HG ' ' A' ' 26' ' ' LEU . 37.3 t-20 -87.8 121.78 30.64 Favored 'General case' 0 C--N 1.319 -0.758 0 CA-C-N 115.832 -0.622 . . . . 0.0 110.408 -177.057 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 23' ' ' ASP . . . . . . . . . . . . . 28.6 t70 -50.77 -46.67 59.59 Favored 'General case' 0 C--N 1.317 -0.806 0 C-N-CA 124.821 1.248 . . . . 0.0 113.379 -177.726 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 48.6 m-20 -64.66 -36.13 83.26 Favored 'General case' 0 N--CA 1.476 0.839 0 CA-C-O 121.365 0.602 . . . . 0.0 110.485 -177.927 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 25' ' ' LYS . . . . . . . . . . . . . 13.7 mptt -84.65 -12.38 54.05 Favored 'General case' 0 C--N 1.311 -1.078 0 CA-C-N 115.334 -0.848 . . . . 0.0 112.663 -175.946 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 26' ' ' LEU . . . . . 0.459 ' HG ' ' O ' ' A' ' 22' ' ' ASN . 74.7 mt -58.04 -36.08 72.23 Favored 'General case' 0 C--O 1.22 -0.496 0 N-CA-C 112.264 0.468 . . . . 0.0 112.264 -178.206 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 27' ' ' LEU . . . . . . . . . . . . . 26.2 tp -57.09 -50.64 72.15 Favored 'General case' 0 N--CA 1.437 -1.119 0 N-CA-C 109.906 -0.405 . . . . 0.0 109.906 176.899 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 28' ' ' GLU . . . . . 0.518 ' HA ' ' CE1' ' A' ' 31' ' ' TYR . 43.8 tt0 -64.48 -31.6 72.88 Favored 'General case' 0 C--O 1.244 0.781 0 CA-C-N 115.483 -0.781 . . . . 0.0 109.824 -179.742 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 29' ' ' MET . . . . . 0.408 ' HA ' ' CE ' ' A' ' 29' ' ' MET . 0.3 OUTLIER -73.4 -30.68 63.42 Favored 'General case' 0 C--O 1.207 -1.14 0 CA-C-N 115.009 -0.996 . . . . 0.0 109.84 -177.752 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' A' A ' 30' ' ' GLY . . . . . . . . . . . . . . . -65.15 -29.35 75.11 Favored Glycine 0 N--CA 1.444 -0.779 0 O-C-N 123.621 0.576 . . . . 0.0 112.886 -179.262 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 31' ' ' TYR . . . . . 0.518 ' CE1' ' HA ' ' A' ' 28' ' ' GLU 0.266 39.9 p90 -100.09 -37.51 8.93 Favored 'General case' 0 N--CA 1.438 -1.074 0 N-CA-C 113.791 1.034 . . . . 0.0 113.791 178.432 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' A' A ' 32' ' ' TYR . . . . . . . . . . . . . 29.2 m-85 -74.26 -48.56 27.84 Favored 'General case' 0 C--N 1.303 -1.415 0 N-CA-C 113.765 1.024 . . . . 0.0 113.765 177.472 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 33' ' ' CYS . . . . . . . . . . . . . 36.3 m -135.52 66.78 65.4 Favored Pre-proline 0 C--N 1.308 -1.234 0 C-N-CA 120.436 -0.505 . . . . 0.0 110.871 -177.024 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 34' ' ' PRO . . . . . 0.461 ' HD2' ' HA ' ' A' ' 5' ' ' ASP . 46.7 Cg_endo -65.99 -24.77 52.48 Favored 'Trans proline' 0 C--N 1.362 1.285 0 C-N-CA 122.404 2.07 . . . . 0.0 112.135 -176.624 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 35' ' ' VAL . . . . . 0.529 ' HB ' ' OD2' ' A' ' 5' ' ' ASP . 54.7 t -86.59 -46.87 16.45 Favored 'Isoleucine or valine' 0 C--N 1.302 -1.494 0 C-N-CA 120.479 -0.489 . . . . 0.0 110.787 -177.16 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 36' ' ' THR . . . . . . . . . . . . . 30.8 m -56.75 -39.57 74.23 Favored 'General case' 0 CA--C 1.55 0.946 0 CA-C-O 121.343 0.592 . . . . 0.0 111.587 179.986 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 37' ' ' CYS . . . . . . . . . . . . . 94.7 m -88.73 4.35 47.7 Favored 'General case' 0 C--N 1.309 -1.156 0 N-CA-C 113.251 0.834 . . . . 0.0 113.251 179.239 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 38' ' ' GLY . . . . . . . . . . . . . . . 72.12 35.89 60.64 Favored Glycine 0 C--O 1.222 -0.596 0 N-CA-C 115.599 0.999 . . . . 0.0 115.599 174.375 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 39' ' ' PHE . . . . . . . . . . . . . 98.4 m-85 -86.77 -37.59 17.7 Favored 'General case' 0 C--N 1.311 -1.108 0 N-CA-C 107.713 -1.218 . . . . 0.0 107.713 174.361 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 40' ' ' CYS . . . . . . . . . . . . . 69.3 m . . . . . 0 C--N 1.304 -1.407 0 CA-C-N 114.167 -1.378 . . . . 0.0 108.775 179.762 . . . . . . . . 0 0 . 1 . 007 nuclear build core ' A' A ' 4' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.437 -1.106 0 N-CA-C 109.595 -0.52 . . . . 0.0 109.595 . . . . . . . . . 0 0 . 1 . 007 nuclear build core ' A' A ' 5' ' ' ASP . . . . . 0.531 ' HB3' ' SG ' ' A' ' 11' ' ' CYS . 23.7 m-20 -58.83 143.18 48.24 Favored 'General case' 0 C--N 1.314 -0.971 0 O-C-N 124.05 0.843 . . . . 0.0 111.81 178.461 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 10.0 tp10 -70.59 135.67 48.64 Favored 'General case' 0 N--CA 1.443 -0.818 0 C-N-CA 123.495 0.718 . . . . 0.0 110.312 178.004 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 7' ' ' LYS . . . . . . . . . . . . . 9.9 ptpp? -85.71 -20.66 29.01 Favored 'General case' 0 C--N 1.314 -0.977 0 CA-C-O 121.386 0.612 . . . . 0.0 111.041 -178.741 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 8' ' ' ASN . . . . . . . . . . . . . 80.5 m-20 -86.71 16.83 4.38 Favored 'General case' 0 C--N 1.311 -1.07 0 CA-C-O 121.789 0.804 . . . . 0.0 110.157 -179.193 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 9' ' ' PHE . . . . . 0.454 ' HD1' ' SG ' ' A' ' 33' ' ' CYS . 36.8 t80 -144.87 144.09 30.93 Favored 'General case' 0 N--CA 1.418 -2.03 0 N-CA-C 105.633 -1.988 . . . . 0.0 105.633 -178.425 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 10' ' ' ASP . . . . . . . . . . . . . 19.7 t70 -100.51 102.62 13.84 Favored 'General case' 0 C--N 1.313 -0.986 0 C-N-CA 118.941 -1.104 . . . . 0.0 110.603 178.088 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 11' ' ' CYS . . . . . 0.531 ' SG ' ' HB3' ' A' ' 5' ' ' ASP . 60.8 m -66.09 -31.79 72.86 Favored 'General case' 0 C--N 1.294 -1.814 0 CA-C-N 114.083 -1.417 . . . . 0.0 112.776 -175.711 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 12' ' ' ARG . . . . . . . . . . . . . 37.6 mmt180 -66.0 -50.46 64.18 Favored 'General case' 0 CA--C 1.514 -0.416 0 N-CA-C 109.711 -0.477 . . . . 0.0 109.711 179.684 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 38.6 ttm180 -53.51 -56.45 16.9 Favored 'General case' 0 C--N 1.322 -0.622 0 C-N-CA 124.741 1.216 . . . . 0.0 111.775 -178.24 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 14' ' ' SER . . . . . . . . . . . . . 20.1 m -61.22 -35.15 76.44 Favored 'General case' 0 C--O 1.249 1.066 0 CA-C-O 120.948 0.404 . . . . 0.0 111.818 -178.101 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 1.3 tm? -68.65 -41.42 79.37 Favored 'General case' 0 CA--C 1.544 0.72 0 N-CA-C 108.098 -1.075 . . . . 0.0 108.098 179.439 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 16' ' ' ARG . . . . . . . . . . . . . 73.8 mtp180 -64.19 -45.99 85.94 Favored 'General case' 0 N--CA 1.467 0.416 0 CA-C-N 115.546 -0.752 . . . . 0.0 111.702 178.593 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 17' ' ' ASN . . . . . . . . . . . . . 73.3 m-20 -61.09 -33.63 73.66 Favored 'General case' 0 N--CA 1.485 1.305 0 CA-C-O 121.652 0.739 . . . . 0.0 110.942 -178.734 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . 103.29 19.07 13.03 Favored Glycine 0 N--CA 1.429 -1.824 0 N-CA-C 110.027 -1.229 . . . . 0.0 110.027 -178.06 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 19' ' ' ASP . . . . . . . . . . . . . 52.6 m-20 -70.04 -28.59 65.59 Favored 'General case' 0 C--O 1.213 -0.827 0 CA-C-O 120.85 0.357 . . . . 0.0 110.549 -178.403 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 20' ' ' CYS . . . . . 0.423 ' HA ' ' HG3' ' A' ' 29' ' ' MET . 23.8 t -84.26 -5.28 59.24 Favored 'General case' 0 C--N 1.317 -0.835 0 CA-C-O 121.578 0.704 . . . . 0.0 109.697 -179.173 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 21' ' ' ASP . . . . . . . . . . . . . 29.7 t70 -98.55 -11.24 22.39 Favored 'General case' 0 C--N 1.314 -0.964 0 N-CA-C 108.686 -0.857 . . . . 0.0 108.686 175.016 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 22' ' ' ASN . . . . . . . . . . . . . 35.5 t30 -88.54 123.64 33.24 Favored 'General case' 0 C--N 1.316 -0.856 0 CA-C-N 115.241 -0.89 . . . . 0.0 110.042 179.242 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 23' ' ' ASP . . . . . 0.467 ' HA ' ' HG ' ' A' ' 26' ' ' LEU . 21.7 t70 -58.68 -36.72 74.66 Favored 'General case' 0 C--N 1.323 -0.581 0 C-N-CA 122.969 0.507 . . . . 0.0 111.957 -178.163 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 27.2 t70 -62.97 -24.81 68.07 Favored 'General case' 0 N--CA 1.475 0.799 0 CA-C-N 115.969 -0.559 . . . . 0.0 111.732 179.5 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 25' ' ' LYS . . . . . . . . . . . . . 69.3 mmtt -111.96 10.24 20.54 Favored 'General case' 0 N--CA 1.442 -0.852 0 N-CA-C 113.101 0.778 . . . . 0.0 113.101 -177.807 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 26' ' ' LEU . . . . . 0.467 ' HG ' ' HA ' ' A' ' 23' ' ' ASP . 65.9 mt -62.76 -46.56 87.49 Favored 'General case' 0 C--N 1.314 -0.941 0 N-CA-C 112.886 0.698 . . . . 0.0 112.886 -179.929 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 27' ' ' LEU . . . . . 0.407 HD22 ' H ' ' A' ' 27' ' ' LEU . 2.7 mm? -65.13 -42.69 93.64 Favored 'General case' 0 CA--C 1.48 -1.714 0 N-CA-C 108.508 -0.923 . . . . 0.0 108.508 -179.237 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 28' ' ' GLU . . . . . 0.527 ' HA ' ' CE1' ' A' ' 31' ' ' TYR . 38.6 tt0 -58.45 -36.97 74.49 Favored 'General case' 0 N--CA 1.442 -0.848 0 O-C-N 124.346 1.029 . . . . 0.0 109.932 -179.492 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 29' ' ' MET . . . . . 0.423 ' HG3' ' HA ' ' A' ' 20' ' ' CYS . 78.2 mmm -80.33 -27.6 38.33 Favored 'General case' 0 N--CA 1.429 -1.512 0 CA-C-N 115.936 -0.575 . . . . 0.0 111.216 -178.204 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 30' ' ' GLY . . . . . . . . . . . . . . . -75.33 -44.64 21.62 Favored Glycine 0 N--CA 1.43 -1.708 0 CA-C-N 115.526 -0.761 . . . . 0.0 111.673 178.065 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 31' ' ' TYR . . . . . 0.527 ' CE1' ' HA ' ' A' ' 28' ' ' GLU 0.265 12.9 p90 -77.58 -32.33 53.62 Favored 'General case' 0 N--CA 1.436 -1.153 0 C-N-CA 119.592 -0.843 . . . . 0.0 113.166 -179.346 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' A' A ' 32' ' ' TYR . . . . . . . . . . . . . 22.6 m-85 -79.07 -54.36 6.09 Favored 'General case' 0 C--N 1.301 -1.505 0 N-CA-C 113.223 0.823 . . . . 0.0 113.223 175.409 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 33' ' ' CYS . . . . . 0.454 ' SG ' ' HD1' ' A' ' 9' ' ' PHE . 53.4 m -129.11 71.68 81.99 Favored Pre-proline 0 C--O 1.264 1.839 0 C-N-CA 120.152 -0.619 . . . . 0.0 111.956 -174.45 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 34' ' ' PRO . . . . . 0.485 ' HB2' ' SG ' ' A' ' 40' ' ' CYS . 48.7 Cg_endo -66.52 -25.91 47.58 Favored 'Trans proline' 0 C--N 1.362 1.285 0 C-N-CA 122.69 2.26 . . . . 0.0 112.163 -176.201 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 35' ' ' VAL . . . . . 0.504 ' HB ' ' OD1' ' A' ' 5' ' ' ASP . 22.0 t -87.04 -40.79 14.24 Favored 'Isoleucine or valine' 0 N--CA 1.425 -1.712 0 CA-C-N 116.162 -0.472 . . . . 0.0 110.844 -176.822 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 36' ' ' THR . . . . . . . . . . . . . 58.9 m -58.1 -43.65 87.21 Favored 'General case' 0 C--N 1.321 -0.662 0 C-N-CA 123.3 0.64 . . . . 0.0 112.097 -179.618 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 37' ' ' CYS . . . . . 0.549 ' HB2' ' CE2' ' A' ' 39' ' ' PHE . 88.7 m -87.51 6.76 32.56 Favored 'General case' 0 C--N 1.313 -0.991 0 C-N-CA 119.696 -0.802 . . . . 0.0 112.007 179.433 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 38' ' ' GLY . . . . . . . . . . . . . . . 64.43 45.91 91.92 Favored Glycine 0 N--CA 1.439 -1.158 0 CA-C-N 116.32 -0.4 . . . . 0.0 114.068 177.045 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 39' ' ' PHE . . . . . 0.549 ' CE2' ' HB2' ' A' ' 37' ' ' CYS . 98.2 m-85 -85.68 -49.89 7.62 Favored 'General case' 0 CA--C 1.498 -1.022 0 N-CA-C 107.247 -1.39 . . . . 0.0 107.247 173.805 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 40' ' ' CYS . . . . . 0.485 ' SG ' ' HB2' ' A' ' 34' ' ' PRO . 25.3 p . . . . . 0 N--CA 1.424 -1.744 0 CA-C-N 114.771 -1.104 . . . . 0.0 109.528 177.013 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 4' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.442 -0.832 0 N-CA-C 109.497 -0.557 . . . . 0.0 109.497 . . . . . . . . . 0 0 . 1 . 008 nuclear build core ' A' A ' 5' ' ' ASP . . . . . 0.556 ' HB3' ' SG ' ' A' ' 11' ' ' CYS . 24.0 m-20 -65.49 149.56 49.83 Favored 'General case' 0 C--O 1.248 1.02 0 N-CA-C 108.887 -0.783 . . . . 0.0 108.887 174.683 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 10.8 tp10 -70.03 130.7 42.87 Favored 'General case' 0 C--N 1.301 -1.538 0 N-CA-C 109.409 -0.589 . . . . 0.0 109.409 178.734 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 7' ' ' LYS . . . . . . . . . . . . . 10.8 ptpp? -85.51 -20.02 30.32 Favored 'General case' 0 C--N 1.321 -0.653 0 CA-C-O 121.097 0.475 . . . . 0.0 110.895 -176.845 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 8' ' ' ASN . . . . . . . . . . . . . 89.2 m-20 -84.49 2.64 40.05 Favored 'General case' 0 C--N 1.316 -0.859 0 CA-C-N 115.465 -0.789 . . . . 0.0 110.053 179.16 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 9' ' ' PHE . . . . . . . . . . . . . 45.4 t80 -127.95 154.25 45.78 Favored 'General case' 0 C--N 1.303 -1.433 0 N-CA-C 107.773 -1.195 . . . . 0.0 107.773 -174.986 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 10' ' ' ASP . . . . . . . . . . . . . 9.3 t70 -104.9 101.26 10.85 Favored 'General case' 0 CA--C 1.493 -1.234 0 C-N-CA 118.624 -1.23 . . . . 0.0 110.647 178.195 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 11' ' ' CYS . . . . . 0.556 ' SG ' ' HB3' ' A' ' 5' ' ' ASP . 92.4 m -72.8 -25.52 61.18 Favored 'General case' 0 C--N 1.286 -2.163 0 CA-C-N 115.34 -0.845 . . . . 0.0 112.615 -178.286 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 12' ' ' ARG . . . . . 0.546 ' O ' ' HG2' ' A' ' 16' ' ' ARG . 28.0 mmm180 -70.07 -53.41 17.58 Favored 'General case' 0 C--N 1.318 -0.803 0 N-CA-C 110.045 -0.354 . . . . 0.0 110.045 -178.406 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 43.9 ttp180 -63.13 -37.49 87.4 Favored 'General case' 0 C--N 1.309 -1.166 0 CA-C-N 115.951 -0.568 . . . . 0.0 110.133 179.464 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 14' ' ' SER . . . . . . . . . . . . . 49.6 m -63.61 -32.79 74.37 Favored 'General case' 0 C--O 1.246 0.905 0 CA-C-O 121.261 0.553 . . . . 0.0 110.977 177.258 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 53.6 tp -70.94 -40.73 71.88 Favored 'General case' 0 N--CA 1.442 -0.845 0 N-CA-C 109.177 -0.675 . . . . 0.0 109.177 177.611 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 16' ' ' ARG . . . . . 0.546 ' HG2' ' O ' ' A' ' 12' ' ' ARG . 31.4 mmm180 -70.04 -33.76 72.38 Favored 'General case' 0 C--N 1.314 -0.971 0 CA-C-N 115.546 -0.752 . . . . 0.0 111.193 -178.942 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 17' ' ' ASN . . . . . . . . . . . . . 89.6 m-20 -71.05 -39.14 72.43 Favored 'General case' 0 CA--C 1.489 -1.376 0 CA-C-O 121.522 0.677 . . . . 0.0 110.428 -179.864 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . 114.02 8.61 17.39 Favored Glycine 0 N--CA 1.426 -1.973 0 CA-C-N 114.833 -1.076 . . . . 0.0 111.016 -177.178 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 19' ' ' ASP . . . . . . . . . . . . . 59.9 m-20 -66.92 -38.13 85.63 Favored 'General case' 0 CA--C 1.502 -0.883 0 CA-C-O 121.235 0.541 . . . . 0.0 109.893 -179.406 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 20' ' ' CYS . . . . . . . . . . . . . 42.7 t -73.32 -13.42 61.11 Favored 'General case' 0 C--N 1.311 -1.068 0 CA-C-N 114.997 -1.001 . . . . 0.0 110.752 -178.945 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 21' ' ' ASP . . . . . . . . . . . . . 27.6 t70 -109.78 -4.48 16.04 Favored 'General case' 0 C--N 1.313 -1.019 0 CA-C-O 121.893 0.854 . . . . 0.0 110.46 179.043 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 22' ' ' ASN . . . . . . . . . . . . . 39.8 t-20 -77.64 116.33 18.11 Favored 'General case' 0 C--N 1.314 -0.946 0 N-CA-C 109.2 -0.667 . . . . 0.0 109.2 -178.363 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 23' ' ' ASP . . . . . 0.411 ' HA ' ' HG ' ' A' ' 26' ' ' LEU . 17.6 m-20 -56.99 -43.82 82.09 Favored 'General case' 0 C--N 1.321 -0.642 0 CA-C-N 115.088 -0.96 . . . . 0.0 112.202 -174.611 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 33.7 t70 -66.33 -31.35 72.09 Favored 'General case' 0 C--N 1.324 -0.529 0 CA-C-O 121.023 0.439 . . . . 0.0 111.085 -178.156 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 25' ' ' LYS . . . . . 0.428 ' O ' ' HG2' ' A' ' 29' ' ' MET . 54.3 mtpt -95.89 -4.45 43.54 Favored 'General case' 0 C--O 1.209 -1.048 0 N-CA-C 112.386 0.513 . . . . 0.0 112.386 -177.555 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 26' ' ' LEU . . . . . 0.411 ' HG ' ' HA ' ' A' ' 23' ' ' ASP . 55.6 mt -48.3 -46.83 36.65 Favored 'General case' 0 N--CA 1.483 1.219 0 N-CA-C 114.705 1.372 . . . . 0.0 114.705 -178.602 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 27' ' ' LEU . . . . . . . . . . . . . 22.3 tp -59.17 -45.31 91.33 Favored 'General case' 0 N--CA 1.446 -0.67 0 CA-C-O 121.286 0.565 . . . . 0.0 110.018 178.954 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 28' ' ' GLU . . . . . 0.625 ' HA ' ' CE1' ' A' ' 31' ' ' TYR . 35.2 tt0 -64.04 -35.47 80.82 Favored 'General case' 0 N--CA 1.444 -0.743 0 CA-C-N 114.791 -1.095 . . . . 0.0 109.55 179.696 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 29' ' ' MET . . . . . 0.428 ' HG2' ' O ' ' A' ' 25' ' ' LYS . 79.6 mmm -78.31 -19.42 53.59 Favored 'General case' 0 C--N 1.302 -1.486 0 CA-C-N 114.803 -1.09 . . . . 0.0 110.205 -177.626 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 30' ' ' GLY . . . . . 0.437 ' HA2' ' CE1' ' A' ' 39' ' ' PHE . . . -71.46 -22.27 78.62 Favored Glycine 0 N--CA 1.436 -1.367 0 CA-C-N 115.01 -0.995 . . . . 0.0 111.996 177.762 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 31' ' ' TYR . . . . . 0.625 ' CE1' ' HA ' ' A' ' 28' ' ' GLU . 27.6 p90 -104.54 -34.67 8.13 Favored 'General case' 0 N--CA 1.436 -1.152 0 C-N-CA 119.609 -0.836 . . . . 0.0 112.383 174.82 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 32' ' ' TYR . . . . . . . . . . . . . 37.4 m-85 -67.34 -47.99 68.85 Favored 'General case' 0 C--N 1.309 -1.186 0 CA-C-N 115.918 -0.583 . . . . 0.0 112.179 174.379 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 33' ' ' CYS . . . . . 0.469 ' HB3' ' HB ' ' A' ' 36' ' ' THR . 35.3 m -140.39 64.7 25.4 Favored Pre-proline 0 C--N 1.306 -1.313 0 C-N-CA 120.355 -0.538 . . . . 0.0 111.667 -177.356 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 34' ' ' PRO . . . . . 0.508 ' HD2' ' HA ' ' A' ' 5' ' ' ASP . 31.1 Cg_endo -63.21 -27.63 72.68 Favored 'Trans proline' 0 C--N 1.366 1.489 0 C-N-CA 122.562 2.174 . . . . 0.0 111.817 -178.92 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 35' ' ' VAL . . . . . 0.431 ' HB ' ' OD2' ' A' ' 5' ' ' ASP . 57.8 t -84.9 -47.25 17.22 Favored 'Isoleucine or valine' 0 N--CA 1.419 -1.977 0 CA-C-N 115.473 -0.785 . . . . 0.0 110.255 -176.178 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 36' ' ' THR . . . . . 0.469 ' HB ' ' HB3' ' A' ' 33' ' ' CYS . 23.8 m -59.9 -42.9 94.85 Favored 'General case' 0 C--N 1.317 -0.843 0 CA-C-N 115.859 -0.61 . . . . 0.0 111.248 179.71 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 37' ' ' CYS . . . . . . . . . . . . . 77.9 m -79.05 -8.13 58.69 Favored 'General case' 0 C--N 1.319 -0.749 0 N-CA-C 112.222 0.453 . . . . 0.0 112.222 179.661 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 38' ' ' GLY . . . . . . . . . . . . . . . 77.49 40.08 24.11 Favored Glycine 0 N--CA 1.445 -0.736 0 N-CA-C 114.985 0.754 . . . . 0.0 114.985 174.54 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 39' ' ' PHE . . . . . 0.437 ' CE1' ' HA2' ' A' ' 30' ' ' GLY . 87.3 m-85 -78.35 -32.14 48.94 Favored 'General case' 0 C--N 1.317 -0.843 0 N-CA-C 108.519 -0.919 . . . . 0.0 108.519 175.245 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 40' ' ' CYS . . . . . . . . . . . . . 1.5 p . . . . . 0 C--N 1.303 -1.451 0 CA-C-N 114.224 -1.353 . . . . 0.0 109.658 -178.592 . . . . . . . . 0 0 . 1 . 009 nuclear build core ' A' A ' 4' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.432 -1.357 0 N-CA-C 109.72 -0.474 . . . . 0.0 109.72 . . . . . . . . . 0 0 . 1 . 009 nuclear build core ' A' A ' 5' ' ' ASP . . . . . 0.678 ' HB3' ' SG ' ' A' ' 11' ' ' CYS . 43.9 m-20 -64.32 141.44 58.77 Favored 'General case' 0 C--O 1.25 1.106 0 N-CA-C 108.761 -0.829 . . . . 0.0 108.761 175.777 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -70.44 150.0 46.66 Favored 'General case' 0 C--N 1.307 -1.269 0 CA-C-O 121.497 0.665 . . . . 0.0 110.796 -176.992 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 7' ' ' LYS . . . . . . . . . . . . . 9.2 ptpp? -85.51 -25.36 26.87 Favored 'General case' 0 C--N 1.307 -1.244 0 CA-C-N 115.133 -0.94 . . . . 0.0 111.997 -177.222 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 8' ' ' ASN . . . . . . . . . . . . . 42.5 m-80 -95.12 1.99 55.02 Favored 'General case' 0 C--N 1.31 -1.143 0 CA-C-N 115.849 -0.614 . . . . 0.0 110.592 -178.101 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 9' ' ' PHE . . . . . 0.416 ' CD2' ' HB3' ' A' ' 32' ' ' TYR . 34.1 t80 -121.75 137.32 54.81 Favored 'General case' 0 C--N 1.291 -1.966 0 N-CA-C 107.099 -1.445 . . . . 0.0 107.099 -178.731 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 10' ' ' ASP . . . . . . . . . . . . . 8.8 t70 -94.24 103.09 15.12 Favored 'General case' 0 C--N 1.309 -1.177 0 C-N-CA 119.678 -0.809 . . . . 0.0 109.914 -177.884 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 11' ' ' CYS . . . . . 0.678 ' SG ' ' HB3' ' A' ' 5' ' ' ASP . 73.8 m -75.03 -28.71 60.57 Favored 'General case' 0 C--N 1.293 -1.886 0 CA-C-N 115.312 -0.858 . . . . 0.0 112.985 -175.51 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 12' ' ' ARG . . . . . . . . . . . . . 28.2 mmt180 -73.86 -44.44 55.49 Favored 'General case' 0 C--N 1.317 -0.822 0 N-CA-C 109.069 -0.715 . . . . 0.0 109.069 -178.186 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 38.3 ttm180 -60.89 -46.83 89.07 Favored 'General case' 0 C--N 1.318 -0.761 0 CA-C-N 115.238 -0.892 . . . . 0.0 109.874 178.242 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 14' ' ' SER . . . . . . . . . . . . . 44.7 m -61.37 -34.6 75.59 Favored 'General case' 0 C--N 1.319 -0.752 0 CA-C-N 115.746 -0.661 . . . . 0.0 111.48 179.953 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 50.2 tp -72.72 -44.38 61.78 Favored 'General case' 0 C--N 1.312 -1.059 0 C-N-CA 120.688 -0.405 . . . . 0.0 110.968 179.611 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 16' ' ' ARG . . . . . . . . . . . . . 21.9 mtm180 -70.17 -35.56 74.07 Favored 'General case' 0 C--N 1.314 -0.953 0 CA-C-N 116.006 -0.543 . . . . 0.0 112.449 -177.848 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 17' ' ' ASN . . . . . . . . . . . . . 35.5 m-80 -77.1 -26.04 52.91 Favored 'General case' 0 CA--C 1.498 -1.038 0 CA-C-O 121.056 0.455 . . . . 0.0 111.612 178.68 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . 104.56 7.03 40.34 Favored Glycine 0 N--CA 1.433 -1.56 0 C-N-CA 119.685 -1.245 . . . . 0.0 112.469 178.448 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 19' ' ' ASP . . . . . 0.402 ' O ' ' HB2' ' A' ' 25' ' ' LYS . 6.0 m-20 -64.65 -35.97 82.74 Favored 'General case' 0 CA--C 1.499 -1.0 0 N-CA-C 108.779 -0.823 . . . . 0.0 108.779 178.15 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 20' ' ' CYS . . . . . 0.461 ' HA ' ' HG3' ' A' ' 29' ' ' MET . 39.3 t -57.04 -31.16 64.88 Favored 'General case' 0 C--N 1.315 -0.897 0 CA-C-N 114.667 -1.152 . . . . 0.0 111.606 178.904 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 21' ' ' ASP . . . . . . . . . . . . . 17.8 t70 -106.37 -9.3 16.81 Favored 'General case' 0 C--N 1.316 -0.889 0 CA-C-N 115.812 -0.631 . . . . 0.0 111.388 -176.49 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 22' ' ' ASN . . . . . . . . . . . . . 54.7 t30 -77.17 131.35 38.23 Favored 'General case' 0 C--N 1.311 -1.067 0 O-C-N 122.237 -0.289 . . . . 0.0 110.989 -174.535 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 23' ' ' ASP . . . . . . . . . . . . . 26.7 t70 -51.76 -48.14 63.82 Favored 'General case' 0 N--CA 1.473 0.705 0 C-N-CA 123.958 0.903 . . . . 0.0 113.065 -174.233 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 32.4 t70 -61.79 -22.76 65.72 Favored 'General case' 0 N--CA 1.48 1.046 0 N-CA-C 112.304 0.483 . . . . 0.0 112.304 -179.823 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 25' ' ' LYS . . . . . 0.54 ' O ' ' HG2' ' A' ' 29' ' ' MET . 69.8 mmtt -101.58 -16.27 16.81 Favored 'General case' 0 C--N 1.305 -1.369 0 C-N-CA 120.475 -0.49 . . . . 0.0 111.614 -174.174 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 26' ' ' LEU . . . . . . . . . . . . . 83.3 mt -48.18 -50.32 29.44 Favored 'General case' 0 N--CA 1.475 0.785 0 N-CA-C 115.699 1.74 . . . . 0.0 115.699 -172.395 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 27' ' ' LEU . . . . . . . . . . . . . 1.6 tm? -60.51 -43.5 97.01 Favored 'General case' 0 N--CA 1.448 -0.574 0 N-CA-C 109.026 -0.731 . . . . 0.0 109.026 -178.239 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 28' ' ' GLU . . . . . 0.452 ' HA ' ' CZ ' ' A' ' 31' ' ' TYR . 1.2 mp0 -65.05 -34.88 79.48 Favored 'General case' 0 CA--C 1.503 -0.864 0 CA-C-N 114.926 -1.034 . . . . 0.0 110.442 178.988 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 29' ' ' MET . . . . . 0.54 ' HG2' ' O ' ' A' ' 25' ' ' LYS . 70.9 mmm -70.5 -25.64 63.23 Favored 'General case' 0 C--N 1.316 -0.888 0 CA-C-N 116.107 -0.497 . . . . 0.0 110.552 -177.269 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 30' ' ' GLY . . . . . . . . . . . . . . . -68.3 -25.98 74.41 Favored Glycine 0 N--CA 1.448 -0.538 0 CA-C-N 115.586 -0.734 . . . . 0.0 112.36 -179.851 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 31' ' ' TYR . . . . . 0.452 ' CZ ' ' HA ' ' A' ' 28' ' ' GLU . 25.9 p90 -109.48 -33.79 6.7 Favored 'General case' 0 N--CA 1.441 -0.885 0 N-CA-C 113.354 0.872 . . . . 0.0 113.354 177.655 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 32' ' ' TYR . . . . . 0.416 ' HB3' ' CD2' ' A' ' 9' ' ' PHE . 21.3 m-85 -69.74 -48.04 60.86 Favored 'General case' 0 C--N 1.304 -1.382 0 N-CA-C 112.317 0.488 . . . . 0.0 112.317 176.679 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 33' ' ' CYS . . . . . . . . . . . . . 34.8 m -136.57 69.73 60.06 Favored Pre-proline 0 C--N 1.306 -1.305 0 C-N-CA 119.436 -0.905 . . . . 0.0 111.35 -177.55 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 34' ' ' PRO . . . . . 0.462 ' HD2' ' HA ' ' A' ' 5' ' ' ASP . 56.2 Cg_endo -69.96 -23.5 29.83 Favored 'Trans proline' 0 N--CA 1.448 -1.18 0 C-N-CA 121.977 1.785 . . . . 0.0 111.487 -178.416 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 35' ' ' VAL . . . . . 0.403 ' HB ' ' OD2' ' A' ' 5' ' ' ASP . 41.7 t -87.49 -52.45 11.5 Favored 'Isoleucine or valine' 0 C--N 1.296 -1.758 0 CA-C-N 115.696 -0.684 . . . . 0.0 111.015 -177.966 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 36' ' ' THR . . . . . . . . . . . . . 58.4 m -61.95 -35.38 78.28 Favored 'General case' 0 CA--C 1.55 0.973 0 N-CA-C 112.224 0.453 . . . . 0.0 112.224 -178.203 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 37' ' ' CYS . . . . . . . . . . . . . 92.5 m -90.94 2.99 55.81 Favored 'General case' 0 C--N 1.308 -1.196 0 N-CA-C 113.337 0.866 . . . . 0.0 113.337 179.603 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 38' ' ' GLY . . . . . . . . . . . . . . . 72.25 46.49 34.21 Favored Glycine 0 CA--C 1.525 0.701 0 N-CA-C 115.062 0.785 . . . . 0.0 115.062 175.259 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 39' ' ' PHE . . . . . 0.442 ' CD1' ' HA ' ' A' ' 34' ' ' PRO . 96.4 m-85 -95.09 -43.08 8.28 Favored 'General case' 0 C--N 1.306 -1.313 0 N-CA-C 107.864 -1.162 . . . . 0.0 107.864 173.756 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 40' ' ' CYS . . . . . . . . . . . . . 49.5 t . . . . . 0 N--CA 1.429 -1.505 0 CA-C-N 114.449 -1.25 . . . . 0.0 108.33 -178.613 . . . . . . . . 0 0 . 1 . 010 nuclear build core ' A' A ' 4' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.433 -1.297 0 CA-C-O 120.481 0.181 . . . . 0.0 110.627 . . . . . . . . . 0 0 . 1 . 010 nuclear build core ' A' A ' 5' ' ' ASP . . . . . 0.413 ' HA ' ' HA ' ' A' ' 33' ' ' CYS . 69.6 m-20 -60.83 147.27 43.34 Favored 'General case' 0 C--N 1.315 -0.916 0 O-C-N 124.009 0.818 . . . . 0.0 110.623 176.773 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 10.7 tp10 -69.02 133.21 47.83 Favored 'General case' 0 C--N 1.308 -1.235 0 CA-C-N 115.922 -0.581 . . . . 0.0 110.058 178.92 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 7' ' ' LYS . . . . . . . . . . . . . 8.8 ptpp? -81.62 -23.55 36.94 Favored 'General case' 0 CA--C 1.512 -0.515 0 CA-C-O 121.298 0.571 . . . . 0.0 110.979 -178.04 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 8' ' ' ASN . . . . . . . . . . . . . 12.7 m120 -86.55 16.8 4.29 Favored 'General case' 0 C--N 1.308 -1.196 0 CA-C-N 115.004 -0.998 . . . . 0.0 110.317 178.594 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 9' ' ' PHE . . . . . . . . . . . . . 0.3 OUTLIER -139.6 138.22 36.0 Favored 'General case' 0 N--CA 1.422 -1.865 0 N-CA-C 105.819 -1.919 . . . . 0.0 105.819 -176.927 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 10' ' ' ASP . . . . . . . . . . . . . 12.3 t70 -104.75 88.71 2.98 Favored 'General case' 0 C--N 1.303 -1.451 0 N-CA-C 108.274 -1.009 . . . . 0.0 108.274 174.518 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 11' ' ' CYS . . . . . . . . . . . . . 95.4 m -79.63 -6.17 56.55 Favored 'General case' 0 C--N 1.301 -1.502 0 N-CA-C 112.732 0.641 . . . . 0.0 112.732 -177.316 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 12' ' ' ARG . . . . . 0.466 ' O ' ' HG2' ' A' ' 16' ' ' ARG . 6.4 mmp_? -65.54 -51.11 62.28 Favored 'General case' 0 N--CA 1.444 -0.753 0 N-CA-C 107.198 -1.408 . . . . 0.0 107.198 173.034 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 58.3 ttp180 -62.0 -44.7 96.18 Favored 'General case' 0 CA--C 1.519 -0.223 0 CA-C-N 115.592 -0.731 . . . . 0.0 110.352 177.135 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 14' ' ' SER . . . . . . . . . . . . . 14.9 m -58.95 -31.73 68.97 Favored 'General case' 0 CA--C 1.543 0.704 0 CA-C-O 120.849 0.357 . . . . 0.0 111.159 178.789 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 15' ' ' LEU . . . . . 0.414 ' HA ' ' HB3' ' A' ' 20' ' ' CYS . 38.8 tp -80.12 -40.14 28.07 Favored 'General case' 0 C--N 1.318 -0.772 0 N-CA-C 110.418 -0.216 . . . . 0.0 110.418 178.921 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 16' ' ' ARG . . . . . 0.466 ' HG2' ' O ' ' A' ' 12' ' ' ARG . 38.8 mmt180 -61.95 -37.9 86.47 Favored 'General case' 0 C--O 1.22 -0.467 0 CA-C-N 115.929 -0.578 . . . . 0.0 110.342 177.121 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 17' ' ' ASN . . . . . . . . . . . . . 4.7 m-20 -77.78 -49.97 13.29 Favored 'General case' 0 C--N 1.316 -0.86 0 CA-C-N 115.665 -0.698 . . . . 0.0 111.562 179.884 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . 129.79 -2.05 5.98 Favored Glycine 0 N--CA 1.446 -0.65 0 C-N-CA 120.03 -1.081 . . . . 0.0 112.751 -179.312 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 19' ' ' ASP . . . . . . . . . . . . . 6.2 m-20 -63.11 -37.86 88.87 Favored 'General case' 0 N--CA 1.477 0.897 0 CA-C-O 121.557 0.694 . . . . 0.0 110.237 -179.956 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 20' ' ' CYS . . . . . 0.414 ' HB3' ' HA ' ' A' ' 15' ' ' LEU . 43.8 t -71.3 -9.07 57.53 Favored 'General case' 0 C--N 1.311 -1.071 0 CA-C-N 114.789 -1.096 . . . . 0.0 111.526 -178.699 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 21' ' ' ASP . . . . . . . . . . . . . 32.6 t70 -116.58 -7.67 11.58 Favored 'General case' 0 C--N 1.32 -0.702 0 CA-C-O 121.478 0.656 . . . . 0.0 110.432 -179.768 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 22' ' ' ASN . . . . . . . . . . . . . 33.6 t30 -74.9 118.93 18.41 Favored 'General case' 0 C--N 1.308 -1.201 0 CA-C-N 115.801 -0.636 . . . . 0.0 110.722 -176.563 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 23' ' ' ASP . . . . . . . . . . . . . 11.4 m-20 -52.25 -40.06 61.17 Favored 'General case' 0 N--CA 1.479 0.978 0 C-N-CA 124.396 1.078 . . . . 0.0 111.836 -176.225 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 33.8 t70 -59.29 -38.75 80.95 Favored 'General case' 0 C--N 1.321 -0.652 0 CA-C-N 116.0 -0.546 . . . . 0.0 112.002 -178.692 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 25' ' ' LYS . . . . . 0.465 ' O ' ' HG2' ' A' ' 29' ' ' MET . 72.1 mmtt -100.47 2.11 41.8 Favored 'General case' 0 C--N 1.308 -1.214 0 N-CA-C 112.827 0.677 . . . . 0.0 112.827 -175.659 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 26' ' ' LEU . . . . . 0.401 HD23 ' HA ' ' A' ' 26' ' ' LEU . 55.9 mt -58.3 -35.49 71.92 Favored 'General case' 0 C--O 1.219 -0.525 0 N-CA-C 113.741 1.015 . . . . 0.0 113.741 -176.877 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 27' ' ' LEU . . . . . . . . . . . . . 1.5 tm? -55.31 -51.09 67.82 Favored 'General case' 0 N--CA 1.439 -0.982 0 N-CA-C 108.933 -0.765 . . . . 0.0 108.933 178.748 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 28' ' ' GLU . . . . . 0.548 ' HA ' ' CE2' ' A' ' 31' ' ' TYR . 43.9 mt-10 -64.87 -34.46 78.44 Favored 'General case' 0 CA--C 1.505 -0.752 0 CA-C-N 115.515 -0.766 . . . . 0.0 110.385 -179.704 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 29' ' ' MET . . . . . 0.465 ' HG2' ' O ' ' A' ' 25' ' ' LYS . 72.2 mmm -76.02 -21.82 56.44 Favored 'General case' 0 C--N 1.311 -1.07 0 CA-C-N 115.565 -0.743 . . . . 0.0 111.541 -174.653 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 30' ' ' GLY . . . . . . . . . . . . . . . -68.53 -37.69 85.6 Favored Glycine 0 CA--C 1.5 -0.862 0 C-N-CA 121.008 -0.615 . . . . 0.0 111.728 -179.892 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 31' ' ' TYR . . . . . 0.548 ' CE2' ' HA ' ' A' ' 28' ' ' GLU . 40.2 p90 -91.25 -36.84 13.67 Favored 'General case' 0 N--CA 1.433 -1.304 0 C-N-CA 119.77 -0.772 . . . . 0.0 112.005 177.775 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 32' ' ' TYR . . . . . . . . . . . . . 22.5 m-85 -65.72 -57.77 7.26 Favored 'General case' 0 C--N 1.316 -0.89 0 N-CA-C 113.259 0.837 . . . . 0.0 113.259 177.42 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 33' ' ' CYS . . . . . 0.413 ' HA ' ' HA ' ' A' ' 5' ' ' ASP . 98.5 m -135.05 80.62 47.48 Favored Pre-proline 0 C--N 1.305 -1.362 0 CA-C-O 121.376 0.608 . . . . 0.0 112.429 -177.694 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 34' ' ' PRO . . . . . 0.474 ' HA ' ' CD1' ' A' ' 39' ' ' PHE . 73.5 Cg_endo -72.59 -20.38 23.45 Favored 'Trans proline' 0 N--CA 1.45 -1.083 0 C-N-CA 122.576 2.184 . . . . 0.0 111.616 -178.404 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 35' ' ' VAL . . . . . . . . . . . . . 21.7 t -86.34 -55.93 5.99 Favored 'Isoleucine or valine' 0 C--N 1.295 -1.794 0 C-N-CA 120.431 -0.508 . . . . 0.0 110.178 -177.852 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 36' ' ' THR . . . . . 0.404 HG22 ' SG ' ' A' ' 20' ' ' CYS . 55.4 m -59.98 -40.12 88.04 Favored 'General case' 0 C--N 1.318 -0.79 0 N-CA-C 112.706 0.632 . . . . 0.0 112.706 -179.201 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 37' ' ' CYS . . . . . 0.411 ' SG ' ' HB3' ' A' ' 29' ' ' MET . 71.9 m -86.1 11.2 12.29 Favored 'General case' 0 C--N 1.307 -1.274 0 N-CA-C 113.212 0.819 . . . . 0.0 113.212 -177.429 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 38' ' ' GLY . . . . . . . . . . . . . . . 73.81 40.18 45.62 Favored Glycine 0 C--N 1.33 0.21 0 N-CA-C 115.332 0.893 . . . . 0.0 115.332 172.102 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 39' ' ' PHE . . . . . 0.474 ' CD1' ' HA ' ' A' ' 34' ' ' PRO . 95.5 m-85 -96.43 -37.9 10.25 Favored 'General case' 0 C--N 1.299 -1.62 0 N-CA-C 108.294 -1.002 . . . . 0.0 108.294 174.36 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 40' ' ' CYS . . . . . 0.425 ' SG ' ' HB2' ' A' ' 34' ' ' PRO . 6.5 p . . . . . 0 C--N 1.314 -0.972 0 CA-C-N 114.93 -1.032 . . . . 0.0 109.855 178.352 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 4' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.43 -1.435 0 N-CA-C 109.627 -0.508 . . . . 0.0 109.627 . . . . . . . . . 0 0 . 1 . 011 nuclear build core ' A' A ' 5' ' ' ASP . . . . . 0.563 ' HB3' ' SG ' ' A' ' 11' ' ' CYS . 14.6 m-20 -63.23 145.43 55.53 Favored 'General case' 0 C--N 1.308 -1.207 0 O-C-N 123.9 0.75 . . . . 0.0 110.654 179.8 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 6' ' ' GLU . . . . . 0.41 ' OE2' ' HB2' ' A' ' 8' ' ' ASN . 0.3 OUTLIER -70.21 124.18 23.48 Favored 'General case' 0 C--N 1.306 -1.283 0 N-CA-C 105.495 -2.039 . . . . 0.0 105.495 176.239 . . . . . . . . 3 3 . 1 . 011 nuclear build core ' A' A ' 7' ' ' LYS . . . . . 0.5 ' HD2' ' H ' ' A' ' 7' ' ' LYS . 0.0 OUTLIER -79.19 -21.37 46.47 Favored 'General case' 0 C--N 1.321 -0.639 0 N-CA-C 113.597 0.962 . . . . 0.0 113.597 -170.687 . . . . . . . . 3 3 . 1 . 011 nuclear build core ' A' A ' 8' ' ' ASN . . . . . 0.41 ' HB2' ' OE2' ' A' ' 6' ' ' GLU . 32.7 m-80 -81.7 -23.03 37.05 Favored 'General case' 0 C--N 1.304 -1.407 0 N-CA-C 108.873 -0.788 . . . . 0.0 108.873 -178.964 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 9' ' ' PHE . . . . . . . . . . . . . 28.7 t80 -81.67 142.32 32.82 Favored 'General case' 0 N--CA 1.428 -1.54 0 CA-C-N 114.593 -1.185 . . . . 0.0 108.362 178.524 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 10' ' ' ASP . . . . . . . . . . . . . 8.9 t70 -92.18 97.14 10.72 Favored 'General case' 0 C--N 1.305 -1.346 0 C-N-CA 118.856 -1.137 . . . . 0.0 109.018 178.759 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 11' ' ' CYS . . . . . 0.563 ' SG ' ' HB3' ' A' ' 5' ' ' ASP . 72.8 m -73.83 -23.06 59.59 Favored 'General case' 0 C--N 1.297 -1.682 0 CA-C-N 115.231 -0.895 . . . . 0.0 111.546 -177.23 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 12' ' ' ARG . . . . . . . . . . . . . 19.9 mmm180 -74.19 -44.56 52.9 Favored 'General case' 0 C--N 1.325 -0.473 0 N-CA-C 109.354 -0.61 . . . . 0.0 109.354 -177.235 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 58.2 ttp180 -56.32 -49.12 75.24 Favored 'General case' 0 C--N 1.321 -0.66 0 C-N-CA 124.253 1.021 . . . . 0.0 108.597 176.083 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 14' ' ' SER . . . . . . . . . . . . . 20.7 m -60.38 -32.73 71.58 Favored 'General case' 0 C--N 1.313 -1.008 0 CA-C-N 114.794 -1.093 . . . . 0.0 111.911 -179.35 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 15' ' ' LEU . . . . . 0.483 ' HA ' ' HB3' ' A' ' 20' ' ' CYS . 29.9 tp -78.08 -39.32 41.93 Favored 'General case' 0 C--N 1.309 -1.174 0 O-C-N 121.973 -0.455 . . . . 0.0 110.559 179.765 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 16' ' ' ARG . . . . . . . . . . . . . 66.6 mtt180 -70.04 -35.93 74.66 Favored 'General case' 0 C--N 1.316 -0.873 0 CA-C-N 115.874 -0.603 . . . . 0.0 111.88 179.663 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 17' ' ' ASN . . . . . . . . . . . . . 95.0 m-20 -70.86 -44.13 67.03 Favored 'General case' 0 CA--C 1.495 -1.136 0 CA-C-O 121.662 0.744 . . . . 0.0 109.533 178.688 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . 118.82 2.65 14.25 Favored Glycine 0 N--CA 1.424 -2.13 0 CA-C-N 114.556 -1.202 . . . . 0.0 110.948 -177.144 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 19' ' ' ASP . . . . . . . . . . . . . 28.0 m-20 -60.16 -41.65 93.27 Favored 'General case' 0 N--CA 1.484 1.256 0 CA-C-O 122.354 1.073 . . . . 0.0 108.518 -179.893 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 20' ' ' CYS . . . . . 0.483 ' HB3' ' HA ' ' A' ' 15' ' ' LEU . 43.2 t -79.6 -3.18 45.9 Favored 'General case' 0 C--N 1.302 -1.46 0 CA-C-N 113.689 -1.596 . . . . 0.0 111.056 -176.548 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 21' ' ' ASP . . . . . . . . . . . . . 32.1 t70 -121.93 -9.75 8.73 Favored 'General case' 0 C--N 1.312 -1.06 0 CA-C-O 121.445 0.641 . . . . 0.0 110.626 -176.275 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 22' ' ' ASN . . . . . 0.437 ' O ' ' HG ' ' A' ' 26' ' ' LEU . 55.0 t-20 -87.26 125.04 33.96 Favored 'General case' 0 C--N 1.31 -1.13 0 N-CA-C 108.909 -0.775 . . . . 0.0 108.909 -177.542 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 23' ' ' ASP . . . . . . . . . . . . . 28.8 t70 -55.22 -36.77 66.33 Favored 'General case' 0 C--N 1.318 -0.767 0 C-N-CA 124.165 0.986 . . . . 0.0 111.782 -179.658 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 31.6 t70 -68.45 -29.51 68.17 Favored 'General case' 0 C--N 1.316 -0.877 0 CA-C-N 115.951 -0.568 . . . . 0.0 111.516 -178.368 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 25' ' ' LYS . . . . . . . . . . . . . 13.2 mptt -100.02 1.55 42.57 Favored 'General case' 0 C--N 1.316 -0.89 0 CA-C-N 116.079 -0.509 . . . . 0.0 112.336 -178.018 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 26' ' ' LEU . . . . . 0.437 ' HG ' ' O ' ' A' ' 22' ' ' ASN . 59.3 mt -62.89 -38.36 90.62 Favored 'General case' 0 C--O 1.214 -0.787 0 N-CA-C 114.737 1.384 . . . . 0.0 114.737 -175.262 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 27' ' ' LEU . . . . . . . . . . . . . 2.0 tm? -59.95 -47.24 86.62 Favored 'General case' 0 N--CA 1.441 -0.921 0 N-CA-C 108.607 -0.886 . . . . 0.0 108.607 -179.285 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 28' ' ' GLU . . . . . 0.58 ' HA ' ' CZ ' ' A' ' 31' ' ' TYR . 34.0 tt0 -64.81 -35.63 81.71 Favored 'General case' 0 C--N 1.311 -1.105 0 CA-C-N 115.401 -0.818 . . . . 0.0 110.139 179.708 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 29' ' ' MET . . . . . 0.511 ' HB3' ' SG ' ' A' ' 37' ' ' CYS . 76.1 mmm -82.64 -12.17 57.84 Favored 'General case' 0 C--N 1.3 -1.563 0 CA-C-N 115.477 -0.783 . . . . 0.0 111.897 -175.03 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 30' ' ' GLY . . . . . . . . . . . . . . . -75.35 -36.96 43.09 Favored Glycine 0 C--N 1.307 -1.037 0 N-CA-C 111.113 -0.795 . . . . 0.0 111.113 177.77 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 31' ' ' TYR . . . . . 0.58 ' CZ ' ' HA ' ' A' ' 28' ' ' GLU . 24.8 p90 -84.78 -27.98 26.5 Favored 'General case' 0 N--CA 1.441 -0.914 0 C-N-CA 119.681 -0.808 . . . . 0.0 112.24 176.408 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 32' ' ' TYR . . . . . . . . . . . . . 30.6 m-85 -77.43 -61.38 2.01 Favored 'General case' 0 C--N 1.295 -1.799 0 N-CA-C 113.737 1.014 . . . . 0.0 113.737 174.961 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 33' ' ' CYS . . . . . . . . . . . . . 31.4 m -132.58 72.86 77.38 Favored Pre-proline 0 C--N 1.303 -1.441 0 C-N-CA 119.734 -0.786 . . . . 0.0 111.466 -175.308 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 34' ' ' PRO . . . . . 0.534 ' HD2' ' HA ' ' A' ' 5' ' ' ASP . 34.6 Cg_endo -62.48 -26.86 76.58 Favored 'Trans proline' 0 C--N 1.363 1.304 0 C-N-CA 122.703 2.269 . . . . 0.0 112.323 -178.549 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 35' ' ' VAL . . . . . . . . . . . . . 38.5 t -85.92 -49.68 15.06 Favored 'Isoleucine or valine' 0 C--N 1.296 -1.754 0 C-N-CA 120.133 -0.627 . . . . 0.0 110.472 -177.45 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 36' ' ' THR . . . . . . . . . . . . . 20.9 m -58.94 -38.51 79.16 Favored 'General case' 0 C--N 1.32 -0.685 0 C-N-CA 123.072 0.549 . . . . 0.0 111.279 -178.917 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 37' ' ' CYS . . . . . 0.511 ' SG ' ' HB3' ' A' ' 29' ' ' MET . 64.6 m -87.91 10.8 17.52 Favored 'General case' 0 C--N 1.312 -1.061 0 CA-C-N 115.9 -0.591 . . . . 0.0 112.246 -178.488 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 38' ' ' GLY . . . . . . . . . . . . . . . 74.73 19.84 79.74 Favored Glycine 0 CA--C 1.522 0.489 0 N-CA-C 116.197 1.239 . . . . 0.0 116.197 172.145 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 39' ' ' PHE . . . . . . . . . . . . . 97.3 m-85 -79.15 -43.01 24.85 Favored 'General case' 0 C--N 1.317 -0.828 0 CA-C-N 118.153 0.976 . . . . 0.0 108.419 176.908 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 40' ' ' CYS . . . . . . . . . . . . . 61.1 m . . . . . 0 C--N 1.303 -1.424 0 CA-C-N 114.728 -1.124 . . . . 0.0 108.618 178.44 . . . . . . . . 0 0 . 1 . 012 nuclear build core ' A' A ' 4' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.435 -1.192 0 N-CA-C 108.701 -0.852 . . . . 0.0 108.701 . . . . . . . . . 0 0 . 1 . 012 nuclear build core ' A' A ' 5' ' ' ASP . . . . . 0.477 ' HB3' ' SG ' ' A' ' 11' ' ' CYS . 24.5 m-20 -56.95 148.83 20.15 Favored 'General case' 0 C--O 1.25 1.129 0 O-C-N 124.095 0.872 . . . . 0.0 110.056 179.907 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 6' ' ' GLU . . . . . 0.468 ' OE1' ' HG2' ' A' ' 7' ' ' LYS . 9.4 tp10 -72.54 145.68 47.28 Favored 'General case' 0 N--CA 1.423 -1.818 0 CA-C-O 121.387 0.613 . . . . 0.0 111.226 -176.562 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 7' ' ' LYS . . . . . 0.468 ' HG2' ' OE1' ' A' ' 6' ' ' GLU . 8.0 ptpp? -84.27 -25.2 29.55 Favored 'General case' 0 C--N 1.315 -0.925 0 CA-C-N 115.085 -0.961 . . . . 0.0 110.885 -175.609 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 8' ' ' ASN . . . . . 0.441 ' H ' ' HG3' ' A' ' 6' ' ' GLU . 15.0 m120 -87.64 4.89 42.16 Favored 'General case' 0 C--N 1.309 -1.187 0 CA-C-N 115.086 -0.961 . . . . 0.0 110.047 -178.001 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 9' ' ' PHE . . . . . . . . . . . . . 20.6 t80 -129.72 143.83 51.0 Favored 'General case' 0 N--CA 1.417 -2.111 0 N-CA-C 107.354 -1.351 . . . . 0.0 107.354 -176.704 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 10' ' ' ASP . . . . . . . . . . . . . 12.1 t70 -103.04 100.9 10.86 Favored 'General case' 0 C--N 1.303 -1.432 0 N-CA-C 108.447 -0.946 . . . . 0.0 108.447 179.617 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 11' ' ' CYS . . . . . 0.477 ' SG ' ' HB3' ' A' ' 5' ' ' ASP . 74.1 m -72.57 -26.38 61.7 Favored 'General case' 0 C--N 1.284 -2.263 0 N-CA-C 113.375 0.88 . . . . 0.0 113.375 -175.004 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 12' ' ' ARG . . . . . . . . . . . . . 37.1 mmt180 -73.17 -49.05 30.28 Favored 'General case' 0 C--N 1.319 -0.728 0 C-N-CA 120.549 -0.461 . . . . 0.0 110.004 -179.792 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 55.2 ttp180 -61.17 -42.72 99.06 Favored 'General case' 0 C--N 1.324 -0.525 0 CA-C-N 115.993 -0.549 . . . . 0.0 110.69 -179.919 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 14' ' ' SER . . . . . . . . . . . . . 16.8 m -66.3 -40.9 90.31 Favored 'General case' 0 C--N 1.312 -1.038 0 CA-C-O 121.185 0.517 . . . . 0.0 110.51 -178.756 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 61.7 tp -63.69 -44.55 93.35 Favored 'General case' 0 C--O 1.238 0.473 0 CA-C-N 115.946 -0.57 . . . . 0.0 110.717 178.704 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 16' ' ' ARG . . . . . . . . . . . . . 78.1 mtp180 -71.56 -28.59 63.96 Favored 'General case' 0 C--N 1.316 -0.89 0 CA-C-N 115.6 -0.727 . . . . 0.0 112.3 -178.786 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 17' ' ' ASN . . . . . . . . . . . . . 13.1 m-80 -77.82 -33.39 52.4 Favored 'General case' 0 CA--C 1.493 -1.22 0 CA-C-O 120.97 0.414 . . . . 0.0 111.89 177.522 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . 116.4 17.19 6.23 Favored Glycine 0 C--N 1.295 -1.728 0 C-N-CA 119.72 -1.228 . . . . 0.0 112.804 177.612 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 19' ' ' ASP . . . . . . . . . . . . . 4.4 m-20 -63.8 -35.45 80.65 Favored 'General case' 0 CA--C 1.505 -0.753 0 CA-C-O 120.99 0.424 . . . . 0.0 111.929 179.203 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 20' ' ' CYS . . . . . . . . . . . . . 11.1 t -85.63 -2.97 58.72 Favored 'General case' 0 C--N 1.309 -1.178 0 CA-C-O 121.851 0.834 . . . . 0.0 109.389 -176.335 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 21' ' ' ASP . . . . . . . . . . . . . 31.2 t70 -105.83 -9.33 17.25 Favored 'General case' 0 C--N 1.319 -0.755 0 CA-C-O 122.404 1.097 . . . . 0.0 108.717 176.692 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 22' ' ' ASN . . . . . . . . . . . . . 49.4 t-20 -87.45 115.07 24.61 Favored 'General case' 0 C--N 1.304 -1.391 0 CA-C-N 114.505 -1.225 . . . . 0.0 108.427 -176.978 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 23' ' ' ASP . . . . . 0.485 ' HA ' ' HG ' ' A' ' 26' ' ' LEU . 7.7 m-20 -56.91 -37.65 71.73 Favored 'General case' 0 N--CA 1.475 0.776 0 N-CA-C 112.607 0.595 . . . . 0.0 112.607 -178.252 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 29.5 m-20 -69.12 -24.15 64.07 Favored 'General case' 0 C--N 1.321 -0.657 0 CA-C-N 116.375 -0.375 . . . . 0.0 111.465 -179.227 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 25' ' ' LYS . . . . . . . . . . . . . 14.0 mptt -107.17 8.7 30.22 Favored 'General case' 0 C--N 1.313 -1.006 0 N-CA-C 113.044 0.757 . . . . 0.0 113.044 -178.825 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 26' ' ' LEU . . . . . 0.485 ' HG ' ' HA ' ' A' ' 23' ' ' ASP . 73.7 mt -59.09 -48.32 82.05 Favored 'General case' 0 N--CA 1.472 0.646 0 N-CA-C 113.502 0.927 . . . . 0.0 113.502 -177.908 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 27' ' ' LEU . . . . . . . . . . . . . 22.1 tp -59.67 -48.52 81.34 Favored 'General case' 0 N--CA 1.44 -0.971 0 N-CA-C 108.952 -0.759 . . . . 0.0 108.952 178.894 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 28' ' ' GLU . . . . . . . . . . . . . 4.7 tp10 -55.74 -37.89 69.06 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 114.055 -1.429 . . . . 0.0 108.935 -177.679 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 29' ' ' MET . . . . . . . . . . . . . 78.5 mmm -84.47 -28.22 26.95 Favored 'General case' 0 C--N 1.309 -1.167 0 CA-C-N 114.997 -1.001 . . . . 0.0 112.4 -173.834 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 30' ' ' GLY . . . . . . . . . . . . . . . -72.69 -32.44 61.54 Favored Glycine 0 N--CA 1.431 -1.638 0 C-N-CA 120.567 -0.825 . . . . 0.0 112.461 -177.76 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 31' ' ' TYR . . . . . . . . . . . . . 47.2 p90 -90.61 -34.79 15.33 Favored 'General case' 0 CA--C 1.5 -0.948 0 C-N-CA 117.935 -1.506 . . . . 0.0 112.349 177.514 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 32' ' ' TYR . . . . . . . . . . . . . 31.4 m-85 -68.69 -41.92 78.51 Favored 'General case' 0 C--N 1.312 -1.022 0 C-N-CA 120.212 -0.595 . . . . 0.0 112.328 176.326 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 33' ' ' CYS . . . . . . . . . . . . . 54.9 m -132.59 64.75 72.64 Favored Pre-proline 0 C--O 1.259 1.553 0 N-CA-C 112.421 0.526 . . . . 0.0 112.421 -176.346 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 34' ' ' PRO . . . . . 0.426 ' HD2' ' HA ' ' A' ' 5' ' ' ASP . 38.6 Cg_endo -67.1 -29.87 39.28 Favored 'Trans proline' 0 N--CA 1.453 -0.908 0 C-N-CA 122.011 1.807 . . . . 0.0 111.718 -178.674 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 35' ' ' VAL . . . . . . . . . . . . . 47.3 t -87.38 -50.08 14.13 Favored 'Isoleucine or valine' 0 N--CA 1.43 -1.455 0 CA-C-N 115.7 -0.682 . . . . 0.0 111.653 -175.379 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 36' ' ' THR . . . . . . . . . . . . . 95.6 m -58.39 -37.69 75.79 Favored 'General case' 0 CA--C 1.545 0.772 0 N-CA-C 112.552 0.575 . . . . 0.0 112.552 -178.683 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 37' ' ' CYS . . . . . 0.416 ' HB2' ' CE2' ' A' ' 39' ' ' PHE . 85.7 m -78.21 -23.62 47.42 Favored 'General case' 0 C--N 1.322 -0.59 0 C-N-CA 119.233 -0.987 . . . . 0.0 111.897 177.668 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 38' ' ' GLY . . . . . . . . . . . . . . . 96.49 41.12 3.73 Favored Glycine 0 N--CA 1.445 -0.727 0 C-N-CA 119.998 -1.096 . . . . 0.0 113.193 179.154 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 39' ' ' PHE . . . . . 0.416 ' CE2' ' HB2' ' A' ' 37' ' ' CYS . 91.4 m-85 -97.47 -38.9 9.41 Favored 'General case' 0 C--N 1.314 -0.943 0 N-CA-C 107.777 -1.194 . . . . 0.0 107.777 174.276 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 40' ' ' CYS . . . . . . . . . . . . . 41.9 t . . . . . 0 C--N 1.299 -1.591 0 CA-C-N 113.97 -1.468 . . . . 0.0 108.723 -176.416 . . . . . . . . 0 0 . 1 . 013 nuclear build core ' A' A ' 4' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.446 -0.649 0 N-CA-C 108.781 -0.822 . . . . 0.0 108.781 . . . . . . . . . 0 0 . 1 . 013 nuclear build core ' A' A ' 5' ' ' ASP . . . . . 0.592 ' HB3' ' SG ' ' A' ' 11' ' ' CYS . 54.3 m-20 -67.44 143.25 56.35 Favored 'General case' 0 C--O 1.248 0.995 0 O-C-N 123.473 0.483 . . . . 0.0 111.122 179.04 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 9.8 tp10 -66.86 140.88 57.81 Favored 'General case' 0 C--N 1.316 -0.869 0 C-N-CA 124.054 0.942 . . . . 0.0 109.741 177.563 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 7' ' ' LYS . . . . . . . . . . . . . 20.8 ptmt -85.44 -23.36 27.9 Favored 'General case' 0 N--CA 1.441 -0.89 0 CA-C-O 121.464 0.649 . . . . 0.0 111.101 -178.652 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 8' ' ' ASN . . . . . . . . . . . . . 38.1 m-80 -86.91 14.66 6.92 Favored 'General case' 0 N--CA 1.48 1.057 0 CA-C-N 114.953 -1.021 . . . . 0.0 110.673 -178.565 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 9' ' ' PHE . . . . . . . . . . . . . 15.3 t80 -141.34 132.95 27.07 Favored 'General case' 0 N--CA 1.41 -2.469 0 N-CA-C 105.232 -2.136 . . . . 0.0 105.232 -178.774 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 10' ' ' ASP . . . . . . . . . . . . . 9.1 t70 -91.78 96.79 10.61 Favored 'General case' 0 C--N 1.297 -1.7 0 C-N-CA 118.63 -1.228 . . . . 0.0 108.774 -179.713 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 11' ' ' CYS . . . . . 0.592 ' SG ' ' HB3' ' A' ' 5' ' ' ASP . 60.0 m -68.33 -30.21 69.14 Favored 'General case' 0 C--N 1.3 -1.546 0 CA-C-N 115.706 -0.679 . . . . 0.0 112.215 -175.574 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 12' ' ' ARG . . . . . . . . . . . . . 30.6 mmt180 -69.36 -47.46 64.25 Favored 'General case' 0 CA--C 1.508 -0.635 0 N-CA-C 110.008 -0.368 . . . . 0.0 110.008 179.468 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 54.6 ttp180 -58.71 -42.25 88.21 Favored 'General case' 0 C--N 1.315 -0.894 0 C-N-CA 122.967 0.507 . . . . 0.0 109.918 176.865 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 14' ' ' SER . . . . . . . . . . . . . 26.2 m -64.51 -33.42 75.84 Favored 'General case' 0 C--N 1.316 -0.891 0 CA-C-N 116.006 -0.543 . . . . 0.0 110.749 179.153 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 29.8 tp -74.88 -41.7 59.29 Favored 'General case' 0 N--CA 1.441 -0.912 0 N-CA-C 109.633 -0.506 . . . . 0.0 109.633 179.609 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 16' ' ' ARG . . . . . . . . . . . . . 78.3 mtp180 -64.49 -31.09 72.15 Favored 'General case' 0 C--N 1.321 -0.656 0 C-N-CA 123.699 0.8 . . . . 0.0 111.883 179.51 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 17' ' ' ASN . . . . . . . . . . . . . 30.6 m-80 -85.25 -42.77 14.36 Favored 'General case' 0 CA--C 1.511 -0.531 0 N-CA-C 112.454 0.539 . . . . 0.0 112.454 179.275 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . 130.55 -4.19 5.83 Favored Glycine 0 C--O 1.225 -0.461 0 C-N-CA 119.614 -1.279 . . . . 0.0 112.414 -179.334 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 19' ' ' ASP . . . . . . . . . . . . . 3.5 m-20 -61.79 -38.99 90.1 Favored 'General case' 0 N--CA 1.478 0.972 0 C-N-CA 123.614 0.766 . . . . 0.0 110.701 -177.336 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 20' ' ' CYS . . . . . . . . . . . . . 44.4 t -77.89 -11.21 59.87 Favored 'General case' 0 C--N 1.302 -1.497 0 CA-C-N 114.728 -1.124 . . . . 0.0 111.845 -173.741 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 21' ' ' ASP . . . . . . . . . . . . . 35.3 t70 -114.07 -6.61 13.1 Favored 'General case' 0 C--N 1.312 -1.036 0 CA-C-O 121.768 0.794 . . . . 0.0 110.612 -178.437 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 22' ' ' ASN . . . . . . . . . . . . . 19.1 t-20 -79.53 115.47 19.17 Favored 'General case' 0 C--N 1.309 -1.177 0 CA-C-N 115.378 -0.828 . . . . 0.0 109.681 -177.297 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 23' ' ' ASP . . . . . 0.4 ' HA ' ' HG ' ' A' ' 26' ' ' LEU . 13.2 t70 -55.02 -39.45 69.13 Favored 'General case' 0 N--CA 1.479 0.988 0 C-N-CA 123.972 0.909 . . . . 0.0 112.616 -175.849 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 6.0 m-20 -72.58 -12.93 61.26 Favored 'General case' 0 C--N 1.31 -1.151 0 N-CA-C 112.819 0.674 . . . . 0.0 112.819 -177.053 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 25' ' ' LYS . . . . . . . . . . . . . 43.7 mtpt -113.41 -2.08 14.04 Favored 'General case' 0 C--N 1.315 -0.934 0 CA-C-O 120.963 0.411 . . . . 0.0 110.432 179.655 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 26' ' ' LEU . . . . . 0.412 HD23 ' HA ' ' A' ' 26' ' ' LEU . 45.8 mt -55.54 -35.54 65.79 Favored 'General case' 0 C--N 1.318 -0.785 0 N-CA-C 115.44 1.644 . . . . 0.0 115.44 -177.632 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 27' ' ' LEU . . . . . . . . . . . . . 2.2 tm? -58.08 -50.96 71.67 Favored 'General case' 0 N--CA 1.441 -0.9 0 N-CA-C 107.672 -1.233 . . . . 0.0 107.672 179.071 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 28' ' ' GLU . . . . . 0.631 ' HA ' ' CZ ' ' A' ' 31' ' ' TYR . 40.0 tt0 -65.38 -32.62 74.35 Favored 'General case' 0 N--CA 1.437 -1.076 0 CA-C-N 114.63 -1.168 . . . . 0.0 110.449 179.753 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 29' ' ' MET . . . . . . . . . . . . . 78.5 mmm -80.51 -17.98 49.91 Favored 'General case' 0 C--O 1.208 -1.121 0 CA-C-N 115.901 -0.59 . . . . 0.0 112.081 -175.764 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 30' ' ' GLY . . . . . . . . . . . . . . . -77.06 -39.78 26.64 Favored Glycine 0 C--N 1.303 -1.284 0 C-N-CA 120.419 -0.896 . . . . 0.0 111.658 -179.604 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 31' ' ' TYR . . . . . 0.631 ' CZ ' ' HA ' ' A' ' 28' ' ' GLU . 25.0 p90 -79.44 -31.64 42.62 Favored 'General case' 0 CA--C 1.501 -0.931 0 C-N-CA 119.173 -1.011 . . . . 0.0 112.059 176.581 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 32' ' ' TYR . . . . . . . . . . . . . 17.8 m-85 -73.77 -54.85 7.11 Favored 'General case' 0 C--N 1.297 -1.689 0 N-CA-C 113.384 0.883 . . . . 0.0 113.384 174.913 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 33' ' ' CYS . . . . . . . . . . . . . 30.3 m -134.89 76.9 58.22 Favored Pre-proline 0 C--N 1.307 -1.281 0 C-N-CA 119.892 -0.723 . . . . 0.0 111.863 -175.99 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 34' ' ' PRO . . . . . 0.492 ' HD2' ' HA ' ' A' ' 5' ' ' ASP . 55.7 Cg_endo -68.79 -25.07 33.75 Favored 'Trans proline' 0 C--N 1.352 0.759 0 C-N-CA 122.261 1.974 . . . . 0.0 112.054 -179.266 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 35' ' ' VAL . . . . . 0.431 ' HB ' ' OD1' ' A' ' 5' ' ' ASP . 47.3 t -86.28 -51.65 12.91 Favored 'Isoleucine or valine' 0 C--N 1.306 -1.313 0 CA-C-N 116.261 -0.427 . . . . 0.0 110.491 -177.326 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 36' ' ' THR . . . . . . . . . . . . . 62.0 m -62.41 -37.6 86.42 Favored 'General case' 0 C--O 1.249 1.039 0 CA-C-N 116.159 -0.473 . . . . 0.0 111.958 -178.615 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 37' ' ' CYS . . . . . . . . . . . . . 72.2 m -84.62 6.53 23.59 Favored 'General case' 0 C--N 1.311 -1.091 0 N-CA-C 112.395 0.517 . . . . 0.0 112.395 -179.726 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 38' ' ' GLY . . . . . . . . . . . . . . . 70.09 46.49 50.87 Favored Glycine 0 N--CA 1.446 -0.676 0 N-CA-C 115.451 0.94 . . . . 0.0 115.451 172.238 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 39' ' ' PHE . . . . . 0.437 ' CD2' ' HA ' ' A' ' 34' ' ' PRO . 91.9 m-85 -87.87 -36.18 17.34 Favored 'General case' 0 C--N 1.302 -1.467 0 N-CA-C 108.766 -0.828 . . . . 0.0 108.766 174.145 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 40' ' ' CYS . . . . . . . . . . . . . 15.8 m . . . . . 0 C--N 1.315 -0.893 0 N-CA-C 109.178 -0.675 . . . . 0.0 109.178 178.889 . . . . . . . . 0 0 . 1 . 014 nuclear build core ' A' A ' 4' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.433 -1.313 0 N-CA-C 108.419 -0.956 . . . . 0.0 108.419 . . . . . . . . . 0 0 . 1 . 014 nuclear build core ' A' A ' 5' ' ' ASP . . . . . 0.601 ' HB3' ' SG ' ' A' ' 11' ' ' CYS . 31.3 m-20 -60.56 137.31 58.18 Favored 'General case' 0 C--N 1.312 -1.04 0 O-C-N 123.527 0.517 . . . . 0.0 111.41 -177.24 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 9.9 tp10 -69.27 127.48 33.2 Favored 'General case' 0 N--CA 1.427 -1.584 0 N-CA-C 109.466 -0.568 . . . . 0.0 109.466 177.534 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 7' ' ' LYS . . . . . . . . . . . . . 17.3 ptpt -85.25 -12.76 51.76 Favored 'General case' 0 C--N 1.306 -1.293 0 CA-C-O 121.576 0.703 . . . . 0.0 110.652 -178.687 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 8' ' ' ASN . . . . . . . . . . . . . 81.1 m-20 -91.64 16.37 10.72 Favored 'General case' 0 C--N 1.315 -0.902 0 CA-C-O 121.91 0.862 . . . . 0.0 109.2 176.398 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 9' ' ' PHE . . . . . 0.431 ' HE2' ' HG ' ' A' ' 14' ' ' SER . 29.6 t80 -136.4 155.98 49.27 Favored 'General case' 0 N--CA 1.427 -1.589 0 N-CA-C 106.748 -1.575 . . . . 0.0 106.748 -177.655 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 10' ' ' ASP . . . . . . . . . . . . . 9.1 t70 -104.49 95.74 6.13 Favored 'General case' 0 C--N 1.311 -1.076 0 N-CA-C 108.501 -0.926 . . . . 0.0 108.501 175.199 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 11' ' ' CYS . . . . . 0.601 ' SG ' ' HB3' ' A' ' 5' ' ' ASP . 81.4 m -67.88 -30.95 70.43 Favored 'General case' 0 C--N 1.301 -1.504 0 CA-C-N 115.61 -0.723 . . . . 0.0 111.727 -175.573 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 12' ' ' ARG . . . . . 0.409 ' O ' ' HG3' ' A' ' 16' ' ' ARG . 28.4 mmm180 -66.93 -43.49 83.11 Favored 'General case' 0 CA--C 1.503 -0.839 0 CA-C-N 116.324 -0.398 . . . . 0.0 110.359 179.496 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 60.7 ttp180 -58.24 -47.59 83.04 Favored 'General case' 0 C--N 1.316 -0.868 0 CA-C-N 115.865 -0.607 . . . . 0.0 110.705 179.333 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 14' ' ' SER . . . . . 0.431 ' HG ' ' HE2' ' A' ' 9' ' ' PHE . 57.0 m -66.66 -28.24 68.31 Favored 'General case' 0 C--N 1.319 -0.743 0 N-CA-C 112.028 0.381 . . . . 0.0 112.028 179.045 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 15' ' ' LEU . . . . . 0.406 HD13 ' SG ' ' A' ' 20' ' ' CYS . 42.3 tp -74.14 -45.2 50.29 Favored 'General case' 0 C--N 1.319 -0.743 0 CA-C-O 120.891 0.377 . . . . 0.0 110.141 177.527 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 16' ' ' ARG . . . . . 0.409 ' HG3' ' O ' ' A' ' 12' ' ' ARG . 48.2 mtm180 -66.5 -34.63 78.36 Favored 'General case' 0 C--N 1.316 -0.849 0 CA-C-N 115.99 -0.55 . . . . 0.0 111.131 179.781 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 17' ' ' ASN . . . . . . . . . . . . . 14.7 m-80 -70.85 -31.08 67.66 Favored 'General case' 0 CA--C 1.496 -1.108 0 CA-C-O 121.167 0.508 . . . . 0.0 111.079 176.318 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . 105.2 -1.66 40.55 Favored Glycine 0 N--CA 1.436 -1.331 0 CA-C-N 115.508 -0.769 . . . . 0.0 112.513 178.489 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 19' ' ' ASP . . . . . . . . . . . . . 18.6 m-20 -63.01 -33.01 74.51 Favored 'General case' 0 N--CA 1.484 1.228 0 CA-C-O 121.657 0.741 . . . . 0.0 109.852 -179.453 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 20' ' ' CYS . . . . . 0.454 ' HA ' ' HG3' ' A' ' 29' ' ' MET . 32.2 t -64.51 -24.14 67.51 Favored 'General case' 0 C--N 1.302 -1.484 0 CA-C-N 114.376 -1.283 . . . . 0.0 110.993 -179.987 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 21' ' ' ASP . . . . . . . . . . . . . 34.6 t70 -112.86 -4.88 13.9 Favored 'General case' 0 N--CA 1.468 0.462 0 CA-C-O 121.585 0.707 . . . . 0.0 110.694 -178.632 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 22' ' ' ASN . . . . . 0.427 ' O ' ' HG ' ' A' ' 26' ' ' LEU . 27.2 t-20 -77.77 126.19 30.48 Favored 'General case' 0 C--N 1.307 -1.246 0 CA-C-N 116.118 -0.492 . . . . 0.0 109.809 -178.602 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 23' ' ' ASP . . . . . 0.483 ' HA ' ' HG ' ' A' ' 26' ' ' LEU . 2.2 m-20 -56.92 -41.74 78.72 Favored 'General case' 0 N--CA 1.474 0.745 0 N-CA-C 113.809 1.04 . . . . 0.0 113.809 -176.333 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 21.9 t70 -67.97 -29.03 67.97 Favored 'General case' 0 C--N 1.314 -0.976 0 CA-C-O 121.408 0.623 . . . . 0.0 110.882 179.824 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 25' ' ' LYS . . . . . 0.41 ' HG2' ' OD1' ' A' ' 22' ' ' ASN . 47.0 mmtm -97.59 -0.63 45.44 Favored 'General case' 0 C--N 1.313 -1.007 0 CA-C-N 116.146 -0.479 . . . . 0.0 111.958 -177.521 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 26' ' ' LEU . . . . . 0.483 ' HG ' ' HA ' ' A' ' 23' ' ' ASP . 74.4 mt -58.46 -44.79 89.38 Favored 'General case' 0 N--CA 1.473 0.684 0 N-CA-C 113.22 0.822 . . . . 0.0 113.22 -177.33 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 27' ' ' LEU . . . . . . . . . . . . . 26.8 tp -60.24 -45.66 92.48 Favored 'General case' 0 N--CA 1.432 -1.346 0 CA-C-O 121.204 0.526 . . . . 0.0 109.747 178.776 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 28' ' ' GLU . . . . . . . . . . . . . 9.5 mm-40 -58.68 -36.67 74.55 Favored 'General case' 0 C--N 1.323 -0.582 0 CA-C-N 114.597 -1.183 . . . . 0.0 109.373 -179.323 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 29' ' ' MET . . . . . 0.466 ' HB3' ' SG ' ' A' ' 37' ' ' CYS . 76.9 mmm -89.29 -16.46 31.1 Favored 'General case' 0 C--N 1.296 -1.737 0 CA-C-N 114.536 -1.211 . . . . 0.0 112.525 -173.271 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 30' ' ' GLY . . . . . . . . . . . . . . . -72.07 -40.23 56.98 Favored Glycine 0 C--N 1.302 -1.307 0 N-CA-C 111.439 -0.665 . . . . 0.0 111.439 178.556 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 31' ' ' TYR . . . . . . . . . . . . . 17.5 p90 -82.66 -29.15 30.19 Favored 'General case' 0 CA--C 1.503 -0.83 0 C-N-CA 119.342 -0.943 . . . . 0.0 112.594 177.618 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 32' ' ' TYR . . . . . . . . . . . . . 15.3 m-85 -76.79 -62.07 1.76 Allowed 'General case' 0 C--N 1.298 -1.669 0 N-CA-C 113.764 1.024 . . . . 0.0 113.764 175.592 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 33' ' ' CYS . . . . . 0.405 ' HA ' ' HA ' ' A' ' 5' ' ' ASP . 56.2 m -131.79 73.4 78.85 Favored Pre-proline 0 C--N 1.309 -1.181 0 C-N-CA 120.294 -0.562 . . . . 0.0 111.445 -175.61 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 34' ' ' PRO . . . . . 0.416 ' HB2' ' SG ' ' A' ' 40' ' ' CYS . 54.3 Cg_endo -67.18 -24.42 44.35 Favored 'Trans proline' 0 C--N 1.351 0.685 0 C-N-CA 122.679 2.253 . . . . 0.0 112.433 -175.683 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 35' ' ' VAL . . . . . 0.43 ' HB ' ' OD2' ' A' ' 5' ' ' ASP . 45.8 t -86.84 -42.86 15.75 Favored 'Isoleucine or valine' 0 C--N 1.301 -1.534 0 CA-C-O 121.077 0.465 . . . . 0.0 110.523 -176.666 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 36' ' ' THR . . . . . . . . . . . . . 31.9 m -63.46 -39.58 94.83 Favored 'General case' 0 C--N 1.308 -1.196 0 CA-C-N 115.75 -0.659 . . . . 0.0 110.985 178.399 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 37' ' ' CYS . . . . . 0.466 ' SG ' ' HB3' ' A' ' 29' ' ' MET . 75.5 m -86.26 5.42 34.46 Favored 'General case' 0 C--N 1.316 -0.876 0 N-CA-C 113.223 0.824 . . . . 0.0 113.223 -178.749 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 38' ' ' GLY . . . . . . . . . . . . . . . 73.11 42.83 42.27 Favored Glycine 0 CA--C 1.52 0.367 0 N-CA-C 115.567 0.987 . . . . 0.0 115.567 173.864 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 39' ' ' PHE . . . . . . . . . . . . . 93.1 m-85 -103.8 -43.59 5.29 Favored 'General case' 0 C--N 1.304 -1.376 0 N-CA-C 107.766 -1.198 . . . . 0.0 107.766 173.316 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 40' ' ' CYS . . . . . 0.416 ' SG ' ' HB2' ' A' ' 34' ' ' PRO . 61.5 m . . . . . 0 C--N 1.306 -1.284 0 CA-C-N 114.566 -1.197 . . . . 0.0 109.275 -179.463 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 4' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.424 -1.748 0 N-CA-C 106.161 -1.792 . . . . 0.0 106.161 . . . . . . . . . 0 0 . 1 . 015 nuclear build core ' A' A ' 5' ' ' ASP . . . . . 0.577 ' OD2' ' HB ' ' A' ' 35' ' ' VAL . 25.9 m-20 -61.56 137.52 58.25 Favored 'General case' 0 C--N 1.315 -0.907 0 O-C-N 123.343 0.402 . . . . 0.0 110.221 -179.506 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER -66.52 136.46 55.69 Favored 'General case' 0 C--N 1.321 -0.671 0 C-N-CA 123.68 0.792 . . . . 0.0 109.558 -175.653 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 7' ' ' LYS . . . . . . . . . . . . . 8.1 ptpp? -73.79 -27.73 61.29 Favored 'General case' 0 C--N 1.309 -1.176 0 N-CA-C 114.986 1.476 . . . . 0.0 114.986 -173.298 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 8' ' ' ASN . . . . . . . . . . . . . 16.2 m120 -98.58 -2.83 37.69 Favored 'General case' 0 C--N 1.285 -2.206 0 C-N-CA 120.436 -0.506 . . . . 0.0 110.933 -178.909 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 9' ' ' PHE . . . . . . . . . . . . . 18.8 t80 -100.7 143.66 30.6 Favored 'General case' 0 C--N 1.302 -1.482 0 N-CA-C 107.499 -1.297 . . . . 0.0 107.499 -179.75 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 10' ' ' ASP . . . . . . . . . . . . . 16.4 t70 -102.82 100.71 10.73 Favored 'General case' 0 C--N 1.307 -1.268 0 C-N-CA 119.064 -1.054 . . . . 0.0 110.788 -179.349 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 11' ' ' CYS . . . . . 0.511 ' SG ' ' HB3' ' A' ' 5' ' ' ASP . 60.1 m -68.32 -27.67 66.49 Favored 'General case' 0 C--N 1.289 -2.03 0 CA-C-N 115.034 -0.984 . . . . 0.0 112.022 -176.1 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 12' ' ' ARG . . . . . . . . . . . . . 38.9 mmt180 -62.2 -48.9 77.97 Favored 'General case' 0 C--O 1.237 0.445 0 N-CA-C 109.575 -0.528 . . . . 0.0 109.575 179.009 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 14.7 ttp180 -59.39 -51.62 69.14 Favored 'General case' 0 C--N 1.325 -0.484 0 CA-C-N 115.394 -0.821 . . . . 0.0 111.092 179.498 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 14' ' ' SER . . . . . . . . . . . . . 25.4 m -63.62 -34.63 78.26 Favored 'General case' 0 C--N 1.311 -1.069 0 N-CA-C 112.048 0.388 . . . . 0.0 112.048 -178.249 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 2.3 tm? -68.34 -43.48 77.43 Favored 'General case' 0 CA--C 1.535 0.386 0 N-CA-C 108.82 -0.807 . . . . 0.0 108.82 179.16 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 16' ' ' ARG . . . . . . . . . . . . . 71.3 mtp180 -70.23 -37.26 74.97 Favored 'General case' 0 C--N 1.319 -0.747 0 N-CA-C 112.824 0.676 . . . . 0.0 112.824 -179.533 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 17' ' ' ASN . . . . . . . . . . . . . 26.4 m-80 -69.99 -36.12 74.92 Favored 'General case' 0 CA--C 1.503 -0.841 0 N-CA-C 111.899 0.333 . . . . 0.0 111.899 178.639 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . 117.79 -1.32 17.71 Favored Glycine 0 N--CA 1.437 -1.283 0 C-N-CA 119.774 -1.203 . . . . 0.0 112.143 179.353 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 19' ' ' ASP . . . . . . . . . . . . . 8.2 m-20 -60.94 -30.46 70.23 Favored 'General case' 0 N--CA 1.482 1.162 0 CA-C-O 121.246 0.546 . . . . 0.0 111.038 -178.38 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 20' ' ' CYS . . . . . . . . . . . . . 52.1 t -82.03 -2.33 51.34 Favored 'General case' 0 C--N 1.304 -1.378 0 CA-C-N 115.411 -0.813 . . . . 0.0 111.001 -176.099 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 21' ' ' ASP . . . . . . . . . . . . . 31.4 t70 -124.32 -9.91 7.51 Favored 'General case' 0 N--CA 1.47 0.554 0 CA-C-O 121.781 0.801 . . . . 0.0 110.065 176.552 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 22' ' ' ASN . . . . . 0.488 ' O ' ' HG ' ' A' ' 26' ' ' LEU . 28.1 t-20 -82.2 121.24 26.37 Favored 'General case' 0 C--N 1.309 -1.153 0 CA-C-N 115.155 -0.93 . . . . 0.0 110.561 -177.041 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 23' ' ' ASP . . . . . . . . . . . . . 13.2 t70 -51.47 -43.32 62.11 Favored 'General case' 0 N--CA 1.483 1.2 0 C-N-CA 124.537 1.135 . . . . 0.0 111.841 -176.904 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 25.4 m-20 -70.2 -14.68 62.73 Favored 'General case' 0 C--N 1.311 -1.093 0 CA-C-N 115.123 -0.944 . . . . 0.0 112.76 -175.911 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 25' ' ' LYS . . . . . . . . . . . . . 14.1 mmmm -115.24 -7.96 12.36 Favored 'General case' 0 C--N 1.313 -1.009 0 N-CA-C 111.56 0.207 . . . . 0.0 111.56 178.894 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 26' ' ' LEU . . . . . 0.488 ' HG ' ' O ' ' A' ' 22' ' ' ASN . 52.3 mt -53.9 -44.55 70.6 Favored 'General case' 0 N--CA 1.473 0.675 0 N-CA-C 114.985 1.476 . . . . 0.0 114.985 -174.329 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 27' ' ' LEU . . . . . . . . . . . . . 26.4 tp -59.27 -46.76 87.66 Favored 'General case' 0 N--CA 1.437 -1.114 0 CA-C-O 121.175 0.512 . . . . 0.0 109.936 -179.309 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 28' ' ' GLU . . . . . 0.513 ' HA ' ' CZ ' ' A' ' 31' ' ' TYR . 46.1 mt-10 -66.14 -32.23 73.56 Favored 'General case' 0 CA--C 1.498 -1.057 0 CA-C-N 114.963 -1.017 . . . . 0.0 110.112 -179.31 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 29' ' ' MET . . . . . 0.433 ' HB3' ' SG ' ' A' ' 37' ' ' CYS . 79.3 mmm -81.51 -19.82 41.39 Favored 'General case' 0 C--N 1.299 -1.616 0 CA-C-N 115.357 -0.838 . . . . 0.0 110.718 -177.901 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 30' ' ' GLY . . . . . 0.453 ' O ' ' HB3' ' A' ' 34' ' ' PRO . . . -74.38 -26.52 67.82 Favored Glycine 0 N--CA 1.43 -1.717 0 CA-C-N 115.259 -0.882 . . . . 0.0 111.216 177.967 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 31' ' ' TYR . . . . . 0.513 ' CZ ' ' HA ' ' A' ' 28' ' ' GLU 0.254 22.2 p90 -98.51 -36.03 10.05 Favored 'General case' 0 N--CA 1.435 -1.194 0 C-N-CA 119.263 -0.975 . . . . 0.0 112.602 173.803 . . . . . . . . 3 3 . 1 . 015 nuclear build core ' A' A ' 32' ' ' TYR . . . . . . . . . . . . . 19.3 m-85 -68.27 -51.71 41.96 Favored 'General case' 0 C--N 1.303 -1.438 0 N-CA-C 113.759 1.022 . . . . 0.0 113.759 176.747 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 33' ' ' CYS . . . . . . . . . . . . . 65.6 m -134.85 66.6 69.07 Favored Pre-proline 0 C--N 1.3 -1.581 0 C-N-CA 119.912 -0.715 . . . . 0.0 111.162 179.684 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 34' ' ' PRO . . . . . 0.453 ' HB3' ' O ' ' A' ' 30' ' ' GLY . 37.1 Cg_endo -64.68 -26.97 60.72 Favored 'Trans proline' 0 C--N 1.352 0.751 0 C-N-CA 122.733 2.289 . . . . 0.0 112.771 -176.566 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 35' ' ' VAL . . . . . 0.577 ' HB ' ' OD2' ' A' ' 5' ' ' ASP . 39.2 t -83.3 -43.38 18.23 Favored 'Isoleucine or valine' 0 C--N 1.307 -1.274 0 C-N-CA 119.796 -0.762 . . . . 0.0 109.617 -178.492 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 36' ' ' THR . . . . . . . . . . . . . 25.2 m -62.61 -40.05 95.72 Favored 'General case' 0 C--N 1.316 -0.851 0 CA-C-N 115.662 -0.699 . . . . 0.0 110.438 178.666 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 37' ' ' CYS . . . . . 0.433 ' SG ' ' HB3' ' A' ' 29' ' ' MET . 79.4 m -81.15 0.18 37.48 Favored 'General case' 0 C--N 1.318 -0.794 0 N-CA-C 112.847 0.684 . . . . 0.0 112.847 178.798 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 38' ' ' GLY . . . . . . . . . . . . . . . 74.21 49.0 13.33 Favored Glycine 0 C--O 1.219 -0.828 0 N-CA-C 115.452 0.941 . . . . 0.0 115.452 173.066 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 39' ' ' PHE . . . . . . . . . . . . . 94.2 m-85 -92.31 -9.58 41.44 Favored 'General case' 0 C--N 1.311 -1.067 0 CA-C-N 117.736 0.768 . . . . 0.0 111.501 175.973 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 40' ' ' CYS . . . . . . . . . . . . . 28.5 p . . . . . 0 C--N 1.31 -1.141 0 N-CA-C 108.304 -0.998 . . . . 0.0 108.304 173.704 . . . . . . . . 0 0 . 1 . 016 nuclear build core ' A' A ' 4' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.448 -0.557 0 N-CA-C 108.489 -0.93 . . . . 0.0 108.489 . . . . . . . . . 0 0 . 1 . 016 nuclear build core ' A' A ' 5' ' ' ASP . . . . . 0.715 ' OD1' ' HB ' ' A' ' 35' ' ' VAL . 11.0 m-20 -59.65 130.39 46.61 Favored 'General case' 0 C--N 1.311 -1.108 0 O-C-N 123.489 0.493 . . . . 0.0 111.844 -179.077 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 8.5 tp10 -66.53 127.12 31.1 Favored 'General case' 0 N--CA 1.44 -0.939 0 C-N-CA 124.015 0.926 . . . . 0.0 110.507 178.426 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 7' ' ' LYS . . . . . . . . . . . . . 10.1 ptpp? -77.09 -21.05 54.94 Favored 'General case' 0 C--N 1.315 -0.893 0 CA-C-N 115.366 -0.834 . . . . 0.0 110.83 -177.608 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 8' ' ' ASN . . . . . . . . . . . . . 15.5 t-20 -87.77 -7.97 56.6 Favored 'General case' 0 C--N 1.302 -1.499 0 CA-C-O 121.961 0.886 . . . . 0.0 109.758 -178.559 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 9' ' ' PHE . . . . . . . . . . . . . 23.2 t80 -108.18 151.23 26.2 Favored 'General case' 0 N--CA 1.43 -1.471 0 N-CA-C 106.983 -1.488 . . . . 0.0 106.983 -179.206 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 10' ' ' ASP . . . . . . . . . . . . . 9.8 t70 -102.55 100.12 10.18 Favored 'General case' 0 C--O 1.253 1.265 0 C-N-CA 118.944 -1.102 . . . . 0.0 109.281 177.483 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 11' ' ' CYS . . . . . 0.482 ' SG ' ' HB3' ' A' ' 5' ' ' ASP . 61.2 m -70.59 -29.3 65.68 Favored 'General case' 0 C--N 1.298 -1.665 0 CA-C-N 114.706 -1.134 . . . . 0.0 111.372 -176.488 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 12' ' ' ARG . . . . . . . . . . . . . 34.1 mmt180 -71.29 -52.32 19.54 Favored 'General case' 0 CA--C 1.506 -0.744 0 CA-C-N 116.03 -0.532 . . . . 0.0 109.896 -175.853 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 38.4 ttm180 -58.31 -46.32 86.38 Favored 'General case' 0 C--N 1.32 -0.69 0 C-N-CA 123.346 0.659 . . . . 0.0 110.42 -179.688 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 14' ' ' SER . . . . . . . . . . . . . 25.9 m -59.83 -38.54 82.34 Favored 'General case' 0 C--O 1.256 1.398 0 CA-C-N 115.875 -0.602 . . . . 0.0 111.142 -178.797 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 41.1 tp -73.26 -46.97 46.88 Favored 'General case' 0 N--CA 1.438 -1.026 0 CA-C-N 116.062 -0.517 . . . . 0.0 110.385 178.016 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 16' ' ' ARG . . . . . . . . . . . . . 97.8 mtt180 -54.28 -47.0 72.85 Favored 'General case' 0 N--CA 1.471 0.583 0 C-N-CA 123.18 0.592 . . . . 0.0 111.504 178.788 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 17' ' ' ASN . . . . . . . . . . . . . 11.0 m120 -65.75 -36.67 84.24 Favored 'General case' 0 CA--C 1.504 -0.789 0 CA-C-O 121.858 0.837 . . . . 0.0 109.576 179.833 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . 109.12 -1.36 31.38 Favored Glycine 0 N--CA 1.432 -1.606 0 CA-C-N 114.376 -1.284 . . . . 0.0 111.863 179.235 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 19' ' ' ASP . . . . . 0.425 ' O ' ' HB2' ' A' ' 25' ' ' LYS . 8.8 m-20 -70.29 -21.44 62.95 Favored 'General case' 0 CA--C 1.49 -1.338 0 N-CA-C 112.554 0.575 . . . . 0.0 112.554 -176.776 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 20' ' ' CYS . . . . . 0.621 ' HA ' ' HG3' ' A' ' 29' ' ' MET . 43.0 t -73.75 -26.38 60.64 Favored 'General case' 0 C--N 1.299 -1.619 0 C-N-CA 120.425 -0.51 . . . . 0.0 111.022 179.912 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 21' ' ' ASP . . . . . . . . . . . . . 33.8 t70 -100.32 -3.33 31.49 Favored 'General case' 0 C--N 1.327 -0.39 0 CA-C-O 122.488 1.137 . . . . 0.0 109.101 -179.814 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 22' ' ' ASN . . . . . . . . . . . . . 19.0 t30 -78.26 130.52 36.34 Favored 'General case' 0 C--N 1.309 -1.18 0 CA-C-N 114.139 -1.391 . . . . 0.0 109.35 178.619 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 23' ' ' ASP . . . . . 0.478 ' HA ' ' HG ' ' A' ' 26' ' ' LEU . 3.1 m-20 -52.9 -34.38 54.64 Favored 'General case' 0 CA--C 1.498 -1.021 0 C-N-CA 124.388 1.075 . . . . 0.0 112.043 -177.118 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 34.2 t70 -59.85 -31.81 70.1 Favored 'General case' 0 C--N 1.307 -1.245 0 CA-C-N 114.974 -1.012 . . . . 0.0 112.133 -179.501 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 25' ' ' LYS . . . . . 0.523 ' O ' ' HG2' ' A' ' 29' ' ' MET . 13.1 mptt -110.81 1.78 17.93 Favored 'General case' 0 C--O 1.204 -1.322 0 N-CA-C 113.624 0.972 . . . . 0.0 113.624 179.794 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 26' ' ' LEU . . . . . 0.478 ' HG ' ' HA ' ' A' ' 23' ' ' ASP . 70.1 mt -50.2 -52.78 32.89 Favored 'General case' 0 N--CA 1.49 1.53 0 N-CA-C 114.655 1.354 . . . . 0.0 114.655 -174.947 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 27' ' ' LEU . . . . . . . . . . . . . 20.0 tp -60.84 -44.62 96.72 Favored 'General case' 0 N--CA 1.44 -0.929 0 CA-C-O 121.17 0.51 . . . . 0.0 109.724 -179.645 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 28' ' ' GLU . . . . . . . . . . . . . 7.5 mm-40 -60.57 -37.12 80.27 Favored 'General case' 0 C--N 1.325 -0.5 0 CA-C-N 114.581 -1.19 . . . . 0.0 108.963 -178.295 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 29' ' ' MET . . . . . 0.621 ' HG3' ' HA ' ' A' ' 20' ' ' CYS . 74.8 mmm -81.14 -20.26 41.71 Favored 'General case' 0 CA--C 1.482 -1.656 0 CA-C-N 115.094 -0.957 . . . . 0.0 111.794 -174.041 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 30' ' ' GLY . . . . . . . . . . . . . . . -64.56 -27.04 71.3 Favored Glycine 0 N--CA 1.436 -1.341 0 O-C-N 124.194 0.934 . . . . 0.0 110.823 177.216 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 31' ' ' TYR . . . . . . . . . . . . . 38.7 p90 -106.16 -31.97 8.44 Favored 'General case' 0 N--CA 1.43 -1.443 0 N-CA-C 112.923 0.712 . . . . 0.0 112.923 176.166 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 32' ' ' TYR . . . . . . . . . . . . . 16.2 m-85 -68.15 -61.59 1.79 Allowed 'General case' 0 C--O 1.21 -1.0 0 N-CA-C 113.232 0.827 . . . . 0.0 113.232 177.482 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 33' ' ' CYS . . . . . . . . . . . . . 61.7 m -136.43 68.55 61.03 Favored Pre-proline 0 C--O 1.265 1.871 0 CA-C-O 121.749 0.785 . . . . 0.0 111.413 -176.846 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 34' ' ' PRO . . . . . 0.66 ' HA ' ' CD2' ' A' ' 39' ' ' PHE . 74.0 Cg_endo -73.09 -23.75 17.89 Favored 'Trans proline' 0 N--CA 1.444 -1.386 0 C-N-CA 122.964 2.443 . . . . 0.0 112.569 -174.955 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 35' ' ' VAL . . . . . 0.715 ' HB ' ' OD1' ' A' ' 5' ' ' ASP . 43.5 t -86.57 -44.48 16.48 Favored 'Isoleucine or valine' 0 C--N 1.289 -2.028 0 C-N-CA 119.51 -0.876 . . . . 0.0 109.506 -179.066 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 36' ' ' THR . . . . . . . . . . . . . 38.3 m -54.61 -51.88 63.94 Favored 'General case' 0 C--N 1.325 -0.472 0 CA-C-N 115.653 -0.703 . . . . 0.0 112.69 -178.49 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 37' ' ' CYS . . . . . . . . . . . . . 85.1 m -91.99 10.88 27.12 Favored 'General case' 0 C--N 1.315 -0.932 0 C-N-CA 118.964 -1.094 . . . . 0.0 113.288 -176.517 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 38' ' ' GLY . . . . . . . . . . . . . . . 78.19 44.14 12.1 Favored Glycine 0 N--CA 1.443 -0.834 0 N-CA-C 115.432 0.933 . . . . 0.0 115.432 171.881 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 39' ' ' PHE . . . . . 0.66 ' CD2' ' HA ' ' A' ' 34' ' ' PRO . 62.2 m-85 -86.19 -50.39 7.02 Favored 'General case' 0 C--N 1.302 -1.496 0 N-CA-C 106.782 -1.562 . . . . 0.0 106.782 174.113 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 40' ' ' CYS . . . . . 0.509 ' SG ' ' HB2' ' A' ' 34' ' ' PRO . 4.0 p . . . . . 0 C--N 1.31 -1.125 0 CA-C-N 114.453 -1.249 . . . . 0.0 109.87 -179.71 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 4' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.426 -1.626 0 N-CA-C 108.883 -0.784 . . . . 0.0 108.883 . . . . . . . . . 0 0 . 1 . 017 nuclear build core ' A' A ' 5' ' ' ASP . . . . . 0.667 ' OD1' ' HB ' ' A' ' 35' ' ' VAL . 5.1 m-20 -58.29 132.5 53.82 Favored 'General case' 0 C--O 1.256 1.406 0 O-C-N 124.395 1.06 . . . . 0.0 109.517 -179.877 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 6' ' ' GLU . . . . . 0.439 ' HG3' ' H ' ' A' ' 8' ' ' ASN . 9.5 tp10 -64.1 131.7 48.31 Favored 'General case' 0 N--CA 1.436 -1.149 0 CA-C-N 115.589 -0.732 . . . . 0.0 110.761 -176.712 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 7' ' ' LYS . . . . . . . . . . . . . 21.1 ptmt -80.22 -13.01 59.56 Favored 'General case' 0 N--CA 1.437 -1.122 0 CA-C-N 115.883 -0.599 . . . . 0.0 112.045 -176.24 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 8' ' ' ASN . . . . . 0.439 ' H ' ' HG3' ' A' ' 6' ' ' GLU . 55.7 m-20 -93.81 4.1 54.43 Favored 'General case' 0 C--N 1.313 -1.018 0 CA-C-O 121.657 0.741 . . . . 0.0 109.367 178.814 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 9' ' ' PHE . . . . . . . . . . . . . 26.8 t80 -128.49 149.52 50.55 Favored 'General case' 0 C--N 1.298 -1.665 0 N-CA-C 106.384 -1.71 . . . . 0.0 106.384 -175.53 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 10' ' ' ASP . . . . . . . . . . . . . 10.0 t70 -105.14 98.73 8.39 Favored 'General case' 0 C--N 1.302 -1.466 0 C-N-CA 119.378 -0.929 . . . . 0.0 108.899 177.172 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 11' ' ' CYS . . . . . 0.417 ' SG ' ' HB3' ' A' ' 5' ' ' ASP . 96.9 m -73.37 -25.08 60.43 Favored 'General case' 0 C--N 1.287 -2.137 0 N-CA-C 113.194 0.813 . . . . 0.0 113.194 -177.19 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 12' ' ' ARG . . . . . 0.457 ' O ' ' HG2' ' A' ' 16' ' ' ARG . 43.8 mmt-85 -69.83 -48.0 60.64 Favored 'General case' 0 C--N 1.32 -0.678 0 N-CA-C 109.502 -0.555 . . . . 0.0 109.502 179.108 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 58.3 ttp180 -64.17 -44.36 92.3 Favored 'General case' 0 C--N 1.311 -1.073 0 CA-C-N 115.54 -0.754 . . . . 0.0 110.355 178.474 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 14' ' ' SER . . . . . . . . . . . . . 25.3 m -60.53 -34.06 73.57 Favored 'General case' 0 C--O 1.25 1.129 0 CA-C-O 121.393 0.616 . . . . 0.0 110.949 179.432 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 65.3 tp -63.35 -46.57 85.94 Favored 'General case' 0 N--CA 1.439 -0.986 0 CA-C-N 115.611 -0.722 . . . . 0.0 109.306 174.956 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 16' ' ' ARG . . . . . 0.457 ' HG2' ' O ' ' A' ' 12' ' ' ARG . 31.0 mmt180 -71.75 -32.74 68.04 Favored 'General case' 0 C--N 1.315 -0.892 0 CA-C-N 115.957 -0.565 . . . . 0.0 112.236 -177.441 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 17' ' ' ASN . . . . . . . . . . . . . 77.0 m-20 -65.57 -35.53 81.12 Favored 'General case' 0 CA--C 1.494 -1.207 0 CA-C-O 121.301 0.572 . . . . 0.0 109.533 179.412 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . 110.77 11.81 18.09 Favored Glycine 0 N--CA 1.426 -1.999 0 CA-C-N 115.11 -0.95 . . . . 0.0 111.483 -178.805 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 19' ' ' ASP . . . . . . . . . . . . . 9.0 m-20 -67.49 -35.05 78.39 Favored 'General case' 0 CA--C 1.501 -0.934 0 N-CA-C 108.782 -0.821 . . . . 0.0 108.782 178.126 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 20' ' ' CYS . . . . . 0.456 ' HA ' ' HG3' ' A' ' 29' ' ' MET . 52.5 t -83.26 -4.48 58.47 Favored 'General case' 0 C--N 1.306 -1.306 0 CA-C-N 114.41 -1.268 . . . . 0.0 110.533 -179.934 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 21' ' ' ASP . . . . . . . . . . . . . 17.2 t70 -104.54 -11.85 16.78 Favored 'General case' 0 C--N 1.318 -0.77 0 CA-C-O 121.77 0.795 . . . . 0.0 109.887 -178.547 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 22' ' ' ASN . . . . . . . . . . . . . 54.1 t-20 -89.3 125.03 34.94 Favored 'General case' 0 C--N 1.311 -1.087 0 CA-C-N 115.127 -0.942 . . . . 0.0 109.243 -179.934 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 23' ' ' ASP . . . . . . . . . . . . . 5.3 p-10 -61.23 -34.34 74.96 Favored 'General case' 0 C--N 1.32 -0.708 0 O-C-N 123.434 0.459 . . . . 0.0 111.673 179.976 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 34.8 t70 -68.46 -28.76 67.33 Favored 'General case' 0 C--N 1.308 -1.209 0 CA-C-O 121.318 0.58 . . . . 0.0 111.67 -177.658 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 25' ' ' LYS . . . . . 0.418 ' O ' ' HG2' ' A' ' 29' ' ' MET . 92.3 mttt -97.18 -2.28 43.25 Favored 'General case' 0 C--N 1.309 -1.181 0 N-CA-C 112.532 0.568 . . . . 0.0 112.532 -177.462 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 26' ' ' LEU . . . . . . . . . . . . . 87.4 mt -55.84 -36.83 67.94 Favored 'General case' 0 C--N 1.312 -1.038 0 N-CA-C 113.269 0.841 . . . . 0.0 113.269 179.806 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 27' ' ' LEU . . . . . . . . . . . . . 1.3 tm? -62.71 -42.22 99.54 Favored 'General case' 0 N--CA 1.44 -0.957 0 N-CA-C 109.02 -0.734 . . . . 0.0 109.02 178.508 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 28' ' ' GLU . . . . . . . . . . . . . 8.3 mm-40 -60.74 -37.24 81.1 Favored 'General case' 0 CA--C 1.514 -0.407 0 N-CA-C 109.062 -0.718 . . . . 0.0 109.062 177.572 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 29' ' ' MET . . . . . 0.456 ' HG3' ' HA ' ' A' ' 20' ' ' CYS . 22.1 mmt -75.68 -22.29 56.82 Favored 'General case' 0 C--O 1.204 -1.29 0 CA-C-N 114.95 -1.023 . . . . 0.0 109.827 -176.744 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 30' ' ' GLY . . . . . . . . . . . . . . . -64.31 -28.03 72.45 Favored Glycine 0 C--O 1.24 0.518 0 CA-C-N 116.227 -0.442 . . . . 0.0 112.338 179.931 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 31' ' ' TYR . . . . . . . . . . . . . 20.6 p90 -113.67 -36.24 4.94 Favored 'General case' 0 N--CA 1.433 -1.318 0 N-CA-C 113.033 0.753 . . . . 0.0 113.033 177.543 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 32' ' ' TYR . . . . . . . . . . . . . 33.4 m-85 -70.0 -47.38 62.41 Favored 'General case' 0 C--N 1.306 -1.307 0 N-CA-C 113.234 0.828 . . . . 0.0 113.234 176.808 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 33' ' ' CYS . . . . . . . . . . . . . 60.4 m -136.4 58.49 21.29 Favored Pre-proline 0 C--O 1.251 1.151 0 C-N-CA 121.053 -0.259 . . . . 0.0 111.678 -173.838 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 34' ' ' PRO . . . . . 0.426 ' HA ' ' CD2' ' A' ' 39' ' ' PHE . 57.3 Cg_endo -67.35 -27.95 39.94 Favored 'Trans proline' 0 C--N 1.359 1.105 0 C-N-CA 122.012 1.808 . . . . 0.0 112.523 -174.66 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 35' ' ' VAL . . . . . 0.667 ' HB ' ' OD1' ' A' ' 5' ' ' ASP . 43.8 t -87.27 -42.9 15.58 Favored 'Isoleucine or valine' 0 C--N 1.301 -1.536 0 C-N-CA 119.971 -0.692 . . . . 0.0 110.433 -177.224 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 36' ' ' THR . . . . . . . . . . . . . 28.0 m -61.24 -40.06 92.64 Favored 'General case' 0 C--N 1.316 -0.88 0 CA-C-N 115.999 -0.546 . . . . 0.0 111.211 179.066 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 37' ' ' CYS . . . . . . . . . . . . . 74.8 m -88.18 -1.45 58.02 Favored 'General case' 0 C--N 1.311 -1.082 0 N-CA-C 113.727 1.01 . . . . 0.0 113.727 -178.954 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 38' ' ' GLY . . . . . . . . . . . . . . . 78.13 43.72 13.05 Favored Glycine 0 CA--C 1.524 0.656 0 N-CA-C 115.325 0.89 . . . . 0.0 115.325 174.908 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 39' ' ' PHE . . . . . 0.426 ' CD2' ' HA ' ' A' ' 34' ' ' PRO . 74.6 m-85 -91.32 -31.4 16.1 Favored 'General case' 0 C--N 1.315 -0.92 0 N-CA-C 108.475 -0.935 . . . . 0.0 108.475 173.886 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 40' ' ' CYS . . . . . . . . . . . . . 58.3 m . . . . . 0 C--N 1.306 -1.299 0 CA-C-N 114.956 -1.02 . . . . 0.0 109.45 -178.42 . . . . . . . . 0 0 . 1 . 018 nuclear build core ' A' A ' 4' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.438 -1.055 0 N-CA-C 107.835 -1.172 . . . . 0.0 107.835 . . . . . . . . . 0 0 . 1 . 018 nuclear build core ' A' A ' 5' ' ' ASP . . . . . 0.432 ' HA ' ' HD2' ' A' ' 34' ' ' PRO . 56.2 m-20 -69.51 147.54 50.7 Favored 'General case' 0 C--N 1.31 -1.121 0 N-CA-C 109.311 -0.626 . . . . 0.0 109.311 178.705 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 9.3 tp10 -67.35 128.55 36.84 Favored 'General case' 0 C--N 1.311 -1.087 0 N-CA-C 109.069 -0.715 . . . . 0.0 109.069 177.744 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 7' ' ' LYS . . . . . . . . . . . . . 19.4 ptpt -77.24 -16.93 58.82 Favored 'General case' 0 C--N 1.307 -1.257 0 CA-C-N 116.348 -0.387 . . . . 0.0 112.008 -177.527 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 8' ' ' ASN . . . . . . . . . . . . . 38.7 m-80 -94.5 4.36 53.95 Favored 'General case' 0 C--N 1.302 -1.488 0 CA-C-O 121.352 0.596 . . . . 0.0 110.321 179.353 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 9' ' ' PHE . . . . . . . . . . . . . 41.5 t80 -123.45 144.32 49.59 Favored 'General case' 0 C--N 1.299 -1.623 0 N-CA-C 106.341 -1.726 . . . . 0.0 106.341 -178.53 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 10' ' ' ASP . . . . . . . . . . . . . 8.3 t70 -102.18 91.76 4.44 Favored 'General case' 0 C--N 1.304 -1.411 0 C-N-CA 118.705 -1.198 . . . . 0.0 109.544 179.859 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 11' ' ' CYS . . . . . 0.421 ' SG ' ' HB3' ' A' ' 5' ' ' ASP . 98.3 m -69.55 -19.93 63.68 Favored 'General case' 0 C--N 1.297 -1.701 0 CA-C-N 114.799 -1.091 . . . . 0.0 112.251 -177.095 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 12' ' ' ARG . . . . . . . . . . . . . 13.8 mmt180 -74.04 -43.5 57.63 Favored 'General case' 0 C--N 1.313 -1.0 0 N-CA-C 107.653 -1.24 . . . . 0.0 107.653 -177.734 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 39.4 ttm180 -59.48 -50.3 74.47 Favored 'General case' 0 C--O 1.238 0.462 0 CA-C-N 114.905 -1.043 . . . . 0.0 110.092 175.472 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 14' ' ' SER . . . . . . . . . . . . . 50.6 m -62.14 -30.82 71.3 Favored 'General case' 0 CA--C 1.546 0.822 0 CA-C-N 116.178 -0.464 . . . . 0.0 111.591 179.633 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 15' ' ' LEU . . . . . 0.432 ' HA ' ' HB3' ' A' ' 20' ' ' CYS . 58.1 tp -67.29 -49.51 63.97 Favored 'General case' 0 N--CA 1.449 -0.522 0 N-CA-C 110.097 -0.334 . . . . 0.0 110.097 176.726 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 16' ' ' ARG . . . . . . . . . . . . . 65.7 mtp180 -62.67 -38.1 89.02 Favored 'General case' 0 C--N 1.321 -0.633 0 CA-C-N 115.434 -0.803 . . . . 0.0 112.228 -179.06 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 17' ' ' ASN . . . . . . . . . . . . . 42.0 m-80 -81.77 -14.56 56.26 Favored 'General case' 0 CA--C 1.506 -0.749 0 CA-C-O 121.017 0.437 . . . . 0.0 111.975 -178.502 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . 95.94 9.93 56.8 Favored Glycine 0 C--O 1.213 -1.201 0 C-N-CA 119.938 -1.125 . . . . 0.0 113.743 173.566 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 19' ' ' ASP . . . . . . . . . . . . . 2.6 m-20 -67.73 -34.65 77.27 Favored 'General case' 0 CA--C 1.498 -1.046 0 N-CA-C 108.072 -1.085 . . . . 0.0 108.072 178.225 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 20' ' ' CYS . . . . . 0.432 ' HB3' ' HA ' ' A' ' 15' ' ' LEU . 42.8 t -72.66 -9.46 58.63 Favored 'General case' 0 C--N 1.309 -1.193 0 CA-C-N 113.711 -1.586 . . . . 0.0 110.787 -179.046 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 21' ' ' ASP . . . . . . . . . . . . . 26.2 t70 -113.64 -10.02 13.15 Favored 'General case' 0 C--N 1.319 -0.742 0 CA-C-O 121.656 0.741 . . . . 0.0 109.672 -179.874 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 22' ' ' ASN . . . . . 0.502 ' OD1' ' HG2' ' A' ' 25' ' ' LYS . 23.5 t-20 -83.4 114.62 21.57 Favored 'General case' 0 C--N 1.298 -1.631 0 CA-C-N 115.713 -0.676 . . . . 0.0 109.958 -174.217 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 23' ' ' ASP . . . . . . . . . . . . . 18.1 t70 -49.66 -45.21 48.31 Favored 'General case' 0 N--CA 1.477 0.904 0 C-N-CA 124.231 1.012 . . . . 0.0 111.708 -176.065 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 24' ' ' ASP . . . . . 0.438 ' HB3' ' OD1' ' A' ' 22' ' ' ASN . 27.4 t70 -60.28 -32.91 71.64 Favored 'General case' 0 C--N 1.31 -1.143 0 CA-C-N 115.278 -0.874 . . . . 0.0 112.441 -178.897 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 25' ' ' LYS . . . . . 0.502 ' HG2' ' OD1' ' A' ' 22' ' ' ASN . 44.3 mmtm -94.63 -7.01 42.13 Favored 'General case' 0 C--N 1.312 -1.029 0 CA-C-N 116.301 -0.409 . . . . 0.0 111.063 -175.727 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 26' ' ' LEU . . . . . . . . . . . . . 64.8 mt -56.81 -34.79 68.04 Favored 'General case' 0 C--O 1.218 -0.553 0 N-CA-C 114.886 1.439 . . . . 0.0 114.886 -174.485 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 27' ' ' LEU . . . . . . . . . . . . . 1.3 tm? -57.52 -50.0 74.49 Favored 'General case' 0 N--CA 1.44 -0.945 0 N-CA-C 108.758 -0.83 . . . . 0.0 108.758 178.539 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 28' ' ' GLU . . . . . . . . . . . . . 1.5 mp0 -63.57 -33.81 76.42 Favored 'General case' 0 N--CA 1.449 -0.508 0 CA-C-N 115.175 -0.921 . . . . 0.0 110.424 178.583 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 29' ' ' MET . . . . . . . . . . . . . 21.7 mmt -74.15 -25.32 59.68 Favored 'General case' 0 C--O 1.2 -1.527 0 CA-C-N 116.154 -0.476 . . . . 0.0 109.856 -177.341 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 30' ' ' GLY . . . . . . . . . . . . . . . -64.44 -34.78 90.83 Favored Glycine 0 N--CA 1.446 -0.664 0 C-N-CA 121.4 -0.429 . . . . 0.0 112.375 179.64 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 31' ' ' TYR . . . . . . . . . . . . . 33.0 p90 -99.03 -36.53 9.69 Favored 'General case' 0 N--CA 1.439 -1.003 0 N-CA-C 113.35 0.87 . . . . 0.0 113.35 178.042 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 32' ' ' TYR . . . . . . . . . . . . . 37.2 m-85 -70.86 -46.61 62.34 Favored 'General case' 0 C--N 1.309 -1.169 0 N-CA-C 112.859 0.689 . . . . 0.0 112.859 177.052 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 33' ' ' CYS . . . . . . . . . . . . . 47.7 m -136.45 61.03 35.72 Favored Pre-proline 0 C--O 1.254 1.335 0 N-CA-C 112.266 0.469 . . . . 0.0 112.266 -173.324 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 34' ' ' PRO . . . . . 0.499 ' HA ' ' CD1' ' A' ' 39' ' ' PHE . 46.0 Cg_endo -65.35 -25.67 56.43 Favored 'Trans proline' 0 C--N 1.359 1.126 0 C-N-CA 121.825 1.683 . . . . 0.0 111.948 -178.567 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 35' ' ' VAL . . . . . . . . . . . . . 61.7 t -86.41 -49.64 14.89 Favored 'Isoleucine or valine' 0 C--N 1.299 -1.607 0 C-N-CA 120.573 -0.451 . . . . 0.0 111.134 -177.725 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 36' ' ' THR . . . . . . . . . . . . . 56.5 m -59.78 -42.22 92.85 Favored 'General case' 0 C--N 1.316 -0.879 0 CA-C-O 121.049 0.452 . . . . 0.0 111.615 -178.945 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 37' ' ' CYS . . . . . 0.414 ' HB2' ' CE1' ' A' ' 39' ' ' PHE . 77.4 m -85.02 1.57 47.04 Favored 'General case' 0 C--N 1.309 -1.183 0 N-CA-C 113.12 0.785 . . . . 0.0 113.12 -178.072 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 38' ' ' GLY . . . . . . . . . . . . . . . 74.26 45.38 25.08 Favored Glycine 0 CA--C 1.521 0.419 0 C-N-CA 120.546 -0.835 . . . . 0.0 114.879 174.913 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 39' ' ' PHE . . . . . 0.499 ' CD1' ' HA ' ' A' ' 34' ' ' PRO . 95.4 m-85 -94.11 -16.87 23.37 Favored 'General case' 0 C--N 1.309 -1.155 0 N-CA-C 108.581 -0.896 . . . . 0.0 108.581 174.07 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 40' ' ' CYS . . . . . 0.475 ' SG ' ' HB2' ' A' ' 34' ' ' PRO . 40.0 m . . . . . 0 C--N 1.313 -1.001 0 CA-C-N 115.048 -0.978 . . . . 0.0 110.132 -176.803 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 4' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.427 -1.617 0 N-CA-C 108.2 -1.037 . . . . 0.0 108.2 . . . . . . . . . 0 0 . 1 . 019 nuclear build core ' A' A ' 5' ' ' ASP . . . . . 0.639 ' HB3' ' SG ' ' A' ' 11' ' ' CYS . 18.5 m-20 -55.91 131.33 46.82 Favored 'General case' 0 C--N 1.309 -1.155 0 O-C-N 123.96 0.787 . . . . 0.0 109.764 178.633 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 9.6 tp10 -61.71 139.39 58.31 Favored 'General case' 0 C--N 1.312 -1.049 0 C-N-CA 123.654 0.782 . . . . 0.0 110.854 -177.545 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 7' ' ' LYS . . . . . . . . . . . . . 18.6 ptpt -85.18 -26.56 26.71 Favored 'General case' 0 C--N 1.309 -1.162 0 N-CA-C 112.932 0.715 . . . . 0.0 112.932 -174.215 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 8' ' ' ASN . . . . . . . . . . . . . 10.5 p30 -92.62 7.38 43.62 Favored 'General case' 0 C--N 1.306 -1.305 0 CA-C-O 121.745 0.783 . . . . 0.0 110.415 178.453 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 9' ' ' PHE . . . . . . . . . . . . . 47.6 t80 -118.57 139.45 51.45 Favored 'General case' 0 N--CA 1.43 -1.464 0 N-CA-C 106.594 -1.632 . . . . 0.0 106.594 178.168 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 10' ' ' ASP . . . . . . . . . . . . . 10.2 t70 -96.96 105.05 17.11 Favored 'General case' 0 C--N 1.301 -1.519 0 C-N-CA 119.369 -0.932 . . . . 0.0 109.534 178.945 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 11' ' ' CYS . . . . . 0.639 ' SG ' ' HB3' ' A' ' 5' ' ' ASP . 73.9 m -74.94 -29.22 60.89 Favored 'General case' 0 C--N 1.292 -1.926 0 CA-C-N 115.642 -0.708 . . . . 0.0 112.866 -177.502 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 12' ' ' ARG . . . . . . . . . . . . . 20.0 mmm180 -72.07 -46.19 57.8 Favored 'General case' 0 CA--C 1.511 -0.536 0 C-N-CA 120.305 -0.558 . . . . 0.0 109.519 -176.09 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 41.0 ttp180 -59.08 -52.15 66.96 Favored 'General case' 0 C--O 1.205 -1.281 0 CA-C-N 114.851 -1.068 . . . . 0.0 109.421 177.996 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 14' ' ' SER . . . . . . . . . . . . . 40.6 m -58.33 -36.27 73.16 Favored 'General case' 0 C--N 1.32 -0.715 0 CA-C-N 116.066 -0.516 . . . . 0.0 111.742 -177.839 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 41.9 tp -69.73 -45.98 66.96 Favored 'General case' 0 N--CA 1.442 -0.846 0 CA-C-O 121.059 0.457 . . . . 0.0 110.065 178.987 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 16' ' ' ARG . . . . . 0.402 ' O ' ' HD2' ' A' ' 16' ' ' ARG . 2.4 tmm_? -68.54 -37.3 79.85 Favored 'General case' 0 N--CA 1.437 -1.095 0 CA-C-N 115.815 -0.63 . . . . 0.0 110.275 -179.349 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 17' ' ' ASN . . . . . . . . . . . . . 6.6 m-20 -68.37 -40.55 81.39 Favored 'General case' 0 CA--C 1.501 -0.92 0 CA-C-N 116.125 -0.488 . . . . 0.0 111.405 -178.535 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . 120.78 8.99 7.84 Favored Glycine 0 N--CA 1.435 -1.414 0 C-N-CA 119.869 -1.158 . . . . 0.0 112.252 -179.874 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 19' ' ' ASP . . . . . . . . . . . . . 3.5 m-20 -65.97 -29.1 69.44 Favored 'General case' 0 C--N 1.32 -0.715 0 CA-C-O 121.064 0.459 . . . . 0.0 110.811 -179.808 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 20' ' ' CYS . . . . . 0.416 ' HA ' ' HG3' ' A' ' 29' ' ' MET . 45.6 t -92.69 0.28 57.4 Favored 'General case' 0 C--N 1.31 -1.121 0 CA-C-O 121.447 0.641 . . . . 0.0 110.331 -178.535 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 21' ' ' ASP . . . . . . . . . . . . . 31.8 t70 -113.09 -11.07 13.38 Favored 'General case' 0 C--N 1.317 -0.83 0 CA-C-O 122.036 0.922 . . . . 0.0 109.238 177.638 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 22' ' ' ASN . . . . . . . . . . . . . 28.6 t-20 -87.98 117.33 26.77 Favored 'General case' 0 C--N 1.301 -1.539 0 CA-C-N 114.919 -1.037 . . . . 0.0 109.784 -178.382 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 23' ' ' ASP . . . . . . . . . . . . . 18.1 t70 -50.98 -45.55 61.01 Favored 'General case' 0 N--CA 1.477 0.888 0 N-CA-C 114.073 1.138 . . . . 0.0 114.073 -172.105 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 3.8 p30 -72.22 -10.02 59.23 Favored 'General case' 0 C--N 1.315 -0.915 0 N-CA-C 113.371 0.878 . . . . 0.0 113.371 -176.468 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 25' ' ' LYS . . . . . . . . . . . . . 87.8 mttt -107.67 -7.04 16.55 Favored 'General case' 0 C--N 1.322 -0.602 0 O-C-N 122.039 -0.413 . . . . 0.0 111.683 178.954 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 26' ' ' LEU . . . . . . . . . . . . . 92.8 mt -52.85 -51.89 59.26 Favored 'General case' 0 N--CA 1.472 0.633 0 N-CA-C 113.858 1.059 . . . . 0.0 113.858 -175.271 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 27' ' ' LEU . . . . . . . . . . . . . 2.3 tm? -58.5 -41.78 86.14 Favored 'General case' 0 N--CA 1.436 -1.149 0 C-N-CA 122.688 0.395 . . . . 0.0 109.965 -179.306 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 28' ' ' GLU . . . . . 0.588 ' HA ' ' CZ ' ' A' ' 31' ' ' TYR . 80.8 mt-10 -62.96 -37.16 85.99 Favored 'General case' 0 CA--C 1.511 -0.526 0 CA-C-N 116.021 -0.536 . . . . 0.0 110.038 179.309 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 29' ' ' MET . . . . . 0.416 ' HG3' ' HA ' ' A' ' 20' ' ' CYS . 81.3 mmm -72.94 -24.84 60.86 Favored 'General case' 0 C--N 1.309 -1.186 0 CA-C-N 115.252 -0.885 . . . . 0.0 110.765 -178.22 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 30' ' ' GLY . . . . . 0.471 ' HA2' ' CE1' ' A' ' 39' ' ' PHE . . . -68.74 -24.84 75.42 Favored Glycine 0 C--N 1.312 -0.787 0 CA-C-N 115.365 -0.834 . . . . 0.0 112.55 178.182 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 31' ' ' TYR . . . . . 0.588 ' CZ ' ' HA ' ' A' ' 28' ' ' GLU 0.255 22.5 p90 -101.52 -37.67 8.3 Favored 'General case' 0 CA--C 1.5 -0.942 0 C-N-CA 119.628 -0.829 . . . . 0.0 112.787 174.883 . . . . . . . . 3 3 . 1 . 019 nuclear build core ' A' A ' 32' ' ' TYR . . . . . . . . . . . . . 28.2 m-85 -65.38 -49.28 69.91 Favored 'General case' 0 C--N 1.308 -1.226 0 N-CA-C 112.959 0.725 . . . . 0.0 112.959 176.61 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 33' ' ' CYS . . . . . . . . . . . . . 36.7 m -135.25 72.6 65.83 Favored Pre-proline 0 C--N 1.308 -1.222 0 C-N-CA 119.938 -0.705 . . . . 0.0 111.1 -177.074 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 34' ' ' PRO . . . . . 0.405 ' HD2' ' HA ' ' A' ' 5' ' ' ASP . 60.1 Cg_endo -69.26 -24.17 32.24 Favored 'Trans proline' 0 N--CA 1.45 -1.031 0 C-N-CA 122.261 1.974 . . . . 0.0 112.053 -177.436 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 35' ' ' VAL . . . . . 0.584 ' HB ' ' OD1' ' A' ' 5' ' ' ASP . 49.6 t -87.2 -46.13 16.21 Favored 'Isoleucine or valine' 0 C--N 1.301 -1.528 0 C-N-CA 119.907 -0.717 . . . . 0.0 110.571 -178.432 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 36' ' ' THR . . . . . . . . . . . . . 21.1 m -62.37 -37.18 84.73 Favored 'General case' 0 C--N 1.314 -0.955 0 CA-C-N 115.58 -0.737 . . . . 0.0 111.295 179.424 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 37' ' ' CYS . . . . . . . . . . . . . 84.4 m -92.37 11.18 26.89 Favored 'General case' 0 C--N 1.313 -0.98 0 N-CA-C 112.921 0.712 . . . . 0.0 112.921 -179.831 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 38' ' ' GLY . . . . . . . . . . . . . . . 68.85 45.5 64.02 Favored Glycine 0 CA--C 1.519 0.337 0 N-CA-C 116.002 1.161 . . . . 0.0 116.002 171.827 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 39' ' ' PHE . . . . . 0.471 ' CE1' ' HA2' ' A' ' 30' ' ' GLY . 96.8 m-85 -100.24 -30.98 11.6 Favored 'General case' 0 C--N 1.302 -1.488 0 N-CA-C 108.825 -0.805 . . . . 0.0 108.825 174.051 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 40' ' ' CYS . . . . . . . . . . . . . 75.6 m . . . . . 0 C--N 1.311 -1.095 0 CA-C-N 115.339 -0.846 . . . . 0.0 109.366 178.601 . . . . . . . . 0 0 . 1 . 020 nuclear build core ' A' A ' 4' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.44 -0.934 0 N-CA-C 108.361 -0.977 . . . . 0.0 108.361 . . . . . . . . . 0 0 . 1 . 020 nuclear build core ' A' A ' 5' ' ' ASP . . . . . 0.566 ' OD2' ' HB ' ' A' ' 35' ' ' VAL . 7.7 m-20 -70.11 148.68 48.45 Favored 'General case' 0 C--N 1.316 -0.859 0 N-CA-C 109.189 -0.671 . . . . 0.0 109.189 179.82 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 0.6 OUTLIER -72.52 152.08 42.09 Favored 'General case' 0 C--N 1.307 -1.259 0 N-CA-C 108.28 -1.007 . . . . 0.0 108.28 -179.095 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 7' ' ' LYS . . . . . . . . . . . . . 9.1 ptpp? -82.03 -35.32 28.94 Favored 'General case' 0 C--N 1.316 -0.879 0 N-CA-C 112.723 0.638 . . . . 0.0 112.723 -172.786 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 8' ' ' ASN . . . . . . . . . . . . . 30.7 m-80 -84.64 -31.21 24.32 Favored 'General case' 0 CA--C 1.486 -1.487 0 N-CA-C 109.29 -0.633 . . . . 0.0 109.29 -175.727 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 9' ' ' PHE . . . . . . . . . . . . . 26.6 t80 -75.12 129.05 36.9 Favored 'General case' 0 N--CA 1.424 -1.758 0 CA-C-N 114.901 -1.045 . . . . 0.0 108.744 -178.76 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 10' ' ' ASP . . . . . . . . . . . . . 9.1 t70 -89.43 102.65 15.32 Favored 'General case' 0 C--N 1.304 -1.385 0 N-CA-C 108.97 -0.752 . . . . 0.0 108.97 -179.461 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 11' ' ' CYS . . . . . 0.465 ' SG ' ' HB3' ' A' ' 5' ' ' ASP . 83.8 m -77.87 -28.55 50.04 Favored 'General case' 0 C--N 1.29 -2.018 0 CA-C-N 115.972 -0.558 . . . . 0.0 111.261 -177.299 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 12' ' ' ARG . . . . . . . . . . . . . 37.5 mmt180 -61.95 -50.27 72.82 Favored 'General case' 0 C--O 1.24 0.579 0 CA-C-O 120.998 0.428 . . . . 0.0 110.074 179.229 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 34.3 ttm180 -59.64 -55.11 38.55 Favored 'General case' 0 C--O 1.208 -1.107 0 CA-C-N 115.026 -0.988 . . . . 0.0 109.236 178.074 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 14' ' ' SER . . . . . . . . . . . . . 18.5 m -60.48 -36.61 78.71 Favored 'General case' 0 C--N 1.307 -1.26 0 CA-C-N 115.599 -0.728 . . . . 0.0 112.747 -174.094 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 45.8 tp -68.86 -47.77 65.1 Favored 'General case' 0 C--N 1.32 -0.68 0 C-N-CA 120.406 -0.517 . . . . 0.0 110.101 178.161 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 16' ' ' ARG . . . . . . . . . . . . . 60.7 mtp180 -71.78 -31.16 66.32 Favored 'General case' 0 C--N 1.324 -0.511 0 CA-C-N 115.923 -0.581 . . . . 0.0 112.008 -177.395 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 17' ' ' ASN . . . . . . . . . . . . . 5.6 m-20 -71.73 -33.2 68.51 Favored 'General case' 0 CA--C 1.494 -1.173 0 CA-C-N 116.424 -0.353 . . . . 0.0 111.467 -179.72 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . 116.81 10.2 10.31 Favored Glycine 0 N--CA 1.431 -1.671 0 C-N-CA 119.587 -1.292 . . . . 0.0 112.393 178.75 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 19' ' ' ASP . . . . . . . . . . . . . 4.1 m-20 -65.83 -35.5 80.84 Favored 'General case' 0 CA--C 1.494 -1.183 0 CA-C-O 121.156 0.503 . . . . 0.0 110.769 -179.018 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 20' ' ' CYS . . . . . . . . . . . . . 39.1 t -79.93 -12.45 59.73 Favored 'General case' 0 C--N 1.301 -1.513 0 CA-C-N 115.729 -0.668 . . . . 0.0 110.253 -176.758 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 21' ' ' ASP . . . . . . . . . . . . . 38.3 t70 -107.58 -0.36 22.08 Favored 'General case' 0 C--N 1.318 -0.797 0 CA-C-O 122.249 1.023 . . . . 0.0 109.146 177.108 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 22' ' ' ASN . . . . . . . . . . . . . 47.8 t-20 -87.83 118.77 27.58 Favored 'General case' 0 C--N 1.304 -1.379 0 CA-C-N 115.286 -0.87 . . . . 0.0 108.657 -179.509 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 23' ' ' ASP . . . . . 0.471 ' HA ' ' HG ' ' A' ' 26' ' ' LEU . 2.7 m-20 -53.08 -44.09 67.25 Favored 'General case' 0 C--N 1.32 -0.702 0 C-N-CA 123.694 0.798 . . . . 0.0 112.499 -177.566 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 23.0 t70 -64.69 -31.48 72.73 Favored 'General case' 0 C--N 1.318 -0.779 0 N-CA-C 112.122 0.416 . . . . 0.0 112.122 -178.737 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 25' ' ' LYS . . . . . . . . . . . . . 88.8 mttt -98.31 -5.29 33.25 Favored 'General case' 0 C--N 1.305 -1.326 0 N-CA-C 112.917 0.71 . . . . 0.0 112.917 -176.024 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 26' ' ' LEU . . . . . 0.471 ' HG ' ' HA ' ' A' ' 23' ' ' ASP . 83.9 mt -49.2 -54.36 16.92 Favored 'General case' 0 N--CA 1.482 1.172 0 N-CA-C 113.651 0.982 . . . . 0.0 113.651 -176.941 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 27' ' ' LEU . . . . . . . . . . . . . 2.2 tm? -57.71 -45.46 85.7 Favored 'General case' 0 N--CA 1.434 -1.251 0 N-CA-C 109.736 -0.468 . . . . 0.0 109.736 -177.503 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 28' ' ' GLU . . . . . . . . . . . . . 13.2 mm-40 -61.76 -37.66 85.14 Favored 'General case' 0 C--N 1.327 -0.402 0 CA-C-N 115.4 -0.818 . . . . 0.0 110.277 -178.047 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 29' ' ' MET . . . . . . . . . . . . . 80.2 mmm -73.76 -26.18 60.53 Favored 'General case' 0 C--N 1.307 -1.252 0 CA-C-N 114.907 -1.042 . . . . 0.0 111.609 -174.342 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 30' ' ' GLY . . . . . 0.471 ' HA2' ' CE2' ' A' ' 39' ' ' PHE . . . -68.07 -33.21 78.28 Favored Glycine 0 N--CA 1.439 -1.138 0 CA-C-N 115.46 -0.791 . . . . 0.0 112.758 -179.678 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 31' ' ' TYR . . . . . . . . . . . . . 44.8 p90 -96.98 -33.32 11.61 Favored 'General case' 0 CA--C 1.498 -1.028 0 C-N-CA 118.86 -1.136 . . . . 0.0 113.207 178.46 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 32' ' ' TYR . . . . . . . . . . . . . 36.5 m-85 -69.13 -42.99 75.27 Favored 'General case' 0 C--N 1.304 -1.413 0 N-CA-C 112.717 0.636 . . . . 0.0 112.717 175.96 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 33' ' ' CYS . . . . . . . . . . . . . 44.8 m -135.45 68.35 67.5 Favored Pre-proline 0 C--O 1.246 0.917 0 C-N-CA 120.194 -0.602 . . . . 0.0 112.007 -179.165 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 34' ' ' PRO . . . . . 0.532 ' HD2' ' HA ' ' A' ' 5' ' ' ASP . 58.4 Cg_endo -69.72 -23.65 30.73 Favored 'Trans proline' 0 C--N 1.355 0.889 0 C-N-CA 122.026 1.818 . . . . 0.0 111.931 -178.777 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 35' ' ' VAL . . . . . 0.566 ' HB ' ' OD2' ' A' ' 5' ' ' ASP . 66.1 t -86.54 -52.36 11.95 Favored 'Isoleucine or valine' 0 C--N 1.295 -1.797 0 C-N-CA 120.144 -0.622 . . . . 0.0 110.544 -178.086 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 36' ' ' THR . . . . . . . . . . . . . 23.3 m -60.41 -27.11 67.2 Favored 'General case' 0 CA--C 1.556 1.176 0 C-N-CA 123.188 0.595 . . . . 0.0 111.887 -178.195 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 37' ' ' CYS . . . . . . . . . . . . . 67.4 m -99.73 5.39 45.69 Favored 'General case' 0 C--N 1.319 -0.719 0 N-CA-C 113.792 1.034 . . . . 0.0 113.792 179.736 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 38' ' ' GLY . . . . . . . . . . . . . . . 76.93 34.72 41.57 Favored Glycine 0 CA--C 1.525 0.683 0 N-CA-C 115.426 0.931 . . . . 0.0 115.426 174.624 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 39' ' ' PHE . . . . . 0.488 ' CD2' ' HA ' ' A' ' 34' ' ' PRO . 90.2 m-85 -88.89 -44.37 10.51 Favored 'General case' 0 C--N 1.311 -1.079 0 N-CA-C 108.252 -1.018 . . . . 0.0 108.252 175.102 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 40' ' ' CYS . . . . . . . . . . . . . 57.9 m . . . . . 0 C--N 1.305 -1.359 0 CA-C-N 114.737 -1.119 . . . . 0.0 109.024 -179.266 . . . . . . . . 0 0 . 1 . 001 nuclear build full ' A' A ' 1' ' ' GLU . . . . . . . . . . . . . 9.7 tp10 . . . . . 0 N--CA 1.445 -0.696 0 N-CA-C 109.368 -0.604 . . . . 0.0 109.368 . . . . . . . . . 0 0 . 1 . 001 nuclear build full ' A' A ' 2' ' ' HIS . . . . . . . . . . . . . 40.0 m80 -84.92 112.29 20.44 Favored 'General case' 0 C--N 1.315 -0.911 0 N-CA-C 107.463 -1.31 . . . . 0.0 107.463 174.98 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 3' ' ' CYS . . . . . . . . . . . . . 23.6 p -85.04 146.76 27.01 Favored 'General case' 0 C--N 1.29 -2.01 0 CA-C-N 115.05 -0.977 . . . . 0.0 112.06 -171.702 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 4' ' ' ALA . . . . . . . . . . . . . . . -152.01 132.11 13.5 Favored 'General case' 0 C--N 1.306 -1.325 0 N-CA-C 108.353 -0.98 . . . . 0.0 108.353 177.65 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 5' ' ' ASP . . . . . 0.693 ' OD2' ' HB ' ' A' ' 35' ' ' VAL . 16.6 m-20 -59.85 141.56 55.16 Favored 'General case' 0 C--O 1.253 1.265 0 O-C-N 123.728 0.643 . . . . 0.0 110.068 177.001 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 0.2 OUTLIER -69.22 152.02 45.59 Favored 'General case' 0 C--N 1.307 -1.277 0 CA-C-N 115.678 -0.692 . . . . 0.0 109.63 -178.394 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 7' ' ' LYS . . . . . . . . . . . . . 8.6 ptpp? -85.61 -34.49 21.39 Favored 'General case' 0 C--N 1.31 -1.132 0 C-N-CA 123.659 0.784 . . . . 0.0 112.845 -175.875 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 8' ' ' ASN . . . . . . . . . . . . . 90.2 m-20 -94.33 -21.05 19.23 Favored 'General case' 0 C--N 1.299 -1.587 0 CA-C-N 115.978 -0.555 . . . . 0.0 111.108 -175.803 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 9' ' ' PHE . . . . . 0.583 ' HD2' ' SG ' ' A' ' 33' ' ' CYS . 37.3 t80 -83.55 129.42 34.97 Favored 'General case' 0 C--N 1.301 -1.507 0 N-CA-C 107.013 -1.477 . . . . 0.0 107.013 175.953 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 10' ' ' ASP . . . . . . . . . . . . . 12.5 t70 -86.76 107.05 18.09 Favored 'General case' 0 C--N 1.307 -1.28 0 C-N-CA 118.762 -1.175 . . . . 0.0 110.111 -179.831 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 11' ' ' CYS . . . . . 0.527 ' SG ' ' HB3' ' A' ' 5' ' ' ASP . 50.9 m -73.58 -27.34 61.26 Favored 'General case' 0 C--N 1.297 -1.706 0 CA-C-N 114.901 -1.045 . . . . 0.0 111.822 -176.406 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 12' ' ' ARG . . . . . . . . . . . . . 34.4 mmt180 -76.66 -45.88 28.01 Favored 'General case' 0 CA--C 1.506 -0.735 0 CA-C-O 120.859 0.362 . . . . 0.0 110.304 -175.217 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 37.2 ttm180 -61.26 -49.66 76.17 Favored 'General case' 0 C--N 1.31 -1.152 0 CA-C-N 115.384 -0.825 . . . . 0.0 109.239 178.616 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 14' ' ' SER . . . . . . . . . . . . . 23.7 m -59.86 -35.19 74.28 Favored 'General case' 0 CA--C 1.547 0.837 0 O-C-N 123.678 0.611 . . . . 0.0 111.629 -178.752 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 47.6 tp -71.69 -41.48 68.59 Favored 'General case' 0 C--N 1.322 -0.616 0 N-CA-C 109.643 -0.502 . . . . 0.0 109.643 178.316 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 16' ' ' ARG . . . . . . . . . . . . . 21.0 tpp180 -67.46 -35.06 78.46 Favored 'General case' 0 N--CA 1.427 -1.604 0 C-N-CA 123.9 0.88 . . . . 0.0 111.47 179.908 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 17' ' ' ASN . . . . . . . . . . . . . 86.0 m-20 -67.96 -47.4 68.75 Favored 'General case' 0 CA--C 1.5 -0.95 0 N-CA-C 108.611 -0.885 . . . . 0.0 108.611 178.266 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . 113.23 19.26 6.79 Favored Glycine 0 N--CA 1.421 -2.311 0 CA-C-N 114.426 -1.261 . . . . 0.0 110.518 -176.056 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 19' ' ' ASP . . . . . . . . . . . . . 10.4 m-20 -58.33 -38.99 78.26 Favored 'General case' 0 CA--C 1.5 -0.971 0 CA-C-O 121.276 0.56 . . . . 0.0 110.055 179.666 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 20' ' ' CYS . . . . . 0.436 ' HA ' ' HG3' ' A' ' 29' ' ' MET . 34.8 t -78.43 -4.01 46.24 Favored 'General case' 0 C--N 1.306 -1.296 0 CA-C-N 115.623 -0.717 . . . . 0.0 111.977 -176.395 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 21' ' ' ASP . . . . . . . . . . . . . 12.3 t70 -99.35 -9.72 23.18 Favored 'General case' 0 C--N 1.315 -0.923 0 CA-C-O 122.233 1.015 . . . . 0.0 108.469 178.402 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 22' ' ' ASN . . . . . . . . . . . . . 25.0 t-20 -84.3 122.59 29.12 Favored 'General case' 0 C--N 1.315 -0.915 0 CA-C-N 114.765 -1.107 . . . . 0.0 108.19 178.902 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 23' ' ' ASP . . . . . . . . . . . . . 20.1 t70 -55.2 -41.47 72.03 Favored 'General case' 0 C--N 1.318 -0.765 0 N-CA-C 113.266 0.839 . . . . 0.0 113.266 -176.368 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 14.4 m-20 -78.44 -16.33 57.69 Favored 'General case' 0 C--N 1.311 -1.073 0 CA-C-O 121.51 0.671 . . . . 0.0 111.405 -176.345 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 25' ' ' LYS . . . . . . . . . . . . . 34.9 mttm -95.06 -7.46 39.49 Favored 'General case' 0 C--N 1.303 -1.445 0 CA-C-N 115.87 -0.605 . . . . 0.0 111.74 176.588 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 26' ' ' LEU . . . . . . . . . . . . . 85.7 mt -55.74 -43.92 77.06 Favored 'General case' 0 C--N 1.314 -0.951 0 O-C-N 123.141 0.275 . . . . 0.0 111.043 176.881 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 27' ' ' LEU . . . . . . . . . . . . . 24.1 tp -57.21 -49.49 75.83 Favored 'General case' 0 N--CA 1.436 -1.162 0 CA-C-O 121.327 0.584 . . . . 0.0 109.498 176.987 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 28' ' ' GLU . . . . . . . . . . . . . 40.3 tt0 -58.19 -36.94 73.82 Favored 'General case' 0 C--N 1.325 -0.464 0 CA-C-N 114.559 -1.201 . . . . 0.0 109.977 -179.266 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 29' ' ' MET . . . . . 0.436 ' HG3' ' HA ' ' A' ' 20' ' ' CYS . 82.7 mmm -83.89 -23.23 31.33 Favored 'General case' 0 C--N 1.3 -1.554 0 CA-C-N 115.173 -0.921 . . . . 0.0 111.658 -174.825 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 30' ' ' GLY . . . . . . . . . . . . . . . -66.77 -28.46 73.78 Favored Glycine 0 C--N 1.308 -1.027 0 CA-C-N 115.192 -0.913 . . . . 0.0 112.234 179.638 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 31' ' ' TYR . . . . . . . . . . . . . 30.0 p90 -105.0 -34.01 8.14 Favored 'General case' 0 N--CA 1.435 -1.221 0 N-CA-C 113.404 0.89 . . . . 0.0 113.404 177.06 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 32' ' ' TYR . . . . . 0.422 ' HB3' ' CD2' ' A' ' 9' ' ' PHE . 19.2 m-85 -71.44 -62.05 1.55 Allowed 'General case' 0 C--N 1.308 -1.229 0 N-CA-C 113.623 0.971 . . . . 0.0 113.623 178.33 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 33' ' ' CYS . . . . . 0.583 ' SG ' ' HD2' ' A' ' 9' ' ' PHE . 62.6 m -134.31 70.3 73.17 Favored Pre-proline 0 C--N 1.299 -1.63 0 C-N-CA 119.896 -0.721 . . . . 0.0 110.988 -177.31 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 34' ' ' PRO . . . . . . . . . . . . . 71.7 Cg_endo -75.87 -23.77 12.11 Favored 'Trans proline' 0 N--CA 1.445 -1.331 0 C-N-CA 122.154 1.903 . . . . 0.0 112.438 -175.408 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 35' ' ' VAL . . . . . 0.693 ' HB ' ' OD2' ' A' ' 5' ' ' ASP . 39.3 t -82.73 -36.72 13.52 Favored 'Isoleucine or valine' 0 N--CA 1.424 -1.751 0 N-CA-C 108.826 -0.805 . . . . 0.0 108.826 -177.145 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 36' ' ' THR . . . . . . . . . . . . . 48.2 m -64.12 -34.86 79.01 Favored 'General case' 0 CA--C 1.546 0.804 0 CA-C-N 115.305 -0.861 . . . . 0.0 110.635 175.362 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 37' ' ' CYS . . . . . . . . . . . . . 90.9 m -84.79 2.11 43.71 Favored 'General case' 0 C--N 1.322 -0.59 0 CA-C-O 121.087 0.47 . . . . 0.0 112.243 177.767 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 38' ' ' GLY . . . . . . . . . . . . . . . 69.58 26.58 74.33 Favored Glycine 0 N--CA 1.445 -0.744 0 CA-C-N 116.124 -0.489 . . . . 0.0 114.224 176.086 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 39' ' ' PHE . . . . . . . . . . . . . 26.8 m-85 -75.05 -34.66 61.87 Favored 'General case' 0 CA--C 1.507 -0.687 0 N-CA-C 108.464 -0.939 . . . . 0.0 108.464 178.402 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 40' ' ' CYS . . . . . . . . . . . . . 3.3 p -159.55 86.28 0.79 Allowed 'General case' 0 C--N 1.306 -1.285 0 CA-C-N 114.537 -1.211 . . . . 0.0 109.989 -179.488 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 41' ' ' NH2 . . . . . . . . . . . . . . . . . . . . 0 C--N 1.307 -1.248 0 CA-C-N 116.11 -0.495 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 002 nuclear build full ' A' A ' 1' ' ' GLU . . . . . . . . . . . . . 11.3 pt-20 . . . . . 0 C--O 1.236 0.375 0 N-CA-C 109.262 -0.644 . . . . 0.0 109.262 . . . . . . . . . 0 0 . 1 . 002 nuclear build full ' A' A ' 2' ' ' HIS . . . . . . . . . . . . . 69.1 m-70 -107.1 112.18 24.98 Favored 'General case' 0 C--N 1.304 -1.39 0 N-CA-C 109.107 -0.701 . . . . 0.0 109.107 177.464 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 3' ' ' CYS . . . . . . . . . . . . . 26.3 p -71.58 102.59 2.77 Favored 'General case' 0 N--CA 1.438 -1.064 0 N-CA-C 108.501 -0.925 . . . . 0.0 108.501 176.073 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 4' ' ' ALA . . . . . . . . . . . . . . . -147.61 145.43 28.99 Favored 'General case' 0 C--N 1.305 -1.328 0 CA-C-N 115.685 -0.688 . . . . 0.0 109.571 -176.435 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 5' ' ' ASP . . . . . 0.626 ' OD2' ' HB ' ' A' ' 35' ' ' VAL . 4.2 m-20 -65.55 160.79 21.61 Favored 'General case' 0 C--N 1.307 -1.244 0 O-C-N 123.779 0.674 . . . . 0.0 109.803 179.381 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 6' ' ' GLU . . . . . 0.448 ' HB3' ' HB3' ' A' ' 9' ' ' PHE . 0.6 OUTLIER -71.25 139.87 50.19 Favored 'General case' 0 C--N 1.309 -1.179 0 N-CA-C 106.537 -1.653 . . . . 0.0 106.537 179.147 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 7' ' ' LYS . . . . . . . . . . . . . 19.5 ptmt -82.19 -26.56 33.25 Favored 'General case' 0 C--N 1.303 -1.421 0 N-CA-C 113.691 0.997 . . . . 0.0 113.691 -171.098 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 8' ' ' ASN . . . . . . . . . . . . . 37.8 m-80 -89.86 -31.22 17.43 Favored 'General case' 0 C--N 1.294 -1.809 0 CA-C-O 121.451 0.644 . . . . 0.0 109.4 -179.23 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 9' ' ' PHE . . . . . 0.457 ' CD2' ' HB3' ' A' ' 32' ' ' TYR . 32.9 t80 -76.55 119.37 20.29 Favored 'General case' 0 N--CA 1.424 -1.771 0 N-CA-C 107.751 -1.203 . . . . 0.0 107.751 176.691 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 10' ' ' ASP . . . . . . . . . . . . . 15.4 t70 -88.39 96.14 10.48 Favored 'General case' 0 C--N 1.294 -1.828 0 N-CA-C 109.002 -0.74 . . . . 0.0 109.002 -179.905 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 11' ' ' CYS . . . . . . . . . . . . . 96.1 m -70.35 -19.53 63.04 Favored 'General case' 0 C--N 1.312 -1.036 0 CA-C-N 115.387 -0.824 . . . . 0.0 111.902 -178.441 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 12' ' ' ARG . . . . . . . . . . . . . 36.3 mmt180 -66.8 -43.36 84.06 Favored 'General case' 0 C--N 1.319 -0.746 0 N-CA-C 108.805 -0.813 . . . . 0.0 108.805 178.287 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 58.6 ttp180 -64.01 -50.08 69.91 Favored 'General case' 0 C--O 1.211 -0.953 0 CA-C-N 115.327 -0.851 . . . . 0.0 109.511 175.52 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 14' ' ' SER . . . . . . . . . . . . . 11.7 m -57.4 -40.07 77.46 Favored 'General case' 0 C--O 1.252 1.194 0 C-N-CA 122.909 0.483 . . . . 0.0 112.087 -178.621 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 46.0 tp -64.77 -41.14 96.1 Favored 'General case' 0 C--N 1.327 -0.388 0 CA-C-O 121.306 0.574 . . . . 0.0 110.259 179.686 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 16' ' ' ARG . . . . . . . . . . . . . 60.5 mtm180 -77.82 -28.2 50.2 Favored 'General case' 0 C--N 1.305 -1.342 0 CA-C-N 116.036 -0.529 . . . . 0.0 111.475 179.523 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 17' ' ' ASN . . . . . . . . . . . . . 7.2 m-20 -69.1 -25.93 64.67 Favored 'General case' 0 N--CA 1.477 0.899 0 CA-C-N 115.811 -0.631 . . . . 0.0 111.226 178.277 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . 102.89 6.4 46.11 Favored Glycine 0 N--CA 1.439 -1.101 0 C-N-CA 120.527 -0.844 . . . . 0.0 112.273 178.024 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 19' ' ' ASP . . . . . . . . . . . . . 15.6 m-20 -73.13 -27.25 61.57 Favored 'General case' 0 CA--C 1.504 -0.805 0 CA-C-O 120.937 0.398 . . . . 0.0 111.53 -178.631 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 20' ' ' CYS . . . . . 0.44 ' HA ' ' HG3' ' A' ' 29' ' ' MET . 46.6 t -81.29 -9.91 59.67 Favored 'General case' 0 C--N 1.306 -1.303 0 CA-C-O 121.669 0.747 . . . . 0.0 110.051 179.92 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 21' ' ' ASP . . . . . . . . . . . . . 28.3 t70 -101.67 -8.9 21.37 Favored 'General case' 0 C--N 1.318 -0.791 0 CA-C-O 121.998 0.904 . . . . 0.0 108.946 177.509 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 22' ' ' ASN . . . . . . . . . . . . . 52.5 t-20 -88.09 123.06 32.38 Favored 'General case' 0 C--N 1.305 -1.368 0 CA-C-N 115.453 -0.794 . . . . 0.0 109.215 -178.896 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 23' ' ' ASP . . . . . 0.407 ' HA ' ' HG ' ' A' ' 26' ' ' LEU . 6.9 m-20 -59.38 -35.34 73.75 Favored 'General case' 0 CA--C 1.507 -0.688 0 C-N-CA 123.61 0.764 . . . . 0.0 111.466 179.857 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 11.8 t70 -66.6 -32.6 74.03 Favored 'General case' 0 C--N 1.311 -1.104 0 C-N-CA 123.59 0.756 . . . . 0.0 111.802 -179.207 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 25' ' ' LYS . . . . . 0.519 ' O ' ' HG2' ' A' ' 29' ' ' MET . 33.8 mmtp -94.01 -2.44 53.01 Favored 'General case' 0 C--N 1.31 -1.117 0 CA-C-N 116.124 -0.489 . . . . 0.0 112.234 -177.358 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 26' ' ' LEU . . . . . 0.407 ' HG ' ' HA ' ' A' ' 23' ' ' ASP . 88.6 mt -58.89 -38.6 79.22 Favored 'General case' 0 N--CA 1.469 0.504 0 N-CA-C 112.834 0.679 . . . . 0.0 112.834 -176.95 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 27' ' ' LEU . . . . . . . . . . . . . 24.4 tp -55.28 -49.89 70.93 Favored 'General case' 0 N--CA 1.437 -1.092 0 N-CA-C 109.436 -0.579 . . . . 0.0 109.436 176.376 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 28' ' ' GLU . . . . . . . . . . . . . 5.7 mm-40 -61.86 -36.78 82.26 Favored 'General case' 0 C--N 1.324 -0.518 0 CA-C-N 114.603 -1.18 . . . . 0.0 109.141 -179.22 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 29' ' ' MET . . . . . 0.519 ' HG2' ' O ' ' A' ' 25' ' ' LYS . 22.3 mmt -70.94 -27.45 63.77 Favored 'General case' 0 C--O 1.203 -1.384 0 CA-C-N 115.203 -0.908 . . . . 0.0 110.885 -175.324 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 30' ' ' GLY . . . . . . . . . . . . . . . -68.42 -34.4 79.49 Favored Glycine 0 C--N 1.312 -0.777 0 C-N-CA 120.186 -1.007 . . . . 0.0 112.768 -178.321 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 31' ' ' TYR . . . . . . . . . . . . . 36.3 p90 -103.15 -27.6 12.44 Favored 'General case' 0 N--CA 1.441 -0.883 0 N-CA-C 113.663 0.986 . . . . 0.0 113.663 179.913 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 32' ' ' TYR . . . . . 0.457 ' HB3' ' CD2' ' A' ' 9' ' ' PHE . 23.0 m-85 -83.35 -36.83 24.06 Favored 'General case' 0 C--N 1.29 -2.018 0 N-CA-C 112.626 0.602 . . . . 0.0 112.626 175.852 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 33' ' ' CYS . . . . . . . . . . . . . 61.0 m -134.71 49.86 4.26 Favored Pre-proline 0 CA--C 1.565 1.528 0 N-CA-C 113.369 0.878 . . . . 0.0 113.369 -174.893 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 34' ' ' PRO . . . . . 0.563 ' HD2' ' HA ' ' A' ' 5' ' ' ASP . 21.7 Cg_endo -57.33 -32.3 93.43 Favored 'Trans proline' 0 C--N 1.38 2.21 0 C-N-CA 122.733 2.289 . . . . 0.0 113.591 -178.916 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 35' ' ' VAL . . . . . 0.626 ' HB ' ' OD2' ' A' ' 5' ' ' ASP . 45.3 t -87.07 -46.76 16.21 Favored 'Isoleucine or valine' 0 C--N 1.299 -1.629 0 C-N-CA 119.917 -0.713 . . . . 0.0 110.892 -177.46 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 36' ' ' THR . . . . . . . . . . . . . 19.5 m -61.56 -40.95 96.56 Favored 'General case' 0 C--N 1.312 -1.053 0 CA-C-N 115.972 -0.558 . . . . 0.0 111.769 -177.336 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 37' ' ' CYS . . . . . . . . . . . . . 94.4 m -91.95 10.91 26.92 Favored 'General case' 0 C--N 1.312 -1.058 0 N-CA-C 113.173 0.805 . . . . 0.0 113.173 -179.163 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 38' ' ' GLY . . . . . . . . . . . . . . . 69.87 48.61 40.33 Favored Glycine 0 CA--C 1.524 0.645 0 N-CA-C 115.761 1.064 . . . . 0.0 115.761 172.908 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 39' ' ' PHE . . . . . 0.522 ' CD2' ' HA ' ' A' ' 34' ' ' PRO . 93.1 m-85 -96.32 -40.1 9.3 Favored 'General case' 0 C--N 1.303 -1.424 0 N-CA-C 107.749 -1.204 . . . . 0.0 107.749 173.183 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 40' ' ' CYS . . . . . . . . . . . . . 49.8 t -148.9 89.41 1.67 Allowed 'General case' 0 C--N 1.309 -1.156 0 N-CA-C 107.878 -1.156 . . . . 0.0 107.878 179.868 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 41' ' ' NH2 . . . . . . . . . . . . . . . . . . . . 0 C--N 1.302 -1.479 0 CA-C-N 116.657 -0.247 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 003 nuclear build full ' A' A ' 1' ' ' GLU . . . . . . . . . . . . . 9.7 tp10 . . . . . 0 C--O 1.241 0.624 0 N-CA-C 108.46 -0.941 . . . . 0.0 108.46 . . . . . . . . . 0 0 . 1 . 003 nuclear build full ' A' A ' 2' ' ' HIS . . . . . . . . . . . . . 40.4 m80 -96.42 110.36 22.73 Favored 'General case' 0 N--CA 1.432 -1.344 0 N-CA-C 108.711 -0.848 . . . . 0.0 108.711 178.728 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 3' ' ' CYS . . . . . 0.465 ' HB3' ' O ' ' A' ' 40' ' ' CYS . 60.7 m -87.46 84.9 7.09 Favored 'General case' 0 C--N 1.297 -1.705 0 CA-C-N 115.876 -0.602 . . . . 0.0 110.903 179.571 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 4' ' ' ALA . . . . . . . . . . . . . . . -152.5 133.68 14.28 Favored 'General case' 0 C--N 1.302 -1.486 0 N-CA-C 108.64 -0.874 . . . . 0.0 108.64 178.847 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 5' ' ' ASP . . . . . 0.582 ' HB3' ' SG ' ' A' ' 11' ' ' CYS . 44.4 m-20 -60.69 141.62 56.63 Favored 'General case' 0 C--N 1.317 -0.825 0 O-C-N 123.733 0.645 . . . . 0.0 110.2 178.945 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 13.3 tp10 -64.11 140.39 58.86 Favored 'General case' 0 N--CA 1.443 -0.825 0 C-N-CA 123.682 0.793 . . . . 0.0 111.543 -178.95 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 7' ' ' LYS . . . . . . . . . . . . . 10.3 ptpp? -85.18 -29.97 24.3 Favored 'General case' 0 N--CA 1.441 -0.905 0 C-N-CA 124.353 1.061 . . . . 0.0 111.227 -176.498 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 8' ' ' ASN . . . . . . . . . . . . . 44.9 m-80 -86.74 -9.17 56.52 Favored 'General case' 0 C--N 1.308 -1.208 0 CA-C-O 121.817 0.818 . . . . 0.0 110.83 -178.497 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 9' ' ' PHE . . . . . . . . . . . . . 36.5 t80 -112.16 144.96 40.68 Favored 'General case' 0 C--N 1.287 -2.12 0 N-CA-C 105.524 -2.028 . . . . 0.0 105.524 -178.834 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 10' ' ' ASP . . . . . . . . . . . . . 15.3 t70 -104.49 98.77 8.49 Favored 'General case' 0 C--N 1.304 -1.403 0 C-N-CA 117.779 -1.568 . . . . 0.0 110.417 179.274 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 11' ' ' CYS . . . . . 0.582 ' SG ' ' HB3' ' A' ' 5' ' ' ASP . 76.1 m -68.33 -20.34 64.72 Favored 'General case' 0 C--N 1.304 -1.393 0 CA-C-N 114.51 -1.223 . . . . 0.0 112.274 -177.924 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 12' ' ' ARG . . . . . . . . . . . . . 7.3 mmt180 -76.6 -46.58 25.51 Favored 'General case' 0 C--N 1.315 -0.899 0 N-CA-C 107.628 -1.249 . . . . 0.0 107.628 -176.793 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 54.9 ttp180 -61.91 -40.95 97.25 Favored 'General case' 0 C--O 1.213 -0.846 0 CA-C-N 115.501 -0.772 . . . . 0.0 109.504 175.51 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 14' ' ' SER . . . . . . . . . . . . . 23.4 m -65.84 -28.02 68.67 Favored 'General case' 0 C--N 1.318 -0.773 0 CA-C-O 121.18 0.515 . . . . 0.0 111.252 179.01 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 2.3 tm? -77.56 -39.36 46.04 Favored 'General case' 0 C--N 1.316 -0.87 0 N-CA-C 107.803 -1.184 . . . . 0.0 107.803 177.267 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 16' ' ' ARG . . . . . . . . . . . . . 23.7 mtp180 -68.24 -44.89 74.65 Favored 'General case' 0 C--N 1.323 -0.548 0 CA-C-N 115.633 -0.712 . . . . 0.0 111.817 179.326 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 17' ' ' ASN . . . . . . . . . . . . . 85.3 m-20 -64.96 -37.95 89.35 Favored 'General case' 0 CA--C 1.496 -1.131 0 CA-C-O 121.67 0.747 . . . . 0.0 109.111 177.164 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . 107.74 5.45 33.63 Favored Glycine 0 N--CA 1.416 -2.657 0 CA-C-N 114.652 -1.158 . . . . 0.0 111.5 -179.122 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 19' ' ' ASP . . . . . . . . . . . . . 30.5 m-20 -57.9 -38.22 75.44 Favored 'General case' 0 N--CA 1.494 1.775 0 CA-C-O 121.618 0.723 . . . . 0.0 109.299 179.345 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 20' ' ' CYS . . . . . . . . . . . . . 44.5 t -61.45 -25.55 67.3 Favored 'General case' 0 C--N 1.31 -1.144 0 CA-C-N 114.198 -1.365 . . . . 0.0 111.982 -178.117 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 21' ' ' ASP . . . . . . . . . . . . . 28.5 t70 -111.28 -9.25 14.3 Favored 'General case' 0 C--N 1.319 -0.725 0 CA-C-O 121.646 0.736 . . . . 0.0 110.248 -179.194 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 22' ' ' ASN . . . . . . . . . . . . . 51.8 t-20 -75.54 119.51 19.7 Favored 'General case' 0 C--N 1.313 -0.996 0 CA-C-N 115.317 -0.856 . . . . 0.0 108.904 -177.272 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 23' ' ' ASP . . . . . 0.44 ' HA ' ' HG ' ' A' ' 26' ' ' LEU . 6.1 m-20 -54.06 -36.71 63.4 Favored 'General case' 0 CA--C 1.501 -0.914 0 C-N-CA 123.545 0.738 . . . . 0.0 112.505 -177.906 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 35.8 m-20 -72.62 -21.41 61.11 Favored 'General case' 0 C--N 1.308 -1.205 0 CA-C-N 115.969 -0.56 . . . . 0.0 111.504 -175.549 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 25' ' ' LYS . . . . . 0.525 ' O ' ' HG2' ' A' ' 29' ' ' MET . 13.3 mptt -104.6 -5.19 21.69 Favored 'General case' 0 C--N 1.311 -1.08 0 N-CA-C 112.1 0.407 . . . . 0.0 112.1 178.29 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 26' ' ' LEU . . . . . 0.44 ' HG ' ' HA ' ' A' ' 23' ' ' ASP . 62.8 mt -52.07 -38.88 58.63 Favored 'General case' 0 N--CA 1.479 0.981 0 N-CA-C 114.657 1.354 . . . . 0.0 114.657 -175.162 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 27' ' ' LEU . . . . . . . . . . . . . 29.6 tp -54.81 -52.72 61.82 Favored 'General case' 0 N--CA 1.44 -0.953 0 CA-C-O 121.048 0.451 . . . . 0.0 109.935 178.059 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 28' ' ' GLU . . . . . 0.5 ' HA ' ' CE2' ' A' ' 31' ' ' TYR . 43.6 mt-10 -65.2 -33.2 75.43 Favored 'General case' 0 N--CA 1.442 -0.829 0 CA-C-N 115.296 -0.865 . . . . 0.0 109.685 -178.197 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 29' ' ' MET . . . . . 0.525 ' HG2' ' O ' ' A' ' 25' ' ' LYS . 72.7 mmm -75.75 -26.54 57.5 Favored 'General case' 0 C--N 1.31 -1.151 0 CA-C-N 115.263 -0.88 . . . . 0.0 111.003 -174.71 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 30' ' ' GLY . . . . . 0.458 ' HA2' ' CE2' ' A' ' 39' ' ' PHE . . . -65.63 -37.31 93.45 Favored Glycine 0 CA--C 1.494 -1.232 0 O-C-N 123.944 0.778 . . . . 0.0 112.174 -178.955 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 31' ' ' TYR . . . . . 0.5 ' CE2' ' HA ' ' A' ' 28' ' ' GLU . 52.3 p90 -96.72 -34.74 11.24 Favored 'General case' 0 N--CA 1.433 -1.307 0 C-N-CA 119.697 -0.801 . . . . 0.0 112.755 178.901 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 32' ' ' TYR . . . . . . . . . . . . . 27.5 m-85 -69.71 -50.42 43.79 Favored 'General case' 0 C--N 1.312 -1.024 0 N-CA-C 112.954 0.724 . . . . 0.0 112.954 177.403 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 33' ' ' CYS . . . . . . . . . . . . . 29.8 m -130.45 69.58 82.16 Favored Pre-proline 0 C--O 1.259 1.574 0 C-N-CA 120.128 -0.629 . . . . 0.0 111.388 -175.836 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 34' ' ' PRO . . . . . 0.434 ' HA ' ' HD2' ' A' ' 39' ' ' PHE . 38.2 Cg_endo -65.28 -26.54 56.37 Favored 'Trans proline' 0 C--N 1.362 1.268 0 C-N-CA 122.429 2.086 . . . . 0.0 112.067 -177.944 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 35' ' ' VAL . . . . . . . . . . . . . 33.5 t -86.78 -49.89 14.52 Favored 'Isoleucine or valine' 0 N--CA 1.433 -1.302 0 CA-C-N 116.091 -0.504 . . . . 0.0 110.966 -176.198 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 36' ' ' THR . . . . . . . . . . . . . 29.0 m -55.68 -52.14 64.87 Favored 'General case' 0 C--N 1.316 -0.875 0 C-N-CA 123.28 0.632 . . . . 0.0 112.644 -177.685 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 37' ' ' CYS . . . . . 0.604 ' HB2' ' CE2' ' A' ' 39' ' ' PHE . 59.6 m -76.83 -11.43 59.83 Favored 'General case' 0 C--N 1.305 -1.333 0 N-CA-C 112.659 0.614 . . . . 0.0 112.659 -176.886 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 38' ' ' GLY . . . . . . . . . . . . . . . 88.97 46.78 4.38 Favored Glycine 0 N--CA 1.442 -0.96 0 C-N-CA 120.391 -0.909 . . . . 0.0 113.724 176.827 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 39' ' ' PHE . . . . . 0.604 ' CE2' ' HB2' ' A' ' 37' ' ' CYS . 98.1 m-85 -98.31 -59.88 1.66 Allowed 'General case' 0 C--N 1.308 -1.225 0 N-CA-C 108.51 -0.922 . . . . 0.0 108.51 176.374 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 40' ' ' CYS . . . . . 0.465 ' O ' ' HB3' ' A' ' 3' ' ' CYS . 42.2 t -147.72 101.69 3.35 Favored 'General case' 0 C--N 1.307 -1.271 0 N-CA-C 108.05 -1.093 . . . . 0.0 108.05 -177.065 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 41' ' ' NH2 . . . . . . . . . . . . . . . . . . . . 0 C--N 1.303 -1.417 0 O-C-N 122.369 -0.207 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 004 nuclear build full ' A' A ' 1' ' ' GLU . . . . . . . . . . . . . 7.1 tp10 . . . . . 0 N--CA 1.452 -0.326 0 N-CA-C 109.084 -0.71 . . . . 0.0 109.084 . . . . . . . . . 0 0 . 1 . 004 nuclear build full ' A' A ' 2' ' ' HIS . . . . . . . . . . . . . 21.5 p80 -87.7 116.95 26.19 Favored 'General case' 0 C--N 1.313 -0.99 0 C-N-CA 119.696 -0.802 . . . . 0.0 108.975 176.006 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 3' ' ' CYS . . . . . . . . . . . . . 22.5 p -81.8 112.39 18.9 Favored 'General case' 0 C--N 1.302 -1.469 0 CA-C-N 115.93 -0.577 . . . . 0.0 110.184 -177.296 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 4' ' ' ALA . . . . . . . . . . . . . . . -143.7 135.7 26.59 Favored 'General case' 0 C--N 1.309 -1.175 0 N-CA-C 109.879 -0.415 . . . . 0.0 109.879 -179.861 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 5' ' ' ASP . . . . . 0.458 ' HA ' ' HD2' ' A' ' 34' ' ' PRO . 61.4 m-20 -66.24 149.8 49.79 Favored 'General case' 0 C--O 1.256 1.414 0 N-CA-C 109.174 -0.676 . . . . 0.0 109.174 176.182 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 6' ' ' GLU . . . . . 0.408 ' HB3' ' HB3' ' A' ' 9' ' ' PHE . 10.4 tp10 -65.81 144.64 56.72 Favored 'General case' 0 C--N 1.302 -1.484 0 C-N-CA 123.665 0.786 . . . . 0.0 110.679 -179.243 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 7' ' ' LYS . . . . . . . . . . . . . 11.3 ptpp? -85.45 -25.78 26.72 Favored 'General case' 0 C--N 1.321 -0.631 0 CA-C-O 121.047 0.451 . . . . 0.0 111.927 -174.76 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 8' ' ' ASN . . . . . . . . . . . . . 10.7 p30 -98.05 5.33 48.83 Favored 'General case' 0 C--N 1.313 -0.992 0 CA-C-O 121.471 0.653 . . . . 0.0 111.11 -179.361 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 9' ' ' PHE . . . . . 0.408 ' HB3' ' HB3' ' A' ' 6' ' ' GLU . 39.2 t80 -120.99 141.01 51.11 Favored 'General case' 0 C--N 1.298 -1.659 0 N-CA-C 107.21 -1.404 . . . . 0.0 107.21 -178.731 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 10' ' ' ASP . . . . . . . . . . . . . 14.1 t70 -104.53 107.78 18.88 Favored 'General case' 0 N--CA 1.434 -1.231 0 C-N-CA 118.792 -1.163 . . . . 0.0 110.295 179.026 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 11' ' ' CYS . . . . . . . . . . . . . 72.1 m -78.01 -22.75 48.8 Favored 'General case' 0 C--N 1.278 -2.535 0 CA-C-N 114.748 -1.114 . . . . 0.0 112.997 -177.499 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 12' ' ' ARG . . . . . 0.432 ' O ' ' HG3' ' A' ' 16' ' ' ARG . 18.9 mmm180 -68.84 -45.25 71.62 Favored 'General case' 0 C--N 1.323 -0.545 0 N-CA-C 108.86 -0.793 . . . . 0.0 108.86 177.633 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 39.4 ttm180 -57.45 -48.77 78.29 Favored 'General case' 0 C--N 1.312 -1.037 0 CA-C-N 115.19 -0.914 . . . . 0.0 110.236 176.441 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 14' ' ' SER . . . . . . . . . . . . . 24.0 m -59.96 -35.09 74.21 Favored 'General case' 0 C--N 1.313 -1.0 0 CA-C-N 115.455 -0.793 . . . . 0.0 110.995 178.981 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 15' ' ' LEU . . . . . 0.452 ' HA ' ' HB3' ' A' ' 20' ' ' CYS . 35.0 tp -72.66 -40.87 65.98 Favored 'General case' 0 C--N 1.32 -0.699 0 CA-C-N 116.113 -0.494 . . . . 0.0 110.306 178.769 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 16' ' ' ARG . . . . . 0.432 ' HG3' ' O ' ' A' ' 12' ' ' ARG . 97.8 mtt180 -68.29 -31.45 70.89 Favored 'General case' 0 C--N 1.316 -0.867 0 N-CA-C 112.44 0.533 . . . . 0.0 112.44 -179.889 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 17' ' ' ASN . . . . . . . . . . . . . 40.4 m-80 -88.7 -24.16 22.79 Favored 'General case' 0 CA--C 1.497 -1.088 0 N-CA-C 113.353 0.871 . . . . 0.0 113.353 -177.384 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . 110.42 5.11 28.39 Favored Glycine 0 C--N 1.301 -1.365 0 C-N-CA 119.044 -1.55 . . . . 0.0 112.834 178.654 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 19' ' ' ASP . . . . . . . . . . . . . 21.5 m-20 -70.23 -32.64 70.6 Favored 'General case' 0 CA--C 1.498 -1.025 0 CA-C-O 121.429 0.633 . . . . 0.0 109.564 -179.697 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 20' ' ' CYS . . . . . 0.452 ' HB3' ' HA ' ' A' ' 15' ' ' LEU . 45.4 t -78.5 -11.91 59.98 Favored 'General case' 0 C--N 1.304 -1.388 0 CA-C-N 114.624 -1.171 . . . . 0.0 110.419 -178.694 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 21' ' ' ASP . . . . . . . . . . . . . 26.5 t70 -106.33 -10.26 16.44 Favored 'General case' 0 C--N 1.319 -0.741 0 CA-C-O 121.651 0.739 . . . . 0.0 110.167 -179.531 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 22' ' ' ASN . . . . . 0.414 ' O ' ' HG ' ' A' ' 26' ' ' LEU . 25.9 t-20 -86.13 121.62 28.99 Favored 'General case' 0 C--N 1.302 -1.483 0 CA-C-N 115.237 -0.892 . . . . 0.0 109.984 -175.332 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 23' ' ' ASP . . . . . . . . . . . . . 24.7 t70 -61.18 -38.47 86.62 Favored 'General case' 0 C--N 1.32 -0.704 0 O-C-N 123.576 0.548 . . . . 0.0 112.453 -174.757 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 13.8 m-20 -64.8 -32.67 74.46 Favored 'General case' 0 N--CA 1.482 1.164 0 CA-C-O 121.466 0.651 . . . . 0.0 110.814 179.235 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 25' ' ' LYS . . . . . 0.469 ' O ' ' HG2' ' A' ' 29' ' ' MET . 13.5 mmmm -88.11 -11.49 46.86 Favored 'General case' 0 C--N 1.311 -1.073 0 CA-C-N 115.671 -0.695 . . . . 0.0 111.605 -177.162 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 26' ' ' LEU . . . . . 0.414 ' HG ' ' O ' ' A' ' 22' ' ' ASN . 60.1 mt -58.1 -31.25 66.95 Favored 'General case' 0 C--O 1.221 -0.422 0 N-CA-C 114.132 1.16 . . . . 0.0 114.132 -176.421 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 27' ' ' LEU . . . . . . . . . . . . . 34.3 tp -56.35 -52.03 66.07 Favored 'General case' 0 N--CA 1.44 -0.955 0 CA-C-O 121.441 0.639 . . . . 0.0 109.356 176.445 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 28' ' ' GLU . . . . . 0.544 ' HA ' ' CE2' ' A' ' 31' ' ' TYR . 44.5 mt-10 -65.93 -31.83 72.98 Favored 'General case' 0 N--CA 1.434 -1.246 0 CA-C-N 114.679 -1.146 . . . . 0.0 109.606 179.884 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 29' ' ' MET . . . . . 0.469 ' HG2' ' O ' ' A' ' 25' ' ' LYS . 22.2 mmt -74.21 -24.77 59.38 Favored 'General case' 0 C--O 1.196 -1.754 0 CA-C-N 115.924 -0.58 . . . . 0.0 110.193 -176.623 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 30' ' ' GLY . . . . . . . . . . . . . . . -71.01 -25.47 75.71 Favored Glycine 0 N--CA 1.448 -0.501 0 C-N-CA 120.501 -0.857 . . . . 0.0 112.046 -179.489 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 31' ' ' TYR . . . . . 0.544 ' CE2' ' HA ' ' A' ' 28' ' ' GLU . 52.7 p90 -105.33 -34.65 7.79 Favored 'General case' 0 N--CA 1.429 -1.482 0 C-N-CA 119.342 -0.943 . . . . 0.0 113.142 176.921 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 32' ' ' TYR . . . . . . . . . . . . . 32.8 m-85 -74.11 -43.56 57.12 Favored 'General case' 0 C--N 1.302 -1.49 0 C-N-CA 120.8 -0.36 . . . . 0.0 111.964 176.075 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 33' ' ' CYS . . . . . . . . . . . . . 39.9 m -135.44 57.61 20.92 Favored Pre-proline 0 C--O 1.253 1.243 0 N-CA-C 112.889 0.7 . . . . 0.0 112.889 -172.799 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 34' ' ' PRO . . . . . 0.512 ' HA ' ' CD2' ' A' ' 39' ' ' PHE . 37.5 Cg_endo -64.19 -27.08 64.59 Favored 'Trans proline' 0 C--N 1.364 1.345 0 C-N-CA 121.874 1.716 . . . . 0.0 111.798 -179.041 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 35' ' ' VAL . . . . . . . . . . . . . 44.4 t -86.95 -56.48 5.24 Favored 'Isoleucine or valine' 0 N--CA 1.43 -1.448 0 CA-C-N 115.794 -0.639 . . . . 0.0 110.945 -177.197 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 36' ' ' THR . . . . . . . . . . . . . 97.4 m -59.27 -39.82 84.13 Favored 'General case' 0 CA--C 1.549 0.907 0 N-CA-C 112.738 0.644 . . . . 0.0 112.738 -177.217 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 37' ' ' CYS . . . . . 0.436 ' HB2' ' CE2' ' A' ' 39' ' ' PHE . 90.4 m -81.16 2.2 28.61 Favored 'General case' 0 C--N 1.31 -1.11 0 N-CA-C 113.235 0.828 . . . . 0.0 113.235 -179.843 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 38' ' ' GLY . . . . . . . . . . . . . . . 77.12 23.39 68.86 Favored Glycine 0 N--CA 1.447 -0.584 0 N-CA-C 114.901 0.721 . . . . 0.0 114.901 174.123 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 39' ' ' PHE . . . . . 0.512 ' CD2' ' HA ' ' A' ' 34' ' ' PRO . 97.9 m-85 -72.45 -51.17 21.43 Favored 'General case' 0 C--N 1.317 -0.828 0 N-CA-C 106.917 -1.512 . . . . 0.0 106.917 175.273 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 40' ' ' CYS . . . . . . . . . . . . . 51.3 t -127.07 91.52 3.35 Favored 'General case' 0 N--CA 1.43 -1.467 0 CA-C-N 114.168 -1.378 . . . . 0.0 108.028 178.433 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 41' ' ' NH2 . . . . . . . . . . . . . . . . . . . . 0 C--N 1.302 -1.468 0 CA-C-N 116.48 -0.327 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 005 nuclear build full ' A' A ' 1' ' ' GLU . . . . . . . . . . . . . 41.4 tt0 . . . . . 0 CA--C 1.503 -0.849 0 N-CA-C 109.788 -0.449 . . . . 0.0 109.788 . . . . . . . . . 0 0 . 1 . 005 nuclear build full ' A' A ' 2' ' ' HIS . . . . . . . . . . . . . 4.0 p80 -106.92 116.9 32.73 Favored 'General case' 0 C--N 1.293 -1.851 0 N-CA-C 108.269 -1.012 . . . . 0.0 108.269 173.817 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 3' ' ' CYS . . . . . . . . . . . . . 69.1 m -79.34 83.51 5.36 Favored 'General case' 0 C--N 1.294 -1.81 0 CA-C-O 121.966 0.889 . . . . 0.0 111.409 -178.935 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 4' ' ' ALA . . . . . . . . . . . . . . . -152.24 115.52 4.72 Favored 'General case' 0 N--CA 1.427 -1.585 0 CA-C-N 114.164 -1.38 . . . . 0.0 108.107 177.809 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 5' ' ' ASP . . . . . 0.637 ' OD2' ' HB ' ' A' ' 35' ' ' VAL . 11.0 m-20 -60.89 146.21 47.4 Favored 'General case' 0 C--N 1.316 -0.857 0 N-CA-C 109.407 -0.59 . . . . 0.0 109.407 175.124 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 9.7 tp10 -72.15 142.03 49.1 Favored 'General case' 0 C--N 1.31 -1.15 0 C-N-CA 123.077 0.551 . . . . 0.0 111.006 -178.781 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 7' ' ' LYS . . . . . . . . . . . . . 18.3 ptmt -85.72 -27.87 25.0 Favored 'General case' 0 C--N 1.326 -0.416 0 CA-C-O 122.32 1.057 . . . . 0.0 110.812 179.663 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 8' ' ' ASN . . . . . . . . . . . . . 19.5 m120 -88.06 15.76 6.96 Favored 'General case' 0 C--N 1.305 -1.365 0 CA-C-N 114.819 -1.082 . . . . 0.0 110.616 -178.713 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 9' ' ' PHE . . . . . . . . . . . . . 40.3 t80 -142.17 143.24 32.87 Favored 'General case' 0 N--CA 1.414 -2.255 0 N-CA-C 104.59 -2.374 . . . . 0.0 104.59 179.275 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 10' ' ' ASP . . . . . 0.424 ' OD1' ' HD3' ' A' ' 12' ' ' ARG . 20.1 t70 -104.7 104.0 13.72 Favored 'General case' 0 C--N 1.302 -1.458 0 C-N-CA 118.144 -1.422 . . . . 0.0 111.009 179.062 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 11' ' ' CYS . . . . . 0.503 ' SG ' ' HB3' ' A' ' 5' ' ' ASP . 71.7 m -71.32 -16.2 62.44 Favored 'General case' 0 C--N 1.301 -1.511 0 CA-C-N 115.073 -0.967 . . . . 0.0 113.562 -177.885 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 12' ' ' ARG . . . . . 0.424 ' HD3' ' OD1' ' A' ' 10' ' ' ASP . 3.9 mpt_? -70.5 -51.22 30.44 Favored 'General case' 0 CA--C 1.493 -1.215 0 N-CA-C 106.62 -1.622 . . . . 0.0 106.62 178.533 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 41.3 ttm180 -49.77 -53.01 27.67 Favored 'General case' 0 C--N 1.319 -0.725 0 CA-C-N 114.168 -1.378 . . . . 0.0 110.513 175.905 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 14' ' ' SER . . . . . . . . . . . . . 12.2 m -55.18 -38.76 68.75 Favored 'General case' 0 C--O 1.253 1.283 0 CA-C-N 115.923 -0.581 . . . . 0.0 111.691 179.748 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 15' ' ' LEU . . . . . 0.456 ' HA ' ' HB3' ' A' ' 20' ' ' CYS . 30.6 tp -79.03 -36.94 40.28 Favored 'General case' 0 C--N 1.327 -0.393 0 CA-C-N 116.436 -0.347 . . . . 0.0 111.008 -178.323 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 16' ' ' ARG . . . . . . . . . . . . . 98.4 mtt180 -65.92 -37.23 85.54 Favored 'General case' 0 C--N 1.315 -0.895 0 CA-C-O 121.296 0.569 . . . . 0.0 110.707 177.966 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 17' ' ' ASN . . . . . . . . . . . . . 91.9 m-20 -76.0 -43.32 44.84 Favored 'General case' 0 CA--C 1.494 -1.201 0 CA-C-N 115.771 -0.649 . . . . 0.0 110.531 179.152 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . 112.94 7.36 21.76 Favored Glycine 0 C--N 1.297 -1.635 0 C-N-CA 119.882 -1.151 . . . . 0.0 111.783 177.794 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 19' ' ' ASP . . . . . . . . . . . . . 12.7 m-20 -68.87 -31.81 71.02 Favored 'General case' 0 C--O 1.212 -0.906 0 N-CA-C 108.267 -1.012 . . . . 0.0 108.267 177.918 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 20' ' ' CYS . . . . . 0.456 ' HB3' ' HA ' ' A' ' 15' ' ' LEU . 45.3 t -69.84 -10.06 57.04 Favored 'General case' 0 C--N 1.309 -1.179 0 CA-C-N 114.076 -1.42 . . . . 0.0 111.272 -179.264 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 21' ' ' ASP . . . . . . . . . . . . . 35.1 t70 -116.69 -8.92 11.38 Favored 'General case' 0 N--CA 1.468 0.43 0 CA-C-O 121.446 0.641 . . . . 0.0 110.388 -179.597 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 22' ' ' ASN . . . . . 0.495 ' O ' ' HG ' ' A' ' 26' ' ' LEU . 34.5 t30 -87.83 128.9 35.34 Favored 'General case' 0 C--N 1.324 -0.541 0 CA-C-N 115.575 -0.739 . . . . 0.0 111.706 -175.925 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 23' ' ' ASP . . . . . . . . . . . . . 5.6 p-10 -52.05 -43.94 64.04 Favored 'General case' 0 C--O 1.241 0.622 0 C-N-CA 124.84 1.256 . . . . 0.0 113.826 -176.057 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 2.8 p30 -74.17 -13.86 60.87 Favored 'General case' 0 N--CA 1.473 0.714 0 C-N-CA 120.331 -0.548 . . . . 0.0 112.404 -176.272 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 25' ' ' LYS . . . . . 0.476 ' O ' ' HG2' ' A' ' 29' ' ' MET . 46.5 mmtm -100.05 -13.35 19.07 Favored 'General case' 0 C--N 1.309 -1.17 0 C-N-CA 120.916 -0.314 . . . . 0.0 110.898 179.795 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 26' ' ' LEU . . . . . 0.495 ' HG ' ' O ' ' A' ' 22' ' ' ASN . 84.6 mt -56.67 -40.96 76.46 Favored 'General case' 0 C--O 1.2 -1.528 0 N-CA-C 115.4 1.63 . . . . 0.0 115.4 -171.707 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 27' ' ' LEU . . . . . . . . . . . . . 20.1 tp -61.01 -44.83 96.84 Favored 'General case' 0 N--CA 1.442 -0.851 0 CA-C-N 119.042 0.837 . . . . 0.0 110.007 -179.377 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 28' ' ' GLU . . . . . 0.494 ' HA ' ' CE1' ' A' ' 31' ' ' TYR . 40.1 tt0 -65.6 -34.27 77.84 Favored 'General case' 0 C--O 1.242 0.695 0 CA-C-N 115.431 -0.804 . . . . 0.0 108.969 178.945 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 29' ' ' MET . . . . . 0.476 ' HG2' ' O ' ' A' ' 25' ' ' LYS . 25.0 mmt -75.22 -23.58 57.6 Favored 'General case' 0 C--O 1.202 -1.434 0 CA-C-N 114.844 -1.071 . . . . 0.0 109.488 -178.365 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 30' ' ' GLY . . . . . . . . . . . . . . . -62.45 -40.75 99.48 Favored Glycine 0 N--CA 1.436 -1.325 0 CA-C-N 116.165 -0.471 . . . . 0.0 111.947 -179.678 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 31' ' ' TYR . . . . . 0.494 ' CE1' ' HA ' ' A' ' 28' ' ' GLU . 29.7 p90 -93.29 -35.8 12.89 Favored 'General case' 0 C--N 1.305 -1.367 0 C-N-CA 119.704 -0.799 . . . . 0.0 112.859 179.03 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 32' ' ' TYR . . . . . . . . . . . . . 24.8 m-85 -73.12 -44.54 60.09 Favored 'General case' 0 C--N 1.309 -1.156 0 N-CA-C 114.173 1.175 . . . . 0.0 114.173 178.076 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 33' ' ' CYS . . . . . . . . . . . . . 62.3 m -138.19 60.72 23.42 Favored Pre-proline 0 C--N 1.308 -1.214 0 N-CA-C 111.596 0.221 . . . . 0.0 111.596 -175.602 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 34' ' ' PRO . . . . . 0.477 ' HD2' ' HA ' ' A' ' 5' ' ' ASP . 32.1 Cg_endo -63.22 -29.57 73.61 Favored 'Trans proline' 0 C--N 1.363 1.305 0 C-N-CA 122.008 1.805 . . . . 0.0 112.279 -176.927 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 35' ' ' VAL . . . . . 0.637 ' HB ' ' OD2' ' A' ' 5' ' ' ASP . 43.3 t -87.35 -46.36 16.13 Favored 'Isoleucine or valine' 0 N--CA 1.428 -1.549 0 CA-C-N 116.149 -0.478 . . . . 0.0 111.656 -175.835 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 36' ' ' THR . . . . . . . . . . . . . 22.1 m -65.23 -38.6 90.91 Favored 'General case' 0 C--N 1.315 -0.892 0 CA-C-N 116.119 -0.491 . . . . 0.0 111.228 -178.8 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 37' ' ' CYS . . . . . 0.428 ' SG ' ' HB3' ' A' ' 29' ' ' MET . 76.4 m -84.73 0.99 48.59 Favored 'General case' 0 C--N 1.316 -0.88 0 N-CA-C 112.845 0.683 . . . . 0.0 112.845 -178.978 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 38' ' ' GLY . . . . . . . . . . . . . . . 81.61 21.31 62.16 Favored Glycine 0 N--CA 1.448 -0.533 0 N-CA-C 116.028 1.171 . . . . 0.0 116.028 172.777 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 39' ' ' PHE . . . . . 0.426 ' CD2' ' HA ' ' A' ' 34' ' ' PRO . 97.4 m-85 -73.53 -44.64 57.11 Favored 'General case' 0 CA--C 1.501 -0.904 0 N-CA-C 107.481 -1.303 . . . . 0.0 107.481 175.021 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 40' ' ' CYS . . . . . . . . . . . . . 61.5 m -106.63 97.74 7.5 Favored 'General case' 0 C--N 1.295 -1.765 0 CA-C-N 114.237 -1.347 . . . . 0.0 108.088 176.591 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 41' ' ' NH2 . . . . . . . . . . . . . . . . . . . . 0 C--N 1.31 -1.111 0 CA-C-N 116.755 -0.202 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 006 nuclear build full ' A' A ' 1' ' ' GLU . . . . . . . . . . . . . 9.7 pt-20 . . . . . 0 CA--C 1.509 -0.619 0 N-CA-C 109.522 -0.547 . . . . 0.0 109.522 . . . . . . . . . 0 0 . 1 . 006 nuclear build full ' A' A ' 2' ' ' HIS . . . . . . . . . . . . . 46.9 t-80 -94.58 118.64 32.0 Favored 'General case' 0 C--N 1.307 -1.274 0 N-CA-C 107.779 -1.193 . . . . 0.0 107.779 175.219 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 3' ' ' CYS . . . . . . . . . . . . . 24.6 p -76.58 112.04 12.69 Favored 'General case' 0 C--N 1.303 -1.45 0 CA-C-O 121.518 0.675 . . . . 0.0 111.445 -178.481 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 4' ' ' ALA . . . . . . . . . . . . . . . -141.41 154.54 45.66 Favored 'General case' 0 N--CA 1.429 -1.501 0 N-CA-C 107.487 -1.301 . . . . 0.0 107.487 178.677 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 5' ' ' ASP . . . . . 0.529 ' OD2' ' HB ' ' A' ' 35' ' ' VAL . 11.7 m-20 -65.15 155.63 34.28 Favored 'General case' 0 C--N 1.313 -1.021 0 O-C-N 123.517 0.511 . . . . 0.0 110.476 -179.654 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 0.5 OUTLIER -84.39 151.12 24.89 Favored 'General case' 0 C--N 1.306 -1.317 0 N-CA-C 108.278 -1.008 . . . . 0.0 108.278 179.824 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 7' ' ' LYS . . . . . . . . . . . . . 7.2 ptpp? -85.4 -36.31 20.77 Favored 'General case' 0 C--N 1.316 -0.852 0 N-CA-C 112.89 0.7 . . . . 0.0 112.89 -174.141 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 8' ' ' ASN . . . . . . . . . . . . . 92.3 m-20 -87.12 -29.37 21.88 Favored 'General case' 0 C--N 1.294 -1.825 0 N-CA-C 109.493 -0.558 . . . . 0.0 109.493 -176.58 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 9' ' ' PHE . . . . . . . . . . . . . 29.0 t80 -69.55 137.45 52.43 Favored 'General case' 0 N--CA 1.434 -1.249 0 N-CA-C 108.163 -1.051 . . . . 0.0 108.163 176.861 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 10' ' ' ASP . . . . . . . . . . . . . 45.7 t0 -91.62 92.97 8.71 Favored 'General case' 0 C--N 1.304 -1.394 0 CA-C-O 121.55 0.69 . . . . 0.0 110.082 -178.259 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 11' ' ' CYS . . . . . 0.4 ' SG ' ' HB3' ' A' ' 5' ' ' ASP . 66.3 m -73.08 -34.44 66.23 Favored 'General case' 0 C--N 1.302 -1.491 0 CA-C-N 115.283 -0.871 . . . . 0.0 111.114 -179.108 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 12' ' ' ARG . . . . . . . . . . . . . 21.9 mmt180 -69.03 -49.69 55.37 Favored 'General case' 0 CA--C 1.516 -0.364 0 CA-C-O 120.88 0.371 . . . . 0.0 111.045 -175.761 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 8.7 ttp180 -66.36 -41.26 89.75 Favored 'General case' 0 C--N 1.309 -1.176 0 CA-C-N 116.12 -0.491 . . . . 0.0 110.971 179.637 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 14' ' ' SER . . . . . . . . . . . . . 50.2 m -60.92 -36.46 79.37 Favored 'General case' 0 C--O 1.251 1.156 0 CA-C-O 121.538 0.685 . . . . 0.0 110.594 177.429 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 54.8 tp -66.27 -43.55 86.09 Favored 'General case' 0 C--N 1.325 -0.488 0 CA-C-N 115.478 -0.783 . . . . 0.0 109.975 177.568 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 16' ' ' ARG . . . . . . . . . . . . . 81.7 mtp180 -69.63 -32.99 71.99 Favored 'General case' 0 C--N 1.315 -0.926 0 CA-C-N 116.175 -0.466 . . . . 0.0 112.239 178.965 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 17' ' ' ASN . . . . . . . . . . . . . 88.0 m-20 -68.43 -47.4 67.3 Favored 'General case' 0 CA--C 1.501 -0.911 0 CA-C-O 121.663 0.744 . . . . 0.0 110.547 -179.394 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . 123.66 11.89 4.79 Favored Glycine 0 N--CA 1.429 -1.788 0 N-CA-C 110.67 -0.972 . . . . 0.0 110.67 -174.655 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 19' ' ' ASP . . . . . . . . . . . . . 32.4 m-20 -71.09 -33.0 69.77 Favored 'General case' 0 CA--C 1.505 -0.786 0 N-CA-C 108.861 -0.792 . . . . 0.0 108.861 179.512 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 20' ' ' CYS . . . . . . . . . . . . . 53.4 t -82.81 0.24 44.77 Favored 'General case' 0 C--N 1.31 -1.12 0 CA-C-N 114.589 -1.187 . . . . 0.0 110.345 -178.084 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 21' ' ' ASP . . . . . . . . . . . . . 20.9 t70 -115.85 -10.49 11.68 Favored 'General case' 0 C--N 1.315 -0.932 0 CA-C-N 115.716 -0.674 . . . . 0.0 109.604 178.502 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 22' ' ' ASN . . . . . 0.459 ' O ' ' HG ' ' A' ' 26' ' ' LEU . 37.3 t-20 -87.8 121.78 30.64 Favored 'General case' 0 C--N 1.319 -0.758 0 CA-C-N 115.832 -0.622 . . . . 0.0 110.408 -177.057 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 23' ' ' ASP . . . . . . . . . . . . . 28.6 t70 -50.77 -46.67 59.59 Favored 'General case' 0 C--N 1.317 -0.806 0 C-N-CA 124.821 1.248 . . . . 0.0 113.379 -177.726 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 48.6 m-20 -64.66 -36.13 83.26 Favored 'General case' 0 N--CA 1.476 0.839 0 CA-C-O 121.365 0.602 . . . . 0.0 110.485 -177.927 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 25' ' ' LYS . . . . . . . . . . . . . 13.7 mptt -84.65 -12.38 54.05 Favored 'General case' 0 C--N 1.311 -1.078 0 CA-C-N 115.334 -0.848 . . . . 0.0 112.663 -175.946 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 26' ' ' LEU . . . . . 0.459 ' HG ' ' O ' ' A' ' 22' ' ' ASN . 74.7 mt -58.04 -36.08 72.23 Favored 'General case' 0 C--O 1.22 -0.496 0 N-CA-C 112.264 0.468 . . . . 0.0 112.264 -178.206 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 27' ' ' LEU . . . . . . . . . . . . . 26.2 tp -57.09 -50.64 72.15 Favored 'General case' 0 N--CA 1.437 -1.119 0 N-CA-C 109.906 -0.405 . . . . 0.0 109.906 176.899 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 28' ' ' GLU . . . . . 0.518 ' HA ' ' CE1' ' A' ' 31' ' ' TYR . 43.8 tt0 -64.48 -31.6 72.88 Favored 'General case' 0 C--O 1.244 0.781 0 CA-C-N 115.483 -0.781 . . . . 0.0 109.824 -179.742 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 29' ' ' MET . . . . . 0.408 ' HA ' ' CE ' ' A' ' 29' ' ' MET . 0.3 OUTLIER -73.4 -30.68 63.42 Favored 'General case' 0 C--O 1.207 -1.14 0 CA-C-N 115.009 -0.996 . . . . 0.0 109.84 -177.752 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 30' ' ' GLY . . . . . . . . . . . . . . . -65.15 -29.35 75.11 Favored Glycine 0 N--CA 1.444 -0.779 0 O-C-N 123.621 0.576 . . . . 0.0 112.886 -179.262 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 31' ' ' TYR . . . . . 0.518 ' CE1' ' HA ' ' A' ' 28' ' ' GLU 0.266 39.9 p90 -100.09 -37.51 8.93 Favored 'General case' 0 N--CA 1.438 -1.074 0 N-CA-C 113.791 1.034 . . . . 0.0 113.791 178.432 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 32' ' ' TYR . . . . . . . . . . . . . 29.2 m-85 -74.26 -48.56 27.84 Favored 'General case' 0 C--N 1.303 -1.415 0 N-CA-C 113.765 1.024 . . . . 0.0 113.765 177.472 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 33' ' ' CYS . . . . . . . . . . . . . 36.3 m -135.52 66.78 65.4 Favored Pre-proline 0 C--N 1.308 -1.234 0 C-N-CA 120.436 -0.505 . . . . 0.0 110.871 -177.024 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 34' ' ' PRO . . . . . 0.461 ' HD2' ' HA ' ' A' ' 5' ' ' ASP . 46.7 Cg_endo -65.99 -24.77 52.48 Favored 'Trans proline' 0 C--N 1.362 1.285 0 C-N-CA 122.404 2.07 . . . . 0.0 112.135 -176.624 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 35' ' ' VAL . . . . . 0.529 ' HB ' ' OD2' ' A' ' 5' ' ' ASP . 54.7 t -86.59 -46.87 16.45 Favored 'Isoleucine or valine' 0 C--N 1.302 -1.494 0 C-N-CA 120.479 -0.489 . . . . 0.0 110.787 -177.16 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 36' ' ' THR . . . . . . . . . . . . . 30.8 m -56.75 -39.57 74.23 Favored 'General case' 0 CA--C 1.55 0.946 0 CA-C-O 121.343 0.592 . . . . 0.0 111.587 179.986 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 37' ' ' CYS . . . . . . . . . . . . . 94.7 m -88.73 4.35 47.7 Favored 'General case' 0 C--N 1.309 -1.156 0 N-CA-C 113.251 0.834 . . . . 0.0 113.251 179.239 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 38' ' ' GLY . . . . . . . . . . . . . . . 72.12 35.89 60.64 Favored Glycine 0 C--O 1.222 -0.596 0 N-CA-C 115.599 0.999 . . . . 0.0 115.599 174.375 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 39' ' ' PHE . . . . . . . . . . . . . 98.4 m-85 -86.77 -37.59 17.7 Favored 'General case' 0 C--N 1.311 -1.108 0 N-CA-C 107.713 -1.218 . . . . 0.0 107.713 174.361 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 40' ' ' CYS . . . . . . . . . . . . . 69.3 m -117.95 89.58 3.15 Favored 'General case' 0 C--N 1.304 -1.407 0 CA-C-N 114.167 -1.378 . . . . 0.0 108.775 179.762 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 41' ' ' NH2 . . . . . . . . . . . . . . . . . . . . 0 C--N 1.307 -1.27 0 CA-C-N 116.689 -0.232 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 007 nuclear build full ' A' A ' 1' ' ' GLU . . . . . . . . . . . . . 10.4 tp10 . . . . . 0 CA--C 1.513 -0.452 0 CA-C-O 119.629 -0.224 . . . . 0.0 110.756 . . . . . . . . . 0 0 . 1 . 007 nuclear build full ' A' A ' 2' ' ' HIS . . . . . . . . . . . . . 21.9 t-80 -49.98 111.09 0.46 Allowed 'General case' 0 C--O 1.246 0.898 0 CA-C-O 121.635 0.731 . . . . 0.0 111.523 -175.537 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 3' ' ' CYS . . . . . . . . . . . . . 10.3 p -75.42 136.3 40.72 Favored 'General case' 0 C--N 1.301 -1.541 0 CA-C-N 114.347 -1.297 . . . . 0.0 110.747 179.424 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 4' ' ' ALA . . . . . . . . . . . . . . . -143.03 145.91 33.35 Favored 'General case' 0 C--N 1.31 -1.125 0 N-CA-C 109.595 -0.52 . . . . 0.0 109.595 -179.157 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 5' ' ' ASP . . . . . 0.531 ' HB3' ' SG ' ' A' ' 11' ' ' CYS . 23.7 m-20 -58.83 143.18 48.24 Favored 'General case' 0 C--N 1.314 -0.971 0 O-C-N 124.05 0.843 . . . . 0.0 111.81 178.461 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 10.0 tp10 -70.59 135.67 48.64 Favored 'General case' 0 N--CA 1.443 -0.818 0 C-N-CA 123.495 0.718 . . . . 0.0 110.312 178.004 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 7' ' ' LYS . . . . . . . . . . . . . 9.9 ptpp? -85.71 -20.66 29.01 Favored 'General case' 0 C--N 1.314 -0.977 0 CA-C-O 121.386 0.612 . . . . 0.0 111.041 -178.741 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 8' ' ' ASN . . . . . . . . . . . . . 80.5 m-20 -86.71 16.83 4.38 Favored 'General case' 0 C--N 1.311 -1.07 0 CA-C-O 121.789 0.804 . . . . 0.0 110.157 -179.193 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 9' ' ' PHE . . . . . 0.454 ' HD1' ' SG ' ' A' ' 33' ' ' CYS . 36.8 t80 -144.87 144.09 30.93 Favored 'General case' 0 N--CA 1.418 -2.03 0 N-CA-C 105.633 -1.988 . . . . 0.0 105.633 -178.425 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 10' ' ' ASP . . . . . . . . . . . . . 19.7 t70 -100.51 102.62 13.84 Favored 'General case' 0 C--N 1.313 -0.986 0 C-N-CA 118.941 -1.104 . . . . 0.0 110.603 178.088 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 11' ' ' CYS . . . . . 0.531 ' SG ' ' HB3' ' A' ' 5' ' ' ASP . 60.8 m -66.09 -31.79 72.86 Favored 'General case' 0 C--N 1.294 -1.814 0 CA-C-N 114.083 -1.417 . . . . 0.0 112.776 -175.711 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 12' ' ' ARG . . . . . . . . . . . . . 37.6 mmt180 -66.0 -50.46 64.18 Favored 'General case' 0 CA--C 1.514 -0.416 0 N-CA-C 109.711 -0.477 . . . . 0.0 109.711 179.684 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 38.6 ttm180 -53.51 -56.45 16.9 Favored 'General case' 0 C--N 1.322 -0.622 0 C-N-CA 124.741 1.216 . . . . 0.0 111.775 -178.24 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 14' ' ' SER . . . . . . . . . . . . . 20.1 m -61.22 -35.15 76.44 Favored 'General case' 0 C--O 1.249 1.066 0 CA-C-O 120.948 0.404 . . . . 0.0 111.818 -178.101 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 1.3 tm? -68.65 -41.42 79.37 Favored 'General case' 0 CA--C 1.544 0.72 0 N-CA-C 108.098 -1.075 . . . . 0.0 108.098 179.439 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 16' ' ' ARG . . . . . . . . . . . . . 73.8 mtp180 -64.19 -45.99 85.94 Favored 'General case' 0 N--CA 1.467 0.416 0 CA-C-N 115.546 -0.752 . . . . 0.0 111.702 178.593 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 17' ' ' ASN . . . . . . . . . . . . . 73.3 m-20 -61.09 -33.63 73.66 Favored 'General case' 0 N--CA 1.485 1.305 0 CA-C-O 121.652 0.739 . . . . 0.0 110.942 -178.734 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . 103.29 19.07 13.03 Favored Glycine 0 N--CA 1.429 -1.824 0 N-CA-C 110.027 -1.229 . . . . 0.0 110.027 -178.06 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 19' ' ' ASP . . . . . . . . . . . . . 52.6 m-20 -70.04 -28.59 65.59 Favored 'General case' 0 C--O 1.213 -0.827 0 CA-C-O 120.85 0.357 . . . . 0.0 110.549 -178.403 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 20' ' ' CYS . . . . . 0.423 ' HA ' ' HG3' ' A' ' 29' ' ' MET . 23.8 t -84.26 -5.28 59.24 Favored 'General case' 0 C--N 1.317 -0.835 0 CA-C-O 121.578 0.704 . . . . 0.0 109.697 -179.173 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 21' ' ' ASP . . . . . . . . . . . . . 29.7 t70 -98.55 -11.24 22.39 Favored 'General case' 0 C--N 1.314 -0.964 0 N-CA-C 108.686 -0.857 . . . . 0.0 108.686 175.016 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 22' ' ' ASN . . . . . . . . . . . . . 35.5 t30 -88.54 123.64 33.24 Favored 'General case' 0 C--N 1.316 -0.856 0 CA-C-N 115.241 -0.89 . . . . 0.0 110.042 179.242 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 23' ' ' ASP . . . . . 0.467 ' HA ' ' HG ' ' A' ' 26' ' ' LEU . 21.7 t70 -58.68 -36.72 74.66 Favored 'General case' 0 C--N 1.323 -0.581 0 C-N-CA 122.969 0.507 . . . . 0.0 111.957 -178.163 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 27.2 t70 -62.97 -24.81 68.07 Favored 'General case' 0 N--CA 1.475 0.799 0 CA-C-N 115.969 -0.559 . . . . 0.0 111.732 179.5 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 25' ' ' LYS . . . . . . . . . . . . . 69.3 mmtt -111.96 10.24 20.54 Favored 'General case' 0 N--CA 1.442 -0.852 0 N-CA-C 113.101 0.778 . . . . 0.0 113.101 -177.807 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 26' ' ' LEU . . . . . 0.467 ' HG ' ' HA ' ' A' ' 23' ' ' ASP . 65.9 mt -62.76 -46.56 87.49 Favored 'General case' 0 C--N 1.314 -0.941 0 N-CA-C 112.886 0.698 . . . . 0.0 112.886 -179.929 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 27' ' ' LEU . . . . . 0.407 HD22 ' H ' ' A' ' 27' ' ' LEU . 2.7 mm? -65.13 -42.69 93.64 Favored 'General case' 0 CA--C 1.48 -1.714 0 N-CA-C 108.508 -0.923 . . . . 0.0 108.508 -179.237 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 28' ' ' GLU . . . . . 0.527 ' HA ' ' CE1' ' A' ' 31' ' ' TYR . 38.6 tt0 -58.45 -36.97 74.49 Favored 'General case' 0 N--CA 1.442 -0.848 0 O-C-N 124.346 1.029 . . . . 0.0 109.932 -179.492 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 29' ' ' MET . . . . . 0.423 ' HG3' ' HA ' ' A' ' 20' ' ' CYS . 78.2 mmm -80.33 -27.6 38.33 Favored 'General case' 0 N--CA 1.429 -1.512 0 CA-C-N 115.936 -0.575 . . . . 0.0 111.216 -178.204 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 30' ' ' GLY . . . . . . . . . . . . . . . -75.33 -44.64 21.62 Favored Glycine 0 N--CA 1.43 -1.708 0 CA-C-N 115.526 -0.761 . . . . 0.0 111.673 178.065 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 31' ' ' TYR . . . . . 0.527 ' CE1' ' HA ' ' A' ' 28' ' ' GLU 0.265 12.9 p90 -77.58 -32.33 53.62 Favored 'General case' 0 N--CA 1.436 -1.153 0 C-N-CA 119.592 -0.843 . . . . 0.0 113.166 -179.346 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 32' ' ' TYR . . . . . . . . . . . . . 22.6 m-85 -79.07 -54.36 6.09 Favored 'General case' 0 C--N 1.301 -1.505 0 N-CA-C 113.223 0.823 . . . . 0.0 113.223 175.409 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 33' ' ' CYS . . . . . 0.454 ' SG ' ' HD1' ' A' ' 9' ' ' PHE . 53.4 m -129.11 71.68 81.99 Favored Pre-proline 0 C--O 1.264 1.839 0 C-N-CA 120.152 -0.619 . . . . 0.0 111.956 -174.45 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 34' ' ' PRO . . . . . 0.485 ' HB2' ' SG ' ' A' ' 40' ' ' CYS . 48.7 Cg_endo -66.52 -25.91 47.58 Favored 'Trans proline' 0 C--N 1.362 1.285 0 C-N-CA 122.69 2.26 . . . . 0.0 112.163 -176.201 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 35' ' ' VAL . . . . . 0.504 ' HB ' ' OD1' ' A' ' 5' ' ' ASP . 22.0 t -87.04 -40.79 14.24 Favored 'Isoleucine or valine' 0 N--CA 1.425 -1.712 0 CA-C-N 116.162 -0.472 . . . . 0.0 110.844 -176.822 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 36' ' ' THR . . . . . . . . . . . . . 58.9 m -58.1 -43.65 87.21 Favored 'General case' 0 C--N 1.321 -0.662 0 C-N-CA 123.3 0.64 . . . . 0.0 112.097 -179.618 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 37' ' ' CYS . . . . . 0.549 ' HB2' ' CE2' ' A' ' 39' ' ' PHE . 88.7 m -87.51 6.76 32.56 Favored 'General case' 0 C--N 1.313 -0.991 0 C-N-CA 119.696 -0.802 . . . . 0.0 112.007 179.433 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 38' ' ' GLY . . . . . . . . . . . . . . . 64.43 45.91 91.92 Favored Glycine 0 N--CA 1.439 -1.158 0 CA-C-N 116.32 -0.4 . . . . 0.0 114.068 177.045 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 39' ' ' PHE . . . . . 0.549 ' CE2' ' HB2' ' A' ' 37' ' ' CYS . 98.2 m-85 -85.68 -49.89 7.62 Favored 'General case' 0 CA--C 1.498 -1.022 0 N-CA-C 107.247 -1.39 . . . . 0.0 107.247 173.805 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 40' ' ' CYS . . . . . 0.485 ' SG ' ' HB2' ' A' ' 34' ' ' PRO . 25.3 p -136.32 87.93 2.34 Favored 'General case' 0 N--CA 1.424 -1.744 0 CA-C-N 114.771 -1.104 . . . . 0.0 109.528 177.013 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 41' ' ' NH2 . . . . . . . . . . . . . . . . . . . . 0 C--N 1.309 -1.153 0 CA-C-N 116.194 -0.457 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 008 nuclear build full ' A' A ' 1' ' ' GLU . . . . . . . . . . . . . 44.8 tt0 . . . . . 0 N--CA 1.455 -0.206 0 N-CA-C 108.545 -0.909 . . . . 0.0 108.545 . . . . . . . . . 0 0 . 1 . 008 nuclear build full ' A' A ' 2' ' ' HIS . . . . . . . . . . . . . 81.4 m-70 -106.33 126.06 51.77 Favored 'General case' 0 CA--C 1.502 -0.892 0 N-CA-C 109.48 -0.563 . . . . 0.0 109.48 174.299 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 3' ' ' CYS . . . . . . . . . . . . . 21.6 p -86.3 150.9 24.02 Favored 'General case' 0 C--N 1.288 -2.106 0 CA-C-N 116.306 -0.406 . . . . 0.0 110.565 177.478 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 4' ' ' ALA . . . . . . . . . . . . . . . -149.32 137.4 20.6 Favored 'General case' 0 C--N 1.313 -0.983 0 N-CA-C 109.497 -0.557 . . . . 0.0 109.497 178.299 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 5' ' ' ASP . . . . . 0.556 ' HB3' ' SG ' ' A' ' 11' ' ' CYS . 24.0 m-20 -65.49 149.56 49.83 Favored 'General case' 0 C--O 1.248 1.02 0 N-CA-C 108.887 -0.783 . . . . 0.0 108.887 174.683 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 10.8 tp10 -70.03 130.7 42.87 Favored 'General case' 0 C--N 1.301 -1.538 0 N-CA-C 109.409 -0.589 . . . . 0.0 109.409 178.734 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 7' ' ' LYS . . . . . . . . . . . . . 10.8 ptpp? -85.51 -20.02 30.32 Favored 'General case' 0 C--N 1.321 -0.653 0 CA-C-O 121.097 0.475 . . . . 0.0 110.895 -176.845 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 8' ' ' ASN . . . . . . . . . . . . . 89.2 m-20 -84.49 2.64 40.05 Favored 'General case' 0 C--N 1.316 -0.859 0 CA-C-N 115.465 -0.789 . . . . 0.0 110.053 179.16 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 9' ' ' PHE . . . . . . . . . . . . . 45.4 t80 -127.95 154.25 45.78 Favored 'General case' 0 C--N 1.303 -1.433 0 N-CA-C 107.773 -1.195 . . . . 0.0 107.773 -174.986 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 10' ' ' ASP . . . . . . . . . . . . . 9.3 t70 -104.9 101.26 10.85 Favored 'General case' 0 CA--C 1.493 -1.234 0 C-N-CA 118.624 -1.23 . . . . 0.0 110.647 178.195 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 11' ' ' CYS . . . . . 0.556 ' SG ' ' HB3' ' A' ' 5' ' ' ASP . 92.4 m -72.8 -25.52 61.18 Favored 'General case' 0 C--N 1.286 -2.163 0 CA-C-N 115.34 -0.845 . . . . 0.0 112.615 -178.286 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 12' ' ' ARG . . . . . 0.546 ' O ' ' HG2' ' A' ' 16' ' ' ARG . 28.0 mmm180 -70.07 -53.41 17.58 Favored 'General case' 0 C--N 1.318 -0.803 0 N-CA-C 110.045 -0.354 . . . . 0.0 110.045 -178.406 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 43.9 ttp180 -63.13 -37.49 87.4 Favored 'General case' 0 C--N 1.309 -1.166 0 CA-C-N 115.951 -0.568 . . . . 0.0 110.133 179.464 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 14' ' ' SER . . . . . . . . . . . . . 49.6 m -63.61 -32.79 74.37 Favored 'General case' 0 C--O 1.246 0.905 0 CA-C-O 121.261 0.553 . . . . 0.0 110.977 177.258 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 53.6 tp -70.94 -40.73 71.88 Favored 'General case' 0 N--CA 1.442 -0.845 0 N-CA-C 109.177 -0.675 . . . . 0.0 109.177 177.611 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 16' ' ' ARG . . . . . 0.546 ' HG2' ' O ' ' A' ' 12' ' ' ARG . 31.4 mmm180 -70.04 -33.76 72.38 Favored 'General case' 0 C--N 1.314 -0.971 0 CA-C-N 115.546 -0.752 . . . . 0.0 111.193 -178.942 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 17' ' ' ASN . . . . . . . . . . . . . 89.6 m-20 -71.05 -39.14 72.43 Favored 'General case' 0 CA--C 1.489 -1.376 0 CA-C-O 121.522 0.677 . . . . 0.0 110.428 -179.864 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . 114.02 8.61 17.39 Favored Glycine 0 N--CA 1.426 -1.973 0 CA-C-N 114.833 -1.076 . . . . 0.0 111.016 -177.178 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 19' ' ' ASP . . . . . . . . . . . . . 59.9 m-20 -66.92 -38.13 85.63 Favored 'General case' 0 CA--C 1.502 -0.883 0 CA-C-O 121.235 0.541 . . . . 0.0 109.893 -179.406 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 20' ' ' CYS . . . . . . . . . . . . . 42.7 t -73.32 -13.42 61.11 Favored 'General case' 0 C--N 1.311 -1.068 0 CA-C-N 114.997 -1.001 . . . . 0.0 110.752 -178.945 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 21' ' ' ASP . . . . . . . . . . . . . 27.6 t70 -109.78 -4.48 16.04 Favored 'General case' 0 C--N 1.313 -1.019 0 CA-C-O 121.893 0.854 . . . . 0.0 110.46 179.043 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 22' ' ' ASN . . . . . . . . . . . . . 39.8 t-20 -77.64 116.33 18.11 Favored 'General case' 0 C--N 1.314 -0.946 0 N-CA-C 109.2 -0.667 . . . . 0.0 109.2 -178.363 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 23' ' ' ASP . . . . . 0.411 ' HA ' ' HG ' ' A' ' 26' ' ' LEU . 17.6 m-20 -56.99 -43.82 82.09 Favored 'General case' 0 C--N 1.321 -0.642 0 CA-C-N 115.088 -0.96 . . . . 0.0 112.202 -174.611 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 33.7 t70 -66.33 -31.35 72.09 Favored 'General case' 0 C--N 1.324 -0.529 0 CA-C-O 121.023 0.439 . . . . 0.0 111.085 -178.156 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 25' ' ' LYS . . . . . 0.428 ' O ' ' HG2' ' A' ' 29' ' ' MET . 54.3 mtpt -95.89 -4.45 43.54 Favored 'General case' 0 C--O 1.209 -1.048 0 N-CA-C 112.386 0.513 . . . . 0.0 112.386 -177.555 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 26' ' ' LEU . . . . . 0.411 ' HG ' ' HA ' ' A' ' 23' ' ' ASP . 55.6 mt -48.3 -46.83 36.65 Favored 'General case' 0 N--CA 1.483 1.219 0 N-CA-C 114.705 1.372 . . . . 0.0 114.705 -178.602 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 27' ' ' LEU . . . . . . . . . . . . . 22.3 tp -59.17 -45.31 91.33 Favored 'General case' 0 N--CA 1.446 -0.67 0 CA-C-O 121.286 0.565 . . . . 0.0 110.018 178.954 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 28' ' ' GLU . . . . . 0.625 ' HA ' ' CE1' ' A' ' 31' ' ' TYR . 35.2 tt0 -64.04 -35.47 80.82 Favored 'General case' 0 N--CA 1.444 -0.743 0 CA-C-N 114.791 -1.095 . . . . 0.0 109.55 179.696 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 29' ' ' MET . . . . . 0.428 ' HG2' ' O ' ' A' ' 25' ' ' LYS . 79.6 mmm -78.31 -19.42 53.59 Favored 'General case' 0 C--N 1.302 -1.486 0 CA-C-N 114.803 -1.09 . . . . 0.0 110.205 -177.626 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 30' ' ' GLY . . . . . 0.437 ' HA2' ' CE1' ' A' ' 39' ' ' PHE . . . -71.46 -22.27 78.62 Favored Glycine 0 N--CA 1.436 -1.367 0 CA-C-N 115.01 -0.995 . . . . 0.0 111.996 177.762 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 31' ' ' TYR . . . . . 0.625 ' CE1' ' HA ' ' A' ' 28' ' ' GLU . 27.6 p90 -104.54 -34.67 8.13 Favored 'General case' 0 N--CA 1.436 -1.152 0 C-N-CA 119.609 -0.836 . . . . 0.0 112.383 174.82 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 32' ' ' TYR . . . . . . . . . . . . . 37.4 m-85 -67.34 -47.99 68.85 Favored 'General case' 0 C--N 1.309 -1.186 0 CA-C-N 115.918 -0.583 . . . . 0.0 112.179 174.379 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 33' ' ' CYS . . . . . 0.469 ' HB3' ' HB ' ' A' ' 36' ' ' THR . 35.3 m -140.39 64.7 25.4 Favored Pre-proline 0 C--N 1.306 -1.313 0 C-N-CA 120.355 -0.538 . . . . 0.0 111.667 -177.356 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 34' ' ' PRO . . . . . 0.508 ' HD2' ' HA ' ' A' ' 5' ' ' ASP . 31.1 Cg_endo -63.21 -27.63 72.68 Favored 'Trans proline' 0 C--N 1.366 1.489 0 C-N-CA 122.562 2.174 . . . . 0.0 111.817 -178.92 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 35' ' ' VAL . . . . . 0.431 ' HB ' ' OD2' ' A' ' 5' ' ' ASP . 57.8 t -84.9 -47.25 17.22 Favored 'Isoleucine or valine' 0 N--CA 1.419 -1.977 0 CA-C-N 115.473 -0.785 . . . . 0.0 110.255 -176.178 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 36' ' ' THR . . . . . 0.469 ' HB ' ' HB3' ' A' ' 33' ' ' CYS . 23.8 m -59.9 -42.9 94.85 Favored 'General case' 0 C--N 1.317 -0.843 0 CA-C-N 115.859 -0.61 . . . . 0.0 111.248 179.71 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 37' ' ' CYS . . . . . . . . . . . . . 77.9 m -79.05 -8.13 58.69 Favored 'General case' 0 C--N 1.319 -0.749 0 N-CA-C 112.222 0.453 . . . . 0.0 112.222 179.661 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 38' ' ' GLY . . . . . . . . . . . . . . . 77.49 40.08 24.11 Favored Glycine 0 N--CA 1.445 -0.736 0 N-CA-C 114.985 0.754 . . . . 0.0 114.985 174.54 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 39' ' ' PHE . . . . . 0.437 ' CE1' ' HA2' ' A' ' 30' ' ' GLY . 87.3 m-85 -78.35 -32.14 48.94 Favored 'General case' 0 C--N 1.317 -0.843 0 N-CA-C 108.519 -0.919 . . . . 0.0 108.519 175.245 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 40' ' ' CYS . . . . . . . . . . . . . 1.5 p -150.14 89.16 1.57 Allowed 'General case' 0 C--N 1.303 -1.451 0 CA-C-N 114.224 -1.353 . . . . 0.0 109.658 -178.592 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 41' ' ' NH2 . . . . . . . . . . . . . . . . . . . . 0 C--N 1.309 -1.186 0 CA-C-N 116.193 -0.458 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 009 nuclear build full ' A' A ' 1' ' ' GLU . . . . . . . . . . . . . 11.2 pt-20 . . . . . 0 CA--C 1.504 -0.826 0 N-CA-C 109.26 -0.644 . . . . 0.0 109.26 . . . . . . . . . 0 0 . 1 . 009 nuclear build full ' A' A ' 2' ' ' HIS . . . . . . . . . . . . . 18.6 t-80 -88.85 112.36 23.16 Favored 'General case' 0 N--CA 1.432 -1.359 0 N-CA-C 108.818 -0.808 . . . . 0.0 108.818 176.504 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 3' ' ' CYS . . . . . . . . . . . . . 25.7 p -71.8 104.78 3.54 Favored 'General case' 0 C--N 1.299 -1.61 0 CA-C-O 121.517 0.675 . . . . 0.0 110.631 178.803 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 4' ' ' ALA . . . . . . . . . . . . . . . -140.87 143.25 34.6 Favored 'General case' 0 N--CA 1.432 -1.357 0 CA-C-N 116.035 -0.53 . . . . 0.0 109.72 -179.86 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 5' ' ' ASP . . . . . 0.678 ' HB3' ' SG ' ' A' ' 11' ' ' CYS . 43.9 m-20 -64.32 141.44 58.77 Favored 'General case' 0 C--O 1.25 1.106 0 N-CA-C 108.761 -0.829 . . . . 0.0 108.761 175.777 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -70.44 150.0 46.66 Favored 'General case' 0 C--N 1.307 -1.269 0 CA-C-O 121.497 0.665 . . . . 0.0 110.796 -176.992 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 7' ' ' LYS . . . . . . . . . . . . . 9.2 ptpp? -85.51 -25.36 26.87 Favored 'General case' 0 C--N 1.307 -1.244 0 CA-C-N 115.133 -0.94 . . . . 0.0 111.997 -177.222 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 8' ' ' ASN . . . . . . . . . . . . . 42.5 m-80 -95.12 1.99 55.02 Favored 'General case' 0 C--N 1.31 -1.143 0 CA-C-N 115.849 -0.614 . . . . 0.0 110.592 -178.101 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 9' ' ' PHE . . . . . 0.416 ' CD2' ' HB3' ' A' ' 32' ' ' TYR . 34.1 t80 -121.75 137.32 54.81 Favored 'General case' 0 C--N 1.291 -1.966 0 N-CA-C 107.099 -1.445 . . . . 0.0 107.099 -178.731 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 10' ' ' ASP . . . . . . . . . . . . . 8.8 t70 -94.24 103.09 15.12 Favored 'General case' 0 C--N 1.309 -1.177 0 C-N-CA 119.678 -0.809 . . . . 0.0 109.914 -177.884 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 11' ' ' CYS . . . . . 0.678 ' SG ' ' HB3' ' A' ' 5' ' ' ASP . 73.8 m -75.03 -28.71 60.57 Favored 'General case' 0 C--N 1.293 -1.886 0 CA-C-N 115.312 -0.858 . . . . 0.0 112.985 -175.51 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 12' ' ' ARG . . . . . . . . . . . . . 28.2 mmt180 -73.86 -44.44 55.49 Favored 'General case' 0 C--N 1.317 -0.822 0 N-CA-C 109.069 -0.715 . . . . 0.0 109.069 -178.186 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 38.3 ttm180 -60.89 -46.83 89.07 Favored 'General case' 0 C--N 1.318 -0.761 0 CA-C-N 115.238 -0.892 . . . . 0.0 109.874 178.242 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 14' ' ' SER . . . . . . . . . . . . . 44.7 m -61.37 -34.6 75.59 Favored 'General case' 0 C--N 1.319 -0.752 0 CA-C-N 115.746 -0.661 . . . . 0.0 111.48 179.953 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 50.2 tp -72.72 -44.38 61.78 Favored 'General case' 0 C--N 1.312 -1.059 0 C-N-CA 120.688 -0.405 . . . . 0.0 110.968 179.611 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 16' ' ' ARG . . . . . . . . . . . . . 21.9 mtm180 -70.17 -35.56 74.07 Favored 'General case' 0 C--N 1.314 -0.953 0 CA-C-N 116.006 -0.543 . . . . 0.0 112.449 -177.848 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 17' ' ' ASN . . . . . . . . . . . . . 35.5 m-80 -77.1 -26.04 52.91 Favored 'General case' 0 CA--C 1.498 -1.038 0 CA-C-O 121.056 0.455 . . . . 0.0 111.612 178.68 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . 104.56 7.03 40.34 Favored Glycine 0 N--CA 1.433 -1.56 0 C-N-CA 119.685 -1.245 . . . . 0.0 112.469 178.448 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 19' ' ' ASP . . . . . 0.402 ' O ' ' HB2' ' A' ' 25' ' ' LYS . 6.0 m-20 -64.65 -35.97 82.74 Favored 'General case' 0 CA--C 1.499 -1.0 0 N-CA-C 108.779 -0.823 . . . . 0.0 108.779 178.15 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 20' ' ' CYS . . . . . 0.461 ' HA ' ' HG3' ' A' ' 29' ' ' MET . 39.3 t -57.04 -31.16 64.88 Favored 'General case' 0 C--N 1.315 -0.897 0 CA-C-N 114.667 -1.152 . . . . 0.0 111.606 178.904 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 21' ' ' ASP . . . . . . . . . . . . . 17.8 t70 -106.37 -9.3 16.81 Favored 'General case' 0 C--N 1.316 -0.889 0 CA-C-N 115.812 -0.631 . . . . 0.0 111.388 -176.49 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 22' ' ' ASN . . . . . . . . . . . . . 54.7 t30 -77.17 131.35 38.23 Favored 'General case' 0 C--N 1.311 -1.067 0 O-C-N 122.237 -0.289 . . . . 0.0 110.989 -174.535 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 23' ' ' ASP . . . . . . . . . . . . . 26.7 t70 -51.76 -48.14 63.82 Favored 'General case' 0 N--CA 1.473 0.705 0 C-N-CA 123.958 0.903 . . . . 0.0 113.065 -174.233 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 32.4 t70 -61.79 -22.76 65.72 Favored 'General case' 0 N--CA 1.48 1.046 0 N-CA-C 112.304 0.483 . . . . 0.0 112.304 -179.823 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 25' ' ' LYS . . . . . 0.54 ' O ' ' HG2' ' A' ' 29' ' ' MET . 69.8 mmtt -101.58 -16.27 16.81 Favored 'General case' 0 C--N 1.305 -1.369 0 C-N-CA 120.475 -0.49 . . . . 0.0 111.614 -174.174 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 26' ' ' LEU . . . . . . . . . . . . . 83.3 mt -48.18 -50.32 29.44 Favored 'General case' 0 N--CA 1.475 0.785 0 N-CA-C 115.699 1.74 . . . . 0.0 115.699 -172.395 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 27' ' ' LEU . . . . . . . . . . . . . 1.6 tm? -60.51 -43.5 97.01 Favored 'General case' 0 N--CA 1.448 -0.574 0 N-CA-C 109.026 -0.731 . . . . 0.0 109.026 -178.239 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 28' ' ' GLU . . . . . 0.452 ' HA ' ' CZ ' ' A' ' 31' ' ' TYR . 1.2 mp0 -65.05 -34.88 79.48 Favored 'General case' 0 CA--C 1.503 -0.864 0 CA-C-N 114.926 -1.034 . . . . 0.0 110.442 178.988 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 29' ' ' MET . . . . . 0.54 ' HG2' ' O ' ' A' ' 25' ' ' LYS . 70.9 mmm -70.5 -25.64 63.23 Favored 'General case' 0 C--N 1.316 -0.888 0 CA-C-N 116.107 -0.497 . . . . 0.0 110.552 -177.269 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 30' ' ' GLY . . . . . . . . . . . . . . . -68.3 -25.98 74.41 Favored Glycine 0 N--CA 1.448 -0.538 0 CA-C-N 115.586 -0.734 . . . . 0.0 112.36 -179.851 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 31' ' ' TYR . . . . . 0.452 ' CZ ' ' HA ' ' A' ' 28' ' ' GLU . 25.9 p90 -109.48 -33.79 6.7 Favored 'General case' 0 N--CA 1.441 -0.885 0 N-CA-C 113.354 0.872 . . . . 0.0 113.354 177.655 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 32' ' ' TYR . . . . . 0.416 ' HB3' ' CD2' ' A' ' 9' ' ' PHE . 21.3 m-85 -69.74 -48.04 60.86 Favored 'General case' 0 C--N 1.304 -1.382 0 N-CA-C 112.317 0.488 . . . . 0.0 112.317 176.679 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 33' ' ' CYS . . . . . . . . . . . . . 34.8 m -136.57 69.73 60.06 Favored Pre-proline 0 C--N 1.306 -1.305 0 C-N-CA 119.436 -0.905 . . . . 0.0 111.35 -177.55 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 34' ' ' PRO . . . . . 0.462 ' HD2' ' HA ' ' A' ' 5' ' ' ASP . 56.2 Cg_endo -69.96 -23.5 29.83 Favored 'Trans proline' 0 N--CA 1.448 -1.18 0 C-N-CA 121.977 1.785 . . . . 0.0 111.487 -178.416 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 35' ' ' VAL . . . . . 0.403 ' HB ' ' OD2' ' A' ' 5' ' ' ASP . 41.7 t -87.49 -52.45 11.5 Favored 'Isoleucine or valine' 0 C--N 1.296 -1.758 0 CA-C-N 115.696 -0.684 . . . . 0.0 111.015 -177.966 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 36' ' ' THR . . . . . . . . . . . . . 58.4 m -61.95 -35.38 78.28 Favored 'General case' 0 CA--C 1.55 0.973 0 N-CA-C 112.224 0.453 . . . . 0.0 112.224 -178.203 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 37' ' ' CYS . . . . . . . . . . . . . 92.5 m -90.94 2.99 55.81 Favored 'General case' 0 C--N 1.308 -1.196 0 N-CA-C 113.337 0.866 . . . . 0.0 113.337 179.603 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 38' ' ' GLY . . . . . . . . . . . . . . . 72.25 46.49 34.21 Favored Glycine 0 CA--C 1.525 0.701 0 N-CA-C 115.062 0.785 . . . . 0.0 115.062 175.259 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 39' ' ' PHE . . . . . 0.442 ' CD1' ' HA ' ' A' ' 34' ' ' PRO . 96.4 m-85 -95.09 -43.08 8.28 Favored 'General case' 0 C--N 1.306 -1.313 0 N-CA-C 107.864 -1.162 . . . . 0.0 107.864 173.756 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 40' ' ' CYS . . . . . . . . . . . . . 49.5 t -139.11 97.3 3.27 Favored 'General case' 0 N--CA 1.429 -1.505 0 CA-C-N 114.449 -1.25 . . . . 0.0 108.33 -178.613 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 41' ' ' NH2 . . . . . . . . . . . . . . . . . . . . 0 C--N 1.302 -1.483 0 CA-C-N 116.51 -0.313 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 010 nuclear build full ' A' A ' 1' ' ' GLU . . . . . . . . . . . . . 9.5 tp10 . . . . . 0 N--CA 1.453 -0.314 0 N-CA-C 108.686 -0.857 . . . . 0.0 108.686 . . . . . . . . . 0 0 . 1 . 010 nuclear build full ' A' A ' 2' ' ' HIS . . . . . . . . . . . . . 7.6 p80 -103.26 121.51 42.86 Favored 'General case' 0 C--N 1.312 -1.035 0 C-N-CA 119.578 -0.849 . . . . 0.0 108.852 178.234 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 3' ' ' CYS . . . . . . . . . . . . . 27.9 p -62.11 122.6 15.96 Favored 'General case' 0 C--N 1.309 -1.188 0 N-CA-C 108.886 -0.783 . . . . 0.0 108.886 176.0 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 4' ' ' ALA . . . . . . . . . . . . . . . -138.93 141.79 38.48 Favored 'General case' 0 C--N 1.303 -1.448 0 CA-C-N 116.686 -0.233 . . . . 0.0 110.627 -175.507 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 5' ' ' ASP . . . . . 0.413 ' HA ' ' HA ' ' A' ' 33' ' ' CYS . 69.6 m-20 -60.83 147.27 43.34 Favored 'General case' 0 C--N 1.315 -0.916 0 O-C-N 124.009 0.818 . . . . 0.0 110.623 176.773 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 10.7 tp10 -69.02 133.21 47.83 Favored 'General case' 0 C--N 1.308 -1.235 0 CA-C-N 115.922 -0.581 . . . . 0.0 110.058 178.92 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 7' ' ' LYS . . . . . . . . . . . . . 8.8 ptpp? -81.62 -23.55 36.94 Favored 'General case' 0 CA--C 1.512 -0.515 0 CA-C-O 121.298 0.571 . . . . 0.0 110.979 -178.04 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 8' ' ' ASN . . . . . . . . . . . . . 12.7 m120 -86.55 16.8 4.29 Favored 'General case' 0 C--N 1.308 -1.196 0 CA-C-N 115.004 -0.998 . . . . 0.0 110.317 178.594 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 9' ' ' PHE . . . . . . . . . . . . . 0.3 OUTLIER -139.6 138.22 36.0 Favored 'General case' 0 N--CA 1.422 -1.865 0 N-CA-C 105.819 -1.919 . . . . 0.0 105.819 -176.927 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 10' ' ' ASP . . . . . . . . . . . . . 12.3 t70 -104.75 88.71 2.98 Favored 'General case' 0 C--N 1.303 -1.451 0 N-CA-C 108.274 -1.009 . . . . 0.0 108.274 174.518 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 11' ' ' CYS . . . . . . . . . . . . . 95.4 m -79.63 -6.17 56.55 Favored 'General case' 0 C--N 1.301 -1.502 0 N-CA-C 112.732 0.641 . . . . 0.0 112.732 -177.316 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 12' ' ' ARG . . . . . 0.466 ' O ' ' HG2' ' A' ' 16' ' ' ARG . 6.4 mmp_? -65.54 -51.11 62.28 Favored 'General case' 0 N--CA 1.444 -0.753 0 N-CA-C 107.198 -1.408 . . . . 0.0 107.198 173.034 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 58.3 ttp180 -62.0 -44.7 96.18 Favored 'General case' 0 CA--C 1.519 -0.223 0 CA-C-N 115.592 -0.731 . . . . 0.0 110.352 177.135 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 14' ' ' SER . . . . . . . . . . . . . 14.9 m -58.95 -31.73 68.97 Favored 'General case' 0 CA--C 1.543 0.704 0 CA-C-O 120.849 0.357 . . . . 0.0 111.159 178.789 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 15' ' ' LEU . . . . . 0.414 ' HA ' ' HB3' ' A' ' 20' ' ' CYS . 38.8 tp -80.12 -40.14 28.07 Favored 'General case' 0 C--N 1.318 -0.772 0 N-CA-C 110.418 -0.216 . . . . 0.0 110.418 178.921 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 16' ' ' ARG . . . . . 0.466 ' HG2' ' O ' ' A' ' 12' ' ' ARG . 38.8 mmt180 -61.95 -37.9 86.47 Favored 'General case' 0 C--O 1.22 -0.467 0 CA-C-N 115.929 -0.578 . . . . 0.0 110.342 177.121 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 17' ' ' ASN . . . . . . . . . . . . . 4.7 m-20 -77.78 -49.97 13.29 Favored 'General case' 0 C--N 1.316 -0.86 0 CA-C-N 115.665 -0.698 . . . . 0.0 111.562 179.884 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . 129.79 -2.05 5.98 Favored Glycine 0 N--CA 1.446 -0.65 0 C-N-CA 120.03 -1.081 . . . . 0.0 112.751 -179.312 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 19' ' ' ASP . . . . . . . . . . . . . 6.2 m-20 -63.11 -37.86 88.87 Favored 'General case' 0 N--CA 1.477 0.897 0 CA-C-O 121.557 0.694 . . . . 0.0 110.237 -179.956 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 20' ' ' CYS . . . . . 0.414 ' HB3' ' HA ' ' A' ' 15' ' ' LEU . 43.8 t -71.3 -9.07 57.53 Favored 'General case' 0 C--N 1.311 -1.071 0 CA-C-N 114.789 -1.096 . . . . 0.0 111.526 -178.699 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 21' ' ' ASP . . . . . . . . . . . . . 32.6 t70 -116.58 -7.67 11.58 Favored 'General case' 0 C--N 1.32 -0.702 0 CA-C-O 121.478 0.656 . . . . 0.0 110.432 -179.768 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 22' ' ' ASN . . . . . . . . . . . . . 33.6 t30 -74.9 118.93 18.41 Favored 'General case' 0 C--N 1.308 -1.201 0 CA-C-N 115.801 -0.636 . . . . 0.0 110.722 -176.563 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 23' ' ' ASP . . . . . . . . . . . . . 11.4 m-20 -52.25 -40.06 61.17 Favored 'General case' 0 N--CA 1.479 0.978 0 C-N-CA 124.396 1.078 . . . . 0.0 111.836 -176.225 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 33.8 t70 -59.29 -38.75 80.95 Favored 'General case' 0 C--N 1.321 -0.652 0 CA-C-N 116.0 -0.546 . . . . 0.0 112.002 -178.692 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 25' ' ' LYS . . . . . 0.465 ' O ' ' HG2' ' A' ' 29' ' ' MET . 72.1 mmtt -100.47 2.11 41.8 Favored 'General case' 0 C--N 1.308 -1.214 0 N-CA-C 112.827 0.677 . . . . 0.0 112.827 -175.659 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 26' ' ' LEU . . . . . 0.401 HD23 ' HA ' ' A' ' 26' ' ' LEU . 55.9 mt -58.3 -35.49 71.92 Favored 'General case' 0 C--O 1.219 -0.525 0 N-CA-C 113.741 1.015 . . . . 0.0 113.741 -176.877 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 27' ' ' LEU . . . . . . . . . . . . . 1.5 tm? -55.31 -51.09 67.82 Favored 'General case' 0 N--CA 1.439 -0.982 0 N-CA-C 108.933 -0.765 . . . . 0.0 108.933 178.748 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 28' ' ' GLU . . . . . 0.548 ' HA ' ' CE2' ' A' ' 31' ' ' TYR . 43.9 mt-10 -64.87 -34.46 78.44 Favored 'General case' 0 CA--C 1.505 -0.752 0 CA-C-N 115.515 -0.766 . . . . 0.0 110.385 -179.704 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 29' ' ' MET . . . . . 0.465 ' HG2' ' O ' ' A' ' 25' ' ' LYS . 72.2 mmm -76.02 -21.82 56.44 Favored 'General case' 0 C--N 1.311 -1.07 0 CA-C-N 115.565 -0.743 . . . . 0.0 111.541 -174.653 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 30' ' ' GLY . . . . . . . . . . . . . . . -68.53 -37.69 85.6 Favored Glycine 0 CA--C 1.5 -0.862 0 C-N-CA 121.008 -0.615 . . . . 0.0 111.728 -179.892 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 31' ' ' TYR . . . . . 0.548 ' CE2' ' HA ' ' A' ' 28' ' ' GLU . 40.2 p90 -91.25 -36.84 13.67 Favored 'General case' 0 N--CA 1.433 -1.304 0 C-N-CA 119.77 -0.772 . . . . 0.0 112.005 177.775 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 32' ' ' TYR . . . . . . . . . . . . . 22.5 m-85 -65.72 -57.77 7.26 Favored 'General case' 0 C--N 1.316 -0.89 0 N-CA-C 113.259 0.837 . . . . 0.0 113.259 177.42 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 33' ' ' CYS . . . . . 0.413 ' HA ' ' HA ' ' A' ' 5' ' ' ASP . 98.5 m -135.05 80.62 47.48 Favored Pre-proline 0 C--N 1.305 -1.362 0 CA-C-O 121.376 0.608 . . . . 0.0 112.429 -177.694 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 34' ' ' PRO . . . . . 0.474 ' HA ' ' CD1' ' A' ' 39' ' ' PHE . 73.5 Cg_endo -72.59 -20.38 23.45 Favored 'Trans proline' 0 N--CA 1.45 -1.083 0 C-N-CA 122.576 2.184 . . . . 0.0 111.616 -178.404 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 35' ' ' VAL . . . . . . . . . . . . . 21.7 t -86.34 -55.93 5.99 Favored 'Isoleucine or valine' 0 C--N 1.295 -1.794 0 C-N-CA 120.431 -0.508 . . . . 0.0 110.178 -177.852 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 36' ' ' THR . . . . . 0.404 HG22 ' SG ' ' A' ' 20' ' ' CYS . 55.4 m -59.98 -40.12 88.04 Favored 'General case' 0 C--N 1.318 -0.79 0 N-CA-C 112.706 0.632 . . . . 0.0 112.706 -179.201 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 37' ' ' CYS . . . . . 0.411 ' SG ' ' HB3' ' A' ' 29' ' ' MET . 71.9 m -86.1 11.2 12.29 Favored 'General case' 0 C--N 1.307 -1.274 0 N-CA-C 113.212 0.819 . . . . 0.0 113.212 -177.429 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 38' ' ' GLY . . . . . . . . . . . . . . . 73.81 40.18 45.62 Favored Glycine 0 C--N 1.33 0.21 0 N-CA-C 115.332 0.893 . . . . 0.0 115.332 172.102 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 39' ' ' PHE . . . . . 0.474 ' CD1' ' HA ' ' A' ' 34' ' ' PRO . 95.5 m-85 -96.43 -37.9 10.25 Favored 'General case' 0 C--N 1.299 -1.62 0 N-CA-C 108.294 -1.002 . . . . 0.0 108.294 174.36 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 40' ' ' CYS . . . . . 0.425 ' SG ' ' HB2' ' A' ' 34' ' ' PRO . 6.5 p -163.04 -101.24 0.02 OUTLIER 'General case' 0 C--N 1.314 -0.972 0 CA-C-N 114.93 -1.032 . . . . 0.0 109.855 178.352 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 41' ' ' NH2 . . . . . . . . . . . . . . . . . . . . 0 C--N 1.315 -0.916 0 O-C-N 121.425 -0.797 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 011 nuclear build full ' A' A ' 1' ' ' GLU . . . . . . . . . . . . . 15.1 pt-20 . . . . . 0 CA--C 1.495 -1.173 0 N-CA-C 109.497 -0.557 . . . . 0.0 109.497 . . . . . . . . . 0 0 . 1 . 011 nuclear build full ' A' A ' 2' ' ' HIS . . . . . . . . . . . . . 69.2 m80 -91.14 130.8 36.99 Favored 'General case' 0 C--N 1.294 -1.841 0 N-CA-C 106.822 -1.547 . . . . 0.0 106.822 173.049 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 3' ' ' CYS . . . . . . . . . . . . . 8.3 p -57.8 114.12 2.16 Favored 'General case' 0 C--N 1.309 -1.17 0 O-C-N 123.696 0.623 . . . . 0.0 110.082 178.194 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 4' ' ' ALA . . . . . . . . . . . . . . . -133.32 156.06 48.28 Favored 'General case' 0 N--CA 1.43 -1.435 0 CA-C-N 115.734 -0.666 . . . . 0.0 109.627 -176.214 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 5' ' ' ASP . . . . . 0.563 ' HB3' ' SG ' ' A' ' 11' ' ' CYS . 14.6 m-20 -63.23 145.43 55.53 Favored 'General case' 0 C--N 1.308 -1.207 0 O-C-N 123.9 0.75 . . . . 0.0 110.654 179.8 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 6' ' ' GLU . . . . . 0.41 ' OE2' ' HB2' ' A' ' 8' ' ' ASN . 0.3 OUTLIER -70.21 124.18 23.48 Favored 'General case' 0 C--N 1.306 -1.283 0 N-CA-C 105.495 -2.039 . . . . 0.0 105.495 176.239 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' A' A ' 7' ' ' LYS . . . . . 0.5 ' HD2' ' H ' ' A' ' 7' ' ' LYS . 0.0 OUTLIER -79.19 -21.37 46.47 Favored 'General case' 0 C--N 1.321 -0.639 0 N-CA-C 113.597 0.962 . . . . 0.0 113.597 -170.687 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' A' A ' 8' ' ' ASN . . . . . 0.41 ' HB2' ' OE2' ' A' ' 6' ' ' GLU . 32.7 m-80 -81.7 -23.03 37.05 Favored 'General case' 0 C--N 1.304 -1.407 0 N-CA-C 108.873 -0.788 . . . . 0.0 108.873 -178.964 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 9' ' ' PHE . . . . . . . . . . . . . 28.7 t80 -81.67 142.32 32.82 Favored 'General case' 0 N--CA 1.428 -1.54 0 CA-C-N 114.593 -1.185 . . . . 0.0 108.362 178.524 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 10' ' ' ASP . . . . . . . . . . . . . 8.9 t70 -92.18 97.14 10.72 Favored 'General case' 0 C--N 1.305 -1.346 0 C-N-CA 118.856 -1.137 . . . . 0.0 109.018 178.759 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 11' ' ' CYS . . . . . 0.563 ' SG ' ' HB3' ' A' ' 5' ' ' ASP . 72.8 m -73.83 -23.06 59.59 Favored 'General case' 0 C--N 1.297 -1.682 0 CA-C-N 115.231 -0.895 . . . . 0.0 111.546 -177.23 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 12' ' ' ARG . . . . . . . . . . . . . 19.9 mmm180 -74.19 -44.56 52.9 Favored 'General case' 0 C--N 1.325 -0.473 0 N-CA-C 109.354 -0.61 . . . . 0.0 109.354 -177.235 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 58.2 ttp180 -56.32 -49.12 75.24 Favored 'General case' 0 C--N 1.321 -0.66 0 C-N-CA 124.253 1.021 . . . . 0.0 108.597 176.083 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 14' ' ' SER . . . . . . . . . . . . . 20.7 m -60.38 -32.73 71.58 Favored 'General case' 0 C--N 1.313 -1.008 0 CA-C-N 114.794 -1.093 . . . . 0.0 111.911 -179.35 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 15' ' ' LEU . . . . . 0.483 ' HA ' ' HB3' ' A' ' 20' ' ' CYS . 29.9 tp -78.08 -39.32 41.93 Favored 'General case' 0 C--N 1.309 -1.174 0 O-C-N 121.973 -0.455 . . . . 0.0 110.559 179.765 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 16' ' ' ARG . . . . . . . . . . . . . 66.6 mtt180 -70.04 -35.93 74.66 Favored 'General case' 0 C--N 1.316 -0.873 0 CA-C-N 115.874 -0.603 . . . . 0.0 111.88 179.663 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 17' ' ' ASN . . . . . . . . . . . . . 95.0 m-20 -70.86 -44.13 67.03 Favored 'General case' 0 CA--C 1.495 -1.136 0 CA-C-O 121.662 0.744 . . . . 0.0 109.533 178.688 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . 118.82 2.65 14.25 Favored Glycine 0 N--CA 1.424 -2.13 0 CA-C-N 114.556 -1.202 . . . . 0.0 110.948 -177.144 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 19' ' ' ASP . . . . . . . . . . . . . 28.0 m-20 -60.16 -41.65 93.27 Favored 'General case' 0 N--CA 1.484 1.256 0 CA-C-O 122.354 1.073 . . . . 0.0 108.518 -179.893 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 20' ' ' CYS . . . . . 0.483 ' HB3' ' HA ' ' A' ' 15' ' ' LEU . 43.2 t -79.6 -3.18 45.9 Favored 'General case' 0 C--N 1.302 -1.46 0 CA-C-N 113.689 -1.596 . . . . 0.0 111.056 -176.548 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 21' ' ' ASP . . . . . . . . . . . . . 32.1 t70 -121.93 -9.75 8.73 Favored 'General case' 0 C--N 1.312 -1.06 0 CA-C-O 121.445 0.641 . . . . 0.0 110.626 -176.275 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 22' ' ' ASN . . . . . 0.437 ' O ' ' HG ' ' A' ' 26' ' ' LEU . 55.0 t-20 -87.26 125.04 33.96 Favored 'General case' 0 C--N 1.31 -1.13 0 N-CA-C 108.909 -0.775 . . . . 0.0 108.909 -177.542 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 23' ' ' ASP . . . . . . . . . . . . . 28.8 t70 -55.22 -36.77 66.33 Favored 'General case' 0 C--N 1.318 -0.767 0 C-N-CA 124.165 0.986 . . . . 0.0 111.782 -179.658 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 31.6 t70 -68.45 -29.51 68.17 Favored 'General case' 0 C--N 1.316 -0.877 0 CA-C-N 115.951 -0.568 . . . . 0.0 111.516 -178.368 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 25' ' ' LYS . . . . . . . . . . . . . 13.2 mptt -100.02 1.55 42.57 Favored 'General case' 0 C--N 1.316 -0.89 0 CA-C-N 116.079 -0.509 . . . . 0.0 112.336 -178.018 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 26' ' ' LEU . . . . . 0.437 ' HG ' ' O ' ' A' ' 22' ' ' ASN . 59.3 mt -62.89 -38.36 90.62 Favored 'General case' 0 C--O 1.214 -0.787 0 N-CA-C 114.737 1.384 . . . . 0.0 114.737 -175.262 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 27' ' ' LEU . . . . . . . . . . . . . 2.0 tm? -59.95 -47.24 86.62 Favored 'General case' 0 N--CA 1.441 -0.921 0 N-CA-C 108.607 -0.886 . . . . 0.0 108.607 -179.285 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 28' ' ' GLU . . . . . 0.58 ' HA ' ' CZ ' ' A' ' 31' ' ' TYR . 34.0 tt0 -64.81 -35.63 81.71 Favored 'General case' 0 C--N 1.311 -1.105 0 CA-C-N 115.401 -0.818 . . . . 0.0 110.139 179.708 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 29' ' ' MET . . . . . 0.511 ' HB3' ' SG ' ' A' ' 37' ' ' CYS . 76.1 mmm -82.64 -12.17 57.84 Favored 'General case' 0 C--N 1.3 -1.563 0 CA-C-N 115.477 -0.783 . . . . 0.0 111.897 -175.03 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 30' ' ' GLY . . . . . . . . . . . . . . . -75.35 -36.96 43.09 Favored Glycine 0 C--N 1.307 -1.037 0 N-CA-C 111.113 -0.795 . . . . 0.0 111.113 177.77 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 31' ' ' TYR . . . . . 0.58 ' CZ ' ' HA ' ' A' ' 28' ' ' GLU . 24.8 p90 -84.78 -27.98 26.5 Favored 'General case' 0 N--CA 1.441 -0.914 0 C-N-CA 119.681 -0.808 . . . . 0.0 112.24 176.408 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 32' ' ' TYR . . . . . . . . . . . . . 30.6 m-85 -77.43 -61.38 2.01 Favored 'General case' 0 C--N 1.295 -1.799 0 N-CA-C 113.737 1.014 . . . . 0.0 113.737 174.961 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 33' ' ' CYS . . . . . . . . . . . . . 31.4 m -132.58 72.86 77.38 Favored Pre-proline 0 C--N 1.303 -1.441 0 C-N-CA 119.734 -0.786 . . . . 0.0 111.466 -175.308 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 34' ' ' PRO . . . . . 0.534 ' HD2' ' HA ' ' A' ' 5' ' ' ASP . 34.6 Cg_endo -62.48 -26.86 76.58 Favored 'Trans proline' 0 C--N 1.363 1.304 0 C-N-CA 122.703 2.269 . . . . 0.0 112.323 -178.549 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 35' ' ' VAL . . . . . . . . . . . . . 38.5 t -85.92 -49.68 15.06 Favored 'Isoleucine or valine' 0 C--N 1.296 -1.754 0 C-N-CA 120.133 -0.627 . . . . 0.0 110.472 -177.45 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 36' ' ' THR . . . . . . . . . . . . . 20.9 m -58.94 -38.51 79.16 Favored 'General case' 0 C--N 1.32 -0.685 0 C-N-CA 123.072 0.549 . . . . 0.0 111.279 -178.917 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 37' ' ' CYS . . . . . 0.511 ' SG ' ' HB3' ' A' ' 29' ' ' MET . 64.6 m -87.91 10.8 17.52 Favored 'General case' 0 C--N 1.312 -1.061 0 CA-C-N 115.9 -0.591 . . . . 0.0 112.246 -178.488 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 38' ' ' GLY . . . . . . . . . . . . . . . 74.73 19.84 79.74 Favored Glycine 0 CA--C 1.522 0.489 0 N-CA-C 116.197 1.239 . . . . 0.0 116.197 172.145 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 39' ' ' PHE . . . . . . . . . . . . . 97.3 m-85 -79.15 -43.01 24.85 Favored 'General case' 0 C--N 1.317 -0.828 0 CA-C-N 118.153 0.976 . . . . 0.0 108.419 176.908 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 40' ' ' CYS . . . . . . . . . . . . . 61.1 m -112.67 86.48 2.37 Favored 'General case' 0 C--N 1.303 -1.424 0 CA-C-N 114.728 -1.124 . . . . 0.0 108.618 178.44 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 41' ' ' NH2 . . . . . . . . . . . . . . . . . . . . 0 C--N 1.307 -1.26 0 CA-C-N 116.586 -0.279 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 012 nuclear build full ' A' A ' 1' ' ' GLU . . . . . . . . . . . . . 6.7 pt-20 . . . . . 0 CA--C 1.508 -0.65 0 CA-C-O 121.084 0.468 . . . . 0.0 110.192 . . . . . . . . . 0 0 . 1 . 012 nuclear build full ' A' A ' 2' ' ' HIS . . . . . . . . . . . . . 76.6 m-70 -102.36 111.98 24.49 Favored 'General case' 0 N--CA 1.428 -1.527 0 N-CA-C 106.864 -1.532 . . . . 0.0 106.864 173.26 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 3' ' ' CYS . . . . . . . . . . . . . 45.2 t -84.32 95.7 8.8 Favored 'General case' 0 C--N 1.3 -1.571 0 CA-C-O 121.899 0.856 . . . . 0.0 109.961 -175.955 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 4' ' ' ALA . . . . . . . . . . . . . . . -149.6 145.7 26.92 Favored 'General case' 0 C--N 1.283 -2.31 0 CA-C-N 114.233 -1.349 . . . . 0.0 108.701 -178.928 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 5' ' ' ASP . . . . . 0.477 ' HB3' ' SG ' ' A' ' 11' ' ' CYS . 24.5 m-20 -56.95 148.83 20.15 Favored 'General case' 0 C--O 1.25 1.129 0 O-C-N 124.095 0.872 . . . . 0.0 110.056 179.907 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 6' ' ' GLU . . . . . 0.468 ' OE1' ' HG2' ' A' ' 7' ' ' LYS . 9.4 tp10 -72.54 145.68 47.28 Favored 'General case' 0 N--CA 1.423 -1.818 0 CA-C-O 121.387 0.613 . . . . 0.0 111.226 -176.562 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 7' ' ' LYS . . . . . 0.468 ' HG2' ' OE1' ' A' ' 6' ' ' GLU . 8.0 ptpp? -84.27 -25.2 29.55 Favored 'General case' 0 C--N 1.315 -0.925 0 CA-C-N 115.085 -0.961 . . . . 0.0 110.885 -175.609 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 8' ' ' ASN . . . . . 0.441 ' H ' ' HG3' ' A' ' 6' ' ' GLU . 15.0 m120 -87.64 4.89 42.16 Favored 'General case' 0 C--N 1.309 -1.187 0 CA-C-N 115.086 -0.961 . . . . 0.0 110.047 -178.001 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 9' ' ' PHE . . . . . . . . . . . . . 20.6 t80 -129.72 143.83 51.0 Favored 'General case' 0 N--CA 1.417 -2.111 0 N-CA-C 107.354 -1.351 . . . . 0.0 107.354 -176.704 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 10' ' ' ASP . . . . . . . . . . . . . 12.1 t70 -103.04 100.9 10.86 Favored 'General case' 0 C--N 1.303 -1.432 0 N-CA-C 108.447 -0.946 . . . . 0.0 108.447 179.617 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 11' ' ' CYS . . . . . 0.477 ' SG ' ' HB3' ' A' ' 5' ' ' ASP . 74.1 m -72.57 -26.38 61.7 Favored 'General case' 0 C--N 1.284 -2.263 0 N-CA-C 113.375 0.88 . . . . 0.0 113.375 -175.004 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 12' ' ' ARG . . . . . . . . . . . . . 37.1 mmt180 -73.17 -49.05 30.28 Favored 'General case' 0 C--N 1.319 -0.728 0 C-N-CA 120.549 -0.461 . . . . 0.0 110.004 -179.792 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 55.2 ttp180 -61.17 -42.72 99.06 Favored 'General case' 0 C--N 1.324 -0.525 0 CA-C-N 115.993 -0.549 . . . . 0.0 110.69 -179.919 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 14' ' ' SER . . . . . . . . . . . . . 16.8 m -66.3 -40.9 90.31 Favored 'General case' 0 C--N 1.312 -1.038 0 CA-C-O 121.185 0.517 . . . . 0.0 110.51 -178.756 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 61.7 tp -63.69 -44.55 93.35 Favored 'General case' 0 C--O 1.238 0.473 0 CA-C-N 115.946 -0.57 . . . . 0.0 110.717 178.704 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 16' ' ' ARG . . . . . . . . . . . . . 78.1 mtp180 -71.56 -28.59 63.96 Favored 'General case' 0 C--N 1.316 -0.89 0 CA-C-N 115.6 -0.727 . . . . 0.0 112.3 -178.786 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 17' ' ' ASN . . . . . . . . . . . . . 13.1 m-80 -77.82 -33.39 52.4 Favored 'General case' 0 CA--C 1.493 -1.22 0 CA-C-O 120.97 0.414 . . . . 0.0 111.89 177.522 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . 116.4 17.19 6.23 Favored Glycine 0 C--N 1.295 -1.728 0 C-N-CA 119.72 -1.228 . . . . 0.0 112.804 177.612 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 19' ' ' ASP . . . . . . . . . . . . . 4.4 m-20 -63.8 -35.45 80.65 Favored 'General case' 0 CA--C 1.505 -0.753 0 CA-C-O 120.99 0.424 . . . . 0.0 111.929 179.203 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 20' ' ' CYS . . . . . . . . . . . . . 11.1 t -85.63 -2.97 58.72 Favored 'General case' 0 C--N 1.309 -1.178 0 CA-C-O 121.851 0.834 . . . . 0.0 109.389 -176.335 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 21' ' ' ASP . . . . . . . . . . . . . 31.2 t70 -105.83 -9.33 17.25 Favored 'General case' 0 C--N 1.319 -0.755 0 CA-C-O 122.404 1.097 . . . . 0.0 108.717 176.692 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 22' ' ' ASN . . . . . . . . . . . . . 49.4 t-20 -87.45 115.07 24.61 Favored 'General case' 0 C--N 1.304 -1.391 0 CA-C-N 114.505 -1.225 . . . . 0.0 108.427 -176.978 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 23' ' ' ASP . . . . . 0.485 ' HA ' ' HG ' ' A' ' 26' ' ' LEU . 7.7 m-20 -56.91 -37.65 71.73 Favored 'General case' 0 N--CA 1.475 0.776 0 N-CA-C 112.607 0.595 . . . . 0.0 112.607 -178.252 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 29.5 m-20 -69.12 -24.15 64.07 Favored 'General case' 0 C--N 1.321 -0.657 0 CA-C-N 116.375 -0.375 . . . . 0.0 111.465 -179.227 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 25' ' ' LYS . . . . . . . . . . . . . 14.0 mptt -107.17 8.7 30.22 Favored 'General case' 0 C--N 1.313 -1.006 0 N-CA-C 113.044 0.757 . . . . 0.0 113.044 -178.825 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 26' ' ' LEU . . . . . 0.485 ' HG ' ' HA ' ' A' ' 23' ' ' ASP . 73.7 mt -59.09 -48.32 82.05 Favored 'General case' 0 N--CA 1.472 0.646 0 N-CA-C 113.502 0.927 . . . . 0.0 113.502 -177.908 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 27' ' ' LEU . . . . . . . . . . . . . 22.1 tp -59.67 -48.52 81.34 Favored 'General case' 0 N--CA 1.44 -0.971 0 N-CA-C 108.952 -0.759 . . . . 0.0 108.952 178.894 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 28' ' ' GLU . . . . . . . . . . . . . 4.7 tp10 -55.74 -37.89 69.06 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 114.055 -1.429 . . . . 0.0 108.935 -177.679 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 29' ' ' MET . . . . . . . . . . . . . 78.5 mmm -84.47 -28.22 26.95 Favored 'General case' 0 C--N 1.309 -1.167 0 CA-C-N 114.997 -1.001 . . . . 0.0 112.4 -173.834 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 30' ' ' GLY . . . . . . . . . . . . . . . -72.69 -32.44 61.54 Favored Glycine 0 N--CA 1.431 -1.638 0 C-N-CA 120.567 -0.825 . . . . 0.0 112.461 -177.76 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 31' ' ' TYR . . . . . . . . . . . . . 47.2 p90 -90.61 -34.79 15.33 Favored 'General case' 0 CA--C 1.5 -0.948 0 C-N-CA 117.935 -1.506 . . . . 0.0 112.349 177.514 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 32' ' ' TYR . . . . . . . . . . . . . 31.4 m-85 -68.69 -41.92 78.51 Favored 'General case' 0 C--N 1.312 -1.022 0 C-N-CA 120.212 -0.595 . . . . 0.0 112.328 176.326 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 33' ' ' CYS . . . . . . . . . . . . . 54.9 m -132.59 64.75 72.64 Favored Pre-proline 0 C--O 1.259 1.553 0 N-CA-C 112.421 0.526 . . . . 0.0 112.421 -176.346 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 34' ' ' PRO . . . . . 0.426 ' HD2' ' HA ' ' A' ' 5' ' ' ASP . 38.6 Cg_endo -67.1 -29.87 39.28 Favored 'Trans proline' 0 N--CA 1.453 -0.908 0 C-N-CA 122.011 1.807 . . . . 0.0 111.718 -178.674 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 35' ' ' VAL . . . . . . . . . . . . . 47.3 t -87.38 -50.08 14.13 Favored 'Isoleucine or valine' 0 N--CA 1.43 -1.455 0 CA-C-N 115.7 -0.682 . . . . 0.0 111.653 -175.379 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 36' ' ' THR . . . . . . . . . . . . . 95.6 m -58.39 -37.69 75.79 Favored 'General case' 0 CA--C 1.545 0.772 0 N-CA-C 112.552 0.575 . . . . 0.0 112.552 -178.683 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 37' ' ' CYS . . . . . 0.416 ' HB2' ' CE2' ' A' ' 39' ' ' PHE . 85.7 m -78.21 -23.62 47.42 Favored 'General case' 0 C--N 1.322 -0.59 0 C-N-CA 119.233 -0.987 . . . . 0.0 111.897 177.668 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 38' ' ' GLY . . . . . . . . . . . . . . . 96.49 41.12 3.73 Favored Glycine 0 N--CA 1.445 -0.727 0 C-N-CA 119.998 -1.096 . . . . 0.0 113.193 179.154 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 39' ' ' PHE . . . . . 0.416 ' CE2' ' HB2' ' A' ' 37' ' ' CYS . 91.4 m-85 -97.47 -38.9 9.41 Favored 'General case' 0 C--N 1.314 -0.943 0 N-CA-C 107.777 -1.194 . . . . 0.0 107.777 174.276 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 40' ' ' CYS . . . . . . . . . . . . . 41.9 t -107.08 94.6 5.18 Favored 'General case' 0 C--N 1.299 -1.591 0 CA-C-N 113.97 -1.468 . . . . 0.0 108.723 -176.416 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 41' ' ' NH2 . . . . . . . . . . . . . . . . . . . . 0 C--N 1.305 -1.334 0 CA-C-N 116.6 -0.273 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 013 nuclear build full ' A' A ' 1' ' ' GLU . . . . . . . . . . . . . 10.2 pt-20 . . . . . 0 C--O 1.236 0.343 0 CA-C-O 119.417 -0.325 . . . . 0.0 111.295 . . . . . . . . . 0 0 . 1 . 013 nuclear build full ' A' A ' 2' ' ' HIS . . . . . . . . . . . . . 20.8 m-70 -60.76 111.5 1.66 Allowed 'General case' 0 CA--C 1.484 -1.559 0 CA-C-O 121.572 0.701 . . . . 0.0 111.197 -172.209 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 3' ' ' CYS . . . . . 0.437 ' SG ' ' HB2' ' A' ' 34' ' ' PRO . 16.0 t -81.66 98.03 8.18 Favored 'General case' 0 C--N 1.279 -2.493 0 CA-C-N 114.486 -1.234 . . . . 0.0 109.307 -178.883 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 4' ' ' ALA . . . . . . . . . . . . . . . -152.03 136.45 16.8 Favored 'General case' 0 C--N 1.292 -1.924 0 CA-C-N 114.479 -1.237 . . . . 0.0 108.781 179.875 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 5' ' ' ASP . . . . . 0.592 ' HB3' ' SG ' ' A' ' 11' ' ' CYS . 54.3 m-20 -67.44 143.25 56.35 Favored 'General case' 0 C--O 1.248 0.995 0 O-C-N 123.473 0.483 . . . . 0.0 111.122 179.04 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 9.8 tp10 -66.86 140.88 57.81 Favored 'General case' 0 C--N 1.316 -0.869 0 C-N-CA 124.054 0.942 . . . . 0.0 109.741 177.563 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 7' ' ' LYS . . . . . . . . . . . . . 20.8 ptmt -85.44 -23.36 27.9 Favored 'General case' 0 N--CA 1.441 -0.89 0 CA-C-O 121.464 0.649 . . . . 0.0 111.101 -178.652 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 8' ' ' ASN . . . . . . . . . . . . . 38.1 m-80 -86.91 14.66 6.92 Favored 'General case' 0 N--CA 1.48 1.057 0 CA-C-N 114.953 -1.021 . . . . 0.0 110.673 -178.565 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 9' ' ' PHE . . . . . . . . . . . . . 15.3 t80 -141.34 132.95 27.07 Favored 'General case' 0 N--CA 1.41 -2.469 0 N-CA-C 105.232 -2.136 . . . . 0.0 105.232 -178.774 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 10' ' ' ASP . . . . . . . . . . . . . 9.1 t70 -91.78 96.79 10.61 Favored 'General case' 0 C--N 1.297 -1.7 0 C-N-CA 118.63 -1.228 . . . . 0.0 108.774 -179.713 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 11' ' ' CYS . . . . . 0.592 ' SG ' ' HB3' ' A' ' 5' ' ' ASP . 60.0 m -68.33 -30.21 69.14 Favored 'General case' 0 C--N 1.3 -1.546 0 CA-C-N 115.706 -0.679 . . . . 0.0 112.215 -175.574 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 12' ' ' ARG . . . . . . . . . . . . . 30.6 mmt180 -69.36 -47.46 64.25 Favored 'General case' 0 CA--C 1.508 -0.635 0 N-CA-C 110.008 -0.368 . . . . 0.0 110.008 179.468 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 54.6 ttp180 -58.71 -42.25 88.21 Favored 'General case' 0 C--N 1.315 -0.894 0 C-N-CA 122.967 0.507 . . . . 0.0 109.918 176.865 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 14' ' ' SER . . . . . . . . . . . . . 26.2 m -64.51 -33.42 75.84 Favored 'General case' 0 C--N 1.316 -0.891 0 CA-C-N 116.006 -0.543 . . . . 0.0 110.749 179.153 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 29.8 tp -74.88 -41.7 59.29 Favored 'General case' 0 N--CA 1.441 -0.912 0 N-CA-C 109.633 -0.506 . . . . 0.0 109.633 179.609 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 16' ' ' ARG . . . . . . . . . . . . . 78.3 mtp180 -64.49 -31.09 72.15 Favored 'General case' 0 C--N 1.321 -0.656 0 C-N-CA 123.699 0.8 . . . . 0.0 111.883 179.51 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 17' ' ' ASN . . . . . . . . . . . . . 30.6 m-80 -85.25 -42.77 14.36 Favored 'General case' 0 CA--C 1.511 -0.531 0 N-CA-C 112.454 0.539 . . . . 0.0 112.454 179.275 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . 130.55 -4.19 5.83 Favored Glycine 0 C--O 1.225 -0.461 0 C-N-CA 119.614 -1.279 . . . . 0.0 112.414 -179.334 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 19' ' ' ASP . . . . . . . . . . . . . 3.5 m-20 -61.79 -38.99 90.1 Favored 'General case' 0 N--CA 1.478 0.972 0 C-N-CA 123.614 0.766 . . . . 0.0 110.701 -177.336 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 20' ' ' CYS . . . . . . . . . . . . . 44.4 t -77.89 -11.21 59.87 Favored 'General case' 0 C--N 1.302 -1.497 0 CA-C-N 114.728 -1.124 . . . . 0.0 111.845 -173.741 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 21' ' ' ASP . . . . . . . . . . . . . 35.3 t70 -114.07 -6.61 13.1 Favored 'General case' 0 C--N 1.312 -1.036 0 CA-C-O 121.768 0.794 . . . . 0.0 110.612 -178.437 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 22' ' ' ASN . . . . . . . . . . . . . 19.1 t-20 -79.53 115.47 19.17 Favored 'General case' 0 C--N 1.309 -1.177 0 CA-C-N 115.378 -0.828 . . . . 0.0 109.681 -177.297 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 23' ' ' ASP . . . . . 0.4 ' HA ' ' HG ' ' A' ' 26' ' ' LEU . 13.2 t70 -55.02 -39.45 69.13 Favored 'General case' 0 N--CA 1.479 0.988 0 C-N-CA 123.972 0.909 . . . . 0.0 112.616 -175.849 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 6.0 m-20 -72.58 -12.93 61.26 Favored 'General case' 0 C--N 1.31 -1.151 0 N-CA-C 112.819 0.674 . . . . 0.0 112.819 -177.053 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 25' ' ' LYS . . . . . . . . . . . . . 43.7 mtpt -113.41 -2.08 14.04 Favored 'General case' 0 C--N 1.315 -0.934 0 CA-C-O 120.963 0.411 . . . . 0.0 110.432 179.655 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 26' ' ' LEU . . . . . 0.412 HD23 ' HA ' ' A' ' 26' ' ' LEU . 45.8 mt -55.54 -35.54 65.79 Favored 'General case' 0 C--N 1.318 -0.785 0 N-CA-C 115.44 1.644 . . . . 0.0 115.44 -177.632 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 27' ' ' LEU . . . . . . . . . . . . . 2.2 tm? -58.08 -50.96 71.67 Favored 'General case' 0 N--CA 1.441 -0.9 0 N-CA-C 107.672 -1.233 . . . . 0.0 107.672 179.071 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 28' ' ' GLU . . . . . 0.631 ' HA ' ' CZ ' ' A' ' 31' ' ' TYR . 40.0 tt0 -65.38 -32.62 74.35 Favored 'General case' 0 N--CA 1.437 -1.076 0 CA-C-N 114.63 -1.168 . . . . 0.0 110.449 179.753 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 29' ' ' MET . . . . . . . . . . . . . 78.5 mmm -80.51 -17.98 49.91 Favored 'General case' 0 C--O 1.208 -1.121 0 CA-C-N 115.901 -0.59 . . . . 0.0 112.081 -175.764 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 30' ' ' GLY . . . . . . . . . . . . . . . -77.06 -39.78 26.64 Favored Glycine 0 C--N 1.303 -1.284 0 C-N-CA 120.419 -0.896 . . . . 0.0 111.658 -179.604 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 31' ' ' TYR . . . . . 0.631 ' CZ ' ' HA ' ' A' ' 28' ' ' GLU . 25.0 p90 -79.44 -31.64 42.62 Favored 'General case' 0 CA--C 1.501 -0.931 0 C-N-CA 119.173 -1.011 . . . . 0.0 112.059 176.581 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 32' ' ' TYR . . . . . . . . . . . . . 17.8 m-85 -73.77 -54.85 7.11 Favored 'General case' 0 C--N 1.297 -1.689 0 N-CA-C 113.384 0.883 . . . . 0.0 113.384 174.913 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 33' ' ' CYS . . . . . . . . . . . . . 30.3 m -134.89 76.9 58.22 Favored Pre-proline 0 C--N 1.307 -1.281 0 C-N-CA 119.892 -0.723 . . . . 0.0 111.863 -175.99 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 34' ' ' PRO . . . . . 0.492 ' HD2' ' HA ' ' A' ' 5' ' ' ASP . 55.7 Cg_endo -68.79 -25.07 33.75 Favored 'Trans proline' 0 C--N 1.352 0.759 0 C-N-CA 122.261 1.974 . . . . 0.0 112.054 -179.266 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 35' ' ' VAL . . . . . 0.431 ' HB ' ' OD1' ' A' ' 5' ' ' ASP . 47.3 t -86.28 -51.65 12.91 Favored 'Isoleucine or valine' 0 C--N 1.306 -1.313 0 CA-C-N 116.261 -0.427 . . . . 0.0 110.491 -177.326 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 36' ' ' THR . . . . . . . . . . . . . 62.0 m -62.41 -37.6 86.42 Favored 'General case' 0 C--O 1.249 1.039 0 CA-C-N 116.159 -0.473 . . . . 0.0 111.958 -178.615 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 37' ' ' CYS . . . . . . . . . . . . . 72.2 m -84.62 6.53 23.59 Favored 'General case' 0 C--N 1.311 -1.091 0 N-CA-C 112.395 0.517 . . . . 0.0 112.395 -179.726 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 38' ' ' GLY . . . . . . . . . . . . . . . 70.09 46.49 50.87 Favored Glycine 0 N--CA 1.446 -0.676 0 N-CA-C 115.451 0.94 . . . . 0.0 115.451 172.238 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 39' ' ' PHE . . . . . 0.437 ' CD2' ' HA ' ' A' ' 34' ' ' PRO . 91.9 m-85 -87.87 -36.18 17.34 Favored 'General case' 0 C--N 1.302 -1.467 0 N-CA-C 108.766 -0.828 . . . . 0.0 108.766 174.145 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 40' ' ' CYS . . . . . . . . . . . . . 15.8 m -116.51 73.6 0.86 Allowed 'General case' 0 C--N 1.315 -0.893 0 N-CA-C 109.178 -0.675 . . . . 0.0 109.178 178.889 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 41' ' ' NH2 . . . . . . . . . . . . . . . . . . . . 0 C--N 1.314 -0.96 0 CA-C-N 116.738 -0.21 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 014 nuclear build full ' A' A ' 1' ' ' GLU . . . . . . . . . . . . . 10.8 pt-20 . . . . . 0 C--O 1.243 0.762 0 CA-C-O 119.739 -0.172 . . . . 0.0 110.901 . . . . . . . . . 0 0 . 1 . 014 nuclear build full ' A' A ' 2' ' ' HIS . . . . . . . . . . . . . 21.7 t-80 -65.4 110.63 2.72 Favored 'General case' 0 N--CA 1.441 -0.887 0 N-CA-C 108.964 -0.754 . . . . 0.0 108.964 -178.562 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 3' ' ' CYS . . . . . . . . . . . . . 26.2 p -86.21 109.71 19.1 Favored 'General case' 0 C--N 1.297 -1.702 0 CA-C-N 115.47 -0.786 . . . . 0.0 110.702 -179.875 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 4' ' ' ALA . . . . . . . . . . . . . . . -142.12 156.01 45.36 Favored 'General case' 0 N--CA 1.433 -1.313 0 N-CA-C 108.419 -0.956 . . . . 0.0 108.419 179.538 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 5' ' ' ASP . . . . . 0.601 ' HB3' ' SG ' ' A' ' 11' ' ' CYS . 31.3 m-20 -60.56 137.31 58.18 Favored 'General case' 0 C--N 1.312 -1.04 0 O-C-N 123.527 0.517 . . . . 0.0 111.41 -177.24 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 9.9 tp10 -69.27 127.48 33.2 Favored 'General case' 0 N--CA 1.427 -1.584 0 N-CA-C 109.466 -0.568 . . . . 0.0 109.466 177.534 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 7' ' ' LYS . . . . . . . . . . . . . 17.3 ptpt -85.25 -12.76 51.76 Favored 'General case' 0 C--N 1.306 -1.293 0 CA-C-O 121.576 0.703 . . . . 0.0 110.652 -178.687 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 8' ' ' ASN . . . . . . . . . . . . . 81.1 m-20 -91.64 16.37 10.72 Favored 'General case' 0 C--N 1.315 -0.902 0 CA-C-O 121.91 0.862 . . . . 0.0 109.2 176.398 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 9' ' ' PHE . . . . . 0.431 ' HE2' ' HG ' ' A' ' 14' ' ' SER . 29.6 t80 -136.4 155.98 49.27 Favored 'General case' 0 N--CA 1.427 -1.589 0 N-CA-C 106.748 -1.575 . . . . 0.0 106.748 -177.655 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 10' ' ' ASP . . . . . . . . . . . . . 9.1 t70 -104.49 95.74 6.13 Favored 'General case' 0 C--N 1.311 -1.076 0 N-CA-C 108.501 -0.926 . . . . 0.0 108.501 175.199 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 11' ' ' CYS . . . . . 0.601 ' SG ' ' HB3' ' A' ' 5' ' ' ASP . 81.4 m -67.88 -30.95 70.43 Favored 'General case' 0 C--N 1.301 -1.504 0 CA-C-N 115.61 -0.723 . . . . 0.0 111.727 -175.573 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 12' ' ' ARG . . . . . 0.409 ' O ' ' HG3' ' A' ' 16' ' ' ARG . 28.4 mmm180 -66.93 -43.49 83.11 Favored 'General case' 0 CA--C 1.503 -0.839 0 CA-C-N 116.324 -0.398 . . . . 0.0 110.359 179.496 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 60.7 ttp180 -58.24 -47.59 83.04 Favored 'General case' 0 C--N 1.316 -0.868 0 CA-C-N 115.865 -0.607 . . . . 0.0 110.705 179.333 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 14' ' ' SER . . . . . 0.431 ' HG ' ' HE2' ' A' ' 9' ' ' PHE . 57.0 m -66.66 -28.24 68.31 Favored 'General case' 0 C--N 1.319 -0.743 0 N-CA-C 112.028 0.381 . . . . 0.0 112.028 179.045 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 15' ' ' LEU . . . . . 0.406 HD13 ' SG ' ' A' ' 20' ' ' CYS . 42.3 tp -74.14 -45.2 50.29 Favored 'General case' 0 C--N 1.319 -0.743 0 CA-C-O 120.891 0.377 . . . . 0.0 110.141 177.527 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 16' ' ' ARG . . . . . 0.409 ' HG3' ' O ' ' A' ' 12' ' ' ARG . 48.2 mtm180 -66.5 -34.63 78.36 Favored 'General case' 0 C--N 1.316 -0.849 0 CA-C-N 115.99 -0.55 . . . . 0.0 111.131 179.781 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 17' ' ' ASN . . . . . . . . . . . . . 14.7 m-80 -70.85 -31.08 67.66 Favored 'General case' 0 CA--C 1.496 -1.108 0 CA-C-O 121.167 0.508 . . . . 0.0 111.079 176.318 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . 105.2 -1.66 40.55 Favored Glycine 0 N--CA 1.436 -1.331 0 CA-C-N 115.508 -0.769 . . . . 0.0 112.513 178.489 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 19' ' ' ASP . . . . . . . . . . . . . 18.6 m-20 -63.01 -33.01 74.51 Favored 'General case' 0 N--CA 1.484 1.228 0 CA-C-O 121.657 0.741 . . . . 0.0 109.852 -179.453 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 20' ' ' CYS . . . . . 0.454 ' HA ' ' HG3' ' A' ' 29' ' ' MET . 32.2 t -64.51 -24.14 67.51 Favored 'General case' 0 C--N 1.302 -1.484 0 CA-C-N 114.376 -1.283 . . . . 0.0 110.993 -179.987 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 21' ' ' ASP . . . . . . . . . . . . . 34.6 t70 -112.86 -4.88 13.9 Favored 'General case' 0 N--CA 1.468 0.462 0 CA-C-O 121.585 0.707 . . . . 0.0 110.694 -178.632 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 22' ' ' ASN . . . . . 0.427 ' O ' ' HG ' ' A' ' 26' ' ' LEU . 27.2 t-20 -77.77 126.19 30.48 Favored 'General case' 0 C--N 1.307 -1.246 0 CA-C-N 116.118 -0.492 . . . . 0.0 109.809 -178.602 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 23' ' ' ASP . . . . . 0.483 ' HA ' ' HG ' ' A' ' 26' ' ' LEU . 2.2 m-20 -56.92 -41.74 78.72 Favored 'General case' 0 N--CA 1.474 0.745 0 N-CA-C 113.809 1.04 . . . . 0.0 113.809 -176.333 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 21.9 t70 -67.97 -29.03 67.97 Favored 'General case' 0 C--N 1.314 -0.976 0 CA-C-O 121.408 0.623 . . . . 0.0 110.882 179.824 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 25' ' ' LYS . . . . . 0.41 ' HG2' ' OD1' ' A' ' 22' ' ' ASN . 47.0 mmtm -97.59 -0.63 45.44 Favored 'General case' 0 C--N 1.313 -1.007 0 CA-C-N 116.146 -0.479 . . . . 0.0 111.958 -177.521 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 26' ' ' LEU . . . . . 0.483 ' HG ' ' HA ' ' A' ' 23' ' ' ASP . 74.4 mt -58.46 -44.79 89.38 Favored 'General case' 0 N--CA 1.473 0.684 0 N-CA-C 113.22 0.822 . . . . 0.0 113.22 -177.33 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 27' ' ' LEU . . . . . . . . . . . . . 26.8 tp -60.24 -45.66 92.48 Favored 'General case' 0 N--CA 1.432 -1.346 0 CA-C-O 121.204 0.526 . . . . 0.0 109.747 178.776 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 28' ' ' GLU . . . . . . . . . . . . . 9.5 mm-40 -58.68 -36.67 74.55 Favored 'General case' 0 C--N 1.323 -0.582 0 CA-C-N 114.597 -1.183 . . . . 0.0 109.373 -179.323 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 29' ' ' MET . . . . . 0.466 ' HB3' ' SG ' ' A' ' 37' ' ' CYS . 76.9 mmm -89.29 -16.46 31.1 Favored 'General case' 0 C--N 1.296 -1.737 0 CA-C-N 114.536 -1.211 . . . . 0.0 112.525 -173.271 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 30' ' ' GLY . . . . . . . . . . . . . . . -72.07 -40.23 56.98 Favored Glycine 0 C--N 1.302 -1.307 0 N-CA-C 111.439 -0.665 . . . . 0.0 111.439 178.556 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 31' ' ' TYR . . . . . . . . . . . . . 17.5 p90 -82.66 -29.15 30.19 Favored 'General case' 0 CA--C 1.503 -0.83 0 C-N-CA 119.342 -0.943 . . . . 0.0 112.594 177.618 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 32' ' ' TYR . . . . . . . . . . . . . 15.3 m-85 -76.79 -62.07 1.76 Allowed 'General case' 0 C--N 1.298 -1.669 0 N-CA-C 113.764 1.024 . . . . 0.0 113.764 175.592 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 33' ' ' CYS . . . . . 0.405 ' HA ' ' HA ' ' A' ' 5' ' ' ASP . 56.2 m -131.79 73.4 78.85 Favored Pre-proline 0 C--N 1.309 -1.181 0 C-N-CA 120.294 -0.562 . . . . 0.0 111.445 -175.61 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 34' ' ' PRO . . . . . 0.416 ' HB2' ' SG ' ' A' ' 40' ' ' CYS . 54.3 Cg_endo -67.18 -24.42 44.35 Favored 'Trans proline' 0 C--N 1.351 0.685 0 C-N-CA 122.679 2.253 . . . . 0.0 112.433 -175.683 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 35' ' ' VAL . . . . . 0.43 ' HB ' ' OD2' ' A' ' 5' ' ' ASP . 45.8 t -86.84 -42.86 15.75 Favored 'Isoleucine or valine' 0 C--N 1.301 -1.534 0 CA-C-O 121.077 0.465 . . . . 0.0 110.523 -176.666 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 36' ' ' THR . . . . . . . . . . . . . 31.9 m -63.46 -39.58 94.83 Favored 'General case' 0 C--N 1.308 -1.196 0 CA-C-N 115.75 -0.659 . . . . 0.0 110.985 178.399 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 37' ' ' CYS . . . . . 0.466 ' SG ' ' HB3' ' A' ' 29' ' ' MET . 75.5 m -86.26 5.42 34.46 Favored 'General case' 0 C--N 1.316 -0.876 0 N-CA-C 113.223 0.824 . . . . 0.0 113.223 -178.749 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 38' ' ' GLY . . . . . . . . . . . . . . . 73.11 42.83 42.27 Favored Glycine 0 CA--C 1.52 0.367 0 N-CA-C 115.567 0.987 . . . . 0.0 115.567 173.864 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 39' ' ' PHE . . . . . . . . . . . . . 93.1 m-85 -103.8 -43.59 5.29 Favored 'General case' 0 C--N 1.304 -1.376 0 N-CA-C 107.766 -1.198 . . . . 0.0 107.766 173.316 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 40' ' ' CYS . . . . . 0.416 ' SG ' ' HB2' ' A' ' 34' ' ' PRO . 61.5 m -113.13 101.95 9.93 Favored 'General case' 0 C--N 1.306 -1.284 0 CA-C-N 114.566 -1.197 . . . . 0.0 109.275 -179.463 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 41' ' ' NH2 . . . . . . . . . . . . . . . . . . . . 0 C--N 1.305 -1.335 0 CA-C-N 116.41 -0.359 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 015 nuclear build full ' A' A ' 1' ' ' GLU . . . . . . . . . . . . . 34.3 tt0 . . . . . 0 CA--C 1.493 -1.235 0 CA-C-O 120.352 0.12 . . . . 0.0 110.769 . . . . . . . . . 0 0 . 1 . 015 nuclear build full ' A' A ' 2' ' ' HIS . . . . . . . . . . . . . 49.6 m80 -61.83 111.18 1.77 Allowed 'General case' 0 CA--C 1.481 -1.682 0 N-CA-C 107.703 -1.221 . . . . 0.0 107.703 -178.488 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 3' ' ' CYS . . . . . . . . . . . . . 29.5 p -59.3 88.98 0.01 OUTLIER 'General case' 0 C--N 1.293 -1.851 0 N-CA-C 114.074 1.139 . . . . 0.0 114.074 -178.446 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 4' ' ' ALA . . . . . . . . . . . . . . . -145.86 122.28 10.99 Favored 'General case' 0 N--CA 1.424 -1.748 0 N-CA-C 106.161 -1.792 . . . . 0.0 106.161 174.607 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 5' ' ' ASP . . . . . 0.577 ' OD2' ' HB ' ' A' ' 35' ' ' VAL . 25.9 m-20 -61.56 137.52 58.25 Favored 'General case' 0 C--N 1.315 -0.907 0 O-C-N 123.343 0.402 . . . . 0.0 110.221 -179.506 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER -66.52 136.46 55.69 Favored 'General case' 0 C--N 1.321 -0.671 0 C-N-CA 123.68 0.792 . . . . 0.0 109.558 -175.653 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 7' ' ' LYS . . . . . . . . . . . . . 8.1 ptpp? -73.79 -27.73 61.29 Favored 'General case' 0 C--N 1.309 -1.176 0 N-CA-C 114.986 1.476 . . . . 0.0 114.986 -173.298 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 8' ' ' ASN . . . . . . . . . . . . . 16.2 m120 -98.58 -2.83 37.69 Favored 'General case' 0 C--N 1.285 -2.206 0 C-N-CA 120.436 -0.506 . . . . 0.0 110.933 -178.909 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 9' ' ' PHE . . . . . . . . . . . . . 18.8 t80 -100.7 143.66 30.6 Favored 'General case' 0 C--N 1.302 -1.482 0 N-CA-C 107.499 -1.297 . . . . 0.0 107.499 -179.75 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 10' ' ' ASP . . . . . . . . . . . . . 16.4 t70 -102.82 100.71 10.73 Favored 'General case' 0 C--N 1.307 -1.268 0 C-N-CA 119.064 -1.054 . . . . 0.0 110.788 -179.349 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 11' ' ' CYS . . . . . 0.511 ' SG ' ' HB3' ' A' ' 5' ' ' ASP . 60.1 m -68.32 -27.67 66.49 Favored 'General case' 0 C--N 1.289 -2.03 0 CA-C-N 115.034 -0.984 . . . . 0.0 112.022 -176.1 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 12' ' ' ARG . . . . . . . . . . . . . 38.9 mmt180 -62.2 -48.9 77.97 Favored 'General case' 0 C--O 1.237 0.445 0 N-CA-C 109.575 -0.528 . . . . 0.0 109.575 179.009 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 14.7 ttp180 -59.39 -51.62 69.14 Favored 'General case' 0 C--N 1.325 -0.484 0 CA-C-N 115.394 -0.821 . . . . 0.0 111.092 179.498 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 14' ' ' SER . . . . . . . . . . . . . 25.4 m -63.62 -34.63 78.26 Favored 'General case' 0 C--N 1.311 -1.069 0 N-CA-C 112.048 0.388 . . . . 0.0 112.048 -178.249 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 2.3 tm? -68.34 -43.48 77.43 Favored 'General case' 0 CA--C 1.535 0.386 0 N-CA-C 108.82 -0.807 . . . . 0.0 108.82 179.16 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 16' ' ' ARG . . . . . . . . . . . . . 71.3 mtp180 -70.23 -37.26 74.97 Favored 'General case' 0 C--N 1.319 -0.747 0 N-CA-C 112.824 0.676 . . . . 0.0 112.824 -179.533 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 17' ' ' ASN . . . . . . . . . . . . . 26.4 m-80 -69.99 -36.12 74.92 Favored 'General case' 0 CA--C 1.503 -0.841 0 N-CA-C 111.899 0.333 . . . . 0.0 111.899 178.639 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . 117.79 -1.32 17.71 Favored Glycine 0 N--CA 1.437 -1.283 0 C-N-CA 119.774 -1.203 . . . . 0.0 112.143 179.353 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 19' ' ' ASP . . . . . . . . . . . . . 8.2 m-20 -60.94 -30.46 70.23 Favored 'General case' 0 N--CA 1.482 1.162 0 CA-C-O 121.246 0.546 . . . . 0.0 111.038 -178.38 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 20' ' ' CYS . . . . . . . . . . . . . 52.1 t -82.03 -2.33 51.34 Favored 'General case' 0 C--N 1.304 -1.378 0 CA-C-N 115.411 -0.813 . . . . 0.0 111.001 -176.099 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 21' ' ' ASP . . . . . . . . . . . . . 31.4 t70 -124.32 -9.91 7.51 Favored 'General case' 0 N--CA 1.47 0.554 0 CA-C-O 121.781 0.801 . . . . 0.0 110.065 176.552 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 22' ' ' ASN . . . . . 0.488 ' O ' ' HG ' ' A' ' 26' ' ' LEU . 28.1 t-20 -82.2 121.24 26.37 Favored 'General case' 0 C--N 1.309 -1.153 0 CA-C-N 115.155 -0.93 . . . . 0.0 110.561 -177.041 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 23' ' ' ASP . . . . . . . . . . . . . 13.2 t70 -51.47 -43.32 62.11 Favored 'General case' 0 N--CA 1.483 1.2 0 C-N-CA 124.537 1.135 . . . . 0.0 111.841 -176.904 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 25.4 m-20 -70.2 -14.68 62.73 Favored 'General case' 0 C--N 1.311 -1.093 0 CA-C-N 115.123 -0.944 . . . . 0.0 112.76 -175.911 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 25' ' ' LYS . . . . . . . . . . . . . 14.1 mmmm -115.24 -7.96 12.36 Favored 'General case' 0 C--N 1.313 -1.009 0 N-CA-C 111.56 0.207 . . . . 0.0 111.56 178.894 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 26' ' ' LEU . . . . . 0.488 ' HG ' ' O ' ' A' ' 22' ' ' ASN . 52.3 mt -53.9 -44.55 70.6 Favored 'General case' 0 N--CA 1.473 0.675 0 N-CA-C 114.985 1.476 . . . . 0.0 114.985 -174.329 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 27' ' ' LEU . . . . . . . . . . . . . 26.4 tp -59.27 -46.76 87.66 Favored 'General case' 0 N--CA 1.437 -1.114 0 CA-C-O 121.175 0.512 . . . . 0.0 109.936 -179.309 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 28' ' ' GLU . . . . . 0.513 ' HA ' ' CZ ' ' A' ' 31' ' ' TYR . 46.1 mt-10 -66.14 -32.23 73.56 Favored 'General case' 0 CA--C 1.498 -1.057 0 CA-C-N 114.963 -1.017 . . . . 0.0 110.112 -179.31 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 29' ' ' MET . . . . . 0.433 ' HB3' ' SG ' ' A' ' 37' ' ' CYS . 79.3 mmm -81.51 -19.82 41.39 Favored 'General case' 0 C--N 1.299 -1.616 0 CA-C-N 115.357 -0.838 . . . . 0.0 110.718 -177.901 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 30' ' ' GLY . . . . . 0.453 ' O ' ' HB3' ' A' ' 34' ' ' PRO . . . -74.38 -26.52 67.82 Favored Glycine 0 N--CA 1.43 -1.717 0 CA-C-N 115.259 -0.882 . . . . 0.0 111.216 177.967 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 31' ' ' TYR . . . . . 0.513 ' CZ ' ' HA ' ' A' ' 28' ' ' GLU 0.254 22.2 p90 -98.51 -36.03 10.05 Favored 'General case' 0 N--CA 1.435 -1.194 0 C-N-CA 119.263 -0.975 . . . . 0.0 112.602 173.803 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' A' A ' 32' ' ' TYR . . . . . . . . . . . . . 19.3 m-85 -68.27 -51.71 41.96 Favored 'General case' 0 C--N 1.303 -1.438 0 N-CA-C 113.759 1.022 . . . . 0.0 113.759 176.747 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 33' ' ' CYS . . . . . . . . . . . . . 65.6 m -134.85 66.6 69.07 Favored Pre-proline 0 C--N 1.3 -1.581 0 C-N-CA 119.912 -0.715 . . . . 0.0 111.162 179.684 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 34' ' ' PRO . . . . . 0.453 ' HB3' ' O ' ' A' ' 30' ' ' GLY . 37.1 Cg_endo -64.68 -26.97 60.72 Favored 'Trans proline' 0 C--N 1.352 0.751 0 C-N-CA 122.733 2.289 . . . . 0.0 112.771 -176.566 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 35' ' ' VAL . . . . . 0.577 ' HB ' ' OD2' ' A' ' 5' ' ' ASP . 39.2 t -83.3 -43.38 18.23 Favored 'Isoleucine or valine' 0 C--N 1.307 -1.274 0 C-N-CA 119.796 -0.762 . . . . 0.0 109.617 -178.492 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 36' ' ' THR . . . . . . . . . . . . . 25.2 m -62.61 -40.05 95.72 Favored 'General case' 0 C--N 1.316 -0.851 0 CA-C-N 115.662 -0.699 . . . . 0.0 110.438 178.666 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 37' ' ' CYS . . . . . 0.433 ' SG ' ' HB3' ' A' ' 29' ' ' MET . 79.4 m -81.15 0.18 37.48 Favored 'General case' 0 C--N 1.318 -0.794 0 N-CA-C 112.847 0.684 . . . . 0.0 112.847 178.798 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 38' ' ' GLY . . . . . . . . . . . . . . . 74.21 49.0 13.33 Favored Glycine 0 C--O 1.219 -0.828 0 N-CA-C 115.452 0.941 . . . . 0.0 115.452 173.066 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 39' ' ' PHE . . . . . . . . . . . . . 94.2 m-85 -92.31 -9.58 41.44 Favored 'General case' 0 C--N 1.311 -1.067 0 CA-C-N 117.736 0.768 . . . . 0.0 111.501 175.973 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 40' ' ' CYS . . . . . . . . . . . . . 28.5 p -153.01 104.7 2.85 Favored 'General case' 0 C--N 1.31 -1.141 0 N-CA-C 108.304 -0.998 . . . . 0.0 108.304 173.704 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 41' ' ' NH2 . . . . . . . . . . . . . . . . . . . . 0 C--N 1.306 -1.283 0 O-C-N 122.045 -0.41 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 016 nuclear build full ' A' A ' 1' ' ' GLU . . . . . . . . . . . . . 9.5 tp10 . . . . . 0 N--CA 1.453 -0.312 0 N-CA-C 109.159 -0.682 . . . . 0.0 109.159 . . . . . . . . . 0 0 . 1 . 016 nuclear build full ' A' A ' 2' ' ' HIS . . . . . . . . . . . . . 84.8 m-70 -106.75 112.47 25.46 Favored 'General case' 0 C--N 1.314 -0.965 0 N-CA-C 107.75 -1.204 . . . . 0.0 107.75 177.616 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 3' ' ' CYS . . . . . . . . . . . . . 29.4 p -83.73 117.01 22.95 Favored 'General case' 0 C--N 1.297 -1.715 0 CA-C-O 121.431 0.634 . . . . 0.0 112.683 -173.008 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 4' ' ' ALA . . . . . . . . . . . . . . . -146.48 137.33 24.16 Favored 'General case' 0 C--N 1.32 -0.686 0 N-CA-C 108.489 -0.93 . . . . 0.0 108.489 178.503 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 5' ' ' ASP . . . . . 0.715 ' OD1' ' HB ' ' A' ' 35' ' ' VAL . 11.0 m-20 -59.65 130.39 46.61 Favored 'General case' 0 C--N 1.311 -1.108 0 O-C-N 123.489 0.493 . . . . 0.0 111.844 -179.077 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 8.5 tp10 -66.53 127.12 31.1 Favored 'General case' 0 N--CA 1.44 -0.939 0 C-N-CA 124.015 0.926 . . . . 0.0 110.507 178.426 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 7' ' ' LYS . . . . . . . . . . . . . 10.1 ptpp? -77.09 -21.05 54.94 Favored 'General case' 0 C--N 1.315 -0.893 0 CA-C-N 115.366 -0.834 . . . . 0.0 110.83 -177.608 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 8' ' ' ASN . . . . . . . . . . . . . 15.5 t-20 -87.77 -7.97 56.6 Favored 'General case' 0 C--N 1.302 -1.499 0 CA-C-O 121.961 0.886 . . . . 0.0 109.758 -178.559 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 9' ' ' PHE . . . . . . . . . . . . . 23.2 t80 -108.18 151.23 26.2 Favored 'General case' 0 N--CA 1.43 -1.471 0 N-CA-C 106.983 -1.488 . . . . 0.0 106.983 -179.206 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 10' ' ' ASP . . . . . . . . . . . . . 9.8 t70 -102.55 100.12 10.18 Favored 'General case' 0 C--O 1.253 1.265 0 C-N-CA 118.944 -1.102 . . . . 0.0 109.281 177.483 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 11' ' ' CYS . . . . . 0.482 ' SG ' ' HB3' ' A' ' 5' ' ' ASP . 61.2 m -70.59 -29.3 65.68 Favored 'General case' 0 C--N 1.298 -1.665 0 CA-C-N 114.706 -1.134 . . . . 0.0 111.372 -176.488 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 12' ' ' ARG . . . . . . . . . . . . . 34.1 mmt180 -71.29 -52.32 19.54 Favored 'General case' 0 CA--C 1.506 -0.744 0 CA-C-N 116.03 -0.532 . . . . 0.0 109.896 -175.853 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 38.4 ttm180 -58.31 -46.32 86.38 Favored 'General case' 0 C--N 1.32 -0.69 0 C-N-CA 123.346 0.659 . . . . 0.0 110.42 -179.688 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 14' ' ' SER . . . . . . . . . . . . . 25.9 m -59.83 -38.54 82.34 Favored 'General case' 0 C--O 1.256 1.398 0 CA-C-N 115.875 -0.602 . . . . 0.0 111.142 -178.797 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 41.1 tp -73.26 -46.97 46.88 Favored 'General case' 0 N--CA 1.438 -1.026 0 CA-C-N 116.062 -0.517 . . . . 0.0 110.385 178.016 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 16' ' ' ARG . . . . . . . . . . . . . 97.8 mtt180 -54.28 -47.0 72.85 Favored 'General case' 0 N--CA 1.471 0.583 0 C-N-CA 123.18 0.592 . . . . 0.0 111.504 178.788 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 17' ' ' ASN . . . . . . . . . . . . . 11.0 m120 -65.75 -36.67 84.24 Favored 'General case' 0 CA--C 1.504 -0.789 0 CA-C-O 121.858 0.837 . . . . 0.0 109.576 179.833 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . 109.12 -1.36 31.38 Favored Glycine 0 N--CA 1.432 -1.606 0 CA-C-N 114.376 -1.284 . . . . 0.0 111.863 179.235 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 19' ' ' ASP . . . . . 0.425 ' O ' ' HB2' ' A' ' 25' ' ' LYS . 8.8 m-20 -70.29 -21.44 62.95 Favored 'General case' 0 CA--C 1.49 -1.338 0 N-CA-C 112.554 0.575 . . . . 0.0 112.554 -176.776 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 20' ' ' CYS . . . . . 0.621 ' HA ' ' HG3' ' A' ' 29' ' ' MET . 43.0 t -73.75 -26.38 60.64 Favored 'General case' 0 C--N 1.299 -1.619 0 C-N-CA 120.425 -0.51 . . . . 0.0 111.022 179.912 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 21' ' ' ASP . . . . . . . . . . . . . 33.8 t70 -100.32 -3.33 31.49 Favored 'General case' 0 C--N 1.327 -0.39 0 CA-C-O 122.488 1.137 . . . . 0.0 109.101 -179.814 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 22' ' ' ASN . . . . . . . . . . . . . 19.0 t30 -78.26 130.52 36.34 Favored 'General case' 0 C--N 1.309 -1.18 0 CA-C-N 114.139 -1.391 . . . . 0.0 109.35 178.619 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 23' ' ' ASP . . . . . 0.478 ' HA ' ' HG ' ' A' ' 26' ' ' LEU . 3.1 m-20 -52.9 -34.38 54.64 Favored 'General case' 0 CA--C 1.498 -1.021 0 C-N-CA 124.388 1.075 . . . . 0.0 112.043 -177.118 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 34.2 t70 -59.85 -31.81 70.1 Favored 'General case' 0 C--N 1.307 -1.245 0 CA-C-N 114.974 -1.012 . . . . 0.0 112.133 -179.501 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 25' ' ' LYS . . . . . 0.523 ' O ' ' HG2' ' A' ' 29' ' ' MET . 13.1 mptt -110.81 1.78 17.93 Favored 'General case' 0 C--O 1.204 -1.322 0 N-CA-C 113.624 0.972 . . . . 0.0 113.624 179.794 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 26' ' ' LEU . . . . . 0.478 ' HG ' ' HA ' ' A' ' 23' ' ' ASP . 70.1 mt -50.2 -52.78 32.89 Favored 'General case' 0 N--CA 1.49 1.53 0 N-CA-C 114.655 1.354 . . . . 0.0 114.655 -174.947 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 27' ' ' LEU . . . . . . . . . . . . . 20.0 tp -60.84 -44.62 96.72 Favored 'General case' 0 N--CA 1.44 -0.929 0 CA-C-O 121.17 0.51 . . . . 0.0 109.724 -179.645 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 28' ' ' GLU . . . . . . . . . . . . . 7.5 mm-40 -60.57 -37.12 80.27 Favored 'General case' 0 C--N 1.325 -0.5 0 CA-C-N 114.581 -1.19 . . . . 0.0 108.963 -178.295 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 29' ' ' MET . . . . . 0.621 ' HG3' ' HA ' ' A' ' 20' ' ' CYS . 74.8 mmm -81.14 -20.26 41.71 Favored 'General case' 0 CA--C 1.482 -1.656 0 CA-C-N 115.094 -0.957 . . . . 0.0 111.794 -174.041 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 30' ' ' GLY . . . . . . . . . . . . . . . -64.56 -27.04 71.3 Favored Glycine 0 N--CA 1.436 -1.341 0 O-C-N 124.194 0.934 . . . . 0.0 110.823 177.216 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 31' ' ' TYR . . . . . . . . . . . . . 38.7 p90 -106.16 -31.97 8.44 Favored 'General case' 0 N--CA 1.43 -1.443 0 N-CA-C 112.923 0.712 . . . . 0.0 112.923 176.166 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 32' ' ' TYR . . . . . . . . . . . . . 16.2 m-85 -68.15 -61.59 1.79 Allowed 'General case' 0 C--O 1.21 -1.0 0 N-CA-C 113.232 0.827 . . . . 0.0 113.232 177.482 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 33' ' ' CYS . . . . . . . . . . . . . 61.7 m -136.43 68.55 61.03 Favored Pre-proline 0 C--O 1.265 1.871 0 CA-C-O 121.749 0.785 . . . . 0.0 111.413 -176.846 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 34' ' ' PRO . . . . . 0.66 ' HA ' ' CD2' ' A' ' 39' ' ' PHE . 74.0 Cg_endo -73.09 -23.75 17.89 Favored 'Trans proline' 0 N--CA 1.444 -1.386 0 C-N-CA 122.964 2.443 . . . . 0.0 112.569 -174.955 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 35' ' ' VAL . . . . . 0.715 ' HB ' ' OD1' ' A' ' 5' ' ' ASP . 43.5 t -86.57 -44.48 16.48 Favored 'Isoleucine or valine' 0 C--N 1.289 -2.028 0 C-N-CA 119.51 -0.876 . . . . 0.0 109.506 -179.066 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 36' ' ' THR . . . . . . . . . . . . . 38.3 m -54.61 -51.88 63.94 Favored 'General case' 0 C--N 1.325 -0.472 0 CA-C-N 115.653 -0.703 . . . . 0.0 112.69 -178.49 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 37' ' ' CYS . . . . . . . . . . . . . 85.1 m -91.99 10.88 27.12 Favored 'General case' 0 C--N 1.315 -0.932 0 C-N-CA 118.964 -1.094 . . . . 0.0 113.288 -176.517 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 38' ' ' GLY . . . . . . . . . . . . . . . 78.19 44.14 12.1 Favored Glycine 0 N--CA 1.443 -0.834 0 N-CA-C 115.432 0.933 . . . . 0.0 115.432 171.881 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 39' ' ' PHE . . . . . 0.66 ' CD2' ' HA ' ' A' ' 34' ' ' PRO . 62.2 m-85 -86.19 -50.39 7.02 Favored 'General case' 0 C--N 1.302 -1.496 0 N-CA-C 106.782 -1.562 . . . . 0.0 106.782 174.113 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 40' ' ' CYS . . . . . 0.509 ' SG ' ' HB2' ' A' ' 34' ' ' PRO . 4.0 p -153.82 87.29 1.21 Allowed 'General case' 0 C--N 1.31 -1.125 0 CA-C-N 114.453 -1.249 . . . . 0.0 109.87 -179.71 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 41' ' ' NH2 . . . . . . . . . . . . . . . . . . . . 0 C--N 1.309 -1.158 0 O-C-N 122.049 -0.407 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 017 nuclear build full ' A' A ' 1' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER . . . . . 0 N--CA 1.452 -0.373 0 N-CA-C 108.424 -0.954 . . . . 0.0 108.424 . . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 2' ' ' HIS . . . . . . . . . . . . . 34.4 m80 -91.23 111.96 23.66 Favored 'General case' 0 C--N 1.294 -1.843 0 N-CA-C 106.82 -1.548 . . . . 0.0 106.82 174.656 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 3' ' ' CYS . . . . . . . . . . . . . 30.3 p -82.1 103.92 12.07 Favored 'General case' 0 C--N 1.303 -1.427 0 C-N-CA 118.84 -1.144 . . . . 0.0 108.987 176.617 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 4' ' ' ALA . . . . . . . . . . . . . . . -145.98 142.08 28.32 Favored 'General case' 0 N--CA 1.426 -1.626 0 CA-C-N 115.438 -0.801 . . . . 0.0 108.883 -177.499 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 5' ' ' ASP . . . . . 0.667 ' OD1' ' HB ' ' A' ' 35' ' ' VAL . 5.1 m-20 -58.29 132.5 53.82 Favored 'General case' 0 C--O 1.256 1.406 0 O-C-N 124.395 1.06 . . . . 0.0 109.517 -179.877 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 6' ' ' GLU . . . . . 0.439 ' HG3' ' H ' ' A' ' 8' ' ' ASN . 9.5 tp10 -64.1 131.7 48.31 Favored 'General case' 0 N--CA 1.436 -1.149 0 CA-C-N 115.589 -0.732 . . . . 0.0 110.761 -176.712 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 7' ' ' LYS . . . . . . . . . . . . . 21.1 ptmt -80.22 -13.01 59.56 Favored 'General case' 0 N--CA 1.437 -1.122 0 CA-C-N 115.883 -0.599 . . . . 0.0 112.045 -176.24 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 8' ' ' ASN . . . . . 0.439 ' H ' ' HG3' ' A' ' 6' ' ' GLU . 55.7 m-20 -93.81 4.1 54.43 Favored 'General case' 0 C--N 1.313 -1.018 0 CA-C-O 121.657 0.741 . . . . 0.0 109.367 178.814 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 9' ' ' PHE . . . . . . . . . . . . . 26.8 t80 -128.49 149.52 50.55 Favored 'General case' 0 C--N 1.298 -1.665 0 N-CA-C 106.384 -1.71 . . . . 0.0 106.384 -175.53 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 10' ' ' ASP . . . . . . . . . . . . . 10.0 t70 -105.14 98.73 8.39 Favored 'General case' 0 C--N 1.302 -1.466 0 C-N-CA 119.378 -0.929 . . . . 0.0 108.899 177.172 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 11' ' ' CYS . . . . . 0.417 ' SG ' ' HB3' ' A' ' 5' ' ' ASP . 96.9 m -73.37 -25.08 60.43 Favored 'General case' 0 C--N 1.287 -2.137 0 N-CA-C 113.194 0.813 . . . . 0.0 113.194 -177.19 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 12' ' ' ARG . . . . . 0.457 ' O ' ' HG2' ' A' ' 16' ' ' ARG . 43.8 mmt-85 -69.83 -48.0 60.64 Favored 'General case' 0 C--N 1.32 -0.678 0 N-CA-C 109.502 -0.555 . . . . 0.0 109.502 179.108 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 58.3 ttp180 -64.17 -44.36 92.3 Favored 'General case' 0 C--N 1.311 -1.073 0 CA-C-N 115.54 -0.754 . . . . 0.0 110.355 178.474 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 14' ' ' SER . . . . . . . . . . . . . 25.3 m -60.53 -34.06 73.57 Favored 'General case' 0 C--O 1.25 1.129 0 CA-C-O 121.393 0.616 . . . . 0.0 110.949 179.432 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 65.3 tp -63.35 -46.57 85.94 Favored 'General case' 0 N--CA 1.439 -0.986 0 CA-C-N 115.611 -0.722 . . . . 0.0 109.306 174.956 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 16' ' ' ARG . . . . . 0.457 ' HG2' ' O ' ' A' ' 12' ' ' ARG . 31.0 mmt180 -71.75 -32.74 68.04 Favored 'General case' 0 C--N 1.315 -0.892 0 CA-C-N 115.957 -0.565 . . . . 0.0 112.236 -177.441 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 17' ' ' ASN . . . . . . . . . . . . . 77.0 m-20 -65.57 -35.53 81.12 Favored 'General case' 0 CA--C 1.494 -1.207 0 CA-C-O 121.301 0.572 . . . . 0.0 109.533 179.412 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . 110.77 11.81 18.09 Favored Glycine 0 N--CA 1.426 -1.999 0 CA-C-N 115.11 -0.95 . . . . 0.0 111.483 -178.805 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 19' ' ' ASP . . . . . . . . . . . . . 9.0 m-20 -67.49 -35.05 78.39 Favored 'General case' 0 CA--C 1.501 -0.934 0 N-CA-C 108.782 -0.821 . . . . 0.0 108.782 178.126 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 20' ' ' CYS . . . . . 0.456 ' HA ' ' HG3' ' A' ' 29' ' ' MET . 52.5 t -83.26 -4.48 58.47 Favored 'General case' 0 C--N 1.306 -1.306 0 CA-C-N 114.41 -1.268 . . . . 0.0 110.533 -179.934 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 21' ' ' ASP . . . . . . . . . . . . . 17.2 t70 -104.54 -11.85 16.78 Favored 'General case' 0 C--N 1.318 -0.77 0 CA-C-O 121.77 0.795 . . . . 0.0 109.887 -178.547 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 22' ' ' ASN . . . . . . . . . . . . . 54.1 t-20 -89.3 125.03 34.94 Favored 'General case' 0 C--N 1.311 -1.087 0 CA-C-N 115.127 -0.942 . . . . 0.0 109.243 -179.934 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 23' ' ' ASP . . . . . . . . . . . . . 5.3 p-10 -61.23 -34.34 74.96 Favored 'General case' 0 C--N 1.32 -0.708 0 O-C-N 123.434 0.459 . . . . 0.0 111.673 179.976 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 34.8 t70 -68.46 -28.76 67.33 Favored 'General case' 0 C--N 1.308 -1.209 0 CA-C-O 121.318 0.58 . . . . 0.0 111.67 -177.658 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 25' ' ' LYS . . . . . 0.418 ' O ' ' HG2' ' A' ' 29' ' ' MET . 92.3 mttt -97.18 -2.28 43.25 Favored 'General case' 0 C--N 1.309 -1.181 0 N-CA-C 112.532 0.568 . . . . 0.0 112.532 -177.462 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 26' ' ' LEU . . . . . . . . . . . . . 87.4 mt -55.84 -36.83 67.94 Favored 'General case' 0 C--N 1.312 -1.038 0 N-CA-C 113.269 0.841 . . . . 0.0 113.269 179.806 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 27' ' ' LEU . . . . . . . . . . . . . 1.3 tm? -62.71 -42.22 99.54 Favored 'General case' 0 N--CA 1.44 -0.957 0 N-CA-C 109.02 -0.734 . . . . 0.0 109.02 178.508 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 28' ' ' GLU . . . . . . . . . . . . . 8.3 mm-40 -60.74 -37.24 81.1 Favored 'General case' 0 CA--C 1.514 -0.407 0 N-CA-C 109.062 -0.718 . . . . 0.0 109.062 177.572 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 29' ' ' MET . . . . . 0.456 ' HG3' ' HA ' ' A' ' 20' ' ' CYS . 22.1 mmt -75.68 -22.29 56.82 Favored 'General case' 0 C--O 1.204 -1.29 0 CA-C-N 114.95 -1.023 . . . . 0.0 109.827 -176.744 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 30' ' ' GLY . . . . . . . . . . . . . . . -64.31 -28.03 72.45 Favored Glycine 0 C--O 1.24 0.518 0 CA-C-N 116.227 -0.442 . . . . 0.0 112.338 179.931 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 31' ' ' TYR . . . . . . . . . . . . . 20.6 p90 -113.67 -36.24 4.94 Favored 'General case' 0 N--CA 1.433 -1.318 0 N-CA-C 113.033 0.753 . . . . 0.0 113.033 177.543 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 32' ' ' TYR . . . . . . . . . . . . . 33.4 m-85 -70.0 -47.38 62.41 Favored 'General case' 0 C--N 1.306 -1.307 0 N-CA-C 113.234 0.828 . . . . 0.0 113.234 176.808 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 33' ' ' CYS . . . . . . . . . . . . . 60.4 m -136.4 58.49 21.29 Favored Pre-proline 0 C--O 1.251 1.151 0 C-N-CA 121.053 -0.259 . . . . 0.0 111.678 -173.838 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 34' ' ' PRO . . . . . 0.426 ' HA ' ' CD2' ' A' ' 39' ' ' PHE . 57.3 Cg_endo -67.35 -27.95 39.94 Favored 'Trans proline' 0 C--N 1.359 1.105 0 C-N-CA 122.012 1.808 . . . . 0.0 112.523 -174.66 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 35' ' ' VAL . . . . . 0.667 ' HB ' ' OD1' ' A' ' 5' ' ' ASP . 43.8 t -87.27 -42.9 15.58 Favored 'Isoleucine or valine' 0 C--N 1.301 -1.536 0 C-N-CA 119.971 -0.692 . . . . 0.0 110.433 -177.224 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 36' ' ' THR . . . . . . . . . . . . . 28.0 m -61.24 -40.06 92.64 Favored 'General case' 0 C--N 1.316 -0.88 0 CA-C-N 115.999 -0.546 . . . . 0.0 111.211 179.066 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 37' ' ' CYS . . . . . . . . . . . . . 74.8 m -88.18 -1.45 58.02 Favored 'General case' 0 C--N 1.311 -1.082 0 N-CA-C 113.727 1.01 . . . . 0.0 113.727 -178.954 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 38' ' ' GLY . . . . . . . . . . . . . . . 78.13 43.72 13.05 Favored Glycine 0 CA--C 1.524 0.656 0 N-CA-C 115.325 0.89 . . . . 0.0 115.325 174.908 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 39' ' ' PHE . . . . . 0.426 ' CD2' ' HA ' ' A' ' 34' ' ' PRO . 74.6 m-85 -91.32 -31.4 16.1 Favored 'General case' 0 C--N 1.315 -0.92 0 N-CA-C 108.475 -0.935 . . . . 0.0 108.475 173.886 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 40' ' ' CYS . . . . . . . . . . . . . 58.3 m -117.27 102.62 9.42 Favored 'General case' 0 C--N 1.306 -1.299 0 CA-C-N 114.956 -1.02 . . . . 0.0 109.45 -178.42 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 41' ' ' NH2 . . . . . . . . . . . . . . . . . . . . 0 C--N 1.31 -1.127 0 CA-C-N 116.402 -0.363 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 018 nuclear build full ' A' A ' 1' ' ' GLU . . . . . . . . . . . . . 35.7 tt0 . . . . . 0 CA--C 1.506 -0.733 0 N-CA-C 110.046 -0.353 . . . . 0.0 110.046 . . . . . . . . . 0 0 . 1 . 018 nuclear build full ' A' A ' 2' ' ' HIS . . . . . . . . . . . . . 16.7 t60 -101.47 111.56 23.84 Favored 'General case' 0 N--CA 1.429 -1.512 0 N-CA-C 106.319 -1.734 . . . . 0.0 106.319 172.652 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 3' ' ' CYS . . . . . . . . . . . . . 16.0 p -87.1 125.35 34.08 Favored 'General case' 0 C--N 1.285 -2.21 0 N-CA-C 109.962 -0.385 . . . . 0.0 109.962 179.26 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 4' ' ' ALA . . . . . . . . . . . . . . . -144.05 158.09 43.93 Favored 'General case' 0 C--N 1.304 -1.371 0 N-CA-C 107.835 -1.172 . . . . 0.0 107.835 178.832 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 5' ' ' ASP . . . . . 0.432 ' HA ' ' HD2' ' A' ' 34' ' ' PRO . 56.2 m-20 -69.51 147.54 50.7 Favored 'General case' 0 C--N 1.31 -1.121 0 N-CA-C 109.311 -0.626 . . . . 0.0 109.311 178.705 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 9.3 tp10 -67.35 128.55 36.84 Favored 'General case' 0 C--N 1.311 -1.087 0 N-CA-C 109.069 -0.715 . . . . 0.0 109.069 177.744 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 7' ' ' LYS . . . . . . . . . . . . . 19.4 ptpt -77.24 -16.93 58.82 Favored 'General case' 0 C--N 1.307 -1.257 0 CA-C-N 116.348 -0.387 . . . . 0.0 112.008 -177.527 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 8' ' ' ASN . . . . . . . . . . . . . 38.7 m-80 -94.5 4.36 53.95 Favored 'General case' 0 C--N 1.302 -1.488 0 CA-C-O 121.352 0.596 . . . . 0.0 110.321 179.353 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 9' ' ' PHE . . . . . . . . . . . . . 41.5 t80 -123.45 144.32 49.59 Favored 'General case' 0 C--N 1.299 -1.623 0 N-CA-C 106.341 -1.726 . . . . 0.0 106.341 -178.53 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 10' ' ' ASP . . . . . . . . . . . . . 8.3 t70 -102.18 91.76 4.44 Favored 'General case' 0 C--N 1.304 -1.411 0 C-N-CA 118.705 -1.198 . . . . 0.0 109.544 179.859 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 11' ' ' CYS . . . . . 0.421 ' SG ' ' HB3' ' A' ' 5' ' ' ASP . 98.3 m -69.55 -19.93 63.68 Favored 'General case' 0 C--N 1.297 -1.701 0 CA-C-N 114.799 -1.091 . . . . 0.0 112.251 -177.095 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 12' ' ' ARG . . . . . . . . . . . . . 13.8 mmt180 -74.04 -43.5 57.63 Favored 'General case' 0 C--N 1.313 -1.0 0 N-CA-C 107.653 -1.24 . . . . 0.0 107.653 -177.734 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 39.4 ttm180 -59.48 -50.3 74.47 Favored 'General case' 0 C--O 1.238 0.462 0 CA-C-N 114.905 -1.043 . . . . 0.0 110.092 175.472 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 14' ' ' SER . . . . . . . . . . . . . 50.6 m -62.14 -30.82 71.3 Favored 'General case' 0 CA--C 1.546 0.822 0 CA-C-N 116.178 -0.464 . . . . 0.0 111.591 179.633 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 15' ' ' LEU . . . . . 0.432 ' HA ' ' HB3' ' A' ' 20' ' ' CYS . 58.1 tp -67.29 -49.51 63.97 Favored 'General case' 0 N--CA 1.449 -0.522 0 N-CA-C 110.097 -0.334 . . . . 0.0 110.097 176.726 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 16' ' ' ARG . . . . . . . . . . . . . 65.7 mtp180 -62.67 -38.1 89.02 Favored 'General case' 0 C--N 1.321 -0.633 0 CA-C-N 115.434 -0.803 . . . . 0.0 112.228 -179.06 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 17' ' ' ASN . . . . . . . . . . . . . 42.0 m-80 -81.77 -14.56 56.26 Favored 'General case' 0 CA--C 1.506 -0.749 0 CA-C-O 121.017 0.437 . . . . 0.0 111.975 -178.502 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . 95.94 9.93 56.8 Favored Glycine 0 C--O 1.213 -1.201 0 C-N-CA 119.938 -1.125 . . . . 0.0 113.743 173.566 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 19' ' ' ASP . . . . . . . . . . . . . 2.6 m-20 -67.73 -34.65 77.27 Favored 'General case' 0 CA--C 1.498 -1.046 0 N-CA-C 108.072 -1.085 . . . . 0.0 108.072 178.225 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 20' ' ' CYS . . . . . 0.432 ' HB3' ' HA ' ' A' ' 15' ' ' LEU . 42.8 t -72.66 -9.46 58.63 Favored 'General case' 0 C--N 1.309 -1.193 0 CA-C-N 113.711 -1.586 . . . . 0.0 110.787 -179.046 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 21' ' ' ASP . . . . . . . . . . . . . 26.2 t70 -113.64 -10.02 13.15 Favored 'General case' 0 C--N 1.319 -0.742 0 CA-C-O 121.656 0.741 . . . . 0.0 109.672 -179.874 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 22' ' ' ASN . . . . . 0.502 ' OD1' ' HG2' ' A' ' 25' ' ' LYS . 23.5 t-20 -83.4 114.62 21.57 Favored 'General case' 0 C--N 1.298 -1.631 0 CA-C-N 115.713 -0.676 . . . . 0.0 109.958 -174.217 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 23' ' ' ASP . . . . . . . . . . . . . 18.1 t70 -49.66 -45.21 48.31 Favored 'General case' 0 N--CA 1.477 0.904 0 C-N-CA 124.231 1.012 . . . . 0.0 111.708 -176.065 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 24' ' ' ASP . . . . . 0.438 ' HB3' ' OD1' ' A' ' 22' ' ' ASN . 27.4 t70 -60.28 -32.91 71.64 Favored 'General case' 0 C--N 1.31 -1.143 0 CA-C-N 115.278 -0.874 . . . . 0.0 112.441 -178.897 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 25' ' ' LYS . . . . . 0.502 ' HG2' ' OD1' ' A' ' 22' ' ' ASN . 44.3 mmtm -94.63 -7.01 42.13 Favored 'General case' 0 C--N 1.312 -1.029 0 CA-C-N 116.301 -0.409 . . . . 0.0 111.063 -175.727 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 26' ' ' LEU . . . . . . . . . . . . . 64.8 mt -56.81 -34.79 68.04 Favored 'General case' 0 C--O 1.218 -0.553 0 N-CA-C 114.886 1.439 . . . . 0.0 114.886 -174.485 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 27' ' ' LEU . . . . . . . . . . . . . 1.3 tm? -57.52 -50.0 74.49 Favored 'General case' 0 N--CA 1.44 -0.945 0 N-CA-C 108.758 -0.83 . . . . 0.0 108.758 178.539 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 28' ' ' GLU . . . . . . . . . . . . . 1.5 mp0 -63.57 -33.81 76.42 Favored 'General case' 0 N--CA 1.449 -0.508 0 CA-C-N 115.175 -0.921 . . . . 0.0 110.424 178.583 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 29' ' ' MET . . . . . . . . . . . . . 21.7 mmt -74.15 -25.32 59.68 Favored 'General case' 0 C--O 1.2 -1.527 0 CA-C-N 116.154 -0.476 . . . . 0.0 109.856 -177.341 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 30' ' ' GLY . . . . . . . . . . . . . . . -64.44 -34.78 90.83 Favored Glycine 0 N--CA 1.446 -0.664 0 C-N-CA 121.4 -0.429 . . . . 0.0 112.375 179.64 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 31' ' ' TYR . . . . . . . . . . . . . 33.0 p90 -99.03 -36.53 9.69 Favored 'General case' 0 N--CA 1.439 -1.003 0 N-CA-C 113.35 0.87 . . . . 0.0 113.35 178.042 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 32' ' ' TYR . . . . . . . . . . . . . 37.2 m-85 -70.86 -46.61 62.34 Favored 'General case' 0 C--N 1.309 -1.169 0 N-CA-C 112.859 0.689 . . . . 0.0 112.859 177.052 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 33' ' ' CYS . . . . . . . . . . . . . 47.7 m -136.45 61.03 35.72 Favored Pre-proline 0 C--O 1.254 1.335 0 N-CA-C 112.266 0.469 . . . . 0.0 112.266 -173.324 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 34' ' ' PRO . . . . . 0.499 ' HA ' ' CD1' ' A' ' 39' ' ' PHE . 46.0 Cg_endo -65.35 -25.67 56.43 Favored 'Trans proline' 0 C--N 1.359 1.126 0 C-N-CA 121.825 1.683 . . . . 0.0 111.948 -178.567 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 35' ' ' VAL . . . . . . . . . . . . . 61.7 t -86.41 -49.64 14.89 Favored 'Isoleucine or valine' 0 C--N 1.299 -1.607 0 C-N-CA 120.573 -0.451 . . . . 0.0 111.134 -177.725 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 36' ' ' THR . . . . . . . . . . . . . 56.5 m -59.78 -42.22 92.85 Favored 'General case' 0 C--N 1.316 -0.879 0 CA-C-O 121.049 0.452 . . . . 0.0 111.615 -178.945 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 37' ' ' CYS . . . . . 0.414 ' HB2' ' CE1' ' A' ' 39' ' ' PHE . 77.4 m -85.02 1.57 47.04 Favored 'General case' 0 C--N 1.309 -1.183 0 N-CA-C 113.12 0.785 . . . . 0.0 113.12 -178.072 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 38' ' ' GLY . . . . . . . . . . . . . . . 74.26 45.38 25.08 Favored Glycine 0 CA--C 1.521 0.419 0 C-N-CA 120.546 -0.835 . . . . 0.0 114.879 174.913 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 39' ' ' PHE . . . . . 0.499 ' CD1' ' HA ' ' A' ' 34' ' ' PRO . 95.4 m-85 -94.11 -16.87 23.37 Favored 'General case' 0 C--N 1.309 -1.155 0 N-CA-C 108.581 -0.896 . . . . 0.0 108.581 174.07 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 40' ' ' CYS . . . . . 0.475 ' SG ' ' HB2' ' A' ' 34' ' ' PRO . 40.0 m -124.21 89.41 3.07 Favored 'General case' 0 C--N 1.313 -1.001 0 CA-C-N 115.048 -0.978 . . . . 0.0 110.132 -176.803 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 41' ' ' NH2 . . . . . . . . . . . . . . . . . . . . 0 C--N 1.306 -1.31 0 CA-C-N 116.633 -0.258 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 019 nuclear build full ' A' A ' 1' ' ' GLU . . . . . . . . . . . . . 9.2 tp10 . . . . . 0 CA--C 1.505 -0.788 0 N-CA-C 109.008 -0.738 . . . . 0.0 109.008 . . . . . . . . . 0 0 . 1 . 019 nuclear build full ' A' A ' 2' ' ' HIS . . . . . . . . . . . . . 61.1 m-70 -94.24 111.92 23.69 Favored 'General case' 0 N--CA 1.432 -1.332 0 N-CA-C 107.312 -1.366 . . . . 0.0 107.312 177.248 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 3' ' ' CYS . . . . . . . . . . . . . 16.5 p -83.75 100.87 11.18 Favored 'General case' 0 C--N 1.295 -1.779 0 CA-C-O 121.627 0.727 . . . . 0.0 111.812 -174.631 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 4' ' ' ALA . . . . . . . . . . . . . . . -135.67 141.56 44.99 Favored 'General case' 0 N--CA 1.427 -1.617 0 N-CA-C 108.2 -1.037 . . . . 0.0 108.2 179.415 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 5' ' ' ASP . . . . . 0.639 ' HB3' ' SG ' ' A' ' 11' ' ' CYS . 18.5 m-20 -55.91 131.33 46.82 Favored 'General case' 0 C--N 1.309 -1.155 0 O-C-N 123.96 0.787 . . . . 0.0 109.764 178.633 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 9.6 tp10 -61.71 139.39 58.31 Favored 'General case' 0 C--N 1.312 -1.049 0 C-N-CA 123.654 0.782 . . . . 0.0 110.854 -177.545 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 7' ' ' LYS . . . . . . . . . . . . . 18.6 ptpt -85.18 -26.56 26.71 Favored 'General case' 0 C--N 1.309 -1.162 0 N-CA-C 112.932 0.715 . . . . 0.0 112.932 -174.215 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 8' ' ' ASN . . . . . . . . . . . . . 10.5 p30 -92.62 7.38 43.62 Favored 'General case' 0 C--N 1.306 -1.305 0 CA-C-O 121.745 0.783 . . . . 0.0 110.415 178.453 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 9' ' ' PHE . . . . . . . . . . . . . 47.6 t80 -118.57 139.45 51.45 Favored 'General case' 0 N--CA 1.43 -1.464 0 N-CA-C 106.594 -1.632 . . . . 0.0 106.594 178.168 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 10' ' ' ASP . . . . . . . . . . . . . 10.2 t70 -96.96 105.05 17.11 Favored 'General case' 0 C--N 1.301 -1.519 0 C-N-CA 119.369 -0.932 . . . . 0.0 109.534 178.945 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 11' ' ' CYS . . . . . 0.639 ' SG ' ' HB3' ' A' ' 5' ' ' ASP . 73.9 m -74.94 -29.22 60.89 Favored 'General case' 0 C--N 1.292 -1.926 0 CA-C-N 115.642 -0.708 . . . . 0.0 112.866 -177.502 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 12' ' ' ARG . . . . . . . . . . . . . 20.0 mmm180 -72.07 -46.19 57.8 Favored 'General case' 0 CA--C 1.511 -0.536 0 C-N-CA 120.305 -0.558 . . . . 0.0 109.519 -176.09 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 41.0 ttp180 -59.08 -52.15 66.96 Favored 'General case' 0 C--O 1.205 -1.281 0 CA-C-N 114.851 -1.068 . . . . 0.0 109.421 177.996 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 14' ' ' SER . . . . . . . . . . . . . 40.6 m -58.33 -36.27 73.16 Favored 'General case' 0 C--N 1.32 -0.715 0 CA-C-N 116.066 -0.516 . . . . 0.0 111.742 -177.839 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 41.9 tp -69.73 -45.98 66.96 Favored 'General case' 0 N--CA 1.442 -0.846 0 CA-C-O 121.059 0.457 . . . . 0.0 110.065 178.987 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 16' ' ' ARG . . . . . 0.402 ' O ' ' HD2' ' A' ' 16' ' ' ARG . 2.4 tmm_? -68.54 -37.3 79.85 Favored 'General case' 0 N--CA 1.437 -1.095 0 CA-C-N 115.815 -0.63 . . . . 0.0 110.275 -179.349 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 17' ' ' ASN . . . . . . . . . . . . . 6.6 m-20 -68.37 -40.55 81.39 Favored 'General case' 0 CA--C 1.501 -0.92 0 CA-C-N 116.125 -0.488 . . . . 0.0 111.405 -178.535 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . 120.78 8.99 7.84 Favored Glycine 0 N--CA 1.435 -1.414 0 C-N-CA 119.869 -1.158 . . . . 0.0 112.252 -179.874 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 19' ' ' ASP . . . . . . . . . . . . . 3.5 m-20 -65.97 -29.1 69.44 Favored 'General case' 0 C--N 1.32 -0.715 0 CA-C-O 121.064 0.459 . . . . 0.0 110.811 -179.808 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 20' ' ' CYS . . . . . 0.416 ' HA ' ' HG3' ' A' ' 29' ' ' MET . 45.6 t -92.69 0.28 57.4 Favored 'General case' 0 C--N 1.31 -1.121 0 CA-C-O 121.447 0.641 . . . . 0.0 110.331 -178.535 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 21' ' ' ASP . . . . . . . . . . . . . 31.8 t70 -113.09 -11.07 13.38 Favored 'General case' 0 C--N 1.317 -0.83 0 CA-C-O 122.036 0.922 . . . . 0.0 109.238 177.638 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 22' ' ' ASN . . . . . . . . . . . . . 28.6 t-20 -87.98 117.33 26.77 Favored 'General case' 0 C--N 1.301 -1.539 0 CA-C-N 114.919 -1.037 . . . . 0.0 109.784 -178.382 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 23' ' ' ASP . . . . . . . . . . . . . 18.1 t70 -50.98 -45.55 61.01 Favored 'General case' 0 N--CA 1.477 0.888 0 N-CA-C 114.073 1.138 . . . . 0.0 114.073 -172.105 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 3.8 p30 -72.22 -10.02 59.23 Favored 'General case' 0 C--N 1.315 -0.915 0 N-CA-C 113.371 0.878 . . . . 0.0 113.371 -176.468 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 25' ' ' LYS . . . . . . . . . . . . . 87.8 mttt -107.67 -7.04 16.55 Favored 'General case' 0 C--N 1.322 -0.602 0 O-C-N 122.039 -0.413 . . . . 0.0 111.683 178.954 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 26' ' ' LEU . . . . . . . . . . . . . 92.8 mt -52.85 -51.89 59.26 Favored 'General case' 0 N--CA 1.472 0.633 0 N-CA-C 113.858 1.059 . . . . 0.0 113.858 -175.271 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 27' ' ' LEU . . . . . . . . . . . . . 2.3 tm? -58.5 -41.78 86.14 Favored 'General case' 0 N--CA 1.436 -1.149 0 C-N-CA 122.688 0.395 . . . . 0.0 109.965 -179.306 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 28' ' ' GLU . . . . . 0.588 ' HA ' ' CZ ' ' A' ' 31' ' ' TYR . 80.8 mt-10 -62.96 -37.16 85.99 Favored 'General case' 0 CA--C 1.511 -0.526 0 CA-C-N 116.021 -0.536 . . . . 0.0 110.038 179.309 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 29' ' ' MET . . . . . 0.416 ' HG3' ' HA ' ' A' ' 20' ' ' CYS . 81.3 mmm -72.94 -24.84 60.86 Favored 'General case' 0 C--N 1.309 -1.186 0 CA-C-N 115.252 -0.885 . . . . 0.0 110.765 -178.22 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 30' ' ' GLY . . . . . 0.471 ' HA2' ' CE1' ' A' ' 39' ' ' PHE . . . -68.74 -24.84 75.42 Favored Glycine 0 C--N 1.312 -0.787 0 CA-C-N 115.365 -0.834 . . . . 0.0 112.55 178.182 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 31' ' ' TYR . . . . . 0.588 ' CZ ' ' HA ' ' A' ' 28' ' ' GLU 0.255 22.5 p90 -101.52 -37.67 8.3 Favored 'General case' 0 CA--C 1.5 -0.942 0 C-N-CA 119.628 -0.829 . . . . 0.0 112.787 174.883 . . . . . . . . 3 3 . 1 . 019 nuclear build full ' A' A ' 32' ' ' TYR . . . . . . . . . . . . . 28.2 m-85 -65.38 -49.28 69.91 Favored 'General case' 0 C--N 1.308 -1.226 0 N-CA-C 112.959 0.725 . . . . 0.0 112.959 176.61 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 33' ' ' CYS . . . . . . . . . . . . . 36.7 m -135.25 72.6 65.83 Favored Pre-proline 0 C--N 1.308 -1.222 0 C-N-CA 119.938 -0.705 . . . . 0.0 111.1 -177.074 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 34' ' ' PRO . . . . . 0.405 ' HD2' ' HA ' ' A' ' 5' ' ' ASP . 60.1 Cg_endo -69.26 -24.17 32.24 Favored 'Trans proline' 0 N--CA 1.45 -1.031 0 C-N-CA 122.261 1.974 . . . . 0.0 112.053 -177.436 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 35' ' ' VAL . . . . . 0.584 ' HB ' ' OD1' ' A' ' 5' ' ' ASP . 49.6 t -87.2 -46.13 16.21 Favored 'Isoleucine or valine' 0 C--N 1.301 -1.528 0 C-N-CA 119.907 -0.717 . . . . 0.0 110.571 -178.432 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 36' ' ' THR . . . . . . . . . . . . . 21.1 m -62.37 -37.18 84.73 Favored 'General case' 0 C--N 1.314 -0.955 0 CA-C-N 115.58 -0.737 . . . . 0.0 111.295 179.424 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 37' ' ' CYS . . . . . . . . . . . . . 84.4 m -92.37 11.18 26.89 Favored 'General case' 0 C--N 1.313 -0.98 0 N-CA-C 112.921 0.712 . . . . 0.0 112.921 -179.831 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 38' ' ' GLY . . . . . . . . . . . . . . . 68.85 45.5 64.02 Favored Glycine 0 CA--C 1.519 0.337 0 N-CA-C 116.002 1.161 . . . . 0.0 116.002 171.827 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 39' ' ' PHE . . . . . 0.471 ' CE1' ' HA2' ' A' ' 30' ' ' GLY . 96.8 m-85 -100.24 -30.98 11.6 Favored 'General case' 0 C--N 1.302 -1.488 0 N-CA-C 108.825 -0.805 . . . . 0.0 108.825 174.051 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 40' ' ' CYS . . . . . . . . . . . . . 75.6 m -127.83 88.29 2.75 Favored 'General case' 0 C--N 1.311 -1.095 0 CA-C-N 115.339 -0.846 . . . . 0.0 109.366 178.601 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 41' ' ' NH2 . . . . . . . . . . . . . . . . . . . . 0 C--N 1.306 -1.287 0 CA-C-N 116.373 -0.376 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 020 nuclear build full ' A' A ' 1' ' ' GLU . . . . . . . . . . . . . 9.8 tp10 . . . . . 0 CA--C 1.506 -0.747 0 N-CA-C 110.409 -0.219 . . . . 0.0 110.409 . . . . . . . . . 0 0 . 1 . 020 nuclear build full ' A' A ' 2' ' ' HIS . . . . . . . . . . . . . 20.7 t60 -51.46 111.43 0.58 Allowed 'General case' 0 C--O 1.242 0.668 0 O-C-N 124.525 1.141 . . . . 0.0 111.435 -173.368 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 3' ' ' CYS . . . . . . . . . . . . . 7.1 p -74.93 110.69 9.43 Favored 'General case' 0 C--N 1.288 -2.106 0 CA-C-N 114.173 -1.376 . . . . 0.0 111.75 179.649 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 4' ' ' ALA . . . . . . . . . . . . . . . -133.26 161.18 35.15 Favored 'General case' 0 N--CA 1.44 -0.934 0 N-CA-C 108.361 -0.977 . . . . 0.0 108.361 -179.907 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 5' ' ' ASP . . . . . 0.566 ' OD2' ' HB ' ' A' ' 35' ' ' VAL . 7.7 m-20 -70.11 148.68 48.45 Favored 'General case' 0 C--N 1.316 -0.859 0 N-CA-C 109.189 -0.671 . . . . 0.0 109.189 179.82 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 0.6 OUTLIER -72.52 152.08 42.09 Favored 'General case' 0 C--N 1.307 -1.259 0 N-CA-C 108.28 -1.007 . . . . 0.0 108.28 -179.095 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 7' ' ' LYS . . . . . . . . . . . . . 9.1 ptpp? -82.03 -35.32 28.94 Favored 'General case' 0 C--N 1.316 -0.879 0 N-CA-C 112.723 0.638 . . . . 0.0 112.723 -172.786 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 8' ' ' ASN . . . . . . . . . . . . . 30.7 m-80 -84.64 -31.21 24.32 Favored 'General case' 0 CA--C 1.486 -1.487 0 N-CA-C 109.29 -0.633 . . . . 0.0 109.29 -175.727 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 9' ' ' PHE . . . . . . . . . . . . . 26.6 t80 -75.12 129.05 36.9 Favored 'General case' 0 N--CA 1.424 -1.758 0 CA-C-N 114.901 -1.045 . . . . 0.0 108.744 -178.76 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 10' ' ' ASP . . . . . . . . . . . . . 9.1 t70 -89.43 102.65 15.32 Favored 'General case' 0 C--N 1.304 -1.385 0 N-CA-C 108.97 -0.752 . . . . 0.0 108.97 -179.461 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 11' ' ' CYS . . . . . 0.465 ' SG ' ' HB3' ' A' ' 5' ' ' ASP . 83.8 m -77.87 -28.55 50.04 Favored 'General case' 0 C--N 1.29 -2.018 0 CA-C-N 115.972 -0.558 . . . . 0.0 111.261 -177.299 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 12' ' ' ARG . . . . . . . . . . . . . 37.5 mmt180 -61.95 -50.27 72.82 Favored 'General case' 0 C--O 1.24 0.579 0 CA-C-O 120.998 0.428 . . . . 0.0 110.074 179.229 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 34.3 ttm180 -59.64 -55.11 38.55 Favored 'General case' 0 C--O 1.208 -1.107 0 CA-C-N 115.026 -0.988 . . . . 0.0 109.236 178.074 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 14' ' ' SER . . . . . . . . . . . . . 18.5 m -60.48 -36.61 78.71 Favored 'General case' 0 C--N 1.307 -1.26 0 CA-C-N 115.599 -0.728 . . . . 0.0 112.747 -174.094 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 45.8 tp -68.86 -47.77 65.1 Favored 'General case' 0 C--N 1.32 -0.68 0 C-N-CA 120.406 -0.517 . . . . 0.0 110.101 178.161 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 16' ' ' ARG . . . . . . . . . . . . . 60.7 mtp180 -71.78 -31.16 66.32 Favored 'General case' 0 C--N 1.324 -0.511 0 CA-C-N 115.923 -0.581 . . . . 0.0 112.008 -177.395 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 17' ' ' ASN . . . . . . . . . . . . . 5.6 m-20 -71.73 -33.2 68.51 Favored 'General case' 0 CA--C 1.494 -1.173 0 CA-C-N 116.424 -0.353 . . . . 0.0 111.467 -179.72 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . 116.81 10.2 10.31 Favored Glycine 0 N--CA 1.431 -1.671 0 C-N-CA 119.587 -1.292 . . . . 0.0 112.393 178.75 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 19' ' ' ASP . . . . . . . . . . . . . 4.1 m-20 -65.83 -35.5 80.84 Favored 'General case' 0 CA--C 1.494 -1.183 0 CA-C-O 121.156 0.503 . . . . 0.0 110.769 -179.018 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 20' ' ' CYS . . . . . . . . . . . . . 39.1 t -79.93 -12.45 59.73 Favored 'General case' 0 C--N 1.301 -1.513 0 CA-C-N 115.729 -0.668 . . . . 0.0 110.253 -176.758 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 21' ' ' ASP . . . . . . . . . . . . . 38.3 t70 -107.58 -0.36 22.08 Favored 'General case' 0 C--N 1.318 -0.797 0 CA-C-O 122.249 1.023 . . . . 0.0 109.146 177.108 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 22' ' ' ASN . . . . . . . . . . . . . 47.8 t-20 -87.83 118.77 27.58 Favored 'General case' 0 C--N 1.304 -1.379 0 CA-C-N 115.286 -0.87 . . . . 0.0 108.657 -179.509 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 23' ' ' ASP . . . . . 0.471 ' HA ' ' HG ' ' A' ' 26' ' ' LEU . 2.7 m-20 -53.08 -44.09 67.25 Favored 'General case' 0 C--N 1.32 -0.702 0 C-N-CA 123.694 0.798 . . . . 0.0 112.499 -177.566 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 23.0 t70 -64.69 -31.48 72.73 Favored 'General case' 0 C--N 1.318 -0.779 0 N-CA-C 112.122 0.416 . . . . 0.0 112.122 -178.737 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 25' ' ' LYS . . . . . . . . . . . . . 88.8 mttt -98.31 -5.29 33.25 Favored 'General case' 0 C--N 1.305 -1.326 0 N-CA-C 112.917 0.71 . . . . 0.0 112.917 -176.024 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 26' ' ' LEU . . . . . 0.471 ' HG ' ' HA ' ' A' ' 23' ' ' ASP . 83.9 mt -49.2 -54.36 16.92 Favored 'General case' 0 N--CA 1.482 1.172 0 N-CA-C 113.651 0.982 . . . . 0.0 113.651 -176.941 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 27' ' ' LEU . . . . . . . . . . . . . 2.2 tm? -57.71 -45.46 85.7 Favored 'General case' 0 N--CA 1.434 -1.251 0 N-CA-C 109.736 -0.468 . . . . 0.0 109.736 -177.503 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 28' ' ' GLU . . . . . . . . . . . . . 13.2 mm-40 -61.76 -37.66 85.14 Favored 'General case' 0 C--N 1.327 -0.402 0 CA-C-N 115.4 -0.818 . . . . 0.0 110.277 -178.047 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 29' ' ' MET . . . . . . . . . . . . . 80.2 mmm -73.76 -26.18 60.53 Favored 'General case' 0 C--N 1.307 -1.252 0 CA-C-N 114.907 -1.042 . . . . 0.0 111.609 -174.342 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 30' ' ' GLY . . . . . 0.471 ' HA2' ' CE2' ' A' ' 39' ' ' PHE . . . -68.07 -33.21 78.28 Favored Glycine 0 N--CA 1.439 -1.138 0 CA-C-N 115.46 -0.791 . . . . 0.0 112.758 -179.678 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 31' ' ' TYR . . . . . . . . . . . . . 44.8 p90 -96.98 -33.32 11.61 Favored 'General case' 0 CA--C 1.498 -1.028 0 C-N-CA 118.86 -1.136 . . . . 0.0 113.207 178.46 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 32' ' ' TYR . . . . . . . . . . . . . 36.5 m-85 -69.13 -42.99 75.27 Favored 'General case' 0 C--N 1.304 -1.413 0 N-CA-C 112.717 0.636 . . . . 0.0 112.717 175.96 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 33' ' ' CYS . . . . . . . . . . . . . 44.8 m -135.45 68.35 67.5 Favored Pre-proline 0 C--O 1.246 0.917 0 C-N-CA 120.194 -0.602 . . . . 0.0 112.007 -179.165 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 34' ' ' PRO . . . . . 0.532 ' HD2' ' HA ' ' A' ' 5' ' ' ASP . 58.4 Cg_endo -69.72 -23.65 30.73 Favored 'Trans proline' 0 C--N 1.355 0.889 0 C-N-CA 122.026 1.818 . . . . 0.0 111.931 -178.777 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 35' ' ' VAL . . . . . 0.566 ' HB ' ' OD2' ' A' ' 5' ' ' ASP . 66.1 t -86.54 -52.36 11.95 Favored 'Isoleucine or valine' 0 C--N 1.295 -1.797 0 C-N-CA 120.144 -0.622 . . . . 0.0 110.544 -178.086 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 36' ' ' THR . . . . . . . . . . . . . 23.3 m -60.41 -27.11 67.2 Favored 'General case' 0 CA--C 1.556 1.176 0 C-N-CA 123.188 0.595 . . . . 0.0 111.887 -178.195 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 37' ' ' CYS . . . . . . . . . . . . . 67.4 m -99.73 5.39 45.69 Favored 'General case' 0 C--N 1.319 -0.719 0 N-CA-C 113.792 1.034 . . . . 0.0 113.792 179.736 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 38' ' ' GLY . . . . . . . . . . . . . . . 76.93 34.72 41.57 Favored Glycine 0 CA--C 1.525 0.683 0 N-CA-C 115.426 0.931 . . . . 0.0 115.426 174.624 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 39' ' ' PHE . . . . . 0.488 ' CD2' ' HA ' ' A' ' 34' ' ' PRO . 90.2 m-85 -88.89 -44.37 10.51 Favored 'General case' 0 C--N 1.311 -1.079 0 N-CA-C 108.252 -1.018 . . . . 0.0 108.252 175.102 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 40' ' ' CYS . . . . . . . . . . . . . 57.9 m -117.99 95.63 5.0 Favored 'General case' 0 C--N 1.305 -1.359 0 CA-C-N 114.737 -1.119 . . . . 0.0 109.024 -179.266 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 41' ' ' NH2 . . . . . . . . . . . . . . . . . . . . 0 C--N 1.307 -1.266 0 CA-C-N 116.412 -0.358 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 001 nuclear nobuild core ' A' A ' 4' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.436 -1.142 0 N-CA-C 108.353 -0.98 . . . . 0.0 108.353 . . . . . . . . . 0 0 . 1 . 001 nuclear nobuild core ' A' A ' 5' ' ' ASP . . . . . 0.693 ' OD2' ' HB ' ' A' ' 35' ' ' VAL . 16.6 m-20 -59.85 141.56 55.16 Favored 'General case' 0 C--O 1.253 1.265 0 O-C-N 123.728 0.643 . . . . 0.0 110.068 177.001 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 0.2 OUTLIER -69.22 152.02 45.59 Favored 'General case' 0 C--N 1.307 -1.277 0 CA-C-N 115.678 -0.692 . . . . 0.0 109.63 -178.394 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 7' ' ' LYS . . . . . . . . . . . . . 8.6 ptpp? -85.61 -34.49 21.39 Favored 'General case' 0 C--N 1.31 -1.132 0 C-N-CA 123.659 0.784 . . . . 0.0 112.845 -175.875 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 8' ' ' ASN . . . . . . . . . . . . . 90.2 m-20 -94.33 -21.05 19.23 Favored 'General case' 0 C--N 1.299 -1.587 0 CA-C-N 115.978 -0.555 . . . . 0.0 111.108 -175.803 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 9' ' ' PHE . . . . . 0.583 ' HD2' ' SG ' ' A' ' 33' ' ' CYS . 37.3 t80 -83.55 129.42 34.97 Favored 'General case' 0 C--N 1.301 -1.507 0 N-CA-C 107.013 -1.477 . . . . 0.0 107.013 175.953 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 10' ' ' ASP . . . . . . . . . . . . . 12.5 t70 -86.76 107.05 18.09 Favored 'General case' 0 C--N 1.307 -1.28 0 C-N-CA 118.762 -1.175 . . . . 0.0 110.111 -179.831 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 11' ' ' CYS . . . . . 0.527 ' SG ' ' HB3' ' A' ' 5' ' ' ASP . 50.9 m -73.58 -27.34 61.26 Favored 'General case' 0 C--N 1.297 -1.706 0 CA-C-N 114.901 -1.045 . . . . 0.0 111.822 -176.406 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 12' ' ' ARG . . . . . . . . . . . . . 34.4 mmt180 -76.66 -45.88 28.01 Favored 'General case' 0 CA--C 1.506 -0.735 0 CA-C-O 120.859 0.362 . . . . 0.0 110.304 -175.217 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 37.2 ttm180 -61.26 -49.66 76.17 Favored 'General case' 0 C--N 1.31 -1.152 0 CA-C-N 115.384 -0.825 . . . . 0.0 109.239 178.616 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 14' ' ' SER . . . . . . . . . . . . . 23.7 m -59.86 -35.19 74.28 Favored 'General case' 0 CA--C 1.547 0.837 0 O-C-N 123.678 0.611 . . . . 0.0 111.629 -178.752 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 47.6 tp -71.69 -41.48 68.59 Favored 'General case' 0 C--N 1.322 -0.616 0 N-CA-C 109.643 -0.502 . . . . 0.0 109.643 178.316 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 16' ' ' ARG . . . . . . . . . . . . . 21.0 tpp180 -67.46 -35.06 78.46 Favored 'General case' 0 N--CA 1.427 -1.604 0 C-N-CA 123.9 0.88 . . . . 0.0 111.47 179.908 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 17' ' ' ASN . . . . . . . . . . . . . 86.0 m-20 -67.96 -47.4 68.75 Favored 'General case' 0 CA--C 1.5 -0.95 0 N-CA-C 108.611 -0.885 . . . . 0.0 108.611 178.266 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . 113.23 19.26 6.79 Favored Glycine 0 N--CA 1.421 -2.311 0 CA-C-N 114.426 -1.261 . . . . 0.0 110.518 -176.056 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 19' ' ' ASP . . . . . . . . . . . . . 10.4 m-20 -58.33 -38.99 78.26 Favored 'General case' 0 CA--C 1.5 -0.971 0 CA-C-O 121.276 0.56 . . . . 0.0 110.055 179.666 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 20' ' ' CYS . . . . . 0.436 ' HA ' ' HG3' ' A' ' 29' ' ' MET . 34.8 t -78.43 -4.01 46.24 Favored 'General case' 0 C--N 1.306 -1.296 0 CA-C-N 115.623 -0.717 . . . . 0.0 111.977 -176.395 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 21' ' ' ASP . . . . . . . . . . . . . 12.3 t70 -99.35 -9.72 23.18 Favored 'General case' 0 C--N 1.315 -0.923 0 CA-C-O 122.233 1.015 . . . . 0.0 108.469 178.402 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 22' ' ' ASN . . . . . . . . . . . . . 25.0 t-20 -84.3 122.59 29.12 Favored 'General case' 0 C--N 1.315 -0.915 0 CA-C-N 114.765 -1.107 . . . . 0.0 108.19 178.902 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 23' ' ' ASP . . . . . . . . . . . . . 20.1 t70 -55.2 -41.47 72.03 Favored 'General case' 0 C--N 1.318 -0.765 0 N-CA-C 113.266 0.839 . . . . 0.0 113.266 -176.368 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 14.4 m-20 -78.44 -16.33 57.69 Favored 'General case' 0 C--N 1.311 -1.073 0 CA-C-O 121.51 0.671 . . . . 0.0 111.405 -176.345 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 25' ' ' LYS . . . . . . . . . . . . . 34.9 mttm -95.06 -7.46 39.49 Favored 'General case' 0 C--N 1.303 -1.445 0 CA-C-N 115.87 -0.605 . . . . 0.0 111.74 176.588 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 26' ' ' LEU . . . . . . . . . . . . . 85.7 mt -55.74 -43.92 77.06 Favored 'General case' 0 C--N 1.314 -0.951 0 O-C-N 123.141 0.275 . . . . 0.0 111.043 176.881 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 27' ' ' LEU . . . . . . . . . . . . . 24.1 tp -57.21 -49.49 75.83 Favored 'General case' 0 N--CA 1.436 -1.162 0 CA-C-O 121.327 0.584 . . . . 0.0 109.498 176.987 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 28' ' ' GLU . . . . . . . . . . . . . 40.3 tt0 -58.19 -36.94 73.82 Favored 'General case' 0 C--N 1.325 -0.464 0 CA-C-N 114.559 -1.201 . . . . 0.0 109.977 -179.266 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 29' ' ' MET . . . . . 0.436 ' HG3' ' HA ' ' A' ' 20' ' ' CYS . 82.7 mmm -83.89 -23.23 31.33 Favored 'General case' 0 C--N 1.3 -1.554 0 CA-C-N 115.173 -0.921 . . . . 0.0 111.658 -174.825 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 30' ' ' GLY . . . . . . . . . . . . . . . -66.77 -28.46 73.78 Favored Glycine 0 C--N 1.308 -1.027 0 CA-C-N 115.192 -0.913 . . . . 0.0 112.234 179.638 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 31' ' ' TYR . . . . . . . . . . . . . 30.0 p90 -105.0 -34.01 8.14 Favored 'General case' 0 N--CA 1.435 -1.221 0 N-CA-C 113.404 0.89 . . . . 0.0 113.404 177.06 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 32' ' ' TYR . . . . . 0.422 ' HB3' ' CD2' ' A' ' 9' ' ' PHE . 19.2 m-85 -71.44 -62.05 1.55 Allowed 'General case' 0 C--N 1.308 -1.229 0 N-CA-C 113.623 0.971 . . . . 0.0 113.623 178.33 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 33' ' ' CYS . . . . . 0.583 ' SG ' ' HD2' ' A' ' 9' ' ' PHE . 62.6 m -134.31 70.3 73.17 Favored Pre-proline 0 C--N 1.299 -1.63 0 C-N-CA 119.896 -0.721 . . . . 0.0 110.988 -177.31 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 34' ' ' PRO . . . . . . . . . . . . . 71.7 Cg_endo -75.87 -23.77 12.11 Favored 'Trans proline' 0 N--CA 1.445 -1.331 0 C-N-CA 122.154 1.903 . . . . 0.0 112.438 -175.408 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 35' ' ' VAL . . . . . 0.693 ' HB ' ' OD2' ' A' ' 5' ' ' ASP . 39.3 t -82.73 -36.72 13.52 Favored 'Isoleucine or valine' 0 N--CA 1.424 -1.751 0 N-CA-C 108.826 -0.805 . . . . 0.0 108.826 -177.145 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 36' ' ' THR . . . . . . . . . . . . . 48.2 m -64.12 -34.86 79.01 Favored 'General case' 0 CA--C 1.546 0.804 0 CA-C-N 115.305 -0.861 . . . . 0.0 110.635 175.362 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 37' ' ' CYS . . . . . . . . . . . . . 90.9 m -84.79 2.11 43.71 Favored 'General case' 0 C--N 1.322 -0.59 0 CA-C-O 121.087 0.47 . . . . 0.0 112.243 177.767 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 38' ' ' GLY . . . . . . . . . . . . . . . 69.58 26.58 74.33 Favored Glycine 0 N--CA 1.445 -0.744 0 CA-C-N 116.124 -0.489 . . . . 0.0 114.224 176.086 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 39' ' ' PHE . . . . . . . . . . . . . 26.8 m-85 -75.05 -34.66 61.87 Favored 'General case' 0 CA--C 1.507 -0.687 0 N-CA-C 108.464 -0.939 . . . . 0.0 108.464 178.402 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 40' ' ' CYS . . . . . . . . . . . . . 3.3 p . . . . . 0 C--N 1.306 -1.285 0 CA-C-N 114.537 -1.211 . . . . 0.0 109.989 -179.488 . . . . . . . . 0 0 . 1 . 002 nuclear nobuild core ' A' A ' 4' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.433 -1.325 0 N-CA-C 109.571 -0.529 . . . . 0.0 109.571 . . . . . . . . . 0 0 . 1 . 002 nuclear nobuild core ' A' A ' 5' ' ' ASP . . . . . 0.626 ' OD2' ' HB ' ' A' ' 35' ' ' VAL . 4.2 m-20 -65.55 160.79 21.61 Favored 'General case' 0 C--N 1.307 -1.244 0 O-C-N 123.779 0.674 . . . . 0.0 109.803 179.381 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 6' ' ' GLU . . . . . 0.448 ' HB3' ' HB3' ' A' ' 9' ' ' PHE . 0.6 OUTLIER -71.25 139.87 50.19 Favored 'General case' 0 C--N 1.309 -1.179 0 N-CA-C 106.537 -1.653 . . . . 0.0 106.537 179.147 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' A' A ' 7' ' ' LYS . . . . . . . . . . . . . 19.5 ptmt -82.19 -26.56 33.25 Favored 'General case' 0 C--N 1.303 -1.421 0 N-CA-C 113.691 0.997 . . . . 0.0 113.691 -171.098 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 8' ' ' ASN . . . . . . . . . . . . . 37.8 m-80 -89.86 -31.22 17.43 Favored 'General case' 0 C--N 1.294 -1.809 0 CA-C-O 121.451 0.644 . . . . 0.0 109.4 -179.23 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 9' ' ' PHE . . . . . 0.457 ' CD2' ' HB3' ' A' ' 32' ' ' TYR . 32.9 t80 -76.55 119.37 20.29 Favored 'General case' 0 N--CA 1.424 -1.771 0 N-CA-C 107.751 -1.203 . . . . 0.0 107.751 176.691 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 10' ' ' ASP . . . . . . . . . . . . . 15.4 t70 -88.39 96.14 10.48 Favored 'General case' 0 C--N 1.294 -1.828 0 N-CA-C 109.002 -0.74 . . . . 0.0 109.002 -179.905 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 11' ' ' CYS . . . . . . . . . . . . . 96.1 m -70.35 -19.53 63.04 Favored 'General case' 0 C--N 1.312 -1.036 0 CA-C-N 115.387 -0.824 . . . . 0.0 111.902 -178.441 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 12' ' ' ARG . . . . . . . . . . . . . 36.3 mmt180 -66.8 -43.36 84.06 Favored 'General case' 0 C--N 1.319 -0.746 0 N-CA-C 108.805 -0.813 . . . . 0.0 108.805 178.287 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 58.6 ttp180 -64.01 -50.08 69.91 Favored 'General case' 0 C--O 1.211 -0.953 0 CA-C-N 115.327 -0.851 . . . . 0.0 109.511 175.52 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 14' ' ' SER . . . . . . . . . . . . . 11.7 m -57.4 -40.07 77.46 Favored 'General case' 0 C--O 1.252 1.194 0 C-N-CA 122.909 0.483 . . . . 0.0 112.087 -178.621 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 46.0 tp -64.77 -41.14 96.1 Favored 'General case' 0 C--N 1.327 -0.388 0 CA-C-O 121.306 0.574 . . . . 0.0 110.259 179.686 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 16' ' ' ARG . . . . . . . . . . . . . 60.5 mtm180 -77.82 -28.2 50.2 Favored 'General case' 0 C--N 1.305 -1.342 0 CA-C-N 116.036 -0.529 . . . . 0.0 111.475 179.523 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 17' ' ' ASN . . . . . . . . . . . . . 0.9 OUTLIER -69.1 -25.93 64.67 Favored 'General case' 0 N--CA 1.477 0.899 0 CA-C-N 115.811 -0.631 . . . . 0.0 111.226 178.277 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . 102.89 6.4 46.11 Favored Glycine 0 N--CA 1.439 -1.101 0 C-N-CA 120.527 -0.844 . . . . 0.0 112.273 178.024 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 19' ' ' ASP . . . . . . . . . . . . . 15.6 m-20 -73.13 -27.25 61.57 Favored 'General case' 0 CA--C 1.504 -0.805 0 CA-C-O 120.937 0.398 . . . . 0.0 111.53 -178.631 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 20' ' ' CYS . . . . . 0.44 ' HA ' ' HG3' ' A' ' 29' ' ' MET . 46.6 t -81.29 -9.91 59.67 Favored 'General case' 0 C--N 1.306 -1.303 0 CA-C-O 121.669 0.747 . . . . 0.0 110.051 179.92 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 21' ' ' ASP . . . . . . . . . . . . . 28.3 t70 -101.67 -8.9 21.37 Favored 'General case' 0 C--N 1.318 -0.791 0 CA-C-O 121.998 0.904 . . . . 0.0 108.946 177.509 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 22' ' ' ASN . . . . . . . . . . . . . 52.5 t-20 -88.09 123.06 32.38 Favored 'General case' 0 C--N 1.305 -1.368 0 CA-C-N 115.453 -0.794 . . . . 0.0 109.215 -178.896 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 23' ' ' ASP . . . . . 0.407 ' HA ' ' HG ' ' A' ' 26' ' ' LEU . 6.9 m-20 -59.38 -35.34 73.75 Favored 'General case' 0 CA--C 1.507 -0.688 0 C-N-CA 123.61 0.764 . . . . 0.0 111.466 179.857 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 11.8 t70 -66.6 -32.6 74.03 Favored 'General case' 0 C--N 1.311 -1.104 0 C-N-CA 123.59 0.756 . . . . 0.0 111.802 -179.207 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 25' ' ' LYS . . . . . 0.519 ' O ' ' HG2' ' A' ' 29' ' ' MET . 33.8 mmtp -94.01 -2.44 53.01 Favored 'General case' 0 C--N 1.31 -1.117 0 CA-C-N 116.124 -0.489 . . . . 0.0 112.234 -177.358 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 26' ' ' LEU . . . . . 0.407 ' HG ' ' HA ' ' A' ' 23' ' ' ASP . 88.6 mt -58.89 -38.6 79.22 Favored 'General case' 0 N--CA 1.469 0.504 0 N-CA-C 112.834 0.679 . . . . 0.0 112.834 -176.95 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 27' ' ' LEU . . . . . . . . . . . . . 24.4 tp -55.28 -49.89 70.93 Favored 'General case' 0 N--CA 1.437 -1.092 0 N-CA-C 109.436 -0.579 . . . . 0.0 109.436 176.376 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 28' ' ' GLU . . . . . . . . . . . . . 5.7 mm-40 -61.86 -36.78 82.26 Favored 'General case' 0 C--N 1.324 -0.518 0 CA-C-N 114.603 -1.18 . . . . 0.0 109.141 -179.22 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 29' ' ' MET . . . . . 0.519 ' HG2' ' O ' ' A' ' 25' ' ' LYS . 22.3 mmt -70.94 -27.45 63.77 Favored 'General case' 0 C--O 1.203 -1.384 0 CA-C-N 115.203 -0.908 . . . . 0.0 110.885 -175.324 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 30' ' ' GLY . . . . . . . . . . . . . . . -68.42 -34.4 79.49 Favored Glycine 0 C--N 1.312 -0.777 0 C-N-CA 120.186 -1.007 . . . . 0.0 112.768 -178.321 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 31' ' ' TYR . . . . . . . . . . . . . 36.3 p90 -103.15 -27.6 12.44 Favored 'General case' 0 N--CA 1.441 -0.883 0 N-CA-C 113.663 0.986 . . . . 0.0 113.663 179.913 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 32' ' ' TYR . . . . . 0.457 ' HB3' ' CD2' ' A' ' 9' ' ' PHE . 23.0 m-85 -83.35 -36.83 24.06 Favored 'General case' 0 C--N 1.29 -2.018 0 N-CA-C 112.626 0.602 . . . . 0.0 112.626 175.852 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 33' ' ' CYS . . . . . . . . . . . . . 61.0 m -134.71 49.86 4.26 Favored Pre-proline 0 CA--C 1.565 1.528 0 N-CA-C 113.369 0.878 . . . . 0.0 113.369 -174.893 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 34' ' ' PRO . . . . . 0.563 ' HD2' ' HA ' ' A' ' 5' ' ' ASP . 21.7 Cg_endo -57.33 -32.3 93.43 Favored 'Trans proline' 0 C--N 1.38 2.21 0 C-N-CA 122.733 2.289 . . . . 0.0 113.591 -178.916 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 35' ' ' VAL . . . . . 0.626 ' HB ' ' OD2' ' A' ' 5' ' ' ASP . 45.3 t -87.07 -46.76 16.21 Favored 'Isoleucine or valine' 0 C--N 1.299 -1.629 0 C-N-CA 119.917 -0.713 . . . . 0.0 110.892 -177.46 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 36' ' ' THR . . . . . . . . . . . . . 19.5 m -61.56 -40.95 96.56 Favored 'General case' 0 C--N 1.312 -1.053 0 CA-C-N 115.972 -0.558 . . . . 0.0 111.769 -177.336 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 37' ' ' CYS . . . . . . . . . . . . . 94.4 m -91.95 10.91 26.92 Favored 'General case' 0 C--N 1.312 -1.058 0 N-CA-C 113.173 0.805 . . . . 0.0 113.173 -179.163 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 38' ' ' GLY . . . . . . . . . . . . . . . 69.87 48.61 40.33 Favored Glycine 0 CA--C 1.524 0.645 0 N-CA-C 115.761 1.064 . . . . 0.0 115.761 172.908 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 39' ' ' PHE . . . . . 0.522 ' CD2' ' HA ' ' A' ' 34' ' ' PRO . 93.1 m-85 -96.32 -40.1 9.3 Favored 'General case' 0 C--N 1.303 -1.424 0 N-CA-C 107.749 -1.204 . . . . 0.0 107.749 173.183 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 40' ' ' CYS . . . . . . . . . . . . . 49.8 t . . . . . 0 C--N 1.309 -1.156 0 N-CA-C 107.878 -1.156 . . . . 0.0 107.878 179.868 . . . . . . . . 0 0 . 1 . 003 nuclear nobuild core ' A' A ' 4' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.501 -0.905 0 N-CA-C 108.64 -0.874 . . . . 0.0 108.64 . . . . . . . . . 0 0 . 1 . 003 nuclear nobuild core ' A' A ' 5' ' ' ASP . . . . . 0.582 ' HB3' ' SG ' ' A' ' 11' ' ' CYS . 44.4 m-20 -60.69 141.62 56.63 Favored 'General case' 0 C--N 1.317 -0.825 0 O-C-N 123.733 0.645 . . . . 0.0 110.2 178.945 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 13.3 tp10 -64.11 140.39 58.86 Favored 'General case' 0 N--CA 1.443 -0.825 0 C-N-CA 123.682 0.793 . . . . 0.0 111.543 -178.95 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 7' ' ' LYS . . . . . . . . . . . . . 10.3 ptpp? -85.18 -29.97 24.3 Favored 'General case' 0 N--CA 1.441 -0.905 0 C-N-CA 124.353 1.061 . . . . 0.0 111.227 -176.498 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 8' ' ' ASN . . . . . . . . . . . . . 44.9 m-80 -86.74 -9.17 56.52 Favored 'General case' 0 C--N 1.308 -1.208 0 CA-C-O 121.817 0.818 . . . . 0.0 110.83 -178.497 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 9' ' ' PHE . . . . . . . . . . . . . 36.5 t80 -112.16 144.96 40.68 Favored 'General case' 0 C--N 1.287 -2.12 0 N-CA-C 105.524 -2.028 . . . . 0.0 105.524 -178.834 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 10' ' ' ASP . . . . . . . . . . . . . 15.3 t70 -104.49 98.77 8.49 Favored 'General case' 0 C--N 1.304 -1.403 0 C-N-CA 117.779 -1.568 . . . . 0.0 110.417 179.274 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 11' ' ' CYS . . . . . 0.582 ' SG ' ' HB3' ' A' ' 5' ' ' ASP . 76.1 m -68.33 -20.34 64.72 Favored 'General case' 0 C--N 1.304 -1.393 0 CA-C-N 114.51 -1.223 . . . . 0.0 112.274 -177.924 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 12' ' ' ARG . . . . . . . . . . . . . 7.3 mmt180 -76.6 -46.58 25.51 Favored 'General case' 0 C--N 1.315 -0.899 0 N-CA-C 107.628 -1.249 . . . . 0.0 107.628 -176.793 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 54.9 ttp180 -61.91 -40.95 97.25 Favored 'General case' 0 C--O 1.213 -0.846 0 CA-C-N 115.501 -0.772 . . . . 0.0 109.504 175.51 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 14' ' ' SER . . . . . . . . . . . . . 23.4 m -65.84 -28.02 68.67 Favored 'General case' 0 C--N 1.318 -0.773 0 CA-C-O 121.18 0.515 . . . . 0.0 111.252 179.01 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 2.3 tm? -77.56 -39.36 46.04 Favored 'General case' 0 C--N 1.316 -0.87 0 N-CA-C 107.803 -1.184 . . . . 0.0 107.803 177.267 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 16' ' ' ARG . . . . . . . . . . . . . 23.7 mtp180 -68.24 -44.89 74.65 Favored 'General case' 0 C--N 1.323 -0.548 0 CA-C-N 115.633 -0.712 . . . . 0.0 111.817 179.326 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 17' ' ' ASN . . . . . . . . . . . . . 85.3 m-20 -64.96 -37.95 89.35 Favored 'General case' 0 CA--C 1.496 -1.131 0 CA-C-O 121.67 0.747 . . . . 0.0 109.111 177.164 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . 107.74 5.45 33.63 Favored Glycine 0 N--CA 1.416 -2.657 0 CA-C-N 114.652 -1.158 . . . . 0.0 111.5 -179.122 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 19' ' ' ASP . . . . . . . . . . . . . 30.5 m-20 -57.9 -38.22 75.44 Favored 'General case' 0 N--CA 1.494 1.775 0 CA-C-O 121.618 0.723 . . . . 0.0 109.299 179.345 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 20' ' ' CYS . . . . . . . . . . . . . 44.5 t -61.45 -25.55 67.3 Favored 'General case' 0 C--N 1.31 -1.144 0 CA-C-N 114.198 -1.365 . . . . 0.0 111.982 -178.117 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 21' ' ' ASP . . . . . . . . . . . . . 28.5 t70 -111.28 -9.25 14.3 Favored 'General case' 0 C--N 1.319 -0.725 0 CA-C-O 121.646 0.736 . . . . 0.0 110.248 -179.194 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 22' ' ' ASN . . . . . . . . . . . . . 51.8 t-20 -75.54 119.51 19.7 Favored 'General case' 0 C--N 1.313 -0.996 0 CA-C-N 115.317 -0.856 . . . . 0.0 108.904 -177.272 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 23' ' ' ASP . . . . . 0.44 ' HA ' ' HG ' ' A' ' 26' ' ' LEU . 6.1 m-20 -54.06 -36.71 63.4 Favored 'General case' 0 CA--C 1.501 -0.914 0 C-N-CA 123.545 0.738 . . . . 0.0 112.505 -177.906 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 35.8 m-20 -72.62 -21.41 61.11 Favored 'General case' 0 C--N 1.308 -1.205 0 CA-C-N 115.969 -0.56 . . . . 0.0 111.504 -175.549 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 25' ' ' LYS . . . . . 0.525 ' O ' ' HG2' ' A' ' 29' ' ' MET . 13.3 mptt -104.6 -5.19 21.69 Favored 'General case' 0 C--N 1.311 -1.08 0 N-CA-C 112.1 0.407 . . . . 0.0 112.1 178.29 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 26' ' ' LEU . . . . . 0.44 ' HG ' ' HA ' ' A' ' 23' ' ' ASP . 62.8 mt -52.07 -38.88 58.63 Favored 'General case' 0 N--CA 1.479 0.981 0 N-CA-C 114.657 1.354 . . . . 0.0 114.657 -175.162 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 27' ' ' LEU . . . . . . . . . . . . . 29.6 tp -54.81 -52.72 61.82 Favored 'General case' 0 N--CA 1.44 -0.953 0 CA-C-O 121.048 0.451 . . . . 0.0 109.935 178.059 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 28' ' ' GLU . . . . . 0.5 ' HA ' ' CE2' ' A' ' 31' ' ' TYR . 43.6 mt-10 -65.2 -33.2 75.43 Favored 'General case' 0 N--CA 1.442 -0.829 0 CA-C-N 115.296 -0.865 . . . . 0.0 109.685 -178.197 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 29' ' ' MET . . . . . 0.525 ' HG2' ' O ' ' A' ' 25' ' ' LYS . 72.7 mmm -75.75 -26.54 57.5 Favored 'General case' 0 C--N 1.31 -1.151 0 CA-C-N 115.263 -0.88 . . . . 0.0 111.003 -174.71 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 30' ' ' GLY . . . . . 0.458 ' HA2' ' CE2' ' A' ' 39' ' ' PHE . . . -65.63 -37.31 93.45 Favored Glycine 0 CA--C 1.494 -1.232 0 O-C-N 123.944 0.778 . . . . 0.0 112.174 -178.955 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 31' ' ' TYR . . . . . 0.5 ' CE2' ' HA ' ' A' ' 28' ' ' GLU . 52.3 p90 -96.72 -34.74 11.24 Favored 'General case' 0 N--CA 1.433 -1.307 0 C-N-CA 119.697 -0.801 . . . . 0.0 112.755 178.901 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 32' ' ' TYR . . . . . . . . . . . . . 27.5 m-85 -69.71 -50.42 43.79 Favored 'General case' 0 C--N 1.312 -1.024 0 N-CA-C 112.954 0.724 . . . . 0.0 112.954 177.403 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 33' ' ' CYS . . . . . . . . . . . . . 29.8 m -130.45 69.58 82.16 Favored Pre-proline 0 C--O 1.259 1.574 0 C-N-CA 120.128 -0.629 . . . . 0.0 111.388 -175.836 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 34' ' ' PRO . . . . . 0.434 ' HA ' ' HD2' ' A' ' 39' ' ' PHE . 38.2 Cg_endo -65.28 -26.54 56.37 Favored 'Trans proline' 0 C--N 1.362 1.268 0 C-N-CA 122.429 2.086 . . . . 0.0 112.067 -177.944 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 35' ' ' VAL . . . . . . . . . . . . . 33.5 t -86.78 -49.89 14.52 Favored 'Isoleucine or valine' 0 N--CA 1.433 -1.302 0 CA-C-N 116.091 -0.504 . . . . 0.0 110.966 -176.198 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 36' ' ' THR . . . . . . . . . . . . . 29.0 m -55.68 -52.14 64.87 Favored 'General case' 0 C--N 1.316 -0.875 0 C-N-CA 123.28 0.632 . . . . 0.0 112.644 -177.685 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 37' ' ' CYS . . . . . 0.604 ' HB2' ' CE2' ' A' ' 39' ' ' PHE . 59.6 m -76.83 -11.43 59.83 Favored 'General case' 0 C--N 1.305 -1.333 0 N-CA-C 112.659 0.614 . . . . 0.0 112.659 -176.886 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 38' ' ' GLY . . . . . . . . . . . . . . . 88.97 46.78 4.38 Favored Glycine 0 N--CA 1.442 -0.96 0 C-N-CA 120.391 -0.909 . . . . 0.0 113.724 176.827 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 39' ' ' PHE . . . . . 0.604 ' CE2' ' HB2' ' A' ' 37' ' ' CYS . 98.1 m-85 -98.31 -59.88 1.66 Allowed 'General case' 0 C--N 1.308 -1.225 0 N-CA-C 108.51 -0.922 . . . . 0.0 108.51 176.374 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 40' ' ' CYS . . . . . . . . . . . . . 42.2 t . . . . . 0 C--N 1.307 -1.271 0 N-CA-C 108.05 -1.093 . . . . 0.0 108.05 -177.065 . . . . . . . . 0 0 . 1 . 004 nuclear nobuild core ' A' A ' 4' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.439 -1.015 0 N-CA-C 109.879 -0.415 . . . . 0.0 109.879 . . . . . . . . . 0 0 . 1 . 004 nuclear nobuild core ' A' A ' 5' ' ' ASP . . . . . 0.458 ' HA ' ' HD2' ' A' ' 34' ' ' PRO . 61.4 m-20 -66.24 149.8 49.79 Favored 'General case' 0 C--O 1.256 1.414 0 N-CA-C 109.174 -0.676 . . . . 0.0 109.174 176.182 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 6' ' ' GLU . . . . . 0.408 ' HB3' ' HB3' ' A' ' 9' ' ' PHE . 10.4 tp10 -65.81 144.64 56.72 Favored 'General case' 0 C--N 1.302 -1.484 0 C-N-CA 123.665 0.786 . . . . 0.0 110.679 -179.243 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 7' ' ' LYS . . . . . . . . . . . . . 11.3 ptpp? -85.45 -25.78 26.72 Favored 'General case' 0 C--N 1.321 -0.631 0 CA-C-O 121.047 0.451 . . . . 0.0 111.927 -174.76 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 8' ' ' ASN . . . . . . . . . . . . . 10.7 p30 -98.05 5.33 48.83 Favored 'General case' 0 C--N 1.313 -0.992 0 CA-C-O 121.471 0.653 . . . . 0.0 111.11 -179.361 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 9' ' ' PHE . . . . . 0.408 ' HB3' ' HB3' ' A' ' 6' ' ' GLU . 39.2 t80 -120.99 141.01 51.11 Favored 'General case' 0 C--N 1.298 -1.659 0 N-CA-C 107.21 -1.404 . . . . 0.0 107.21 -178.731 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 10' ' ' ASP . . . . . . . . . . . . . 14.1 t70 -104.53 107.78 18.88 Favored 'General case' 0 N--CA 1.434 -1.231 0 C-N-CA 118.792 -1.163 . . . . 0.0 110.295 179.026 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 11' ' ' CYS . . . . . . . . . . . . . 72.1 m -78.01 -22.75 48.8 Favored 'General case' 0 C--N 1.278 -2.535 0 CA-C-N 114.748 -1.114 . . . . 0.0 112.997 -177.499 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 12' ' ' ARG . . . . . 0.432 ' O ' ' HG3' ' A' ' 16' ' ' ARG . 18.9 mmm180 -68.84 -45.25 71.62 Favored 'General case' 0 C--N 1.323 -0.545 0 N-CA-C 108.86 -0.793 . . . . 0.0 108.86 177.633 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 39.4 ttm180 -57.45 -48.77 78.29 Favored 'General case' 0 C--N 1.312 -1.037 0 CA-C-N 115.19 -0.914 . . . . 0.0 110.236 176.441 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 14' ' ' SER . . . . . . . . . . . . . 24.0 m -59.96 -35.09 74.21 Favored 'General case' 0 C--N 1.313 -1.0 0 CA-C-N 115.455 -0.793 . . . . 0.0 110.995 178.981 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 15' ' ' LEU . . . . . 0.452 ' HA ' ' HB3' ' A' ' 20' ' ' CYS . 35.0 tp -72.66 -40.87 65.98 Favored 'General case' 0 C--N 1.32 -0.699 0 CA-C-N 116.113 -0.494 . . . . 0.0 110.306 178.769 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 16' ' ' ARG . . . . . 0.432 ' HG3' ' O ' ' A' ' 12' ' ' ARG . 97.8 mtt180 -68.29 -31.45 70.89 Favored 'General case' 0 C--N 1.316 -0.867 0 N-CA-C 112.44 0.533 . . . . 0.0 112.44 -179.889 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 17' ' ' ASN . . . . . . . . . . . . . 40.4 m-80 -88.7 -24.16 22.79 Favored 'General case' 0 CA--C 1.497 -1.088 0 N-CA-C 113.353 0.871 . . . . 0.0 113.353 -177.384 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . 110.42 5.11 28.39 Favored Glycine 0 C--N 1.301 -1.365 0 C-N-CA 119.044 -1.55 . . . . 0.0 112.834 178.654 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 19' ' ' ASP . . . . . . . . . . . . . 21.5 m-20 -70.23 -32.64 70.6 Favored 'General case' 0 CA--C 1.498 -1.025 0 CA-C-O 121.429 0.633 . . . . 0.0 109.564 -179.697 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 20' ' ' CYS . . . . . 0.452 ' HB3' ' HA ' ' A' ' 15' ' ' LEU . 45.4 t -78.5 -11.91 59.98 Favored 'General case' 0 C--N 1.304 -1.388 0 CA-C-N 114.624 -1.171 . . . . 0.0 110.419 -178.694 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 21' ' ' ASP . . . . . . . . . . . . . 26.5 t70 -106.33 -10.26 16.44 Favored 'General case' 0 C--N 1.319 -0.741 0 CA-C-O 121.651 0.739 . . . . 0.0 110.167 -179.531 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 22' ' ' ASN . . . . . 0.414 ' O ' ' HG ' ' A' ' 26' ' ' LEU . 25.9 t-20 -86.13 121.62 28.99 Favored 'General case' 0 C--N 1.302 -1.483 0 CA-C-N 115.237 -0.892 . . . . 0.0 109.984 -175.332 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 23' ' ' ASP . . . . . . . . . . . . . 24.7 t70 -61.18 -38.47 86.62 Favored 'General case' 0 C--N 1.32 -0.704 0 O-C-N 123.576 0.548 . . . . 0.0 112.453 -174.757 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 13.8 m-20 -64.8 -32.67 74.46 Favored 'General case' 0 N--CA 1.482 1.164 0 CA-C-O 121.466 0.651 . . . . 0.0 110.814 179.235 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 25' ' ' LYS . . . . . 0.469 ' O ' ' HG2' ' A' ' 29' ' ' MET . 13.5 mmmm -88.11 -11.49 46.86 Favored 'General case' 0 C--N 1.311 -1.073 0 CA-C-N 115.671 -0.695 . . . . 0.0 111.605 -177.162 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 26' ' ' LEU . . . . . 0.414 ' HG ' ' O ' ' A' ' 22' ' ' ASN . 60.1 mt -58.1 -31.25 66.95 Favored 'General case' 0 C--O 1.221 -0.422 0 N-CA-C 114.132 1.16 . . . . 0.0 114.132 -176.421 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 27' ' ' LEU . . . . . . . . . . . . . 34.3 tp -56.35 -52.03 66.07 Favored 'General case' 0 N--CA 1.44 -0.955 0 CA-C-O 121.441 0.639 . . . . 0.0 109.356 176.445 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 28' ' ' GLU . . . . . 0.544 ' HA ' ' CE2' ' A' ' 31' ' ' TYR . 44.5 mt-10 -65.93 -31.83 72.98 Favored 'General case' 0 N--CA 1.434 -1.246 0 CA-C-N 114.679 -1.146 . . . . 0.0 109.606 179.884 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 29' ' ' MET . . . . . 0.469 ' HG2' ' O ' ' A' ' 25' ' ' LYS . 22.2 mmt -74.21 -24.77 59.38 Favored 'General case' 0 C--O 1.196 -1.754 0 CA-C-N 115.924 -0.58 . . . . 0.0 110.193 -176.623 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 30' ' ' GLY . . . . . . . . . . . . . . . -71.01 -25.47 75.71 Favored Glycine 0 N--CA 1.448 -0.501 0 C-N-CA 120.501 -0.857 . . . . 0.0 112.046 -179.489 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 31' ' ' TYR . . . . . 0.544 ' CE2' ' HA ' ' A' ' 28' ' ' GLU . 52.7 p90 -105.33 -34.65 7.79 Favored 'General case' 0 N--CA 1.429 -1.482 0 C-N-CA 119.342 -0.943 . . . . 0.0 113.142 176.921 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 32' ' ' TYR . . . . . . . . . . . . . 32.8 m-85 -74.11 -43.56 57.12 Favored 'General case' 0 C--N 1.302 -1.49 0 C-N-CA 120.8 -0.36 . . . . 0.0 111.964 176.075 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 33' ' ' CYS . . . . . . . . . . . . . 39.9 m -135.44 57.61 20.92 Favored Pre-proline 0 C--O 1.253 1.243 0 N-CA-C 112.889 0.7 . . . . 0.0 112.889 -172.799 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 34' ' ' PRO . . . . . 0.512 ' HA ' ' CD2' ' A' ' 39' ' ' PHE . 37.5 Cg_endo -64.19 -27.08 64.59 Favored 'Trans proline' 0 C--N 1.364 1.345 0 C-N-CA 121.874 1.716 . . . . 0.0 111.798 -179.041 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 35' ' ' VAL . . . . . . . . . . . . . 44.4 t -86.95 -56.48 5.24 Favored 'Isoleucine or valine' 0 N--CA 1.43 -1.448 0 CA-C-N 115.794 -0.639 . . . . 0.0 110.945 -177.197 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 36' ' ' THR . . . . . . . . . . . . . 97.4 m -59.27 -39.82 84.13 Favored 'General case' 0 CA--C 1.549 0.907 0 N-CA-C 112.738 0.644 . . . . 0.0 112.738 -177.217 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 37' ' ' CYS . . . . . 0.436 ' HB2' ' CE2' ' A' ' 39' ' ' PHE . 90.4 m -81.16 2.2 28.61 Favored 'General case' 0 C--N 1.31 -1.11 0 N-CA-C 113.235 0.828 . . . . 0.0 113.235 -179.843 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 38' ' ' GLY . . . . . . . . . . . . . . . 77.12 23.39 68.86 Favored Glycine 0 N--CA 1.447 -0.584 0 N-CA-C 114.901 0.721 . . . . 0.0 114.901 174.123 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 39' ' ' PHE . . . . . 0.512 ' CD2' ' HA ' ' A' ' 34' ' ' PRO . 97.9 m-85 -72.45 -51.17 21.43 Favored 'General case' 0 C--N 1.317 -0.828 0 N-CA-C 106.917 -1.512 . . . . 0.0 106.917 175.273 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 40' ' ' CYS . . . . . . . . . . . . . 51.3 t . . . . . 0 N--CA 1.43 -1.467 0 CA-C-N 114.168 -1.378 . . . . 0.0 108.028 178.433 . . . . . . . . 0 0 . 1 . 005 nuclear nobuild core ' A' A ' 4' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.427 -1.585 0 N-CA-C 108.107 -1.071 . . . . 0.0 108.107 . . . . . . . . . 0 0 . 1 . 005 nuclear nobuild core ' A' A ' 5' ' ' ASP . . . . . 0.637 ' OD2' ' HB ' ' A' ' 35' ' ' VAL . 11.0 m-20 -60.89 146.21 47.4 Favored 'General case' 0 C--N 1.316 -0.857 0 N-CA-C 109.407 -0.59 . . . . 0.0 109.407 175.124 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 9.7 tp10 -72.15 142.03 49.1 Favored 'General case' 0 C--N 1.31 -1.15 0 C-N-CA 123.077 0.551 . . . . 0.0 111.006 -178.781 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 7' ' ' LYS . . . . . . . . . . . . . 18.3 ptmt -85.72 -27.87 25.0 Favored 'General case' 0 C--N 1.326 -0.416 0 CA-C-O 122.32 1.057 . . . . 0.0 110.812 179.663 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 8' ' ' ASN . . . . . . . . . . . . . 19.5 m120 -88.06 15.76 6.96 Favored 'General case' 0 C--N 1.305 -1.365 0 CA-C-N 114.819 -1.082 . . . . 0.0 110.616 -178.713 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 9' ' ' PHE . . . . . . . . . . . . . 40.3 t80 -142.17 143.24 32.87 Favored 'General case' 0 N--CA 1.414 -2.255 0 N-CA-C 104.59 -2.374 . . . . 0.0 104.59 179.275 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 10' ' ' ASP . . . . . 0.424 ' OD1' ' HD3' ' A' ' 12' ' ' ARG . 20.1 t70 -104.7 104.0 13.72 Favored 'General case' 0 C--N 1.302 -1.458 0 C-N-CA 118.144 -1.422 . . . . 0.0 111.009 179.062 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 11' ' ' CYS . . . . . 0.503 ' SG ' ' HB3' ' A' ' 5' ' ' ASP . 71.7 m -71.32 -16.2 62.44 Favored 'General case' 0 C--N 1.301 -1.511 0 CA-C-N 115.073 -0.967 . . . . 0.0 113.562 -177.885 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 12' ' ' ARG . . . . . 0.424 ' HD3' ' OD1' ' A' ' 10' ' ' ASP . 3.9 mpt_? -70.5 -51.22 30.44 Favored 'General case' 0 CA--C 1.493 -1.215 0 N-CA-C 106.62 -1.622 . . . . 0.0 106.62 178.533 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 41.3 ttm180 -49.77 -53.01 27.67 Favored 'General case' 0 C--N 1.319 -0.725 0 CA-C-N 114.168 -1.378 . . . . 0.0 110.513 175.905 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 14' ' ' SER . . . . . . . . . . . . . 12.2 m -55.18 -38.76 68.75 Favored 'General case' 0 C--O 1.253 1.283 0 CA-C-N 115.923 -0.581 . . . . 0.0 111.691 179.748 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 15' ' ' LEU . . . . . 0.456 ' HA ' ' HB3' ' A' ' 20' ' ' CYS . 30.6 tp -79.03 -36.94 40.28 Favored 'General case' 0 C--N 1.327 -0.393 0 CA-C-N 116.436 -0.347 . . . . 0.0 111.008 -178.323 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 16' ' ' ARG . . . . . . . . . . . . . 98.4 mtt180 -65.92 -37.23 85.54 Favored 'General case' 0 C--N 1.315 -0.895 0 CA-C-O 121.296 0.569 . . . . 0.0 110.707 177.966 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 17' ' ' ASN . . . . . . . . . . . . . 91.9 m-20 -76.0 -43.32 44.84 Favored 'General case' 0 CA--C 1.494 -1.201 0 CA-C-N 115.771 -0.649 . . . . 0.0 110.531 179.152 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . 112.94 7.36 21.76 Favored Glycine 0 C--N 1.297 -1.635 0 C-N-CA 119.882 -1.151 . . . . 0.0 111.783 177.794 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 19' ' ' ASP . . . . . . . . . . . . . 12.7 m-20 -68.87 -31.81 71.02 Favored 'General case' 0 C--O 1.212 -0.906 0 N-CA-C 108.267 -1.012 . . . . 0.0 108.267 177.918 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 20' ' ' CYS . . . . . 0.456 ' HB3' ' HA ' ' A' ' 15' ' ' LEU . 45.3 t -69.84 -10.06 57.04 Favored 'General case' 0 C--N 1.309 -1.179 0 CA-C-N 114.076 -1.42 . . . . 0.0 111.272 -179.264 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 21' ' ' ASP . . . . . . . . . . . . . 35.1 t70 -116.69 -8.92 11.38 Favored 'General case' 0 N--CA 1.468 0.43 0 CA-C-O 121.446 0.641 . . . . 0.0 110.388 -179.597 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 22' ' ' ASN . . . . . 0.495 ' O ' ' HG ' ' A' ' 26' ' ' LEU . 34.5 t30 -87.83 128.9 35.34 Favored 'General case' 0 C--N 1.324 -0.541 0 CA-C-N 115.575 -0.739 . . . . 0.0 111.706 -175.925 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 23' ' ' ASP . . . . . . . . . . . . . 5.6 p-10 -52.05 -43.94 64.04 Favored 'General case' 0 C--O 1.241 0.622 0 C-N-CA 124.84 1.256 . . . . 0.0 113.826 -176.057 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 2.8 p30 -74.17 -13.86 60.87 Favored 'General case' 0 N--CA 1.473 0.714 0 C-N-CA 120.331 -0.548 . . . . 0.0 112.404 -176.272 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 25' ' ' LYS . . . . . 0.476 ' O ' ' HG2' ' A' ' 29' ' ' MET . 46.5 mmtm -100.05 -13.35 19.07 Favored 'General case' 0 C--N 1.309 -1.17 0 C-N-CA 120.916 -0.314 . . . . 0.0 110.898 179.795 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 26' ' ' LEU . . . . . 0.495 ' HG ' ' O ' ' A' ' 22' ' ' ASN . 84.6 mt -56.67 -40.96 76.46 Favored 'General case' 0 C--O 1.2 -1.528 0 N-CA-C 115.4 1.63 . . . . 0.0 115.4 -171.707 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 27' ' ' LEU . . . . . . . . . . . . . 20.1 tp -61.01 -44.83 96.84 Favored 'General case' 0 N--CA 1.442 -0.851 0 CA-C-N 119.042 0.837 . . . . 0.0 110.007 -179.377 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 28' ' ' GLU . . . . . 0.494 ' HA ' ' CE1' ' A' ' 31' ' ' TYR . 40.1 tt0 -65.6 -34.27 77.84 Favored 'General case' 0 C--O 1.242 0.695 0 CA-C-N 115.431 -0.804 . . . . 0.0 108.969 178.945 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 29' ' ' MET . . . . . 0.476 ' HG2' ' O ' ' A' ' 25' ' ' LYS . 25.0 mmt -75.22 -23.58 57.6 Favored 'General case' 0 C--O 1.202 -1.434 0 CA-C-N 114.844 -1.071 . . . . 0.0 109.488 -178.365 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 30' ' ' GLY . . . . . . . . . . . . . . . -62.45 -40.75 99.48 Favored Glycine 0 N--CA 1.436 -1.325 0 CA-C-N 116.165 -0.471 . . . . 0.0 111.947 -179.678 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 31' ' ' TYR . . . . . 0.494 ' CE1' ' HA ' ' A' ' 28' ' ' GLU . 29.7 p90 -93.29 -35.8 12.89 Favored 'General case' 0 C--N 1.305 -1.367 0 C-N-CA 119.704 -0.799 . . . . 0.0 112.859 179.03 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 32' ' ' TYR . . . . . . . . . . . . . 24.8 m-85 -73.12 -44.54 60.09 Favored 'General case' 0 C--N 1.309 -1.156 0 N-CA-C 114.173 1.175 . . . . 0.0 114.173 178.076 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 33' ' ' CYS . . . . . . . . . . . . . 62.3 m -138.19 60.72 23.42 Favored Pre-proline 0 C--N 1.308 -1.214 0 N-CA-C 111.596 0.221 . . . . 0.0 111.596 -175.602 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 34' ' ' PRO . . . . . 0.477 ' HD2' ' HA ' ' A' ' 5' ' ' ASP . 32.1 Cg_endo -63.22 -29.57 73.61 Favored 'Trans proline' 0 C--N 1.363 1.305 0 C-N-CA 122.008 1.805 . . . . 0.0 112.279 -176.927 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 35' ' ' VAL . . . . . 0.637 ' HB ' ' OD2' ' A' ' 5' ' ' ASP . 43.3 t -87.35 -46.36 16.13 Favored 'Isoleucine or valine' 0 N--CA 1.428 -1.549 0 CA-C-N 116.149 -0.478 . . . . 0.0 111.656 -175.835 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 36' ' ' THR . . . . . . . . . . . . . 22.1 m -65.23 -38.6 90.91 Favored 'General case' 0 C--N 1.315 -0.892 0 CA-C-N 116.119 -0.491 . . . . 0.0 111.228 -178.8 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 37' ' ' CYS . . . . . 0.428 ' SG ' ' HB3' ' A' ' 29' ' ' MET . 76.4 m -84.73 0.99 48.59 Favored 'General case' 0 C--N 1.316 -0.88 0 N-CA-C 112.845 0.683 . . . . 0.0 112.845 -178.978 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 38' ' ' GLY . . . . . . . . . . . . . . . 81.61 21.31 62.16 Favored Glycine 0 N--CA 1.448 -0.533 0 N-CA-C 116.028 1.171 . . . . 0.0 116.028 172.777 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 39' ' ' PHE . . . . . 0.426 ' CD2' ' HA ' ' A' ' 34' ' ' PRO . 97.4 m-85 -73.53 -44.64 57.11 Favored 'General case' 0 CA--C 1.501 -0.904 0 N-CA-C 107.481 -1.303 . . . . 0.0 107.481 175.021 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 40' ' ' CYS . . . . . . . . . . . . . 61.5 m . . . . . 0 C--N 1.295 -1.765 0 CA-C-N 114.237 -1.347 . . . . 0.0 108.088 176.591 . . . . . . . . 0 0 . 1 . 006 nuclear nobuild core ' A' A ' 4' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.429 -1.501 0 N-CA-C 107.487 -1.301 . . . . 0.0 107.487 . . . . . . . . . 0 0 . 1 . 006 nuclear nobuild core ' A' A ' 5' ' ' ASP . . . . . 0.529 ' OD2' ' HB ' ' A' ' 35' ' ' VAL . 11.7 m-20 -65.15 155.63 34.28 Favored 'General case' 0 C--N 1.313 -1.021 0 O-C-N 123.517 0.511 . . . . 0.0 110.476 -179.654 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 0.5 OUTLIER -84.39 151.12 24.89 Favored 'General case' 0 C--N 1.306 -1.317 0 N-CA-C 108.278 -1.008 . . . . 0.0 108.278 179.824 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 7' ' ' LYS . . . . . . . . . . . . . 7.2 ptpp? -85.4 -36.31 20.77 Favored 'General case' 0 C--N 1.316 -0.852 0 N-CA-C 112.89 0.7 . . . . 0.0 112.89 -174.141 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 8' ' ' ASN . . . . . . . . . . . . . 92.3 m-20 -87.12 -29.37 21.88 Favored 'General case' 0 C--N 1.294 -1.825 0 N-CA-C 109.493 -0.558 . . . . 0.0 109.493 -176.58 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 9' ' ' PHE . . . . . . . . . . . . . 29.0 t80 -69.55 137.45 52.43 Favored 'General case' 0 N--CA 1.434 -1.249 0 N-CA-C 108.163 -1.051 . . . . 0.0 108.163 176.861 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 10' ' ' ASP . . . . . . . . . . . . . 45.7 t0 -91.62 92.97 8.71 Favored 'General case' 0 C--N 1.304 -1.394 0 CA-C-O 121.55 0.69 . . . . 0.0 110.082 -178.259 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 11' ' ' CYS . . . . . 0.4 ' SG ' ' HB3' ' A' ' 5' ' ' ASP . 66.3 m -73.08 -34.44 66.23 Favored 'General case' 0 C--N 1.302 -1.491 0 CA-C-N 115.283 -0.871 . . . . 0.0 111.114 -179.108 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 12' ' ' ARG . . . . . . . . . . . . . 21.9 mmt180 -69.03 -49.69 55.37 Favored 'General case' 0 CA--C 1.516 -0.364 0 CA-C-O 120.88 0.371 . . . . 0.0 111.045 -175.761 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 8.7 ttp180 -66.36 -41.26 89.75 Favored 'General case' 0 C--N 1.309 -1.176 0 CA-C-N 116.12 -0.491 . . . . 0.0 110.971 179.637 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 14' ' ' SER . . . . . . . . . . . . . 50.2 m -60.92 -36.46 79.37 Favored 'General case' 0 C--O 1.251 1.156 0 CA-C-O 121.538 0.685 . . . . 0.0 110.594 177.429 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 54.8 tp -66.27 -43.55 86.09 Favored 'General case' 0 C--N 1.325 -0.488 0 CA-C-N 115.478 -0.783 . . . . 0.0 109.975 177.568 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 16' ' ' ARG . . . . . . . . . . . . . 81.7 mtp180 -69.63 -32.99 71.99 Favored 'General case' 0 C--N 1.315 -0.926 0 CA-C-N 116.175 -0.466 . . . . 0.0 112.239 178.965 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 17' ' ' ASN . . . . . . . . . . . . . 88.0 m-20 -68.43 -47.4 67.3 Favored 'General case' 0 CA--C 1.501 -0.911 0 CA-C-O 121.663 0.744 . . . . 0.0 110.547 -179.394 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . 123.66 11.89 4.79 Favored Glycine 0 N--CA 1.429 -1.788 0 N-CA-C 110.67 -0.972 . . . . 0.0 110.67 -174.655 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 19' ' ' ASP . . . . . . . . . . . . . 32.4 m-20 -71.09 -33.0 69.77 Favored 'General case' 0 CA--C 1.505 -0.786 0 N-CA-C 108.861 -0.792 . . . . 0.0 108.861 179.512 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 20' ' ' CYS . . . . . . . . . . . . . 53.4 t -82.81 0.24 44.77 Favored 'General case' 0 C--N 1.31 -1.12 0 CA-C-N 114.589 -1.187 . . . . 0.0 110.345 -178.084 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 21' ' ' ASP . . . . . . . . . . . . . 20.9 t70 -115.85 -10.49 11.68 Favored 'General case' 0 C--N 1.315 -0.932 0 CA-C-N 115.716 -0.674 . . . . 0.0 109.604 178.502 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 22' ' ' ASN . . . . . 0.459 ' O ' ' HG ' ' A' ' 26' ' ' LEU . 37.3 t-20 -87.8 121.78 30.64 Favored 'General case' 0 C--N 1.319 -0.758 0 CA-C-N 115.832 -0.622 . . . . 0.0 110.408 -177.057 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 23' ' ' ASP . . . . . . . . . . . . . 28.6 t70 -50.77 -46.67 59.59 Favored 'General case' 0 C--N 1.317 -0.806 0 C-N-CA 124.821 1.248 . . . . 0.0 113.379 -177.726 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 48.6 m-20 -64.66 -36.13 83.26 Favored 'General case' 0 N--CA 1.476 0.839 0 CA-C-O 121.365 0.602 . . . . 0.0 110.485 -177.927 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 25' ' ' LYS . . . . . . . . . . . . . 13.7 mptt -84.65 -12.38 54.05 Favored 'General case' 0 C--N 1.311 -1.078 0 CA-C-N 115.334 -0.848 . . . . 0.0 112.663 -175.946 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 26' ' ' LEU . . . . . 0.459 ' HG ' ' O ' ' A' ' 22' ' ' ASN . 74.7 mt -58.04 -36.08 72.23 Favored 'General case' 0 C--O 1.22 -0.496 0 N-CA-C 112.264 0.468 . . . . 0.0 112.264 -178.206 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 27' ' ' LEU . . . . . . . . . . . . . 26.2 tp -57.09 -50.64 72.15 Favored 'General case' 0 N--CA 1.437 -1.119 0 N-CA-C 109.906 -0.405 . . . . 0.0 109.906 176.899 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 28' ' ' GLU . . . . . 0.518 ' HA ' ' CE1' ' A' ' 31' ' ' TYR . 43.8 tt0 -64.48 -31.6 72.88 Favored 'General case' 0 C--O 1.244 0.781 0 CA-C-N 115.483 -0.781 . . . . 0.0 109.824 -179.742 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 29' ' ' MET . . . . . 0.408 ' HA ' ' CE ' ' A' ' 29' ' ' MET . 0.3 OUTLIER -73.4 -30.68 63.42 Favored 'General case' 0 C--O 1.207 -1.14 0 CA-C-N 115.009 -0.996 . . . . 0.0 109.84 -177.752 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' A' A ' 30' ' ' GLY . . . . . . . . . . . . . . . -65.15 -29.35 75.11 Favored Glycine 0 N--CA 1.444 -0.779 0 O-C-N 123.621 0.576 . . . . 0.0 112.886 -179.262 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 31' ' ' TYR . . . . . 0.518 ' CE1' ' HA ' ' A' ' 28' ' ' GLU 0.266 39.9 p90 -100.09 -37.51 8.93 Favored 'General case' 0 N--CA 1.438 -1.074 0 N-CA-C 113.791 1.034 . . . . 0.0 113.791 178.432 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' A' A ' 32' ' ' TYR . . . . . . . . . . . . . 29.2 m-85 -74.26 -48.56 27.84 Favored 'General case' 0 C--N 1.303 -1.415 0 N-CA-C 113.765 1.024 . . . . 0.0 113.765 177.472 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 33' ' ' CYS . . . . . . . . . . . . . 36.3 m -135.52 66.78 65.4 Favored Pre-proline 0 C--N 1.308 -1.234 0 C-N-CA 120.436 -0.505 . . . . 0.0 110.871 -177.024 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 34' ' ' PRO . . . . . 0.461 ' HD2' ' HA ' ' A' ' 5' ' ' ASP . 46.7 Cg_endo -65.99 -24.77 52.48 Favored 'Trans proline' 0 C--N 1.362 1.285 0 C-N-CA 122.404 2.07 . . . . 0.0 112.135 -176.624 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 35' ' ' VAL . . . . . 0.529 ' HB ' ' OD2' ' A' ' 5' ' ' ASP . 54.7 t -86.59 -46.87 16.45 Favored 'Isoleucine or valine' 0 C--N 1.302 -1.494 0 C-N-CA 120.479 -0.489 . . . . 0.0 110.787 -177.16 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 36' ' ' THR . . . . . . . . . . . . . 30.8 m -56.75 -39.57 74.23 Favored 'General case' 0 CA--C 1.55 0.946 0 CA-C-O 121.343 0.592 . . . . 0.0 111.587 179.986 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 37' ' ' CYS . . . . . . . . . . . . . 94.7 m -88.73 4.35 47.7 Favored 'General case' 0 C--N 1.309 -1.156 0 N-CA-C 113.251 0.834 . . . . 0.0 113.251 179.239 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 38' ' ' GLY . . . . . . . . . . . . . . . 72.12 35.89 60.64 Favored Glycine 0 C--O 1.222 -0.596 0 N-CA-C 115.599 0.999 . . . . 0.0 115.599 174.375 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 39' ' ' PHE . . . . . . . . . . . . . 98.4 m-85 -86.77 -37.59 17.7 Favored 'General case' 0 C--N 1.311 -1.108 0 N-CA-C 107.713 -1.218 . . . . 0.0 107.713 174.361 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 40' ' ' CYS . . . . . . . . . . . . . 69.3 m . . . . . 0 C--N 1.304 -1.407 0 CA-C-N 114.167 -1.378 . . . . 0.0 108.775 179.762 . . . . . . . . 0 0 . 1 . 007 nuclear nobuild core ' A' A ' 4' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.437 -1.106 0 N-CA-C 109.595 -0.52 . . . . 0.0 109.595 . . . . . . . . . 0 0 . 1 . 007 nuclear nobuild core ' A' A ' 5' ' ' ASP . . . . . 0.531 ' HB3' ' SG ' ' A' ' 11' ' ' CYS . 23.7 m-20 -58.83 143.18 48.24 Favored 'General case' 0 C--N 1.314 -0.971 0 O-C-N 124.05 0.843 . . . . 0.0 111.81 178.461 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 10.0 tp10 -70.59 135.67 48.64 Favored 'General case' 0 N--CA 1.443 -0.818 0 C-N-CA 123.495 0.718 . . . . 0.0 110.312 178.004 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 7' ' ' LYS . . . . . . . . . . . . . 9.9 ptpp? -85.71 -20.66 29.01 Favored 'General case' 0 C--N 1.314 -0.977 0 CA-C-O 121.386 0.612 . . . . 0.0 111.041 -178.741 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 8' ' ' ASN . . . . . . . . . . . . . 13.7 m120 -86.71 16.83 4.38 Favored 'General case' 0 C--N 1.311 -1.07 0 CA-C-O 121.789 0.804 . . . . 0.0 110.157 -179.193 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 9' ' ' PHE . . . . . 0.454 ' HD1' ' SG ' ' A' ' 33' ' ' CYS . 36.8 t80 -144.87 144.09 30.93 Favored 'General case' 0 N--CA 1.418 -2.03 0 N-CA-C 105.633 -1.988 . . . . 0.0 105.633 -178.425 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 10' ' ' ASP . . . . . . . . . . . . . 19.7 t70 -100.51 102.62 13.84 Favored 'General case' 0 C--N 1.313 -0.986 0 C-N-CA 118.941 -1.104 . . . . 0.0 110.603 178.088 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 11' ' ' CYS . . . . . 0.531 ' SG ' ' HB3' ' A' ' 5' ' ' ASP . 60.8 m -66.09 -31.79 72.86 Favored 'General case' 0 C--N 1.294 -1.814 0 CA-C-N 114.083 -1.417 . . . . 0.0 112.776 -175.711 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 12' ' ' ARG . . . . . . . . . . . . . 37.6 mmt180 -66.0 -50.46 64.18 Favored 'General case' 0 CA--C 1.514 -0.416 0 N-CA-C 109.711 -0.477 . . . . 0.0 109.711 179.684 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 38.6 ttm180 -53.51 -56.45 16.9 Favored 'General case' 0 C--N 1.322 -0.622 0 C-N-CA 124.741 1.216 . . . . 0.0 111.775 -178.24 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 14' ' ' SER . . . . . . . . . . . . . 20.1 m -61.22 -35.15 76.44 Favored 'General case' 0 C--O 1.249 1.066 0 CA-C-O 120.948 0.404 . . . . 0.0 111.818 -178.101 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 1.3 tm? -68.65 -41.42 79.37 Favored 'General case' 0 CA--C 1.544 0.72 0 N-CA-C 108.098 -1.075 . . . . 0.0 108.098 179.439 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 16' ' ' ARG . . . . . . . . . . . . . 73.8 mtp180 -64.19 -45.99 85.94 Favored 'General case' 0 N--CA 1.467 0.416 0 CA-C-N 115.546 -0.752 . . . . 0.0 111.702 178.593 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 17' ' ' ASN . . . . . . . . . . . . . 73.3 m-20 -61.09 -33.63 73.66 Favored 'General case' 0 N--CA 1.485 1.305 0 CA-C-O 121.652 0.739 . . . . 0.0 110.942 -178.734 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . 103.29 19.07 13.03 Favored Glycine 0 N--CA 1.429 -1.824 0 N-CA-C 110.027 -1.229 . . . . 0.0 110.027 -178.06 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 19' ' ' ASP . . . . . . . . . . . . . 52.6 m-20 -70.04 -28.59 65.59 Favored 'General case' 0 C--O 1.213 -0.827 0 CA-C-O 120.85 0.357 . . . . 0.0 110.549 -178.403 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 20' ' ' CYS . . . . . 0.423 ' HA ' ' HG3' ' A' ' 29' ' ' MET . 23.8 t -84.26 -5.28 59.24 Favored 'General case' 0 C--N 1.317 -0.835 0 CA-C-O 121.578 0.704 . . . . 0.0 109.697 -179.173 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 21' ' ' ASP . . . . . . . . . . . . . 29.7 t70 -98.55 -11.24 22.39 Favored 'General case' 0 C--N 1.314 -0.964 0 N-CA-C 108.686 -0.857 . . . . 0.0 108.686 175.016 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 22' ' ' ASN . . . . . . . . . . . . . 35.5 t30 -88.54 123.64 33.24 Favored 'General case' 0 C--N 1.316 -0.856 0 CA-C-N 115.241 -0.89 . . . . 0.0 110.042 179.242 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 23' ' ' ASP . . . . . 0.467 ' HA ' ' HG ' ' A' ' 26' ' ' LEU . 21.7 t70 -58.68 -36.72 74.66 Favored 'General case' 0 C--N 1.323 -0.581 0 C-N-CA 122.969 0.507 . . . . 0.0 111.957 -178.163 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 27.2 t70 -62.97 -24.81 68.07 Favored 'General case' 0 N--CA 1.475 0.799 0 CA-C-N 115.969 -0.559 . . . . 0.0 111.732 179.5 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 25' ' ' LYS . . . . . . . . . . . . . 69.3 mmtt -111.96 10.24 20.54 Favored 'General case' 0 N--CA 1.442 -0.852 0 N-CA-C 113.101 0.778 . . . . 0.0 113.101 -177.807 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 26' ' ' LEU . . . . . 0.467 ' HG ' ' HA ' ' A' ' 23' ' ' ASP . 65.9 mt -62.76 -46.56 87.49 Favored 'General case' 0 C--N 1.314 -0.941 0 N-CA-C 112.886 0.698 . . . . 0.0 112.886 -179.929 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 27' ' ' LEU . . . . . 0.407 HD22 ' H ' ' A' ' 27' ' ' LEU . 2.7 mm? -65.13 -42.69 93.64 Favored 'General case' 0 CA--C 1.48 -1.714 0 N-CA-C 108.508 -0.923 . . . . 0.0 108.508 -179.237 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 28' ' ' GLU . . . . . 0.527 ' HA ' ' CE1' ' A' ' 31' ' ' TYR . 38.6 tt0 -58.45 -36.97 74.49 Favored 'General case' 0 N--CA 1.442 -0.848 0 O-C-N 124.346 1.029 . . . . 0.0 109.932 -179.492 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 29' ' ' MET . . . . . 0.423 ' HG3' ' HA ' ' A' ' 20' ' ' CYS . 78.2 mmm -80.33 -27.6 38.33 Favored 'General case' 0 N--CA 1.429 -1.512 0 CA-C-N 115.936 -0.575 . . . . 0.0 111.216 -178.204 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 30' ' ' GLY . . . . . . . . . . . . . . . -75.33 -44.64 21.62 Favored Glycine 0 N--CA 1.43 -1.708 0 CA-C-N 115.526 -0.761 . . . . 0.0 111.673 178.065 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 31' ' ' TYR . . . . . 0.527 ' CE1' ' HA ' ' A' ' 28' ' ' GLU 0.265 12.9 p90 -77.58 -32.33 53.62 Favored 'General case' 0 N--CA 1.436 -1.153 0 C-N-CA 119.592 -0.843 . . . . 0.0 113.166 -179.346 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' A' A ' 32' ' ' TYR . . . . . . . . . . . . . 22.6 m-85 -79.07 -54.36 6.09 Favored 'General case' 0 C--N 1.301 -1.505 0 N-CA-C 113.223 0.823 . . . . 0.0 113.223 175.409 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 33' ' ' CYS . . . . . 0.454 ' SG ' ' HD1' ' A' ' 9' ' ' PHE . 53.4 m -129.11 71.68 81.99 Favored Pre-proline 0 C--O 1.264 1.839 0 C-N-CA 120.152 -0.619 . . . . 0.0 111.956 -174.45 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 34' ' ' PRO . . . . . 0.485 ' HB2' ' SG ' ' A' ' 40' ' ' CYS . 48.7 Cg_endo -66.52 -25.91 47.58 Favored 'Trans proline' 0 C--N 1.362 1.285 0 C-N-CA 122.69 2.26 . . . . 0.0 112.163 -176.201 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 35' ' ' VAL . . . . . 0.504 ' HB ' ' OD1' ' A' ' 5' ' ' ASP . 22.0 t -87.04 -40.79 14.24 Favored 'Isoleucine or valine' 0 N--CA 1.425 -1.712 0 CA-C-N 116.162 -0.472 . . . . 0.0 110.844 -176.822 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 36' ' ' THR . . . . . . . . . . . . . 58.9 m -58.1 -43.65 87.21 Favored 'General case' 0 C--N 1.321 -0.662 0 C-N-CA 123.3 0.64 . . . . 0.0 112.097 -179.618 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 37' ' ' CYS . . . . . 0.549 ' HB2' ' CE2' ' A' ' 39' ' ' PHE . 88.7 m -87.51 6.76 32.56 Favored 'General case' 0 C--N 1.313 -0.991 0 C-N-CA 119.696 -0.802 . . . . 0.0 112.007 179.433 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 38' ' ' GLY . . . . . . . . . . . . . . . 64.43 45.91 91.92 Favored Glycine 0 N--CA 1.439 -1.158 0 CA-C-N 116.32 -0.4 . . . . 0.0 114.068 177.045 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 39' ' ' PHE . . . . . 0.549 ' CE2' ' HB2' ' A' ' 37' ' ' CYS . 98.2 m-85 -85.68 -49.89 7.62 Favored 'General case' 0 CA--C 1.498 -1.022 0 N-CA-C 107.247 -1.39 . . . . 0.0 107.247 173.805 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 40' ' ' CYS . . . . . 0.485 ' SG ' ' HB2' ' A' ' 34' ' ' PRO . 25.3 p . . . . . 0 N--CA 1.424 -1.744 0 CA-C-N 114.771 -1.104 . . . . 0.0 109.528 177.013 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 4' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.442 -0.832 0 N-CA-C 109.497 -0.557 . . . . 0.0 109.497 . . . . . . . . . 0 0 . 1 . 008 nuclear nobuild core ' A' A ' 5' ' ' ASP . . . . . 0.556 ' HB3' ' SG ' ' A' ' 11' ' ' CYS . 24.0 m-20 -65.49 149.56 49.83 Favored 'General case' 0 C--O 1.248 1.02 0 N-CA-C 108.887 -0.783 . . . . 0.0 108.887 174.683 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 10.8 tp10 -70.03 130.7 42.87 Favored 'General case' 0 C--N 1.301 -1.538 0 N-CA-C 109.409 -0.589 . . . . 0.0 109.409 178.734 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 7' ' ' LYS . . . . . . . . . . . . . 10.8 ptpp? -85.51 -20.02 30.32 Favored 'General case' 0 C--N 1.321 -0.653 0 CA-C-O 121.097 0.475 . . . . 0.0 110.895 -176.845 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 8' ' ' ASN . . . . . . . . . . . . . 89.2 m-20 -84.49 2.64 40.05 Favored 'General case' 0 C--N 1.316 -0.859 0 CA-C-N 115.465 -0.789 . . . . 0.0 110.053 179.16 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 9' ' ' PHE . . . . . . . . . . . . . 45.4 t80 -127.95 154.25 45.78 Favored 'General case' 0 C--N 1.303 -1.433 0 N-CA-C 107.773 -1.195 . . . . 0.0 107.773 -174.986 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 10' ' ' ASP . . . . . . . . . . . . . 9.3 t70 -104.9 101.26 10.85 Favored 'General case' 0 CA--C 1.493 -1.234 0 C-N-CA 118.624 -1.23 . . . . 0.0 110.647 178.195 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 11' ' ' CYS . . . . . 0.556 ' SG ' ' HB3' ' A' ' 5' ' ' ASP . 92.4 m -72.8 -25.52 61.18 Favored 'General case' 0 C--N 1.286 -2.163 0 CA-C-N 115.34 -0.845 . . . . 0.0 112.615 -178.286 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 12' ' ' ARG . . . . . 0.546 ' O ' ' HG2' ' A' ' 16' ' ' ARG . 28.0 mmm180 -70.07 -53.41 17.58 Favored 'General case' 0 C--N 1.318 -0.803 0 N-CA-C 110.045 -0.354 . . . . 0.0 110.045 -178.406 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 43.9 ttp180 -63.13 -37.49 87.4 Favored 'General case' 0 C--N 1.309 -1.166 0 CA-C-N 115.951 -0.568 . . . . 0.0 110.133 179.464 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 14' ' ' SER . . . . . . . . . . . . . 49.6 m -63.61 -32.79 74.37 Favored 'General case' 0 C--O 1.246 0.905 0 CA-C-O 121.261 0.553 . . . . 0.0 110.977 177.258 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 53.6 tp -70.94 -40.73 71.88 Favored 'General case' 0 N--CA 1.442 -0.845 0 N-CA-C 109.177 -0.675 . . . . 0.0 109.177 177.611 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 16' ' ' ARG . . . . . 0.546 ' HG2' ' O ' ' A' ' 12' ' ' ARG . 31.4 mmm180 -70.04 -33.76 72.38 Favored 'General case' 0 C--N 1.314 -0.971 0 CA-C-N 115.546 -0.752 . . . . 0.0 111.193 -178.942 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 17' ' ' ASN . . . . . . . . . . . . . 89.6 m-20 -71.05 -39.14 72.43 Favored 'General case' 0 CA--C 1.489 -1.376 0 CA-C-O 121.522 0.677 . . . . 0.0 110.428 -179.864 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . 114.02 8.61 17.39 Favored Glycine 0 N--CA 1.426 -1.973 0 CA-C-N 114.833 -1.076 . . . . 0.0 111.016 -177.178 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 19' ' ' ASP . . . . . . . . . . . . . 59.9 m-20 -66.92 -38.13 85.63 Favored 'General case' 0 CA--C 1.502 -0.883 0 CA-C-O 121.235 0.541 . . . . 0.0 109.893 -179.406 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 20' ' ' CYS . . . . . . . . . . . . . 42.7 t -73.32 -13.42 61.11 Favored 'General case' 0 C--N 1.311 -1.068 0 CA-C-N 114.997 -1.001 . . . . 0.0 110.752 -178.945 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 21' ' ' ASP . . . . . . . . . . . . . 27.6 t70 -109.78 -4.48 16.04 Favored 'General case' 0 C--N 1.313 -1.019 0 CA-C-O 121.893 0.854 . . . . 0.0 110.46 179.043 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 22' ' ' ASN . . . . . . . . . . . . . 39.8 t-20 -77.64 116.33 18.11 Favored 'General case' 0 C--N 1.314 -0.946 0 N-CA-C 109.2 -0.667 . . . . 0.0 109.2 -178.363 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 23' ' ' ASP . . . . . 0.411 ' HA ' ' HG ' ' A' ' 26' ' ' LEU . 17.6 m-20 -56.99 -43.82 82.09 Favored 'General case' 0 C--N 1.321 -0.642 0 CA-C-N 115.088 -0.96 . . . . 0.0 112.202 -174.611 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 33.7 t70 -66.33 -31.35 72.09 Favored 'General case' 0 C--N 1.324 -0.529 0 CA-C-O 121.023 0.439 . . . . 0.0 111.085 -178.156 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 25' ' ' LYS . . . . . 0.428 ' O ' ' HG2' ' A' ' 29' ' ' MET . 54.3 mtpt -95.89 -4.45 43.54 Favored 'General case' 0 C--O 1.209 -1.048 0 N-CA-C 112.386 0.513 . . . . 0.0 112.386 -177.555 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 26' ' ' LEU . . . . . 0.411 ' HG ' ' HA ' ' A' ' 23' ' ' ASP . 55.6 mt -48.3 -46.83 36.65 Favored 'General case' 0 N--CA 1.483 1.219 0 N-CA-C 114.705 1.372 . . . . 0.0 114.705 -178.602 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 27' ' ' LEU . . . . . . . . . . . . . 22.3 tp -59.17 -45.31 91.33 Favored 'General case' 0 N--CA 1.446 -0.67 0 CA-C-O 121.286 0.565 . . . . 0.0 110.018 178.954 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 28' ' ' GLU . . . . . 0.625 ' HA ' ' CE1' ' A' ' 31' ' ' TYR . 35.2 tt0 -64.04 -35.47 80.82 Favored 'General case' 0 N--CA 1.444 -0.743 0 CA-C-N 114.791 -1.095 . . . . 0.0 109.55 179.696 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 29' ' ' MET . . . . . 0.428 ' HG2' ' O ' ' A' ' 25' ' ' LYS . 79.6 mmm -78.31 -19.42 53.59 Favored 'General case' 0 C--N 1.302 -1.486 0 CA-C-N 114.803 -1.09 . . . . 0.0 110.205 -177.626 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 30' ' ' GLY . . . . . 0.437 ' HA2' ' CE1' ' A' ' 39' ' ' PHE . . . -71.46 -22.27 78.62 Favored Glycine 0 N--CA 1.436 -1.367 0 CA-C-N 115.01 -0.995 . . . . 0.0 111.996 177.762 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 31' ' ' TYR . . . . . 0.625 ' CE1' ' HA ' ' A' ' 28' ' ' GLU . 27.6 p90 -104.54 -34.67 8.13 Favored 'General case' 0 N--CA 1.436 -1.152 0 C-N-CA 119.609 -0.836 . . . . 0.0 112.383 174.82 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 32' ' ' TYR . . . . . . . . . . . . . 37.4 m-85 -67.34 -47.99 68.85 Favored 'General case' 0 C--N 1.309 -1.186 0 CA-C-N 115.918 -0.583 . . . . 0.0 112.179 174.379 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 33' ' ' CYS . . . . . 0.469 ' HB3' ' HB ' ' A' ' 36' ' ' THR . 35.3 m -140.39 64.7 25.4 Favored Pre-proline 0 C--N 1.306 -1.313 0 C-N-CA 120.355 -0.538 . . . . 0.0 111.667 -177.356 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 34' ' ' PRO . . . . . 0.508 ' HD2' ' HA ' ' A' ' 5' ' ' ASP . 31.1 Cg_endo -63.21 -27.63 72.68 Favored 'Trans proline' 0 C--N 1.366 1.489 0 C-N-CA 122.562 2.174 . . . . 0.0 111.817 -178.92 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 35' ' ' VAL . . . . . 0.431 ' HB ' ' OD2' ' A' ' 5' ' ' ASP . 57.8 t -84.9 -47.25 17.22 Favored 'Isoleucine or valine' 0 N--CA 1.419 -1.977 0 CA-C-N 115.473 -0.785 . . . . 0.0 110.255 -176.178 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 36' ' ' THR . . . . . 0.469 ' HB ' ' HB3' ' A' ' 33' ' ' CYS . 23.8 m -59.9 -42.9 94.85 Favored 'General case' 0 C--N 1.317 -0.843 0 CA-C-N 115.859 -0.61 . . . . 0.0 111.248 179.71 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 37' ' ' CYS . . . . . . . . . . . . . 77.9 m -79.05 -8.13 58.69 Favored 'General case' 0 C--N 1.319 -0.749 0 N-CA-C 112.222 0.453 . . . . 0.0 112.222 179.661 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 38' ' ' GLY . . . . . . . . . . . . . . . 77.49 40.08 24.11 Favored Glycine 0 N--CA 1.445 -0.736 0 N-CA-C 114.985 0.754 . . . . 0.0 114.985 174.54 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 39' ' ' PHE . . . . . 0.437 ' CE1' ' HA2' ' A' ' 30' ' ' GLY . 87.3 m-85 -78.35 -32.14 48.94 Favored 'General case' 0 C--N 1.317 -0.843 0 N-CA-C 108.519 -0.919 . . . . 0.0 108.519 175.245 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 40' ' ' CYS . . . . . . . . . . . . . 1.5 p . . . . . 0 C--N 1.303 -1.451 0 CA-C-N 114.224 -1.353 . . . . 0.0 109.658 -178.592 . . . . . . . . 0 0 . 1 . 009 nuclear nobuild core ' A' A ' 4' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.432 -1.357 0 N-CA-C 109.72 -0.474 . . . . 0.0 109.72 . . . . . . . . . 0 0 . 1 . 009 nuclear nobuild core ' A' A ' 5' ' ' ASP . . . . . 0.678 ' HB3' ' SG ' ' A' ' 11' ' ' CYS . 43.9 m-20 -64.32 141.44 58.77 Favored 'General case' 0 C--O 1.25 1.106 0 N-CA-C 108.761 -0.829 . . . . 0.0 108.761 175.777 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -70.44 150.0 46.66 Favored 'General case' 0 C--N 1.307 -1.269 0 CA-C-O 121.497 0.665 . . . . 0.0 110.796 -176.992 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 7' ' ' LYS . . . . . . . . . . . . . 9.2 ptpp? -85.51 -25.36 26.87 Favored 'General case' 0 C--N 1.307 -1.244 0 CA-C-N 115.133 -0.94 . . . . 0.0 111.997 -177.222 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 8' ' ' ASN . . . . . . . . . . . . . 42.5 m-80 -95.12 1.99 55.02 Favored 'General case' 0 C--N 1.31 -1.143 0 CA-C-N 115.849 -0.614 . . . . 0.0 110.592 -178.101 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 9' ' ' PHE . . . . . 0.416 ' CD2' ' HB3' ' A' ' 32' ' ' TYR . 34.1 t80 -121.75 137.32 54.81 Favored 'General case' 0 C--N 1.291 -1.966 0 N-CA-C 107.099 -1.445 . . . . 0.0 107.099 -178.731 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 10' ' ' ASP . . . . . . . . . . . . . 8.8 t70 -94.24 103.09 15.12 Favored 'General case' 0 C--N 1.309 -1.177 0 C-N-CA 119.678 -0.809 . . . . 0.0 109.914 -177.884 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 11' ' ' CYS . . . . . 0.678 ' SG ' ' HB3' ' A' ' 5' ' ' ASP . 73.8 m -75.03 -28.71 60.57 Favored 'General case' 0 C--N 1.293 -1.886 0 CA-C-N 115.312 -0.858 . . . . 0.0 112.985 -175.51 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 12' ' ' ARG . . . . . . . . . . . . . 28.2 mmt180 -73.86 -44.44 55.49 Favored 'General case' 0 C--N 1.317 -0.822 0 N-CA-C 109.069 -0.715 . . . . 0.0 109.069 -178.186 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 38.3 ttm180 -60.89 -46.83 89.07 Favored 'General case' 0 C--N 1.318 -0.761 0 CA-C-N 115.238 -0.892 . . . . 0.0 109.874 178.242 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 14' ' ' SER . . . . . . . . . . . . . 44.7 m -61.37 -34.6 75.59 Favored 'General case' 0 C--N 1.319 -0.752 0 CA-C-N 115.746 -0.661 . . . . 0.0 111.48 179.953 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 50.2 tp -72.72 -44.38 61.78 Favored 'General case' 0 C--N 1.312 -1.059 0 C-N-CA 120.688 -0.405 . . . . 0.0 110.968 179.611 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 16' ' ' ARG . . . . . . . . . . . . . 21.9 mtm180 -70.17 -35.56 74.07 Favored 'General case' 0 C--N 1.314 -0.953 0 CA-C-N 116.006 -0.543 . . . . 0.0 112.449 -177.848 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 17' ' ' ASN . . . . . . . . . . . . . 35.5 m-80 -77.1 -26.04 52.91 Favored 'General case' 0 CA--C 1.498 -1.038 0 CA-C-O 121.056 0.455 . . . . 0.0 111.612 178.68 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . 104.56 7.03 40.34 Favored Glycine 0 N--CA 1.433 -1.56 0 C-N-CA 119.685 -1.245 . . . . 0.0 112.469 178.448 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 19' ' ' ASP . . . . . 0.402 ' O ' ' HB2' ' A' ' 25' ' ' LYS . 6.0 m-20 -64.65 -35.97 82.74 Favored 'General case' 0 CA--C 1.499 -1.0 0 N-CA-C 108.779 -0.823 . . . . 0.0 108.779 178.15 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 20' ' ' CYS . . . . . 0.461 ' HA ' ' HG3' ' A' ' 29' ' ' MET . 39.3 t -57.04 -31.16 64.88 Favored 'General case' 0 C--N 1.315 -0.897 0 CA-C-N 114.667 -1.152 . . . . 0.0 111.606 178.904 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 21' ' ' ASP . . . . . . . . . . . . . 17.8 t70 -106.37 -9.3 16.81 Favored 'General case' 0 C--N 1.316 -0.889 0 CA-C-N 115.812 -0.631 . . . . 0.0 111.388 -176.49 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 22' ' ' ASN . . . . . . . . . . . . . 54.7 t30 -77.17 131.35 38.23 Favored 'General case' 0 C--N 1.311 -1.067 0 O-C-N 122.237 -0.289 . . . . 0.0 110.989 -174.535 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 23' ' ' ASP . . . . . . . . . . . . . 26.7 t70 -51.76 -48.14 63.82 Favored 'General case' 0 N--CA 1.473 0.705 0 C-N-CA 123.958 0.903 . . . . 0.0 113.065 -174.233 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 32.4 t70 -61.79 -22.76 65.72 Favored 'General case' 0 N--CA 1.48 1.046 0 N-CA-C 112.304 0.483 . . . . 0.0 112.304 -179.823 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 25' ' ' LYS . . . . . 0.54 ' O ' ' HG2' ' A' ' 29' ' ' MET . 69.8 mmtt -101.58 -16.27 16.81 Favored 'General case' 0 C--N 1.305 -1.369 0 C-N-CA 120.475 -0.49 . . . . 0.0 111.614 -174.174 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 26' ' ' LEU . . . . . . . . . . . . . 83.3 mt -48.18 -50.32 29.44 Favored 'General case' 0 N--CA 1.475 0.785 0 N-CA-C 115.699 1.74 . . . . 0.0 115.699 -172.395 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 27' ' ' LEU . . . . . . . . . . . . . 1.6 tm? -60.51 -43.5 97.01 Favored 'General case' 0 N--CA 1.448 -0.574 0 N-CA-C 109.026 -0.731 . . . . 0.0 109.026 -178.239 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 28' ' ' GLU . . . . . 0.452 ' HA ' ' CZ ' ' A' ' 31' ' ' TYR . 1.2 mp0 -65.05 -34.88 79.48 Favored 'General case' 0 CA--C 1.503 -0.864 0 CA-C-N 114.926 -1.034 . . . . 0.0 110.442 178.988 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 29' ' ' MET . . . . . 0.54 ' HG2' ' O ' ' A' ' 25' ' ' LYS . 70.9 mmm -70.5 -25.64 63.23 Favored 'General case' 0 C--N 1.316 -0.888 0 CA-C-N 116.107 -0.497 . . . . 0.0 110.552 -177.269 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 30' ' ' GLY . . . . . . . . . . . . . . . -68.3 -25.98 74.41 Favored Glycine 0 N--CA 1.448 -0.538 0 CA-C-N 115.586 -0.734 . . . . 0.0 112.36 -179.851 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 31' ' ' TYR . . . . . 0.452 ' CZ ' ' HA ' ' A' ' 28' ' ' GLU . 25.9 p90 -109.48 -33.79 6.7 Favored 'General case' 0 N--CA 1.441 -0.885 0 N-CA-C 113.354 0.872 . . . . 0.0 113.354 177.655 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 32' ' ' TYR . . . . . 0.416 ' HB3' ' CD2' ' A' ' 9' ' ' PHE . 21.3 m-85 -69.74 -48.04 60.86 Favored 'General case' 0 C--N 1.304 -1.382 0 N-CA-C 112.317 0.488 . . . . 0.0 112.317 176.679 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 33' ' ' CYS . . . . . . . . . . . . . 34.8 m -136.57 69.73 60.06 Favored Pre-proline 0 C--N 1.306 -1.305 0 C-N-CA 119.436 -0.905 . . . . 0.0 111.35 -177.55 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 34' ' ' PRO . . . . . 0.462 ' HD2' ' HA ' ' A' ' 5' ' ' ASP . 56.2 Cg_endo -69.96 -23.5 29.83 Favored 'Trans proline' 0 N--CA 1.448 -1.18 0 C-N-CA 121.977 1.785 . . . . 0.0 111.487 -178.416 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 35' ' ' VAL . . . . . 0.403 ' HB ' ' OD2' ' A' ' 5' ' ' ASP . 41.7 t -87.49 -52.45 11.5 Favored 'Isoleucine or valine' 0 C--N 1.296 -1.758 0 CA-C-N 115.696 -0.684 . . . . 0.0 111.015 -177.966 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 36' ' ' THR . . . . . . . . . . . . . 58.4 m -61.95 -35.38 78.28 Favored 'General case' 0 CA--C 1.55 0.973 0 N-CA-C 112.224 0.453 . . . . 0.0 112.224 -178.203 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 37' ' ' CYS . . . . . . . . . . . . . 92.5 m -90.94 2.99 55.81 Favored 'General case' 0 C--N 1.308 -1.196 0 N-CA-C 113.337 0.866 . . . . 0.0 113.337 179.603 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 38' ' ' GLY . . . . . . . . . . . . . . . 72.25 46.49 34.21 Favored Glycine 0 CA--C 1.525 0.701 0 N-CA-C 115.062 0.785 . . . . 0.0 115.062 175.259 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 39' ' ' PHE . . . . . 0.442 ' CD1' ' HA ' ' A' ' 34' ' ' PRO . 96.4 m-85 -95.09 -43.08 8.28 Favored 'General case' 0 C--N 1.306 -1.313 0 N-CA-C 107.864 -1.162 . . . . 0.0 107.864 173.756 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 40' ' ' CYS . . . . . . . . . . . . . 49.5 t . . . . . 0 N--CA 1.429 -1.505 0 CA-C-N 114.449 -1.25 . . . . 0.0 108.33 -178.613 . . . . . . . . 0 0 . 1 . 010 nuclear nobuild core ' A' A ' 4' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.433 -1.297 0 CA-C-O 120.481 0.181 . . . . 0.0 110.627 . . . . . . . . . 0 0 . 1 . 010 nuclear nobuild core ' A' A ' 5' ' ' ASP . . . . . 0.413 ' HA ' ' HA ' ' A' ' 33' ' ' CYS . 69.6 m-20 -60.83 147.27 43.34 Favored 'General case' 0 C--N 1.315 -0.916 0 O-C-N 124.009 0.818 . . . . 0.0 110.623 176.773 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 10.7 tp10 -69.02 133.21 47.83 Favored 'General case' 0 C--N 1.308 -1.235 0 CA-C-N 115.922 -0.581 . . . . 0.0 110.058 178.92 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 7' ' ' LYS . . . . . . . . . . . . . 8.8 ptpp? -81.62 -23.55 36.94 Favored 'General case' 0 CA--C 1.512 -0.515 0 CA-C-O 121.298 0.571 . . . . 0.0 110.979 -178.04 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 8' ' ' ASN . . . . . . . . . . . . . 12.7 m120 -86.55 16.8 4.29 Favored 'General case' 0 C--N 1.308 -1.196 0 CA-C-N 115.004 -0.998 . . . . 0.0 110.317 178.594 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 9' ' ' PHE . . . . . . . . . . . . . 0.3 OUTLIER -139.6 138.22 36.0 Favored 'General case' 0 N--CA 1.422 -1.865 0 N-CA-C 105.819 -1.919 . . . . 0.0 105.819 -176.927 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 10' ' ' ASP . . . . . . . . . . . . . 12.3 t70 -104.75 88.71 2.98 Favored 'General case' 0 C--N 1.303 -1.451 0 N-CA-C 108.274 -1.009 . . . . 0.0 108.274 174.518 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 11' ' ' CYS . . . . . . . . . . . . . 95.4 m -79.63 -6.17 56.55 Favored 'General case' 0 C--N 1.301 -1.502 0 N-CA-C 112.732 0.641 . . . . 0.0 112.732 -177.316 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 12' ' ' ARG . . . . . 0.466 ' O ' ' HG2' ' A' ' 16' ' ' ARG . 6.4 mmp_? -65.54 -51.11 62.28 Favored 'General case' 0 N--CA 1.444 -0.753 0 N-CA-C 107.198 -1.408 . . . . 0.0 107.198 173.034 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 58.3 ttp180 -62.0 -44.7 96.18 Favored 'General case' 0 CA--C 1.519 -0.223 0 CA-C-N 115.592 -0.731 . . . . 0.0 110.352 177.135 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 14' ' ' SER . . . . . . . . . . . . . 14.9 m -58.95 -31.73 68.97 Favored 'General case' 0 CA--C 1.543 0.704 0 CA-C-O 120.849 0.357 . . . . 0.0 111.159 178.789 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 15' ' ' LEU . . . . . 0.414 ' HA ' ' HB3' ' A' ' 20' ' ' CYS . 38.8 tp -80.12 -40.14 28.07 Favored 'General case' 0 C--N 1.318 -0.772 0 N-CA-C 110.418 -0.216 . . . . 0.0 110.418 178.921 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 16' ' ' ARG . . . . . 0.466 ' HG2' ' O ' ' A' ' 12' ' ' ARG . 38.8 mmt180 -61.95 -37.9 86.47 Favored 'General case' 0 C--O 1.22 -0.467 0 CA-C-N 115.929 -0.578 . . . . 0.0 110.342 177.121 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 17' ' ' ASN . . . . . . . . . . . . . 0.9 OUTLIER -77.78 -49.97 13.29 Favored 'General case' 0 C--N 1.316 -0.86 0 CA-C-N 115.665 -0.698 . . . . 0.0 111.562 179.884 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . 129.79 -2.05 5.98 Favored Glycine 0 N--CA 1.446 -0.65 0 C-N-CA 120.03 -1.081 . . . . 0.0 112.751 -179.312 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 19' ' ' ASP . . . . . . . . . . . . . 6.2 m-20 -63.11 -37.86 88.87 Favored 'General case' 0 N--CA 1.477 0.897 0 CA-C-O 121.557 0.694 . . . . 0.0 110.237 -179.956 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 20' ' ' CYS . . . . . 0.414 ' HB3' ' HA ' ' A' ' 15' ' ' LEU . 43.8 t -71.3 -9.07 57.53 Favored 'General case' 0 C--N 1.311 -1.071 0 CA-C-N 114.789 -1.096 . . . . 0.0 111.526 -178.699 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 21' ' ' ASP . . . . . . . . . . . . . 32.6 t70 -116.58 -7.67 11.58 Favored 'General case' 0 C--N 1.32 -0.702 0 CA-C-O 121.478 0.656 . . . . 0.0 110.432 -179.768 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 22' ' ' ASN . . . . . . . . . . . . . 33.6 t30 -74.9 118.93 18.41 Favored 'General case' 0 C--N 1.308 -1.201 0 CA-C-N 115.801 -0.636 . . . . 0.0 110.722 -176.563 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 23' ' ' ASP . . . . . . . . . . . . . 11.4 m-20 -52.25 -40.06 61.17 Favored 'General case' 0 N--CA 1.479 0.978 0 C-N-CA 124.396 1.078 . . . . 0.0 111.836 -176.225 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 33.8 t70 -59.29 -38.75 80.95 Favored 'General case' 0 C--N 1.321 -0.652 0 CA-C-N 116.0 -0.546 . . . . 0.0 112.002 -178.692 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 25' ' ' LYS . . . . . 0.465 ' O ' ' HG2' ' A' ' 29' ' ' MET . 72.1 mmtt -100.47 2.11 41.8 Favored 'General case' 0 C--N 1.308 -1.214 0 N-CA-C 112.827 0.677 . . . . 0.0 112.827 -175.659 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 26' ' ' LEU . . . . . 0.401 HD23 ' HA ' ' A' ' 26' ' ' LEU . 55.9 mt -58.3 -35.49 71.92 Favored 'General case' 0 C--O 1.219 -0.525 0 N-CA-C 113.741 1.015 . . . . 0.0 113.741 -176.877 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 27' ' ' LEU . . . . . . . . . . . . . 1.5 tm? -55.31 -51.09 67.82 Favored 'General case' 0 N--CA 1.439 -0.982 0 N-CA-C 108.933 -0.765 . . . . 0.0 108.933 178.748 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 28' ' ' GLU . . . . . 0.548 ' HA ' ' CE2' ' A' ' 31' ' ' TYR . 43.9 mt-10 -64.87 -34.46 78.44 Favored 'General case' 0 CA--C 1.505 -0.752 0 CA-C-N 115.515 -0.766 . . . . 0.0 110.385 -179.704 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 29' ' ' MET . . . . . 0.465 ' HG2' ' O ' ' A' ' 25' ' ' LYS . 72.2 mmm -76.02 -21.82 56.44 Favored 'General case' 0 C--N 1.311 -1.07 0 CA-C-N 115.565 -0.743 . . . . 0.0 111.541 -174.653 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 30' ' ' GLY . . . . . . . . . . . . . . . -68.53 -37.69 85.6 Favored Glycine 0 CA--C 1.5 -0.862 0 C-N-CA 121.008 -0.615 . . . . 0.0 111.728 -179.892 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 31' ' ' TYR . . . . . 0.548 ' CE2' ' HA ' ' A' ' 28' ' ' GLU . 40.2 p90 -91.25 -36.84 13.67 Favored 'General case' 0 N--CA 1.433 -1.304 0 C-N-CA 119.77 -0.772 . . . . 0.0 112.005 177.775 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 32' ' ' TYR . . . . . . . . . . . . . 22.5 m-85 -65.72 -57.77 7.26 Favored 'General case' 0 C--N 1.316 -0.89 0 N-CA-C 113.259 0.837 . . . . 0.0 113.259 177.42 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 33' ' ' CYS . . . . . 0.413 ' HA ' ' HA ' ' A' ' 5' ' ' ASP . 98.5 m -135.05 80.62 47.48 Favored Pre-proline 0 C--N 1.305 -1.362 0 CA-C-O 121.376 0.608 . . . . 0.0 112.429 -177.694 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 34' ' ' PRO . . . . . 0.474 ' HA ' ' CD1' ' A' ' 39' ' ' PHE . 73.5 Cg_endo -72.59 -20.38 23.45 Favored 'Trans proline' 0 N--CA 1.45 -1.083 0 C-N-CA 122.576 2.184 . . . . 0.0 111.616 -178.404 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 35' ' ' VAL . . . . . . . . . . . . . 21.7 t -86.34 -55.93 5.99 Favored 'Isoleucine or valine' 0 C--N 1.295 -1.794 0 C-N-CA 120.431 -0.508 . . . . 0.0 110.178 -177.852 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 36' ' ' THR . . . . . 0.404 HG22 ' SG ' ' A' ' 20' ' ' CYS . 55.4 m -59.98 -40.12 88.04 Favored 'General case' 0 C--N 1.318 -0.79 0 N-CA-C 112.706 0.632 . . . . 0.0 112.706 -179.201 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 37' ' ' CYS . . . . . 0.411 ' SG ' ' HB3' ' A' ' 29' ' ' MET . 71.9 m -86.1 11.2 12.29 Favored 'General case' 0 C--N 1.307 -1.274 0 N-CA-C 113.212 0.819 . . . . 0.0 113.212 -177.429 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 38' ' ' GLY . . . . . . . . . . . . . . . 73.81 40.18 45.62 Favored Glycine 0 C--N 1.33 0.21 0 N-CA-C 115.332 0.893 . . . . 0.0 115.332 172.102 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 39' ' ' PHE . . . . . 0.474 ' CD1' ' HA ' ' A' ' 34' ' ' PRO . 95.5 m-85 -96.43 -37.9 10.25 Favored 'General case' 0 C--N 1.299 -1.62 0 N-CA-C 108.294 -1.002 . . . . 0.0 108.294 174.36 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 40' ' ' CYS . . . . . 0.425 ' SG ' ' HB2' ' A' ' 34' ' ' PRO . 6.5 p . . . . . 0 C--N 1.314 -0.972 0 CA-C-N 114.93 -1.032 . . . . 0.0 109.855 178.352 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 4' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.43 -1.435 0 N-CA-C 109.627 -0.508 . . . . 0.0 109.627 . . . . . . . . . 0 0 . 1 . 011 nuclear nobuild core ' A' A ' 5' ' ' ASP . . . . . 0.563 ' HB3' ' SG ' ' A' ' 11' ' ' CYS . 14.6 m-20 -63.23 145.43 55.53 Favored 'General case' 0 C--N 1.308 -1.207 0 O-C-N 123.9 0.75 . . . . 0.0 110.654 179.8 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 6' ' ' GLU . . . . . 0.41 ' OE2' ' HB2' ' A' ' 8' ' ' ASN . 0.3 OUTLIER -70.21 124.18 23.48 Favored 'General case' 0 C--N 1.306 -1.283 0 N-CA-C 105.495 -2.039 . . . . 0.0 105.495 176.239 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild core ' A' A ' 7' ' ' LYS . . . . . 0.5 ' H ' ' HD2' ' A' ' 7' ' ' LYS . 0.0 OUTLIER -79.19 -21.37 46.47 Favored 'General case' 0 C--N 1.321 -0.639 0 N-CA-C 113.597 0.962 . . . . 0.0 113.597 -170.687 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild core ' A' A ' 8' ' ' ASN . . . . . 0.41 ' HB2' ' OE2' ' A' ' 6' ' ' GLU . 32.7 m-80 -81.7 -23.03 37.05 Favored 'General case' 0 C--N 1.304 -1.407 0 N-CA-C 108.873 -0.788 . . . . 0.0 108.873 -178.964 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 9' ' ' PHE . . . . . . . . . . . . . 28.7 t80 -81.67 142.32 32.82 Favored 'General case' 0 N--CA 1.428 -1.54 0 CA-C-N 114.593 -1.185 . . . . 0.0 108.362 178.524 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 10' ' ' ASP . . . . . . . . . . . . . 8.9 t70 -92.18 97.14 10.72 Favored 'General case' 0 C--N 1.305 -1.346 0 C-N-CA 118.856 -1.137 . . . . 0.0 109.018 178.759 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 11' ' ' CYS . . . . . 0.563 ' SG ' ' HB3' ' A' ' 5' ' ' ASP . 72.8 m -73.83 -23.06 59.59 Favored 'General case' 0 C--N 1.297 -1.682 0 CA-C-N 115.231 -0.895 . . . . 0.0 111.546 -177.23 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 12' ' ' ARG . . . . . . . . . . . . . 19.9 mmm180 -74.19 -44.56 52.9 Favored 'General case' 0 C--N 1.325 -0.473 0 N-CA-C 109.354 -0.61 . . . . 0.0 109.354 -177.235 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 58.2 ttp180 -56.32 -49.12 75.24 Favored 'General case' 0 C--N 1.321 -0.66 0 C-N-CA 124.253 1.021 . . . . 0.0 108.597 176.083 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 14' ' ' SER . . . . . . . . . . . . . 20.7 m -60.38 -32.73 71.58 Favored 'General case' 0 C--N 1.313 -1.008 0 CA-C-N 114.794 -1.093 . . . . 0.0 111.911 -179.35 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 15' ' ' LEU . . . . . 0.483 ' HA ' ' HB3' ' A' ' 20' ' ' CYS . 29.9 tp -78.08 -39.32 41.93 Favored 'General case' 0 C--N 1.309 -1.174 0 O-C-N 121.973 -0.455 . . . . 0.0 110.559 179.765 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 16' ' ' ARG . . . . . . . . . . . . . 66.6 mtt180 -70.04 -35.93 74.66 Favored 'General case' 0 C--N 1.316 -0.873 0 CA-C-N 115.874 -0.603 . . . . 0.0 111.88 179.663 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 17' ' ' ASN . . . . . . . . . . . . . 95.0 m-20 -70.86 -44.13 67.03 Favored 'General case' 0 CA--C 1.495 -1.136 0 CA-C-O 121.662 0.744 . . . . 0.0 109.533 178.688 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . 118.82 2.65 14.25 Favored Glycine 0 N--CA 1.424 -2.13 0 CA-C-N 114.556 -1.202 . . . . 0.0 110.948 -177.144 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 19' ' ' ASP . . . . . . . . . . . . . 28.0 m-20 -60.16 -41.65 93.27 Favored 'General case' 0 N--CA 1.484 1.256 0 CA-C-O 122.354 1.073 . . . . 0.0 108.518 -179.893 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 20' ' ' CYS . . . . . 0.483 ' HB3' ' HA ' ' A' ' 15' ' ' LEU . 43.2 t -79.6 -3.18 45.9 Favored 'General case' 0 C--N 1.302 -1.46 0 CA-C-N 113.689 -1.596 . . . . 0.0 111.056 -176.548 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 21' ' ' ASP . . . . . . . . . . . . . 32.1 t70 -121.93 -9.75 8.73 Favored 'General case' 0 C--N 1.312 -1.06 0 CA-C-O 121.445 0.641 . . . . 0.0 110.626 -176.275 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 22' ' ' ASN . . . . . 0.437 ' O ' ' HG ' ' A' ' 26' ' ' LEU . 55.0 t-20 -87.26 125.04 33.96 Favored 'General case' 0 C--N 1.31 -1.13 0 N-CA-C 108.909 -0.775 . . . . 0.0 108.909 -177.542 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 23' ' ' ASP . . . . . . . . . . . . . 28.8 t70 -55.22 -36.77 66.33 Favored 'General case' 0 C--N 1.318 -0.767 0 C-N-CA 124.165 0.986 . . . . 0.0 111.782 -179.658 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 31.6 t70 -68.45 -29.51 68.17 Favored 'General case' 0 C--N 1.316 -0.877 0 CA-C-N 115.951 -0.568 . . . . 0.0 111.516 -178.368 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 25' ' ' LYS . . . . . . . . . . . . . 13.2 mptt -100.02 1.55 42.57 Favored 'General case' 0 C--N 1.316 -0.89 0 CA-C-N 116.079 -0.509 . . . . 0.0 112.336 -178.018 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 26' ' ' LEU . . . . . 0.437 ' HG ' ' O ' ' A' ' 22' ' ' ASN . 59.3 mt -62.89 -38.36 90.62 Favored 'General case' 0 C--O 1.214 -0.787 0 N-CA-C 114.737 1.384 . . . . 0.0 114.737 -175.262 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 27' ' ' LEU . . . . . . . . . . . . . 2.0 tm? -59.95 -47.24 86.62 Favored 'General case' 0 N--CA 1.441 -0.921 0 N-CA-C 108.607 -0.886 . . . . 0.0 108.607 -179.285 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 28' ' ' GLU . . . . . 0.58 ' HA ' ' CZ ' ' A' ' 31' ' ' TYR . 34.0 tt0 -64.81 -35.63 81.71 Favored 'General case' 0 C--N 1.311 -1.105 0 CA-C-N 115.401 -0.818 . . . . 0.0 110.139 179.708 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 29' ' ' MET . . . . . 0.511 ' HB3' ' SG ' ' A' ' 37' ' ' CYS . 76.1 mmm -82.64 -12.17 57.84 Favored 'General case' 0 C--N 1.3 -1.563 0 CA-C-N 115.477 -0.783 . . . . 0.0 111.897 -175.03 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 30' ' ' GLY . . . . . . . . . . . . . . . -75.35 -36.96 43.09 Favored Glycine 0 C--N 1.307 -1.037 0 N-CA-C 111.113 -0.795 . . . . 0.0 111.113 177.77 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 31' ' ' TYR . . . . . 0.58 ' CZ ' ' HA ' ' A' ' 28' ' ' GLU . 24.8 p90 -84.78 -27.98 26.5 Favored 'General case' 0 N--CA 1.441 -0.914 0 C-N-CA 119.681 -0.808 . . . . 0.0 112.24 176.408 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 32' ' ' TYR . . . . . . . . . . . . . 30.6 m-85 -77.43 -61.38 2.01 Favored 'General case' 0 C--N 1.295 -1.799 0 N-CA-C 113.737 1.014 . . . . 0.0 113.737 174.961 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 33' ' ' CYS . . . . . . . . . . . . . 31.4 m -132.58 72.86 77.38 Favored Pre-proline 0 C--N 1.303 -1.441 0 C-N-CA 119.734 -0.786 . . . . 0.0 111.466 -175.308 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 34' ' ' PRO . . . . . 0.534 ' HD2' ' HA ' ' A' ' 5' ' ' ASP . 34.6 Cg_endo -62.48 -26.86 76.58 Favored 'Trans proline' 0 C--N 1.363 1.304 0 C-N-CA 122.703 2.269 . . . . 0.0 112.323 -178.549 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 35' ' ' VAL . . . . . . . . . . . . . 38.5 t -85.92 -49.68 15.06 Favored 'Isoleucine or valine' 0 C--N 1.296 -1.754 0 C-N-CA 120.133 -0.627 . . . . 0.0 110.472 -177.45 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 36' ' ' THR . . . . . . . . . . . . . 20.9 m -58.94 -38.51 79.16 Favored 'General case' 0 C--N 1.32 -0.685 0 C-N-CA 123.072 0.549 . . . . 0.0 111.279 -178.917 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 37' ' ' CYS . . . . . 0.511 ' SG ' ' HB3' ' A' ' 29' ' ' MET . 64.6 m -87.91 10.8 17.52 Favored 'General case' 0 C--N 1.312 -1.061 0 CA-C-N 115.9 -0.591 . . . . 0.0 112.246 -178.488 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 38' ' ' GLY . . . . . . . . . . . . . . . 74.73 19.84 79.74 Favored Glycine 0 CA--C 1.522 0.489 0 N-CA-C 116.197 1.239 . . . . 0.0 116.197 172.145 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 39' ' ' PHE . . . . . . . . . . . . . 97.3 m-85 -79.15 -43.01 24.85 Favored 'General case' 0 C--N 1.317 -0.828 0 CA-C-N 118.153 0.976 . . . . 0.0 108.419 176.908 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 40' ' ' CYS . . . . . . . . . . . . . 61.1 m . . . . . 0 C--N 1.303 -1.424 0 CA-C-N 114.728 -1.124 . . . . 0.0 108.618 178.44 . . . . . . . . 0 0 . 1 . 012 nuclear nobuild core ' A' A ' 4' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.435 -1.192 0 N-CA-C 108.701 -0.852 . . . . 0.0 108.701 . . . . . . . . . 0 0 . 1 . 012 nuclear nobuild core ' A' A ' 5' ' ' ASP . . . . . 0.477 ' HB3' ' SG ' ' A' ' 11' ' ' CYS . 24.5 m-20 -56.95 148.83 20.15 Favored 'General case' 0 C--O 1.25 1.129 0 O-C-N 124.095 0.872 . . . . 0.0 110.056 179.907 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 6' ' ' GLU . . . . . 0.468 ' OE1' ' HG2' ' A' ' 7' ' ' LYS . 9.4 tp10 -72.54 145.68 47.28 Favored 'General case' 0 N--CA 1.423 -1.818 0 CA-C-O 121.387 0.613 . . . . 0.0 111.226 -176.562 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 7' ' ' LYS . . . . . 0.468 ' HG2' ' OE1' ' A' ' 6' ' ' GLU . 8.0 ptpp? -84.27 -25.2 29.55 Favored 'General case' 0 C--N 1.315 -0.925 0 CA-C-N 115.085 -0.961 . . . . 0.0 110.885 -175.609 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 8' ' ' ASN . . . . . 0.441 ' H ' ' HG3' ' A' ' 6' ' ' GLU . 15.0 m120 -87.64 4.89 42.16 Favored 'General case' 0 C--N 1.309 -1.187 0 CA-C-N 115.086 -0.961 . . . . 0.0 110.047 -178.001 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 9' ' ' PHE . . . . . . . . . . . . . 20.6 t80 -129.72 143.83 51.0 Favored 'General case' 0 N--CA 1.417 -2.111 0 N-CA-C 107.354 -1.351 . . . . 0.0 107.354 -176.704 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 10' ' ' ASP . . . . . . . . . . . . . 12.1 t70 -103.04 100.9 10.86 Favored 'General case' 0 C--N 1.303 -1.432 0 N-CA-C 108.447 -0.946 . . . . 0.0 108.447 179.617 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 11' ' ' CYS . . . . . 0.477 ' SG ' ' HB3' ' A' ' 5' ' ' ASP . 74.1 m -72.57 -26.38 61.7 Favored 'General case' 0 C--N 1.284 -2.263 0 N-CA-C 113.375 0.88 . . . . 0.0 113.375 -175.004 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 12' ' ' ARG . . . . . . . . . . . . . 37.1 mmt180 -73.17 -49.05 30.28 Favored 'General case' 0 C--N 1.319 -0.728 0 C-N-CA 120.549 -0.461 . . . . 0.0 110.004 -179.792 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 55.2 ttp180 -61.17 -42.72 99.06 Favored 'General case' 0 C--N 1.324 -0.525 0 CA-C-N 115.993 -0.549 . . . . 0.0 110.69 -179.919 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 14' ' ' SER . . . . . . . . . . . . . 16.8 m -66.3 -40.9 90.31 Favored 'General case' 0 C--N 1.312 -1.038 0 CA-C-O 121.185 0.517 . . . . 0.0 110.51 -178.756 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 61.7 tp -63.69 -44.55 93.35 Favored 'General case' 0 C--O 1.238 0.473 0 CA-C-N 115.946 -0.57 . . . . 0.0 110.717 178.704 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 16' ' ' ARG . . . . . . . . . . . . . 78.1 mtp180 -71.56 -28.59 63.96 Favored 'General case' 0 C--N 1.316 -0.89 0 CA-C-N 115.6 -0.727 . . . . 0.0 112.3 -178.786 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 17' ' ' ASN . . . . . . . . . . . . . 13.1 m-80 -77.82 -33.39 52.4 Favored 'General case' 0 CA--C 1.493 -1.22 0 CA-C-O 120.97 0.414 . . . . 0.0 111.89 177.522 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . 116.4 17.19 6.23 Favored Glycine 0 C--N 1.295 -1.728 0 C-N-CA 119.72 -1.228 . . . . 0.0 112.804 177.612 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 19' ' ' ASP . . . . . . . . . . . . . 4.4 m-20 -63.8 -35.45 80.65 Favored 'General case' 0 CA--C 1.505 -0.753 0 CA-C-O 120.99 0.424 . . . . 0.0 111.929 179.203 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 20' ' ' CYS . . . . . . . . . . . . . 11.1 t -85.63 -2.97 58.72 Favored 'General case' 0 C--N 1.309 -1.178 0 CA-C-O 121.851 0.834 . . . . 0.0 109.389 -176.335 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 21' ' ' ASP . . . . . . . . . . . . . 31.2 t70 -105.83 -9.33 17.25 Favored 'General case' 0 C--N 1.319 -0.755 0 CA-C-O 122.404 1.097 . . . . 0.0 108.717 176.692 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 22' ' ' ASN . . . . . . . . . . . . . 49.4 t-20 -87.45 115.07 24.61 Favored 'General case' 0 C--N 1.304 -1.391 0 CA-C-N 114.505 -1.225 . . . . 0.0 108.427 -176.978 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 23' ' ' ASP . . . . . 0.485 ' HA ' ' HG ' ' A' ' 26' ' ' LEU . 7.7 m-20 -56.91 -37.65 71.73 Favored 'General case' 0 N--CA 1.475 0.776 0 N-CA-C 112.607 0.595 . . . . 0.0 112.607 -178.252 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 29.5 m-20 -69.12 -24.15 64.07 Favored 'General case' 0 C--N 1.321 -0.657 0 CA-C-N 116.375 -0.375 . . . . 0.0 111.465 -179.227 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 25' ' ' LYS . . . . . . . . . . . . . 14.0 mptt -107.17 8.7 30.22 Favored 'General case' 0 C--N 1.313 -1.006 0 N-CA-C 113.044 0.757 . . . . 0.0 113.044 -178.825 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 26' ' ' LEU . . . . . 0.485 ' HG ' ' HA ' ' A' ' 23' ' ' ASP . 73.7 mt -59.09 -48.32 82.05 Favored 'General case' 0 N--CA 1.472 0.646 0 N-CA-C 113.502 0.927 . . . . 0.0 113.502 -177.908 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 27' ' ' LEU . . . . . . . . . . . . . 22.1 tp -59.67 -48.52 81.34 Favored 'General case' 0 N--CA 1.44 -0.971 0 N-CA-C 108.952 -0.759 . . . . 0.0 108.952 178.894 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 28' ' ' GLU . . . . . . . . . . . . . 4.7 tp10 -55.74 -37.89 69.06 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 114.055 -1.429 . . . . 0.0 108.935 -177.679 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 29' ' ' MET . . . . . . . . . . . . . 78.5 mmm -84.47 -28.22 26.95 Favored 'General case' 0 C--N 1.309 -1.167 0 CA-C-N 114.997 -1.001 . . . . 0.0 112.4 -173.834 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 30' ' ' GLY . . . . . . . . . . . . . . . -72.69 -32.44 61.54 Favored Glycine 0 N--CA 1.431 -1.638 0 C-N-CA 120.567 -0.825 . . . . 0.0 112.461 -177.76 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 31' ' ' TYR . . . . . . . . . . . . . 47.2 p90 -90.61 -34.79 15.33 Favored 'General case' 0 CA--C 1.5 -0.948 0 C-N-CA 117.935 -1.506 . . . . 0.0 112.349 177.514 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 32' ' ' TYR . . . . . . . . . . . . . 31.4 m-85 -68.69 -41.92 78.51 Favored 'General case' 0 C--N 1.312 -1.022 0 C-N-CA 120.212 -0.595 . . . . 0.0 112.328 176.326 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 33' ' ' CYS . . . . . . . . . . . . . 54.9 m -132.59 64.75 72.64 Favored Pre-proline 0 C--O 1.259 1.553 0 N-CA-C 112.421 0.526 . . . . 0.0 112.421 -176.346 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 34' ' ' PRO . . . . . 0.426 ' HD2' ' HA ' ' A' ' 5' ' ' ASP . 38.6 Cg_endo -67.1 -29.87 39.28 Favored 'Trans proline' 0 N--CA 1.453 -0.908 0 C-N-CA 122.011 1.807 . . . . 0.0 111.718 -178.674 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 35' ' ' VAL . . . . . . . . . . . . . 47.3 t -87.38 -50.08 14.13 Favored 'Isoleucine or valine' 0 N--CA 1.43 -1.455 0 CA-C-N 115.7 -0.682 . . . . 0.0 111.653 -175.379 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 36' ' ' THR . . . . . . . . . . . . . 95.6 m -58.39 -37.69 75.79 Favored 'General case' 0 CA--C 1.545 0.772 0 N-CA-C 112.552 0.575 . . . . 0.0 112.552 -178.683 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 37' ' ' CYS . . . . . 0.416 ' HB2' ' CE2' ' A' ' 39' ' ' PHE . 85.7 m -78.21 -23.62 47.42 Favored 'General case' 0 C--N 1.322 -0.59 0 C-N-CA 119.233 -0.987 . . . . 0.0 111.897 177.668 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 38' ' ' GLY . . . . . . . . . . . . . . . 96.49 41.12 3.73 Favored Glycine 0 N--CA 1.445 -0.727 0 C-N-CA 119.998 -1.096 . . . . 0.0 113.193 179.154 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 39' ' ' PHE . . . . . 0.416 ' CE2' ' HB2' ' A' ' 37' ' ' CYS . 91.4 m-85 -97.47 -38.9 9.41 Favored 'General case' 0 C--N 1.314 -0.943 0 N-CA-C 107.777 -1.194 . . . . 0.0 107.777 174.276 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 40' ' ' CYS . . . . . . . . . . . . . 41.9 t . . . . . 0 C--N 1.299 -1.591 0 CA-C-N 113.97 -1.468 . . . . 0.0 108.723 -176.416 . . . . . . . . 0 0 . 1 . 013 nuclear nobuild core ' A' A ' 4' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.446 -0.649 0 N-CA-C 108.781 -0.822 . . . . 0.0 108.781 . . . . . . . . . 0 0 . 1 . 013 nuclear nobuild core ' A' A ' 5' ' ' ASP . . . . . 0.592 ' HB3' ' SG ' ' A' ' 11' ' ' CYS . 54.3 m-20 -67.44 143.25 56.35 Favored 'General case' 0 C--O 1.248 0.995 0 O-C-N 123.473 0.483 . . . . 0.0 111.122 179.04 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 9.8 tp10 -66.86 140.88 57.81 Favored 'General case' 0 C--N 1.316 -0.869 0 C-N-CA 124.054 0.942 . . . . 0.0 109.741 177.563 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 7' ' ' LYS . . . . . . . . . . . . . 20.8 ptmt -85.44 -23.36 27.9 Favored 'General case' 0 N--CA 1.441 -0.89 0 CA-C-O 121.464 0.649 . . . . 0.0 111.101 -178.652 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 8' ' ' ASN . . . . . . . . . . . . . 38.1 m-80 -86.91 14.66 6.92 Favored 'General case' 0 N--CA 1.48 1.057 0 CA-C-N 114.953 -1.021 . . . . 0.0 110.673 -178.565 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 9' ' ' PHE . . . . . . . . . . . . . 15.3 t80 -141.34 132.95 27.07 Favored 'General case' 0 N--CA 1.41 -2.469 0 N-CA-C 105.232 -2.136 . . . . 0.0 105.232 -178.774 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 10' ' ' ASP . . . . . . . . . . . . . 9.1 t70 -91.78 96.79 10.61 Favored 'General case' 0 C--N 1.297 -1.7 0 C-N-CA 118.63 -1.228 . . . . 0.0 108.774 -179.713 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 11' ' ' CYS . . . . . 0.592 ' SG ' ' HB3' ' A' ' 5' ' ' ASP . 60.0 m -68.33 -30.21 69.14 Favored 'General case' 0 C--N 1.3 -1.546 0 CA-C-N 115.706 -0.679 . . . . 0.0 112.215 -175.574 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 12' ' ' ARG . . . . . . . . . . . . . 30.6 mmt180 -69.36 -47.46 64.25 Favored 'General case' 0 CA--C 1.508 -0.635 0 N-CA-C 110.008 -0.368 . . . . 0.0 110.008 179.468 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 54.6 ttp180 -58.71 -42.25 88.21 Favored 'General case' 0 C--N 1.315 -0.894 0 C-N-CA 122.967 0.507 . . . . 0.0 109.918 176.865 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 14' ' ' SER . . . . . . . . . . . . . 26.2 m -64.51 -33.42 75.84 Favored 'General case' 0 C--N 1.316 -0.891 0 CA-C-N 116.006 -0.543 . . . . 0.0 110.749 179.153 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 29.8 tp -74.88 -41.7 59.29 Favored 'General case' 0 N--CA 1.441 -0.912 0 N-CA-C 109.633 -0.506 . . . . 0.0 109.633 179.609 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 16' ' ' ARG . . . . . . . . . . . . . 78.3 mtp180 -64.49 -31.09 72.15 Favored 'General case' 0 C--N 1.321 -0.656 0 C-N-CA 123.699 0.8 . . . . 0.0 111.883 179.51 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 17' ' ' ASN . . . . . . . . . . . . . 30.6 m-80 -85.25 -42.77 14.36 Favored 'General case' 0 CA--C 1.511 -0.531 0 N-CA-C 112.454 0.539 . . . . 0.0 112.454 179.275 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . 130.55 -4.19 5.83 Favored Glycine 0 C--O 1.225 -0.461 0 C-N-CA 119.614 -1.279 . . . . 0.0 112.414 -179.334 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 19' ' ' ASP . . . . . . . . . . . . . 3.5 m-20 -61.79 -38.99 90.1 Favored 'General case' 0 N--CA 1.478 0.972 0 C-N-CA 123.614 0.766 . . . . 0.0 110.701 -177.336 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 20' ' ' CYS . . . . . . . . . . . . . 44.4 t -77.89 -11.21 59.87 Favored 'General case' 0 C--N 1.302 -1.497 0 CA-C-N 114.728 -1.124 . . . . 0.0 111.845 -173.741 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 21' ' ' ASP . . . . . . . . . . . . . 35.3 t70 -114.07 -6.61 13.1 Favored 'General case' 0 C--N 1.312 -1.036 0 CA-C-O 121.768 0.794 . . . . 0.0 110.612 -178.437 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 22' ' ' ASN . . . . . . . . . . . . . 19.1 t-20 -79.53 115.47 19.17 Favored 'General case' 0 C--N 1.309 -1.177 0 CA-C-N 115.378 -0.828 . . . . 0.0 109.681 -177.297 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 23' ' ' ASP . . . . . 0.4 ' HA ' ' HG ' ' A' ' 26' ' ' LEU . 13.2 t70 -55.02 -39.45 69.13 Favored 'General case' 0 N--CA 1.479 0.988 0 C-N-CA 123.972 0.909 . . . . 0.0 112.616 -175.849 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 6.0 m-20 -72.58 -12.93 61.26 Favored 'General case' 0 C--N 1.31 -1.151 0 N-CA-C 112.819 0.674 . . . . 0.0 112.819 -177.053 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 25' ' ' LYS . . . . . . . . . . . . . 43.7 mtpt -113.41 -2.08 14.04 Favored 'General case' 0 C--N 1.315 -0.934 0 CA-C-O 120.963 0.411 . . . . 0.0 110.432 179.655 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 26' ' ' LEU . . . . . 0.412 HD23 ' HA ' ' A' ' 26' ' ' LEU . 45.8 mt -55.54 -35.54 65.79 Favored 'General case' 0 C--N 1.318 -0.785 0 N-CA-C 115.44 1.644 . . . . 0.0 115.44 -177.632 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 27' ' ' LEU . . . . . . . . . . . . . 2.2 tm? -58.08 -50.96 71.67 Favored 'General case' 0 N--CA 1.441 -0.9 0 N-CA-C 107.672 -1.233 . . . . 0.0 107.672 179.071 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 28' ' ' GLU . . . . . 0.631 ' HA ' ' CZ ' ' A' ' 31' ' ' TYR . 40.0 tt0 -65.38 -32.62 74.35 Favored 'General case' 0 N--CA 1.437 -1.076 0 CA-C-N 114.63 -1.168 . . . . 0.0 110.449 179.753 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 29' ' ' MET . . . . . . . . . . . . . 78.5 mmm -80.51 -17.98 49.91 Favored 'General case' 0 C--O 1.208 -1.121 0 CA-C-N 115.901 -0.59 . . . . 0.0 112.081 -175.764 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 30' ' ' GLY . . . . . . . . . . . . . . . -77.06 -39.78 26.64 Favored Glycine 0 C--N 1.303 -1.284 0 C-N-CA 120.419 -0.896 . . . . 0.0 111.658 -179.604 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 31' ' ' TYR . . . . . 0.631 ' CZ ' ' HA ' ' A' ' 28' ' ' GLU . 25.0 p90 -79.44 -31.64 42.62 Favored 'General case' 0 CA--C 1.501 -0.931 0 C-N-CA 119.173 -1.011 . . . . 0.0 112.059 176.581 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 32' ' ' TYR . . . . . . . . . . . . . 17.8 m-85 -73.77 -54.85 7.11 Favored 'General case' 0 C--N 1.297 -1.689 0 N-CA-C 113.384 0.883 . . . . 0.0 113.384 174.913 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 33' ' ' CYS . . . . . . . . . . . . . 30.3 m -134.89 76.9 58.22 Favored Pre-proline 0 C--N 1.307 -1.281 0 C-N-CA 119.892 -0.723 . . . . 0.0 111.863 -175.99 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 34' ' ' PRO . . . . . 0.492 ' HD2' ' HA ' ' A' ' 5' ' ' ASP . 55.7 Cg_endo -68.79 -25.07 33.75 Favored 'Trans proline' 0 C--N 1.352 0.759 0 C-N-CA 122.261 1.974 . . . . 0.0 112.054 -179.266 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 35' ' ' VAL . . . . . 0.431 ' HB ' ' OD1' ' A' ' 5' ' ' ASP . 47.3 t -86.28 -51.65 12.91 Favored 'Isoleucine or valine' 0 C--N 1.306 -1.313 0 CA-C-N 116.261 -0.427 . . . . 0.0 110.491 -177.326 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 36' ' ' THR . . . . . . . . . . . . . 62.0 m -62.41 -37.6 86.42 Favored 'General case' 0 C--O 1.249 1.039 0 CA-C-N 116.159 -0.473 . . . . 0.0 111.958 -178.615 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 37' ' ' CYS . . . . . . . . . . . . . 72.2 m -84.62 6.53 23.59 Favored 'General case' 0 C--N 1.311 -1.091 0 N-CA-C 112.395 0.517 . . . . 0.0 112.395 -179.726 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 38' ' ' GLY . . . . . . . . . . . . . . . 70.09 46.49 50.87 Favored Glycine 0 N--CA 1.446 -0.676 0 N-CA-C 115.451 0.94 . . . . 0.0 115.451 172.238 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 39' ' ' PHE . . . . . 0.437 ' CD2' ' HA ' ' A' ' 34' ' ' PRO . 91.9 m-85 -87.87 -36.18 17.34 Favored 'General case' 0 C--N 1.302 -1.467 0 N-CA-C 108.766 -0.828 . . . . 0.0 108.766 174.145 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 40' ' ' CYS . . . . . . . . . . . . . 15.8 m . . . . . 0 C--N 1.315 -0.893 0 N-CA-C 109.178 -0.675 . . . . 0.0 109.178 178.889 . . . . . . . . 0 0 . 1 . 014 nuclear nobuild core ' A' A ' 4' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.433 -1.313 0 N-CA-C 108.419 -0.956 . . . . 0.0 108.419 . . . . . . . . . 0 0 . 1 . 014 nuclear nobuild core ' A' A ' 5' ' ' ASP . . . . . 0.601 ' HB3' ' SG ' ' A' ' 11' ' ' CYS . 31.3 m-20 -60.56 137.31 58.18 Favored 'General case' 0 C--N 1.312 -1.04 0 O-C-N 123.527 0.517 . . . . 0.0 111.41 -177.24 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 9.9 tp10 -69.27 127.48 33.2 Favored 'General case' 0 N--CA 1.427 -1.584 0 N-CA-C 109.466 -0.568 . . . . 0.0 109.466 177.534 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 7' ' ' LYS . . . . . . . . . . . . . 17.3 ptpt -85.25 -12.76 51.76 Favored 'General case' 0 C--N 1.306 -1.293 0 CA-C-O 121.576 0.703 . . . . 0.0 110.652 -178.687 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 8' ' ' ASN . . . . . . . . . . . . . 13.0 m120 -91.64 16.37 10.72 Favored 'General case' 0 C--N 1.315 -0.902 0 CA-C-O 121.91 0.862 . . . . 0.0 109.2 176.398 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 9' ' ' PHE . . . . . 0.431 ' HE2' ' HG ' ' A' ' 14' ' ' SER . 29.6 t80 -136.4 155.98 49.27 Favored 'General case' 0 N--CA 1.427 -1.589 0 N-CA-C 106.748 -1.575 . . . . 0.0 106.748 -177.655 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 10' ' ' ASP . . . . . . . . . . . . . 9.1 t70 -104.49 95.74 6.13 Favored 'General case' 0 C--N 1.311 -1.076 0 N-CA-C 108.501 -0.926 . . . . 0.0 108.501 175.199 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 11' ' ' CYS . . . . . 0.601 ' SG ' ' HB3' ' A' ' 5' ' ' ASP . 81.4 m -67.88 -30.95 70.43 Favored 'General case' 0 C--N 1.301 -1.504 0 CA-C-N 115.61 -0.723 . . . . 0.0 111.727 -175.573 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 12' ' ' ARG . . . . . 0.409 ' O ' ' HG3' ' A' ' 16' ' ' ARG . 28.4 mmm180 -66.93 -43.49 83.11 Favored 'General case' 0 CA--C 1.503 -0.839 0 CA-C-N 116.324 -0.398 . . . . 0.0 110.359 179.496 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 60.7 ttp180 -58.24 -47.59 83.04 Favored 'General case' 0 C--N 1.316 -0.868 0 CA-C-N 115.865 -0.607 . . . . 0.0 110.705 179.333 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 14' ' ' SER . . . . . 0.431 ' HG ' ' HE2' ' A' ' 9' ' ' PHE . 57.0 m -66.66 -28.24 68.31 Favored 'General case' 0 C--N 1.319 -0.743 0 N-CA-C 112.028 0.381 . . . . 0.0 112.028 179.045 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 15' ' ' LEU . . . . . 0.406 HD13 ' SG ' ' A' ' 20' ' ' CYS . 42.3 tp -74.14 -45.2 50.29 Favored 'General case' 0 C--N 1.319 -0.743 0 CA-C-O 120.891 0.377 . . . . 0.0 110.141 177.527 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 16' ' ' ARG . . . . . 0.409 ' HG3' ' O ' ' A' ' 12' ' ' ARG . 48.2 mtm180 -66.5 -34.63 78.36 Favored 'General case' 0 C--N 1.316 -0.849 0 CA-C-N 115.99 -0.55 . . . . 0.0 111.131 179.781 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 17' ' ' ASN . . . . . . . . . . . . . 14.7 m-80 -70.85 -31.08 67.66 Favored 'General case' 0 CA--C 1.496 -1.108 0 CA-C-O 121.167 0.508 . . . . 0.0 111.079 176.318 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . 105.2 -1.66 40.55 Favored Glycine 0 N--CA 1.436 -1.331 0 CA-C-N 115.508 -0.769 . . . . 0.0 112.513 178.489 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 19' ' ' ASP . . . . . . . . . . . . . 18.6 m-20 -63.01 -33.01 74.51 Favored 'General case' 0 N--CA 1.484 1.228 0 CA-C-O 121.657 0.741 . . . . 0.0 109.852 -179.453 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 20' ' ' CYS . . . . . 0.454 ' HA ' ' HG3' ' A' ' 29' ' ' MET . 32.2 t -64.51 -24.14 67.51 Favored 'General case' 0 C--N 1.302 -1.484 0 CA-C-N 114.376 -1.283 . . . . 0.0 110.993 -179.987 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 21' ' ' ASP . . . . . . . . . . . . . 34.6 t70 -112.86 -4.88 13.9 Favored 'General case' 0 N--CA 1.468 0.462 0 CA-C-O 121.585 0.707 . . . . 0.0 110.694 -178.632 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 22' ' ' ASN . . . . . 0.427 ' O ' ' HG ' ' A' ' 26' ' ' LEU . 27.2 t-20 -77.77 126.19 30.48 Favored 'General case' 0 C--N 1.307 -1.246 0 CA-C-N 116.118 -0.492 . . . . 0.0 109.809 -178.602 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 23' ' ' ASP . . . . . 0.483 ' HA ' ' HG ' ' A' ' 26' ' ' LEU . 2.2 m-20 -56.92 -41.74 78.72 Favored 'General case' 0 N--CA 1.474 0.745 0 N-CA-C 113.809 1.04 . . . . 0.0 113.809 -176.333 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 21.9 t70 -67.97 -29.03 67.97 Favored 'General case' 0 C--N 1.314 -0.976 0 CA-C-O 121.408 0.623 . . . . 0.0 110.882 179.824 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 25' ' ' LYS . . . . . 0.41 ' HG2' ' OD1' ' A' ' 22' ' ' ASN . 47.0 mmtm -97.59 -0.63 45.44 Favored 'General case' 0 C--N 1.313 -1.007 0 CA-C-N 116.146 -0.479 . . . . 0.0 111.958 -177.521 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 26' ' ' LEU . . . . . 0.483 ' HG ' ' HA ' ' A' ' 23' ' ' ASP . 74.4 mt -58.46 -44.79 89.38 Favored 'General case' 0 N--CA 1.473 0.684 0 N-CA-C 113.22 0.822 . . . . 0.0 113.22 -177.33 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 27' ' ' LEU . . . . . . . . . . . . . 26.8 tp -60.24 -45.66 92.48 Favored 'General case' 0 N--CA 1.432 -1.346 0 CA-C-O 121.204 0.526 . . . . 0.0 109.747 178.776 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 28' ' ' GLU . . . . . . . . . . . . . 9.5 mm-40 -58.68 -36.67 74.55 Favored 'General case' 0 C--N 1.323 -0.582 0 CA-C-N 114.597 -1.183 . . . . 0.0 109.373 -179.323 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 29' ' ' MET . . . . . 0.466 ' HB3' ' SG ' ' A' ' 37' ' ' CYS . 76.9 mmm -89.29 -16.46 31.1 Favored 'General case' 0 C--N 1.296 -1.737 0 CA-C-N 114.536 -1.211 . . . . 0.0 112.525 -173.271 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 30' ' ' GLY . . . . . . . . . . . . . . . -72.07 -40.23 56.98 Favored Glycine 0 C--N 1.302 -1.307 0 N-CA-C 111.439 -0.665 . . . . 0.0 111.439 178.556 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 31' ' ' TYR . . . . . . . . . . . . . 17.5 p90 -82.66 -29.15 30.19 Favored 'General case' 0 CA--C 1.503 -0.83 0 C-N-CA 119.342 -0.943 . . . . 0.0 112.594 177.618 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 32' ' ' TYR . . . . . . . . . . . . . 15.3 m-85 -76.79 -62.07 1.76 Allowed 'General case' 0 C--N 1.298 -1.669 0 N-CA-C 113.764 1.024 . . . . 0.0 113.764 175.592 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 33' ' ' CYS . . . . . 0.405 ' HA ' ' HA ' ' A' ' 5' ' ' ASP . 56.2 m -131.79 73.4 78.85 Favored Pre-proline 0 C--N 1.309 -1.181 0 C-N-CA 120.294 -0.562 . . . . 0.0 111.445 -175.61 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 34' ' ' PRO . . . . . 0.416 ' HB2' ' SG ' ' A' ' 40' ' ' CYS . 54.3 Cg_endo -67.18 -24.42 44.35 Favored 'Trans proline' 0 C--N 1.351 0.685 0 C-N-CA 122.679 2.253 . . . . 0.0 112.433 -175.683 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 35' ' ' VAL . . . . . 0.43 ' HB ' ' OD2' ' A' ' 5' ' ' ASP . 45.8 t -86.84 -42.86 15.75 Favored 'Isoleucine or valine' 0 C--N 1.301 -1.534 0 CA-C-O 121.077 0.465 . . . . 0.0 110.523 -176.666 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 36' ' ' THR . . . . . . . . . . . . . 31.9 m -63.46 -39.58 94.83 Favored 'General case' 0 C--N 1.308 -1.196 0 CA-C-N 115.75 -0.659 . . . . 0.0 110.985 178.399 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 37' ' ' CYS . . . . . 0.466 ' SG ' ' HB3' ' A' ' 29' ' ' MET . 75.5 m -86.26 5.42 34.46 Favored 'General case' 0 C--N 1.316 -0.876 0 N-CA-C 113.223 0.824 . . . . 0.0 113.223 -178.749 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 38' ' ' GLY . . . . . . . . . . . . . . . 73.11 42.83 42.27 Favored Glycine 0 CA--C 1.52 0.367 0 N-CA-C 115.567 0.987 . . . . 0.0 115.567 173.864 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 39' ' ' PHE . . . . . . . . . . . . . 93.1 m-85 -103.8 -43.59 5.29 Favored 'General case' 0 C--N 1.304 -1.376 0 N-CA-C 107.766 -1.198 . . . . 0.0 107.766 173.316 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 40' ' ' CYS . . . . . 0.416 ' SG ' ' HB2' ' A' ' 34' ' ' PRO . 61.5 m . . . . . 0 C--N 1.306 -1.284 0 CA-C-N 114.566 -1.197 . . . . 0.0 109.275 -179.463 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 4' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.424 -1.748 0 N-CA-C 106.161 -1.792 . . . . 0.0 106.161 . . . . . . . . . 0 0 . 1 . 015 nuclear nobuild core ' A' A ' 5' ' ' ASP . . . . . 0.577 ' OD2' ' HB ' ' A' ' 35' ' ' VAL . 25.9 m-20 -61.56 137.52 58.25 Favored 'General case' 0 C--N 1.315 -0.907 0 O-C-N 123.343 0.402 . . . . 0.0 110.221 -179.506 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER -66.52 136.46 55.69 Favored 'General case' 0 C--N 1.321 -0.671 0 C-N-CA 123.68 0.792 . . . . 0.0 109.558 -175.653 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 7' ' ' LYS . . . . . . . . . . . . . 8.1 ptpp? -73.79 -27.73 61.29 Favored 'General case' 0 C--N 1.309 -1.176 0 N-CA-C 114.986 1.476 . . . . 0.0 114.986 -173.298 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 8' ' ' ASN . . . . . . . . . . . . . 16.2 m120 -98.58 -2.83 37.69 Favored 'General case' 0 C--N 1.285 -2.206 0 C-N-CA 120.436 -0.506 . . . . 0.0 110.933 -178.909 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 9' ' ' PHE . . . . . . . . . . . . . 18.8 t80 -100.7 143.66 30.6 Favored 'General case' 0 C--N 1.302 -1.482 0 N-CA-C 107.499 -1.297 . . . . 0.0 107.499 -179.75 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 10' ' ' ASP . . . . . . . . . . . . . 16.4 t70 -102.82 100.71 10.73 Favored 'General case' 0 C--N 1.307 -1.268 0 C-N-CA 119.064 -1.054 . . . . 0.0 110.788 -179.349 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 11' ' ' CYS . . . . . 0.511 ' SG ' ' HB3' ' A' ' 5' ' ' ASP . 60.1 m -68.32 -27.67 66.49 Favored 'General case' 0 C--N 1.289 -2.03 0 CA-C-N 115.034 -0.984 . . . . 0.0 112.022 -176.1 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 12' ' ' ARG . . . . . . . . . . . . . 38.9 mmt180 -62.2 -48.9 77.97 Favored 'General case' 0 C--O 1.237 0.445 0 N-CA-C 109.575 -0.528 . . . . 0.0 109.575 179.009 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 14.7 ttp180 -59.39 -51.62 69.14 Favored 'General case' 0 C--N 1.325 -0.484 0 CA-C-N 115.394 -0.821 . . . . 0.0 111.092 179.498 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 14' ' ' SER . . . . . . . . . . . . . 25.4 m -63.62 -34.63 78.26 Favored 'General case' 0 C--N 1.311 -1.069 0 N-CA-C 112.048 0.388 . . . . 0.0 112.048 -178.249 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 2.3 tm? -68.34 -43.48 77.43 Favored 'General case' 0 CA--C 1.535 0.386 0 N-CA-C 108.82 -0.807 . . . . 0.0 108.82 179.16 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 16' ' ' ARG . . . . . . . . . . . . . 71.3 mtp180 -70.23 -37.26 74.97 Favored 'General case' 0 C--N 1.319 -0.747 0 N-CA-C 112.824 0.676 . . . . 0.0 112.824 -179.533 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 17' ' ' ASN . . . . . . . . . . . . . 26.4 m-80 -69.99 -36.12 74.92 Favored 'General case' 0 CA--C 1.503 -0.841 0 N-CA-C 111.899 0.333 . . . . 0.0 111.899 178.639 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . 117.79 -1.32 17.71 Favored Glycine 0 N--CA 1.437 -1.283 0 C-N-CA 119.774 -1.203 . . . . 0.0 112.143 179.353 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 19' ' ' ASP . . . . . . . . . . . . . 8.2 m-20 -60.94 -30.46 70.23 Favored 'General case' 0 N--CA 1.482 1.162 0 CA-C-O 121.246 0.546 . . . . 0.0 111.038 -178.38 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 20' ' ' CYS . . . . . . . . . . . . . 52.1 t -82.03 -2.33 51.34 Favored 'General case' 0 C--N 1.304 -1.378 0 CA-C-N 115.411 -0.813 . . . . 0.0 111.001 -176.099 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 21' ' ' ASP . . . . . . . . . . . . . 31.4 t70 -124.32 -9.91 7.51 Favored 'General case' 0 N--CA 1.47 0.554 0 CA-C-O 121.781 0.801 . . . . 0.0 110.065 176.552 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 22' ' ' ASN . . . . . 0.488 ' O ' ' HG ' ' A' ' 26' ' ' LEU . 28.1 t-20 -82.2 121.24 26.37 Favored 'General case' 0 C--N 1.309 -1.153 0 CA-C-N 115.155 -0.93 . . . . 0.0 110.561 -177.041 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 23' ' ' ASP . . . . . . . . . . . . . 13.2 t70 -51.47 -43.32 62.11 Favored 'General case' 0 N--CA 1.483 1.2 0 C-N-CA 124.537 1.135 . . . . 0.0 111.841 -176.904 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 25.4 m-20 -70.2 -14.68 62.73 Favored 'General case' 0 C--N 1.311 -1.093 0 CA-C-N 115.123 -0.944 . . . . 0.0 112.76 -175.911 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 25' ' ' LYS . . . . . . . . . . . . . 14.1 mmmm -115.24 -7.96 12.36 Favored 'General case' 0 C--N 1.313 -1.009 0 N-CA-C 111.56 0.207 . . . . 0.0 111.56 178.894 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 26' ' ' LEU . . . . . 0.488 ' HG ' ' O ' ' A' ' 22' ' ' ASN . 52.3 mt -53.9 -44.55 70.6 Favored 'General case' 0 N--CA 1.473 0.675 0 N-CA-C 114.985 1.476 . . . . 0.0 114.985 -174.329 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 27' ' ' LEU . . . . . . . . . . . . . 26.4 tp -59.27 -46.76 87.66 Favored 'General case' 0 N--CA 1.437 -1.114 0 CA-C-O 121.175 0.512 . . . . 0.0 109.936 -179.309 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 28' ' ' GLU . . . . . 0.513 ' HA ' ' CZ ' ' A' ' 31' ' ' TYR . 46.1 mt-10 -66.14 -32.23 73.56 Favored 'General case' 0 CA--C 1.498 -1.057 0 CA-C-N 114.963 -1.017 . . . . 0.0 110.112 -179.31 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 29' ' ' MET . . . . . 0.433 ' HB3' ' SG ' ' A' ' 37' ' ' CYS . 79.3 mmm -81.51 -19.82 41.39 Favored 'General case' 0 C--N 1.299 -1.616 0 CA-C-N 115.357 -0.838 . . . . 0.0 110.718 -177.901 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 30' ' ' GLY . . . . . 0.453 ' O ' ' HB3' ' A' ' 34' ' ' PRO . . . -74.38 -26.52 67.82 Favored Glycine 0 N--CA 1.43 -1.717 0 CA-C-N 115.259 -0.882 . . . . 0.0 111.216 177.967 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 31' ' ' TYR . . . . . 0.513 ' CZ ' ' HA ' ' A' ' 28' ' ' GLU 0.254 22.2 p90 -98.51 -36.03 10.05 Favored 'General case' 0 N--CA 1.435 -1.194 0 C-N-CA 119.263 -0.975 . . . . 0.0 112.602 173.803 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild core ' A' A ' 32' ' ' TYR . . . . . . . . . . . . . 19.3 m-85 -68.27 -51.71 41.96 Favored 'General case' 0 C--N 1.303 -1.438 0 N-CA-C 113.759 1.022 . . . . 0.0 113.759 176.747 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 33' ' ' CYS . . . . . . . . . . . . . 65.6 m -134.85 66.6 69.07 Favored Pre-proline 0 C--N 1.3 -1.581 0 C-N-CA 119.912 -0.715 . . . . 0.0 111.162 179.684 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 34' ' ' PRO . . . . . 0.453 ' HB3' ' O ' ' A' ' 30' ' ' GLY . 37.1 Cg_endo -64.68 -26.97 60.72 Favored 'Trans proline' 0 C--N 1.352 0.751 0 C-N-CA 122.733 2.289 . . . . 0.0 112.771 -176.566 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 35' ' ' VAL . . . . . 0.577 ' HB ' ' OD2' ' A' ' 5' ' ' ASP . 39.2 t -83.3 -43.38 18.23 Favored 'Isoleucine or valine' 0 C--N 1.307 -1.274 0 C-N-CA 119.796 -0.762 . . . . 0.0 109.617 -178.492 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 36' ' ' THR . . . . . . . . . . . . . 25.2 m -62.61 -40.05 95.72 Favored 'General case' 0 C--N 1.316 -0.851 0 CA-C-N 115.662 -0.699 . . . . 0.0 110.438 178.666 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 37' ' ' CYS . . . . . 0.433 ' SG ' ' HB3' ' A' ' 29' ' ' MET . 79.4 m -81.15 0.18 37.48 Favored 'General case' 0 C--N 1.318 -0.794 0 N-CA-C 112.847 0.684 . . . . 0.0 112.847 178.798 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 38' ' ' GLY . . . . . . . . . . . . . . . 74.21 49.0 13.33 Favored Glycine 0 C--O 1.219 -0.828 0 N-CA-C 115.452 0.941 . . . . 0.0 115.452 173.066 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 39' ' ' PHE . . . . . . . . . . . . . 94.2 m-85 -92.31 -9.58 41.44 Favored 'General case' 0 C--N 1.311 -1.067 0 CA-C-N 117.736 0.768 . . . . 0.0 111.501 175.973 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 40' ' ' CYS . . . . . . . . . . . . . 28.5 p . . . . . 0 C--N 1.31 -1.141 0 N-CA-C 108.304 -0.998 . . . . 0.0 108.304 173.704 . . . . . . . . 0 0 . 1 . 016 nuclear nobuild core ' A' A ' 4' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.448 -0.557 0 N-CA-C 108.489 -0.93 . . . . 0.0 108.489 . . . . . . . . . 0 0 . 1 . 016 nuclear nobuild core ' A' A ' 5' ' ' ASP . . . . . 0.715 ' OD1' ' HB ' ' A' ' 35' ' ' VAL . 11.0 m-20 -59.65 130.39 46.61 Favored 'General case' 0 C--N 1.311 -1.108 0 O-C-N 123.489 0.493 . . . . 0.0 111.844 -179.077 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 8.5 tp10 -66.53 127.12 31.1 Favored 'General case' 0 N--CA 1.44 -0.939 0 C-N-CA 124.015 0.926 . . . . 0.0 110.507 178.426 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 7' ' ' LYS . . . . . . . . . . . . . 10.1 ptpp? -77.09 -21.05 54.94 Favored 'General case' 0 C--N 1.315 -0.893 0 CA-C-N 115.366 -0.834 . . . . 0.0 110.83 -177.608 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 8' ' ' ASN . . . . . . . . . . . . . 15.5 t-20 -87.77 -7.97 56.6 Favored 'General case' 0 C--N 1.302 -1.499 0 CA-C-O 121.961 0.886 . . . . 0.0 109.758 -178.559 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 9' ' ' PHE . . . . . . . . . . . . . 23.2 t80 -108.18 151.23 26.2 Favored 'General case' 0 N--CA 1.43 -1.471 0 N-CA-C 106.983 -1.488 . . . . 0.0 106.983 -179.206 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 10' ' ' ASP . . . . . . . . . . . . . 9.8 t70 -102.55 100.12 10.18 Favored 'General case' 0 C--O 1.253 1.265 0 C-N-CA 118.944 -1.102 . . . . 0.0 109.281 177.483 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 11' ' ' CYS . . . . . 0.482 ' SG ' ' HB3' ' A' ' 5' ' ' ASP . 61.2 m -70.59 -29.3 65.68 Favored 'General case' 0 C--N 1.298 -1.665 0 CA-C-N 114.706 -1.134 . . . . 0.0 111.372 -176.488 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 12' ' ' ARG . . . . . . . . . . . . . 34.1 mmt180 -71.29 -52.32 19.54 Favored 'General case' 0 CA--C 1.506 -0.744 0 CA-C-N 116.03 -0.532 . . . . 0.0 109.896 -175.853 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 38.4 ttm180 -58.31 -46.32 86.38 Favored 'General case' 0 C--N 1.32 -0.69 0 C-N-CA 123.346 0.659 . . . . 0.0 110.42 -179.688 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 14' ' ' SER . . . . . . . . . . . . . 25.9 m -59.83 -38.54 82.34 Favored 'General case' 0 C--O 1.256 1.398 0 CA-C-N 115.875 -0.602 . . . . 0.0 111.142 -178.797 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 41.1 tp -73.26 -46.97 46.88 Favored 'General case' 0 N--CA 1.438 -1.026 0 CA-C-N 116.062 -0.517 . . . . 0.0 110.385 178.016 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 16' ' ' ARG . . . . . . . . . . . . . 97.8 mtt180 -54.28 -47.0 72.85 Favored 'General case' 0 N--CA 1.471 0.583 0 C-N-CA 123.18 0.592 . . . . 0.0 111.504 178.788 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 17' ' ' ASN . . . . . . . . . . . . . 11.0 m120 -65.75 -36.67 84.24 Favored 'General case' 0 CA--C 1.504 -0.789 0 CA-C-O 121.858 0.837 . . . . 0.0 109.576 179.833 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . 109.12 -1.36 31.38 Favored Glycine 0 N--CA 1.432 -1.606 0 CA-C-N 114.376 -1.284 . . . . 0.0 111.863 179.235 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 19' ' ' ASP . . . . . 0.425 ' O ' ' HB2' ' A' ' 25' ' ' LYS . 8.8 m-20 -70.29 -21.44 62.95 Favored 'General case' 0 CA--C 1.49 -1.338 0 N-CA-C 112.554 0.575 . . . . 0.0 112.554 -176.776 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 20' ' ' CYS . . . . . 0.621 ' HA ' ' HG3' ' A' ' 29' ' ' MET . 43.0 t -73.75 -26.38 60.64 Favored 'General case' 0 C--N 1.299 -1.619 0 C-N-CA 120.425 -0.51 . . . . 0.0 111.022 179.912 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 21' ' ' ASP . . . . . . . . . . . . . 33.8 t70 -100.32 -3.33 31.49 Favored 'General case' 0 C--N 1.327 -0.39 0 CA-C-O 122.488 1.137 . . . . 0.0 109.101 -179.814 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 22' ' ' ASN . . . . . . . . . . . . . 19.0 t30 -78.26 130.52 36.34 Favored 'General case' 0 C--N 1.309 -1.18 0 CA-C-N 114.139 -1.391 . . . . 0.0 109.35 178.619 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 23' ' ' ASP . . . . . 0.478 ' HA ' ' HG ' ' A' ' 26' ' ' LEU . 3.1 m-20 -52.9 -34.38 54.64 Favored 'General case' 0 CA--C 1.498 -1.021 0 C-N-CA 124.388 1.075 . . . . 0.0 112.043 -177.118 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 34.2 t70 -59.85 -31.81 70.1 Favored 'General case' 0 C--N 1.307 -1.245 0 CA-C-N 114.974 -1.012 . . . . 0.0 112.133 -179.501 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 25' ' ' LYS . . . . . 0.523 ' O ' ' HG2' ' A' ' 29' ' ' MET . 13.1 mptt -110.81 1.78 17.93 Favored 'General case' 0 C--O 1.204 -1.322 0 N-CA-C 113.624 0.972 . . . . 0.0 113.624 179.794 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 26' ' ' LEU . . . . . 0.478 ' HG ' ' HA ' ' A' ' 23' ' ' ASP . 70.1 mt -50.2 -52.78 32.89 Favored 'General case' 0 N--CA 1.49 1.53 0 N-CA-C 114.655 1.354 . . . . 0.0 114.655 -174.947 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 27' ' ' LEU . . . . . . . . . . . . . 20.0 tp -60.84 -44.62 96.72 Favored 'General case' 0 N--CA 1.44 -0.929 0 CA-C-O 121.17 0.51 . . . . 0.0 109.724 -179.645 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 28' ' ' GLU . . . . . . . . . . . . . 7.5 mm-40 -60.57 -37.12 80.27 Favored 'General case' 0 C--N 1.325 -0.5 0 CA-C-N 114.581 -1.19 . . . . 0.0 108.963 -178.295 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 29' ' ' MET . . . . . 0.621 ' HG3' ' HA ' ' A' ' 20' ' ' CYS . 74.8 mmm -81.14 -20.26 41.71 Favored 'General case' 0 CA--C 1.482 -1.656 0 CA-C-N 115.094 -0.957 . . . . 0.0 111.794 -174.041 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 30' ' ' GLY . . . . . . . . . . . . . . . -64.56 -27.04 71.3 Favored Glycine 0 N--CA 1.436 -1.341 0 O-C-N 124.194 0.934 . . . . 0.0 110.823 177.216 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 31' ' ' TYR . . . . . . . . . . . . . 38.7 p90 -106.16 -31.97 8.44 Favored 'General case' 0 N--CA 1.43 -1.443 0 N-CA-C 112.923 0.712 . . . . 0.0 112.923 176.166 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 32' ' ' TYR . . . . . . . . . . . . . 16.2 m-85 -68.15 -61.59 1.79 Allowed 'General case' 0 C--O 1.21 -1.0 0 N-CA-C 113.232 0.827 . . . . 0.0 113.232 177.482 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 33' ' ' CYS . . . . . . . . . . . . . 61.7 m -136.43 68.55 61.03 Favored Pre-proline 0 C--O 1.265 1.871 0 CA-C-O 121.749 0.785 . . . . 0.0 111.413 -176.846 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 34' ' ' PRO . . . . . 0.66 ' HA ' ' CD2' ' A' ' 39' ' ' PHE . 74.0 Cg_endo -73.09 -23.75 17.89 Favored 'Trans proline' 0 N--CA 1.444 -1.386 0 C-N-CA 122.964 2.443 . . . . 0.0 112.569 -174.955 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 35' ' ' VAL . . . . . 0.715 ' HB ' ' OD1' ' A' ' 5' ' ' ASP . 43.5 t -86.57 -44.48 16.48 Favored 'Isoleucine or valine' 0 C--N 1.289 -2.028 0 C-N-CA 119.51 -0.876 . . . . 0.0 109.506 -179.066 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 36' ' ' THR . . . . . . . . . . . . . 38.3 m -54.61 -51.88 63.94 Favored 'General case' 0 C--N 1.325 -0.472 0 CA-C-N 115.653 -0.703 . . . . 0.0 112.69 -178.49 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 37' ' ' CYS . . . . . . . . . . . . . 85.1 m -91.99 10.88 27.12 Favored 'General case' 0 C--N 1.315 -0.932 0 C-N-CA 118.964 -1.094 . . . . 0.0 113.288 -176.517 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 38' ' ' GLY . . . . . . . . . . . . . . . 78.19 44.14 12.1 Favored Glycine 0 N--CA 1.443 -0.834 0 N-CA-C 115.432 0.933 . . . . 0.0 115.432 171.881 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 39' ' ' PHE . . . . . 0.66 ' CD2' ' HA ' ' A' ' 34' ' ' PRO . 62.2 m-85 -86.19 -50.39 7.02 Favored 'General case' 0 C--N 1.302 -1.496 0 N-CA-C 106.782 -1.562 . . . . 0.0 106.782 174.113 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 40' ' ' CYS . . . . . 0.509 ' SG ' ' HB2' ' A' ' 34' ' ' PRO . 4.0 p . . . . . 0 C--N 1.31 -1.125 0 CA-C-N 114.453 -1.249 . . . . 0.0 109.87 -179.71 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 4' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.426 -1.626 0 N-CA-C 108.883 -0.784 . . . . 0.0 108.883 . . . . . . . . . 0 0 . 1 . 017 nuclear nobuild core ' A' A ' 5' ' ' ASP . . . . . 0.667 ' OD1' ' HB ' ' A' ' 35' ' ' VAL . 5.1 m-20 -58.29 132.5 53.82 Favored 'General case' 0 C--O 1.256 1.406 0 O-C-N 124.395 1.06 . . . . 0.0 109.517 -179.877 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 6' ' ' GLU . . . . . 0.439 ' HG3' ' H ' ' A' ' 8' ' ' ASN . 9.5 tp10 -64.1 131.7 48.31 Favored 'General case' 0 N--CA 1.436 -1.149 0 CA-C-N 115.589 -0.732 . . . . 0.0 110.761 -176.712 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 7' ' ' LYS . . . . . . . . . . . . . 21.1 ptmt -80.22 -13.01 59.56 Favored 'General case' 0 N--CA 1.437 -1.122 0 CA-C-N 115.883 -0.599 . . . . 0.0 112.045 -176.24 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 8' ' ' ASN . . . . . 0.439 ' H ' ' HG3' ' A' ' 6' ' ' GLU . 55.7 m-20 -93.81 4.1 54.43 Favored 'General case' 0 C--N 1.313 -1.018 0 CA-C-O 121.657 0.741 . . . . 0.0 109.367 178.814 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 9' ' ' PHE . . . . . . . . . . . . . 26.8 t80 -128.49 149.52 50.55 Favored 'General case' 0 C--N 1.298 -1.665 0 N-CA-C 106.384 -1.71 . . . . 0.0 106.384 -175.53 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 10' ' ' ASP . . . . . . . . . . . . . 10.0 t70 -105.14 98.73 8.39 Favored 'General case' 0 C--N 1.302 -1.466 0 C-N-CA 119.378 -0.929 . . . . 0.0 108.899 177.172 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 11' ' ' CYS . . . . . 0.417 ' SG ' ' HB3' ' A' ' 5' ' ' ASP . 96.9 m -73.37 -25.08 60.43 Favored 'General case' 0 C--N 1.287 -2.137 0 N-CA-C 113.194 0.813 . . . . 0.0 113.194 -177.19 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 12' ' ' ARG . . . . . 0.457 ' O ' ' HG2' ' A' ' 16' ' ' ARG . 43.8 mmt-85 -69.83 -48.0 60.64 Favored 'General case' 0 C--N 1.32 -0.678 0 N-CA-C 109.502 -0.555 . . . . 0.0 109.502 179.108 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 58.3 ttp180 -64.17 -44.36 92.3 Favored 'General case' 0 C--N 1.311 -1.073 0 CA-C-N 115.54 -0.754 . . . . 0.0 110.355 178.474 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 14' ' ' SER . . . . . . . . . . . . . 25.3 m -60.53 -34.06 73.57 Favored 'General case' 0 C--O 1.25 1.129 0 CA-C-O 121.393 0.616 . . . . 0.0 110.949 179.432 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 65.3 tp -63.35 -46.57 85.94 Favored 'General case' 0 N--CA 1.439 -0.986 0 CA-C-N 115.611 -0.722 . . . . 0.0 109.306 174.956 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 16' ' ' ARG . . . . . 0.457 ' HG2' ' O ' ' A' ' 12' ' ' ARG . 31.0 mmt180 -71.75 -32.74 68.04 Favored 'General case' 0 C--N 1.315 -0.892 0 CA-C-N 115.957 -0.565 . . . . 0.0 112.236 -177.441 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 17' ' ' ASN . . . . . . . . . . . . . 77.0 m-20 -65.57 -35.53 81.12 Favored 'General case' 0 CA--C 1.494 -1.207 0 CA-C-O 121.301 0.572 . . . . 0.0 109.533 179.412 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . 110.77 11.81 18.09 Favored Glycine 0 N--CA 1.426 -1.999 0 CA-C-N 115.11 -0.95 . . . . 0.0 111.483 -178.805 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 19' ' ' ASP . . . . . . . . . . . . . 9.0 m-20 -67.49 -35.05 78.39 Favored 'General case' 0 CA--C 1.501 -0.934 0 N-CA-C 108.782 -0.821 . . . . 0.0 108.782 178.126 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 20' ' ' CYS . . . . . 0.456 ' HA ' ' HG3' ' A' ' 29' ' ' MET . 52.5 t -83.26 -4.48 58.47 Favored 'General case' 0 C--N 1.306 -1.306 0 CA-C-N 114.41 -1.268 . . . . 0.0 110.533 -179.934 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 21' ' ' ASP . . . . . . . . . . . . . 17.2 t70 -104.54 -11.85 16.78 Favored 'General case' 0 C--N 1.318 -0.77 0 CA-C-O 121.77 0.795 . . . . 0.0 109.887 -178.547 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 22' ' ' ASN . . . . . . . . . . . . . 54.1 t-20 -89.3 125.03 34.94 Favored 'General case' 0 C--N 1.311 -1.087 0 CA-C-N 115.127 -0.942 . . . . 0.0 109.243 -179.934 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 23' ' ' ASP . . . . . . . . . . . . . 5.3 p-10 -61.23 -34.34 74.96 Favored 'General case' 0 C--N 1.32 -0.708 0 O-C-N 123.434 0.459 . . . . 0.0 111.673 179.976 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 34.8 t70 -68.46 -28.76 67.33 Favored 'General case' 0 C--N 1.308 -1.209 0 CA-C-O 121.318 0.58 . . . . 0.0 111.67 -177.658 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 25' ' ' LYS . . . . . 0.418 ' O ' ' HG2' ' A' ' 29' ' ' MET . 92.3 mttt -97.18 -2.28 43.25 Favored 'General case' 0 C--N 1.309 -1.181 0 N-CA-C 112.532 0.568 . . . . 0.0 112.532 -177.462 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 26' ' ' LEU . . . . . . . . . . . . . 87.4 mt -55.84 -36.83 67.94 Favored 'General case' 0 C--N 1.312 -1.038 0 N-CA-C 113.269 0.841 . . . . 0.0 113.269 179.806 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 27' ' ' LEU . . . . . . . . . . . . . 1.3 tm? -62.71 -42.22 99.54 Favored 'General case' 0 N--CA 1.44 -0.957 0 N-CA-C 109.02 -0.734 . . . . 0.0 109.02 178.508 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 28' ' ' GLU . . . . . . . . . . . . . 8.3 mm-40 -60.74 -37.24 81.1 Favored 'General case' 0 CA--C 1.514 -0.407 0 N-CA-C 109.062 -0.718 . . . . 0.0 109.062 177.572 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 29' ' ' MET . . . . . 0.456 ' HG3' ' HA ' ' A' ' 20' ' ' CYS . 22.1 mmt -75.68 -22.29 56.82 Favored 'General case' 0 C--O 1.204 -1.29 0 CA-C-N 114.95 -1.023 . . . . 0.0 109.827 -176.744 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 30' ' ' GLY . . . . . . . . . . . . . . . -64.31 -28.03 72.45 Favored Glycine 0 C--O 1.24 0.518 0 CA-C-N 116.227 -0.442 . . . . 0.0 112.338 179.931 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 31' ' ' TYR . . . . . . . . . . . . . 20.6 p90 -113.67 -36.24 4.94 Favored 'General case' 0 N--CA 1.433 -1.318 0 N-CA-C 113.033 0.753 . . . . 0.0 113.033 177.543 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 32' ' ' TYR . . . . . . . . . . . . . 33.4 m-85 -70.0 -47.38 62.41 Favored 'General case' 0 C--N 1.306 -1.307 0 N-CA-C 113.234 0.828 . . . . 0.0 113.234 176.808 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 33' ' ' CYS . . . . . . . . . . . . . 60.4 m -136.4 58.49 21.29 Favored Pre-proline 0 C--O 1.251 1.151 0 C-N-CA 121.053 -0.259 . . . . 0.0 111.678 -173.838 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 34' ' ' PRO . . . . . 0.426 ' HA ' ' CD2' ' A' ' 39' ' ' PHE . 57.3 Cg_endo -67.35 -27.95 39.94 Favored 'Trans proline' 0 C--N 1.359 1.105 0 C-N-CA 122.012 1.808 . . . . 0.0 112.523 -174.66 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 35' ' ' VAL . . . . . 0.667 ' HB ' ' OD1' ' A' ' 5' ' ' ASP . 43.8 t -87.27 -42.9 15.58 Favored 'Isoleucine or valine' 0 C--N 1.301 -1.536 0 C-N-CA 119.971 -0.692 . . . . 0.0 110.433 -177.224 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 36' ' ' THR . . . . . . . . . . . . . 28.0 m -61.24 -40.06 92.64 Favored 'General case' 0 C--N 1.316 -0.88 0 CA-C-N 115.999 -0.546 . . . . 0.0 111.211 179.066 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 37' ' ' CYS . . . . . . . . . . . . . 74.8 m -88.18 -1.45 58.02 Favored 'General case' 0 C--N 1.311 -1.082 0 N-CA-C 113.727 1.01 . . . . 0.0 113.727 -178.954 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 38' ' ' GLY . . . . . . . . . . . . . . . 78.13 43.72 13.05 Favored Glycine 0 CA--C 1.524 0.656 0 N-CA-C 115.325 0.89 . . . . 0.0 115.325 174.908 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 39' ' ' PHE . . . . . 0.426 ' CD2' ' HA ' ' A' ' 34' ' ' PRO . 74.6 m-85 -91.32 -31.4 16.1 Favored 'General case' 0 C--N 1.315 -0.92 0 N-CA-C 108.475 -0.935 . . . . 0.0 108.475 173.886 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 40' ' ' CYS . . . . . . . . . . . . . 58.3 m . . . . . 0 C--N 1.306 -1.299 0 CA-C-N 114.956 -1.02 . . . . 0.0 109.45 -178.42 . . . . . . . . 0 0 . 1 . 018 nuclear nobuild core ' A' A ' 4' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.438 -1.055 0 N-CA-C 107.835 -1.172 . . . . 0.0 107.835 . . . . . . . . . 0 0 . 1 . 018 nuclear nobuild core ' A' A ' 5' ' ' ASP . . . . . 0.432 ' HA ' ' HD2' ' A' ' 34' ' ' PRO . 56.2 m-20 -69.51 147.54 50.7 Favored 'General case' 0 C--N 1.31 -1.121 0 N-CA-C 109.311 -0.626 . . . . 0.0 109.311 178.705 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 9.3 tp10 -67.35 128.55 36.84 Favored 'General case' 0 C--N 1.311 -1.087 0 N-CA-C 109.069 -0.715 . . . . 0.0 109.069 177.744 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 7' ' ' LYS . . . . . . . . . . . . . 19.4 ptpt -77.24 -16.93 58.82 Favored 'General case' 0 C--N 1.307 -1.257 0 CA-C-N 116.348 -0.387 . . . . 0.0 112.008 -177.527 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 8' ' ' ASN . . . . . . . . . . . . . 38.7 m-80 -94.5 4.36 53.95 Favored 'General case' 0 C--N 1.302 -1.488 0 CA-C-O 121.352 0.596 . . . . 0.0 110.321 179.353 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 9' ' ' PHE . . . . . . . . . . . . . 41.5 t80 -123.45 144.32 49.59 Favored 'General case' 0 C--N 1.299 -1.623 0 N-CA-C 106.341 -1.726 . . . . 0.0 106.341 -178.53 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 10' ' ' ASP . . . . . . . . . . . . . 8.3 t70 -102.18 91.76 4.44 Favored 'General case' 0 C--N 1.304 -1.411 0 C-N-CA 118.705 -1.198 . . . . 0.0 109.544 179.859 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 11' ' ' CYS . . . . . 0.421 ' SG ' ' HB3' ' A' ' 5' ' ' ASP . 98.3 m -69.55 -19.93 63.68 Favored 'General case' 0 C--N 1.297 -1.701 0 CA-C-N 114.799 -1.091 . . . . 0.0 112.251 -177.095 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 12' ' ' ARG . . . . . . . . . . . . . 13.8 mmt180 -74.04 -43.5 57.63 Favored 'General case' 0 C--N 1.313 -1.0 0 N-CA-C 107.653 -1.24 . . . . 0.0 107.653 -177.734 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 39.4 ttm180 -59.48 -50.3 74.47 Favored 'General case' 0 C--O 1.238 0.462 0 CA-C-N 114.905 -1.043 . . . . 0.0 110.092 175.472 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 14' ' ' SER . . . . . . . . . . . . . 50.6 m -62.14 -30.82 71.3 Favored 'General case' 0 CA--C 1.546 0.822 0 CA-C-N 116.178 -0.464 . . . . 0.0 111.591 179.633 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 15' ' ' LEU . . . . . 0.432 ' HA ' ' HB3' ' A' ' 20' ' ' CYS . 58.1 tp -67.29 -49.51 63.97 Favored 'General case' 0 N--CA 1.449 -0.522 0 N-CA-C 110.097 -0.334 . . . . 0.0 110.097 176.726 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 16' ' ' ARG . . . . . . . . . . . . . 65.7 mtp180 -62.67 -38.1 89.02 Favored 'General case' 0 C--N 1.321 -0.633 0 CA-C-N 115.434 -0.803 . . . . 0.0 112.228 -179.06 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 17' ' ' ASN . . . . . . . . . . . . . 42.0 m-80 -81.77 -14.56 56.26 Favored 'General case' 0 CA--C 1.506 -0.749 0 CA-C-O 121.017 0.437 . . . . 0.0 111.975 -178.502 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . 95.94 9.93 56.8 Favored Glycine 0 C--O 1.213 -1.201 0 C-N-CA 119.938 -1.125 . . . . 0.0 113.743 173.566 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 19' ' ' ASP . . . . . . . . . . . . . 2.6 m-20 -67.73 -34.65 77.27 Favored 'General case' 0 CA--C 1.498 -1.046 0 N-CA-C 108.072 -1.085 . . . . 0.0 108.072 178.225 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 20' ' ' CYS . . . . . 0.432 ' HB3' ' HA ' ' A' ' 15' ' ' LEU . 42.8 t -72.66 -9.46 58.63 Favored 'General case' 0 C--N 1.309 -1.193 0 CA-C-N 113.711 -1.586 . . . . 0.0 110.787 -179.046 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 21' ' ' ASP . . . . . . . . . . . . . 26.2 t70 -113.64 -10.02 13.15 Favored 'General case' 0 C--N 1.319 -0.742 0 CA-C-O 121.656 0.741 . . . . 0.0 109.672 -179.874 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 22' ' ' ASN . . . . . 0.502 ' OD1' ' HG2' ' A' ' 25' ' ' LYS . 23.5 t-20 -83.4 114.62 21.57 Favored 'General case' 0 C--N 1.298 -1.631 0 CA-C-N 115.713 -0.676 . . . . 0.0 109.958 -174.217 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 23' ' ' ASP . . . . . . . . . . . . . 18.1 t70 -49.66 -45.21 48.31 Favored 'General case' 0 N--CA 1.477 0.904 0 C-N-CA 124.231 1.012 . . . . 0.0 111.708 -176.065 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 24' ' ' ASP . . . . . 0.438 ' HB3' ' OD1' ' A' ' 22' ' ' ASN . 27.4 t70 -60.28 -32.91 71.64 Favored 'General case' 0 C--N 1.31 -1.143 0 CA-C-N 115.278 -0.874 . . . . 0.0 112.441 -178.897 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 25' ' ' LYS . . . . . 0.502 ' HG2' ' OD1' ' A' ' 22' ' ' ASN . 44.3 mmtm -94.63 -7.01 42.13 Favored 'General case' 0 C--N 1.312 -1.029 0 CA-C-N 116.301 -0.409 . . . . 0.0 111.063 -175.727 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 26' ' ' LEU . . . . . . . . . . . . . 64.8 mt -56.81 -34.79 68.04 Favored 'General case' 0 C--O 1.218 -0.553 0 N-CA-C 114.886 1.439 . . . . 0.0 114.886 -174.485 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 27' ' ' LEU . . . . . . . . . . . . . 1.3 tm? -57.52 -50.0 74.49 Favored 'General case' 0 N--CA 1.44 -0.945 0 N-CA-C 108.758 -0.83 . . . . 0.0 108.758 178.539 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 28' ' ' GLU . . . . . . . . . . . . . 1.5 mp0 -63.57 -33.81 76.42 Favored 'General case' 0 N--CA 1.449 -0.508 0 CA-C-N 115.175 -0.921 . . . . 0.0 110.424 178.583 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 29' ' ' MET . . . . . . . . . . . . . 21.7 mmt -74.15 -25.32 59.68 Favored 'General case' 0 C--O 1.2 -1.527 0 CA-C-N 116.154 -0.476 . . . . 0.0 109.856 -177.341 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 30' ' ' GLY . . . . . . . . . . . . . . . -64.44 -34.78 90.83 Favored Glycine 0 N--CA 1.446 -0.664 0 C-N-CA 121.4 -0.429 . . . . 0.0 112.375 179.64 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 31' ' ' TYR . . . . . . . . . . . . . 33.0 p90 -99.03 -36.53 9.69 Favored 'General case' 0 N--CA 1.439 -1.003 0 N-CA-C 113.35 0.87 . . . . 0.0 113.35 178.042 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 32' ' ' TYR . . . . . . . . . . . . . 37.2 m-85 -70.86 -46.61 62.34 Favored 'General case' 0 C--N 1.309 -1.169 0 N-CA-C 112.859 0.689 . . . . 0.0 112.859 177.052 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 33' ' ' CYS . . . . . . . . . . . . . 47.7 m -136.45 61.03 35.72 Favored Pre-proline 0 C--O 1.254 1.335 0 N-CA-C 112.266 0.469 . . . . 0.0 112.266 -173.324 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 34' ' ' PRO . . . . . 0.499 ' HA ' ' CD1' ' A' ' 39' ' ' PHE . 46.0 Cg_endo -65.35 -25.67 56.43 Favored 'Trans proline' 0 C--N 1.359 1.126 0 C-N-CA 121.825 1.683 . . . . 0.0 111.948 -178.567 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 35' ' ' VAL . . . . . . . . . . . . . 61.7 t -86.41 -49.64 14.89 Favored 'Isoleucine or valine' 0 C--N 1.299 -1.607 0 C-N-CA 120.573 -0.451 . . . . 0.0 111.134 -177.725 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 36' ' ' THR . . . . . . . . . . . . . 56.5 m -59.78 -42.22 92.85 Favored 'General case' 0 C--N 1.316 -0.879 0 CA-C-O 121.049 0.452 . . . . 0.0 111.615 -178.945 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 37' ' ' CYS . . . . . 0.414 ' HB2' ' CE1' ' A' ' 39' ' ' PHE . 77.4 m -85.02 1.57 47.04 Favored 'General case' 0 C--N 1.309 -1.183 0 N-CA-C 113.12 0.785 . . . . 0.0 113.12 -178.072 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 38' ' ' GLY . . . . . . . . . . . . . . . 74.26 45.38 25.08 Favored Glycine 0 CA--C 1.521 0.419 0 C-N-CA 120.546 -0.835 . . . . 0.0 114.879 174.913 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 39' ' ' PHE . . . . . 0.499 ' CD1' ' HA ' ' A' ' 34' ' ' PRO . 95.4 m-85 -94.11 -16.87 23.37 Favored 'General case' 0 C--N 1.309 -1.155 0 N-CA-C 108.581 -0.896 . . . . 0.0 108.581 174.07 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 40' ' ' CYS . . . . . 0.475 ' SG ' ' HB2' ' A' ' 34' ' ' PRO . 40.0 m . . . . . 0 C--N 1.313 -1.001 0 CA-C-N 115.048 -0.978 . . . . 0.0 110.132 -176.803 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 4' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.427 -1.617 0 N-CA-C 108.2 -1.037 . . . . 0.0 108.2 . . . . . . . . . 0 0 . 1 . 019 nuclear nobuild core ' A' A ' 5' ' ' ASP . . . . . 0.639 ' HB3' ' SG ' ' A' ' 11' ' ' CYS . 18.5 m-20 -55.91 131.33 46.82 Favored 'General case' 0 C--N 1.309 -1.155 0 O-C-N 123.96 0.787 . . . . 0.0 109.764 178.633 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 9.6 tp10 -61.71 139.39 58.31 Favored 'General case' 0 C--N 1.312 -1.049 0 C-N-CA 123.654 0.782 . . . . 0.0 110.854 -177.545 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 7' ' ' LYS . . . . . . . . . . . . . 18.6 ptpt -85.18 -26.56 26.71 Favored 'General case' 0 C--N 1.309 -1.162 0 N-CA-C 112.932 0.715 . . . . 0.0 112.932 -174.215 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 8' ' ' ASN . . . . . . . . . . . . . 10.5 p30 -92.62 7.38 43.62 Favored 'General case' 0 C--N 1.306 -1.305 0 CA-C-O 121.745 0.783 . . . . 0.0 110.415 178.453 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 9' ' ' PHE . . . . . . . . . . . . . 47.6 t80 -118.57 139.45 51.45 Favored 'General case' 0 N--CA 1.43 -1.464 0 N-CA-C 106.594 -1.632 . . . . 0.0 106.594 178.168 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 10' ' ' ASP . . . . . . . . . . . . . 10.2 t70 -96.96 105.05 17.11 Favored 'General case' 0 C--N 1.301 -1.519 0 C-N-CA 119.369 -0.932 . . . . 0.0 109.534 178.945 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 11' ' ' CYS . . . . . 0.639 ' SG ' ' HB3' ' A' ' 5' ' ' ASP . 73.9 m -74.94 -29.22 60.89 Favored 'General case' 0 C--N 1.292 -1.926 0 CA-C-N 115.642 -0.708 . . . . 0.0 112.866 -177.502 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 12' ' ' ARG . . . . . . . . . . . . . 20.0 mmm180 -72.07 -46.19 57.8 Favored 'General case' 0 CA--C 1.511 -0.536 0 C-N-CA 120.305 -0.558 . . . . 0.0 109.519 -176.09 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 41.0 ttp180 -59.08 -52.15 66.96 Favored 'General case' 0 C--O 1.205 -1.281 0 CA-C-N 114.851 -1.068 . . . . 0.0 109.421 177.996 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 14' ' ' SER . . . . . . . . . . . . . 40.6 m -58.33 -36.27 73.16 Favored 'General case' 0 C--N 1.32 -0.715 0 CA-C-N 116.066 -0.516 . . . . 0.0 111.742 -177.839 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 41.9 tp -69.73 -45.98 66.96 Favored 'General case' 0 N--CA 1.442 -0.846 0 CA-C-O 121.059 0.457 . . . . 0.0 110.065 178.987 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 16' ' ' ARG . . . . . 0.402 ' O ' ' HD2' ' A' ' 16' ' ' ARG . 2.4 tmm_? -68.54 -37.3 79.85 Favored 'General case' 0 N--CA 1.437 -1.095 0 CA-C-N 115.815 -0.63 . . . . 0.0 110.275 -179.349 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 17' ' ' ASN . . . . . . . . . . . . . 0.9 OUTLIER -68.37 -40.55 81.39 Favored 'General case' 0 CA--C 1.501 -0.92 0 CA-C-N 116.125 -0.488 . . . . 0.0 111.405 -178.535 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . 120.78 8.99 7.84 Favored Glycine 0 N--CA 1.435 -1.414 0 C-N-CA 119.869 -1.158 . . . . 0.0 112.252 -179.874 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 19' ' ' ASP . . . . . . . . . . . . . 3.5 m-20 -65.97 -29.1 69.44 Favored 'General case' 0 C--N 1.32 -0.715 0 CA-C-O 121.064 0.459 . . . . 0.0 110.811 -179.808 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 20' ' ' CYS . . . . . 0.416 ' HA ' ' HG3' ' A' ' 29' ' ' MET . 45.6 t -92.69 0.28 57.4 Favored 'General case' 0 C--N 1.31 -1.121 0 CA-C-O 121.447 0.641 . . . . 0.0 110.331 -178.535 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 21' ' ' ASP . . . . . . . . . . . . . 31.8 t70 -113.09 -11.07 13.38 Favored 'General case' 0 C--N 1.317 -0.83 0 CA-C-O 122.036 0.922 . . . . 0.0 109.238 177.638 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 22' ' ' ASN . . . . . . . . . . . . . 8.6 t30 -87.98 117.33 26.77 Favored 'General case' 0 C--N 1.301 -1.539 0 CA-C-N 114.919 -1.037 . . . . 0.0 109.784 -178.382 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 23' ' ' ASP . . . . . . . . . . . . . 18.1 t70 -50.98 -45.55 61.01 Favored 'General case' 0 N--CA 1.477 0.888 0 N-CA-C 114.073 1.138 . . . . 0.0 114.073 -172.105 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 3.8 p30 -72.22 -10.02 59.23 Favored 'General case' 0 C--N 1.315 -0.915 0 N-CA-C 113.371 0.878 . . . . 0.0 113.371 -176.468 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 25' ' ' LYS . . . . . . . . . . . . . 87.8 mttt -107.67 -7.04 16.55 Favored 'General case' 0 C--N 1.322 -0.602 0 O-C-N 122.039 -0.413 . . . . 0.0 111.683 178.954 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 26' ' ' LEU . . . . . . . . . . . . . 92.8 mt -52.85 -51.89 59.26 Favored 'General case' 0 N--CA 1.472 0.633 0 N-CA-C 113.858 1.059 . . . . 0.0 113.858 -175.271 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 27' ' ' LEU . . . . . . . . . . . . . 2.3 tm? -58.5 -41.78 86.14 Favored 'General case' 0 N--CA 1.436 -1.149 0 C-N-CA 122.688 0.395 . . . . 0.0 109.965 -179.306 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 28' ' ' GLU . . . . . 0.588 ' HA ' ' CZ ' ' A' ' 31' ' ' TYR . 80.8 mt-10 -62.96 -37.16 85.99 Favored 'General case' 0 CA--C 1.511 -0.526 0 CA-C-N 116.021 -0.536 . . . . 0.0 110.038 179.309 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 29' ' ' MET . . . . . 0.416 ' HG3' ' HA ' ' A' ' 20' ' ' CYS . 81.3 mmm -72.94 -24.84 60.86 Favored 'General case' 0 C--N 1.309 -1.186 0 CA-C-N 115.252 -0.885 . . . . 0.0 110.765 -178.22 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 30' ' ' GLY . . . . . 0.471 ' HA2' ' CE1' ' A' ' 39' ' ' PHE . . . -68.74 -24.84 75.42 Favored Glycine 0 C--N 1.312 -0.787 0 CA-C-N 115.365 -0.834 . . . . 0.0 112.55 178.182 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 31' ' ' TYR . . . . . 0.588 ' CZ ' ' HA ' ' A' ' 28' ' ' GLU 0.255 22.5 p90 -101.52 -37.67 8.3 Favored 'General case' 0 CA--C 1.5 -0.942 0 C-N-CA 119.628 -0.829 . . . . 0.0 112.787 174.883 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild core ' A' A ' 32' ' ' TYR . . . . . . . . . . . . . 28.2 m-85 -65.38 -49.28 69.91 Favored 'General case' 0 C--N 1.308 -1.226 0 N-CA-C 112.959 0.725 . . . . 0.0 112.959 176.61 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 33' ' ' CYS . . . . . . . . . . . . . 36.7 m -135.25 72.6 65.83 Favored Pre-proline 0 C--N 1.308 -1.222 0 C-N-CA 119.938 -0.705 . . . . 0.0 111.1 -177.074 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 34' ' ' PRO . . . . . 0.405 ' HD2' ' HA ' ' A' ' 5' ' ' ASP . 60.1 Cg_endo -69.26 -24.17 32.24 Favored 'Trans proline' 0 N--CA 1.45 -1.031 0 C-N-CA 122.261 1.974 . . . . 0.0 112.053 -177.436 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 35' ' ' VAL . . . . . 0.584 ' HB ' ' OD1' ' A' ' 5' ' ' ASP . 49.6 t -87.2 -46.13 16.21 Favored 'Isoleucine or valine' 0 C--N 1.301 -1.528 0 C-N-CA 119.907 -0.717 . . . . 0.0 110.571 -178.432 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 36' ' ' THR . . . . . . . . . . . . . 21.1 m -62.37 -37.18 84.73 Favored 'General case' 0 C--N 1.314 -0.955 0 CA-C-N 115.58 -0.737 . . . . 0.0 111.295 179.424 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 37' ' ' CYS . . . . . . . . . . . . . 84.4 m -92.37 11.18 26.89 Favored 'General case' 0 C--N 1.313 -0.98 0 N-CA-C 112.921 0.712 . . . . 0.0 112.921 -179.831 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 38' ' ' GLY . . . . . . . . . . . . . . . 68.85 45.5 64.02 Favored Glycine 0 CA--C 1.519 0.337 0 N-CA-C 116.002 1.161 . . . . 0.0 116.002 171.827 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 39' ' ' PHE . . . . . 0.471 ' CE1' ' HA2' ' A' ' 30' ' ' GLY . 96.8 m-85 -100.24 -30.98 11.6 Favored 'General case' 0 C--N 1.302 -1.488 0 N-CA-C 108.825 -0.805 . . . . 0.0 108.825 174.051 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 40' ' ' CYS . . . . . . . . . . . . . 75.6 m . . . . . 0 C--N 1.311 -1.095 0 CA-C-N 115.339 -0.846 . . . . 0.0 109.366 178.601 . . . . . . . . 0 0 . 1 . 020 nuclear nobuild core ' A' A ' 4' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.44 -0.934 0 N-CA-C 108.361 -0.977 . . . . 0.0 108.361 . . . . . . . . . 0 0 . 1 . 020 nuclear nobuild core ' A' A ' 5' ' ' ASP . . . . . 0.566 ' OD2' ' HB ' ' A' ' 35' ' ' VAL . 7.7 m-20 -70.11 148.68 48.45 Favored 'General case' 0 C--N 1.316 -0.859 0 N-CA-C 109.189 -0.671 . . . . 0.0 109.189 179.82 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 0.6 OUTLIER -72.52 152.08 42.09 Favored 'General case' 0 C--N 1.307 -1.259 0 N-CA-C 108.28 -1.007 . . . . 0.0 108.28 -179.095 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 7' ' ' LYS . . . . . . . . . . . . . 9.1 ptpp? -82.03 -35.32 28.94 Favored 'General case' 0 C--N 1.316 -0.879 0 N-CA-C 112.723 0.638 . . . . 0.0 112.723 -172.786 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 8' ' ' ASN . . . . . . . . . . . . . 30.7 m-80 -84.64 -31.21 24.32 Favored 'General case' 0 CA--C 1.486 -1.487 0 N-CA-C 109.29 -0.633 . . . . 0.0 109.29 -175.727 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 9' ' ' PHE . . . . . . . . . . . . . 26.6 t80 -75.12 129.05 36.9 Favored 'General case' 0 N--CA 1.424 -1.758 0 CA-C-N 114.901 -1.045 . . . . 0.0 108.744 -178.76 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 10' ' ' ASP . . . . . . . . . . . . . 9.1 t70 -89.43 102.65 15.32 Favored 'General case' 0 C--N 1.304 -1.385 0 N-CA-C 108.97 -0.752 . . . . 0.0 108.97 -179.461 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 11' ' ' CYS . . . . . 0.465 ' SG ' ' HB3' ' A' ' 5' ' ' ASP . 83.8 m -77.87 -28.55 50.04 Favored 'General case' 0 C--N 1.29 -2.018 0 CA-C-N 115.972 -0.558 . . . . 0.0 111.261 -177.299 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 12' ' ' ARG . . . . . . . . . . . . . 37.5 mmt180 -61.95 -50.27 72.82 Favored 'General case' 0 C--O 1.24 0.579 0 CA-C-O 120.998 0.428 . . . . 0.0 110.074 179.229 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 34.3 ttm180 -59.64 -55.11 38.55 Favored 'General case' 0 C--O 1.208 -1.107 0 CA-C-N 115.026 -0.988 . . . . 0.0 109.236 178.074 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 14' ' ' SER . . . . . . . . . . . . . 18.5 m -60.48 -36.61 78.71 Favored 'General case' 0 C--N 1.307 -1.26 0 CA-C-N 115.599 -0.728 . . . . 0.0 112.747 -174.094 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 45.8 tp -68.86 -47.77 65.1 Favored 'General case' 0 C--N 1.32 -0.68 0 C-N-CA 120.406 -0.517 . . . . 0.0 110.101 178.161 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 16' ' ' ARG . . . . . . . . . . . . . 60.7 mtp180 -71.78 -31.16 66.32 Favored 'General case' 0 C--N 1.324 -0.511 0 CA-C-N 115.923 -0.581 . . . . 0.0 112.008 -177.395 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 17' ' ' ASN . . . . . . . . . . . . . 0.9 OUTLIER -71.73 -33.2 68.51 Favored 'General case' 0 CA--C 1.494 -1.173 0 CA-C-N 116.424 -0.353 . . . . 0.0 111.467 -179.72 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . 116.81 10.2 10.31 Favored Glycine 0 N--CA 1.431 -1.671 0 C-N-CA 119.587 -1.292 . . . . 0.0 112.393 178.75 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 19' ' ' ASP . . . . . . . . . . . . . 4.1 m-20 -65.83 -35.5 80.84 Favored 'General case' 0 CA--C 1.494 -1.183 0 CA-C-O 121.156 0.503 . . . . 0.0 110.769 -179.018 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 20' ' ' CYS . . . . . . . . . . . . . 39.1 t -79.93 -12.45 59.73 Favored 'General case' 0 C--N 1.301 -1.513 0 CA-C-N 115.729 -0.668 . . . . 0.0 110.253 -176.758 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 21' ' ' ASP . . . . . . . . . . . . . 38.3 t70 -107.58 -0.36 22.08 Favored 'General case' 0 C--N 1.318 -0.797 0 CA-C-O 122.249 1.023 . . . . 0.0 109.146 177.108 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 22' ' ' ASN . . . . . . . . . . . . . 47.8 t-20 -87.83 118.77 27.58 Favored 'General case' 0 C--N 1.304 -1.379 0 CA-C-N 115.286 -0.87 . . . . 0.0 108.657 -179.509 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 23' ' ' ASP . . . . . 0.471 ' HA ' ' HG ' ' A' ' 26' ' ' LEU . 2.7 m-20 -53.08 -44.09 67.25 Favored 'General case' 0 C--N 1.32 -0.702 0 C-N-CA 123.694 0.798 . . . . 0.0 112.499 -177.566 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 23.0 t70 -64.69 -31.48 72.73 Favored 'General case' 0 C--N 1.318 -0.779 0 N-CA-C 112.122 0.416 . . . . 0.0 112.122 -178.737 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 25' ' ' LYS . . . . . . . . . . . . . 88.8 mttt -98.31 -5.29 33.25 Favored 'General case' 0 C--N 1.305 -1.326 0 N-CA-C 112.917 0.71 . . . . 0.0 112.917 -176.024 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 26' ' ' LEU . . . . . 0.471 ' HG ' ' HA ' ' A' ' 23' ' ' ASP . 83.9 mt -49.2 -54.36 16.92 Favored 'General case' 0 N--CA 1.482 1.172 0 N-CA-C 113.651 0.982 . . . . 0.0 113.651 -176.941 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 27' ' ' LEU . . . . . . . . . . . . . 2.2 tm? -57.71 -45.46 85.7 Favored 'General case' 0 N--CA 1.434 -1.251 0 N-CA-C 109.736 -0.468 . . . . 0.0 109.736 -177.503 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 28' ' ' GLU . . . . . . . . . . . . . 13.2 mm-40 -61.76 -37.66 85.14 Favored 'General case' 0 C--N 1.327 -0.402 0 CA-C-N 115.4 -0.818 . . . . 0.0 110.277 -178.047 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 29' ' ' MET . . . . . . . . . . . . . 80.2 mmm -73.76 -26.18 60.53 Favored 'General case' 0 C--N 1.307 -1.252 0 CA-C-N 114.907 -1.042 . . . . 0.0 111.609 -174.342 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 30' ' ' GLY . . . . . 0.471 ' HA2' ' CE2' ' A' ' 39' ' ' PHE . . . -68.07 -33.21 78.28 Favored Glycine 0 N--CA 1.439 -1.138 0 CA-C-N 115.46 -0.791 . . . . 0.0 112.758 -179.678 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 31' ' ' TYR . . . . . . . . . . . . . 44.8 p90 -96.98 -33.32 11.61 Favored 'General case' 0 CA--C 1.498 -1.028 0 C-N-CA 118.86 -1.136 . . . . 0.0 113.207 178.46 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 32' ' ' TYR . . . . . . . . . . . . . 36.5 m-85 -69.13 -42.99 75.27 Favored 'General case' 0 C--N 1.304 -1.413 0 N-CA-C 112.717 0.636 . . . . 0.0 112.717 175.96 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 33' ' ' CYS . . . . . . . . . . . . . 44.8 m -135.45 68.35 67.5 Favored Pre-proline 0 C--O 1.246 0.917 0 C-N-CA 120.194 -0.602 . . . . 0.0 112.007 -179.165 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 34' ' ' PRO . . . . . 0.532 ' HD2' ' HA ' ' A' ' 5' ' ' ASP . 58.4 Cg_endo -69.72 -23.65 30.73 Favored 'Trans proline' 0 C--N 1.355 0.889 0 C-N-CA 122.026 1.818 . . . . 0.0 111.931 -178.777 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 35' ' ' VAL . . . . . 0.566 ' HB ' ' OD2' ' A' ' 5' ' ' ASP . 66.1 t -86.54 -52.36 11.95 Favored 'Isoleucine or valine' 0 C--N 1.295 -1.797 0 C-N-CA 120.144 -0.622 . . . . 0.0 110.544 -178.086 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 36' ' ' THR . . . . . . . . . . . . . 23.3 m -60.41 -27.11 67.2 Favored 'General case' 0 CA--C 1.556 1.176 0 C-N-CA 123.188 0.595 . . . . 0.0 111.887 -178.195 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 37' ' ' CYS . . . . . . . . . . . . . 67.4 m -99.73 5.39 45.69 Favored 'General case' 0 C--N 1.319 -0.719 0 N-CA-C 113.792 1.034 . . . . 0.0 113.792 179.736 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 38' ' ' GLY . . . . . . . . . . . . . . . 76.93 34.72 41.57 Favored Glycine 0 CA--C 1.525 0.683 0 N-CA-C 115.426 0.931 . . . . 0.0 115.426 174.624 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 39' ' ' PHE . . . . . 0.488 ' CD2' ' HA ' ' A' ' 34' ' ' PRO . 90.2 m-85 -88.89 -44.37 10.51 Favored 'General case' 0 C--N 1.311 -1.079 0 N-CA-C 108.252 -1.018 . . . . 0.0 108.252 175.102 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 40' ' ' CYS . . . . . . . . . . . . . 57.9 m . . . . . 0 C--N 1.305 -1.359 0 CA-C-N 114.737 -1.119 . . . . 0.0 109.024 -179.266 . . . . . . . . 0 0 . 1 . 001 nuclear nobuild full ' A' A ' 1' ' ' GLU . . . . . . . . . . . . . 9.7 tp10 . . . . . 0 N--CA 1.445 -0.696 0 N-CA-C 109.368 -0.604 . . . . 0.0 109.368 . . . . . . . . . 0 0 . 1 . 001 nuclear nobuild full ' A' A ' 2' ' ' HIS . . . . . . . . . . . . . 40.0 m80 -84.92 112.29 20.44 Favored 'General case' 0 C--N 1.315 -0.911 0 N-CA-C 107.463 -1.31 . . . . 0.0 107.463 174.98 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 3' ' ' CYS . . . . . . . . . . . . . 23.6 p -85.04 146.76 27.01 Favored 'General case' 0 C--N 1.29 -2.01 0 CA-C-N 115.05 -0.977 . . . . 0.0 112.06 -171.702 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 4' ' ' ALA . . . . . . . . . . . . . . . -152.01 132.11 13.5 Favored 'General case' 0 C--N 1.306 -1.325 0 N-CA-C 108.353 -0.98 . . . . 0.0 108.353 177.65 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 5' ' ' ASP . . . . . 0.693 ' OD2' ' HB ' ' A' ' 35' ' ' VAL . 16.6 m-20 -59.85 141.56 55.16 Favored 'General case' 0 C--O 1.253 1.265 0 O-C-N 123.728 0.643 . . . . 0.0 110.068 177.001 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 0.2 OUTLIER -69.22 152.02 45.59 Favored 'General case' 0 C--N 1.307 -1.277 0 CA-C-N 115.678 -0.692 . . . . 0.0 109.63 -178.394 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 7' ' ' LYS . . . . . . . . . . . . . 8.6 ptpp? -85.61 -34.49 21.39 Favored 'General case' 0 C--N 1.31 -1.132 0 C-N-CA 123.659 0.784 . . . . 0.0 112.845 -175.875 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 8' ' ' ASN . . . . . . . . . . . . . 90.2 m-20 -94.33 -21.05 19.23 Favored 'General case' 0 C--N 1.299 -1.587 0 CA-C-N 115.978 -0.555 . . . . 0.0 111.108 -175.803 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 9' ' ' PHE . . . . . 0.583 ' HD2' ' SG ' ' A' ' 33' ' ' CYS . 37.3 t80 -83.55 129.42 34.97 Favored 'General case' 0 C--N 1.301 -1.507 0 N-CA-C 107.013 -1.477 . . . . 0.0 107.013 175.953 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 10' ' ' ASP . . . . . . . . . . . . . 12.5 t70 -86.76 107.05 18.09 Favored 'General case' 0 C--N 1.307 -1.28 0 C-N-CA 118.762 -1.175 . . . . 0.0 110.111 -179.831 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 11' ' ' CYS . . . . . 0.527 ' SG ' ' HB3' ' A' ' 5' ' ' ASP . 50.9 m -73.58 -27.34 61.26 Favored 'General case' 0 C--N 1.297 -1.706 0 CA-C-N 114.901 -1.045 . . . . 0.0 111.822 -176.406 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 12' ' ' ARG . . . . . . . . . . . . . 34.4 mmt180 -76.66 -45.88 28.01 Favored 'General case' 0 CA--C 1.506 -0.735 0 CA-C-O 120.859 0.362 . . . . 0.0 110.304 -175.217 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 37.2 ttm180 -61.26 -49.66 76.17 Favored 'General case' 0 C--N 1.31 -1.152 0 CA-C-N 115.384 -0.825 . . . . 0.0 109.239 178.616 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 14' ' ' SER . . . . . . . . . . . . . 23.7 m -59.86 -35.19 74.28 Favored 'General case' 0 CA--C 1.547 0.837 0 O-C-N 123.678 0.611 . . . . 0.0 111.629 -178.752 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 47.6 tp -71.69 -41.48 68.59 Favored 'General case' 0 C--N 1.322 -0.616 0 N-CA-C 109.643 -0.502 . . . . 0.0 109.643 178.316 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 16' ' ' ARG . . . . . . . . . . . . . 21.0 tpp180 -67.46 -35.06 78.46 Favored 'General case' 0 N--CA 1.427 -1.604 0 C-N-CA 123.9 0.88 . . . . 0.0 111.47 179.908 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 17' ' ' ASN . . . . . . . . . . . . . 86.0 m-20 -67.96 -47.4 68.75 Favored 'General case' 0 CA--C 1.5 -0.95 0 N-CA-C 108.611 -0.885 . . . . 0.0 108.611 178.266 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . 113.23 19.26 6.79 Favored Glycine 0 N--CA 1.421 -2.311 0 CA-C-N 114.426 -1.261 . . . . 0.0 110.518 -176.056 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 19' ' ' ASP . . . . . . . . . . . . . 10.4 m-20 -58.33 -38.99 78.26 Favored 'General case' 0 CA--C 1.5 -0.971 0 CA-C-O 121.276 0.56 . . . . 0.0 110.055 179.666 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 20' ' ' CYS . . . . . 0.436 ' HA ' ' HG3' ' A' ' 29' ' ' MET . 34.8 t -78.43 -4.01 46.24 Favored 'General case' 0 C--N 1.306 -1.296 0 CA-C-N 115.623 -0.717 . . . . 0.0 111.977 -176.395 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 21' ' ' ASP . . . . . . . . . . . . . 12.3 t70 -99.35 -9.72 23.18 Favored 'General case' 0 C--N 1.315 -0.923 0 CA-C-O 122.233 1.015 . . . . 0.0 108.469 178.402 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 22' ' ' ASN . . . . . . . . . . . . . 25.0 t-20 -84.3 122.59 29.12 Favored 'General case' 0 C--N 1.315 -0.915 0 CA-C-N 114.765 -1.107 . . . . 0.0 108.19 178.902 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 23' ' ' ASP . . . . . . . . . . . . . 20.1 t70 -55.2 -41.47 72.03 Favored 'General case' 0 C--N 1.318 -0.765 0 N-CA-C 113.266 0.839 . . . . 0.0 113.266 -176.368 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 14.4 m-20 -78.44 -16.33 57.69 Favored 'General case' 0 C--N 1.311 -1.073 0 CA-C-O 121.51 0.671 . . . . 0.0 111.405 -176.345 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 25' ' ' LYS . . . . . . . . . . . . . 34.9 mttm -95.06 -7.46 39.49 Favored 'General case' 0 C--N 1.303 -1.445 0 CA-C-N 115.87 -0.605 . . . . 0.0 111.74 176.588 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 26' ' ' LEU . . . . . . . . . . . . . 85.7 mt -55.74 -43.92 77.06 Favored 'General case' 0 C--N 1.314 -0.951 0 O-C-N 123.141 0.275 . . . . 0.0 111.043 176.881 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 27' ' ' LEU . . . . . . . . . . . . . 24.1 tp -57.21 -49.49 75.83 Favored 'General case' 0 N--CA 1.436 -1.162 0 CA-C-O 121.327 0.584 . . . . 0.0 109.498 176.987 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 28' ' ' GLU . . . . . . . . . . . . . 40.3 tt0 -58.19 -36.94 73.82 Favored 'General case' 0 C--N 1.325 -0.464 0 CA-C-N 114.559 -1.201 . . . . 0.0 109.977 -179.266 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 29' ' ' MET . . . . . 0.436 ' HG3' ' HA ' ' A' ' 20' ' ' CYS . 82.7 mmm -83.89 -23.23 31.33 Favored 'General case' 0 C--N 1.3 -1.554 0 CA-C-N 115.173 -0.921 . . . . 0.0 111.658 -174.825 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 30' ' ' GLY . . . . . . . . . . . . . . . -66.77 -28.46 73.78 Favored Glycine 0 C--N 1.308 -1.027 0 CA-C-N 115.192 -0.913 . . . . 0.0 112.234 179.638 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 31' ' ' TYR . . . . . . . . . . . . . 30.0 p90 -105.0 -34.01 8.14 Favored 'General case' 0 N--CA 1.435 -1.221 0 N-CA-C 113.404 0.89 . . . . 0.0 113.404 177.06 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 32' ' ' TYR . . . . . 0.422 ' HB3' ' CD2' ' A' ' 9' ' ' PHE . 19.2 m-85 -71.44 -62.05 1.55 Allowed 'General case' 0 C--N 1.308 -1.229 0 N-CA-C 113.623 0.971 . . . . 0.0 113.623 178.33 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 33' ' ' CYS . . . . . 0.583 ' SG ' ' HD2' ' A' ' 9' ' ' PHE . 62.6 m -134.31 70.3 73.17 Favored Pre-proline 0 C--N 1.299 -1.63 0 C-N-CA 119.896 -0.721 . . . . 0.0 110.988 -177.31 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 34' ' ' PRO . . . . . . . . . . . . . 71.7 Cg_endo -75.87 -23.77 12.11 Favored 'Trans proline' 0 N--CA 1.445 -1.331 0 C-N-CA 122.154 1.903 . . . . 0.0 112.438 -175.408 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 35' ' ' VAL . . . . . 0.693 ' HB ' ' OD2' ' A' ' 5' ' ' ASP . 39.3 t -82.73 -36.72 13.52 Favored 'Isoleucine or valine' 0 N--CA 1.424 -1.751 0 N-CA-C 108.826 -0.805 . . . . 0.0 108.826 -177.145 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 36' ' ' THR . . . . . . . . . . . . . 48.2 m -64.12 -34.86 79.01 Favored 'General case' 0 CA--C 1.546 0.804 0 CA-C-N 115.305 -0.861 . . . . 0.0 110.635 175.362 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 37' ' ' CYS . . . . . . . . . . . . . 90.9 m -84.79 2.11 43.71 Favored 'General case' 0 C--N 1.322 -0.59 0 CA-C-O 121.087 0.47 . . . . 0.0 112.243 177.767 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 38' ' ' GLY . . . . . . . . . . . . . . . 69.58 26.58 74.33 Favored Glycine 0 N--CA 1.445 -0.744 0 CA-C-N 116.124 -0.489 . . . . 0.0 114.224 176.086 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 39' ' ' PHE . . . . . . . . . . . . . 26.8 m-85 -75.05 -34.66 61.87 Favored 'General case' 0 CA--C 1.507 -0.687 0 N-CA-C 108.464 -0.939 . . . . 0.0 108.464 178.402 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 40' ' ' CYS . . . . . . . . . . . . . 3.3 p -159.55 86.28 0.79 Allowed 'General case' 0 C--N 1.306 -1.285 0 CA-C-N 114.537 -1.211 . . . . 0.0 109.989 -179.488 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 41' ' ' NH2 . . . . . . . . . . . . . . . . . . . . 0 C--N 1.307 -1.248 0 CA-C-N 116.11 -0.495 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 002 nuclear nobuild full ' A' A ' 1' ' ' GLU . . . . . . . . . . . . . 11.3 pt-20 . . . . . 0 C--O 1.236 0.375 0 N-CA-C 109.262 -0.644 . . . . 0.0 109.262 . . . . . . . . . 0 0 . 1 . 002 nuclear nobuild full ' A' A ' 2' ' ' HIS . . . . . . . . . . . . . 69.1 m-70 -107.1 112.18 24.98 Favored 'General case' 0 C--N 1.304 -1.39 0 N-CA-C 109.107 -0.701 . . . . 0.0 109.107 177.464 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 3' ' ' CYS . . . . . . . . . . . . . 26.3 p -71.58 102.59 2.77 Favored 'General case' 0 N--CA 1.438 -1.064 0 N-CA-C 108.501 -0.925 . . . . 0.0 108.501 176.073 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 4' ' ' ALA . . . . . . . . . . . . . . . -147.61 145.43 28.99 Favored 'General case' 0 C--N 1.305 -1.328 0 CA-C-N 115.685 -0.688 . . . . 0.0 109.571 -176.435 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 5' ' ' ASP . . . . . 0.626 ' OD2' ' HB ' ' A' ' 35' ' ' VAL . 4.2 m-20 -65.55 160.79 21.61 Favored 'General case' 0 C--N 1.307 -1.244 0 O-C-N 123.779 0.674 . . . . 0.0 109.803 179.381 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 6' ' ' GLU . . . . . 0.448 ' HB3' ' HB3' ' A' ' 9' ' ' PHE . 0.6 OUTLIER -71.25 139.87 50.19 Favored 'General case' 0 C--N 1.309 -1.179 0 N-CA-C 106.537 -1.653 . . . . 0.0 106.537 179.147 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 7' ' ' LYS . . . . . . . . . . . . . 19.5 ptmt -82.19 -26.56 33.25 Favored 'General case' 0 C--N 1.303 -1.421 0 N-CA-C 113.691 0.997 . . . . 0.0 113.691 -171.098 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 8' ' ' ASN . . . . . . . . . . . . . 37.8 m-80 -89.86 -31.22 17.43 Favored 'General case' 0 C--N 1.294 -1.809 0 CA-C-O 121.451 0.644 . . . . 0.0 109.4 -179.23 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 9' ' ' PHE . . . . . 0.457 ' CD2' ' HB3' ' A' ' 32' ' ' TYR . 32.9 t80 -76.55 119.37 20.29 Favored 'General case' 0 N--CA 1.424 -1.771 0 N-CA-C 107.751 -1.203 . . . . 0.0 107.751 176.691 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 10' ' ' ASP . . . . . . . . . . . . . 15.4 t70 -88.39 96.14 10.48 Favored 'General case' 0 C--N 1.294 -1.828 0 N-CA-C 109.002 -0.74 . . . . 0.0 109.002 -179.905 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 11' ' ' CYS . . . . . . . . . . . . . 96.1 m -70.35 -19.53 63.04 Favored 'General case' 0 C--N 1.312 -1.036 0 CA-C-N 115.387 -0.824 . . . . 0.0 111.902 -178.441 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 12' ' ' ARG . . . . . . . . . . . . . 36.3 mmt180 -66.8 -43.36 84.06 Favored 'General case' 0 C--N 1.319 -0.746 0 N-CA-C 108.805 -0.813 . . . . 0.0 108.805 178.287 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 58.6 ttp180 -64.01 -50.08 69.91 Favored 'General case' 0 C--O 1.211 -0.953 0 CA-C-N 115.327 -0.851 . . . . 0.0 109.511 175.52 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 14' ' ' SER . . . . . . . . . . . . . 11.7 m -57.4 -40.07 77.46 Favored 'General case' 0 C--O 1.252 1.194 0 C-N-CA 122.909 0.483 . . . . 0.0 112.087 -178.621 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 46.0 tp -64.77 -41.14 96.1 Favored 'General case' 0 C--N 1.327 -0.388 0 CA-C-O 121.306 0.574 . . . . 0.0 110.259 179.686 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 16' ' ' ARG . . . . . . . . . . . . . 60.5 mtm180 -77.82 -28.2 50.2 Favored 'General case' 0 C--N 1.305 -1.342 0 CA-C-N 116.036 -0.529 . . . . 0.0 111.475 179.523 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 17' ' ' ASN . . . . . . . . . . . . . 0.9 OUTLIER -69.1 -25.93 64.67 Favored 'General case' 0 N--CA 1.477 0.899 0 CA-C-N 115.811 -0.631 . . . . 0.0 111.226 178.277 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . 102.89 6.4 46.11 Favored Glycine 0 N--CA 1.439 -1.101 0 C-N-CA 120.527 -0.844 . . . . 0.0 112.273 178.024 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 19' ' ' ASP . . . . . . . . . . . . . 15.6 m-20 -73.13 -27.25 61.57 Favored 'General case' 0 CA--C 1.504 -0.805 0 CA-C-O 120.937 0.398 . . . . 0.0 111.53 -178.631 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 20' ' ' CYS . . . . . 0.44 ' HA ' ' HG3' ' A' ' 29' ' ' MET . 46.6 t -81.29 -9.91 59.67 Favored 'General case' 0 C--N 1.306 -1.303 0 CA-C-O 121.669 0.747 . . . . 0.0 110.051 179.92 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 21' ' ' ASP . . . . . . . . . . . . . 28.3 t70 -101.67 -8.9 21.37 Favored 'General case' 0 C--N 1.318 -0.791 0 CA-C-O 121.998 0.904 . . . . 0.0 108.946 177.509 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 22' ' ' ASN . . . . . . . . . . . . . 52.5 t-20 -88.09 123.06 32.38 Favored 'General case' 0 C--N 1.305 -1.368 0 CA-C-N 115.453 -0.794 . . . . 0.0 109.215 -178.896 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 23' ' ' ASP . . . . . 0.407 ' HA ' ' HG ' ' A' ' 26' ' ' LEU . 6.9 m-20 -59.38 -35.34 73.75 Favored 'General case' 0 CA--C 1.507 -0.688 0 C-N-CA 123.61 0.764 . . . . 0.0 111.466 179.857 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 11.8 t70 -66.6 -32.6 74.03 Favored 'General case' 0 C--N 1.311 -1.104 0 C-N-CA 123.59 0.756 . . . . 0.0 111.802 -179.207 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 25' ' ' LYS . . . . . 0.519 ' O ' ' HG2' ' A' ' 29' ' ' MET . 33.8 mmtp -94.01 -2.44 53.01 Favored 'General case' 0 C--N 1.31 -1.117 0 CA-C-N 116.124 -0.489 . . . . 0.0 112.234 -177.358 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 26' ' ' LEU . . . . . 0.407 ' HG ' ' HA ' ' A' ' 23' ' ' ASP . 88.6 mt -58.89 -38.6 79.22 Favored 'General case' 0 N--CA 1.469 0.504 0 N-CA-C 112.834 0.679 . . . . 0.0 112.834 -176.95 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 27' ' ' LEU . . . . . . . . . . . . . 24.4 tp -55.28 -49.89 70.93 Favored 'General case' 0 N--CA 1.437 -1.092 0 N-CA-C 109.436 -0.579 . . . . 0.0 109.436 176.376 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 28' ' ' GLU . . . . . . . . . . . . . 5.7 mm-40 -61.86 -36.78 82.26 Favored 'General case' 0 C--N 1.324 -0.518 0 CA-C-N 114.603 -1.18 . . . . 0.0 109.141 -179.22 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 29' ' ' MET . . . . . 0.519 ' HG2' ' O ' ' A' ' 25' ' ' LYS . 22.3 mmt -70.94 -27.45 63.77 Favored 'General case' 0 C--O 1.203 -1.384 0 CA-C-N 115.203 -0.908 . . . . 0.0 110.885 -175.324 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 30' ' ' GLY . . . . . . . . . . . . . . . -68.42 -34.4 79.49 Favored Glycine 0 C--N 1.312 -0.777 0 C-N-CA 120.186 -1.007 . . . . 0.0 112.768 -178.321 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 31' ' ' TYR . . . . . . . . . . . . . 36.3 p90 -103.15 -27.6 12.44 Favored 'General case' 0 N--CA 1.441 -0.883 0 N-CA-C 113.663 0.986 . . . . 0.0 113.663 179.913 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 32' ' ' TYR . . . . . 0.457 ' HB3' ' CD2' ' A' ' 9' ' ' PHE . 23.0 m-85 -83.35 -36.83 24.06 Favored 'General case' 0 C--N 1.29 -2.018 0 N-CA-C 112.626 0.602 . . . . 0.0 112.626 175.852 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 33' ' ' CYS . . . . . . . . . . . . . 61.0 m -134.71 49.86 4.26 Favored Pre-proline 0 CA--C 1.565 1.528 0 N-CA-C 113.369 0.878 . . . . 0.0 113.369 -174.893 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 34' ' ' PRO . . . . . 0.563 ' HD2' ' HA ' ' A' ' 5' ' ' ASP . 21.7 Cg_endo -57.33 -32.3 93.43 Favored 'Trans proline' 0 C--N 1.38 2.21 0 C-N-CA 122.733 2.289 . . . . 0.0 113.591 -178.916 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 35' ' ' VAL . . . . . 0.626 ' HB ' ' OD2' ' A' ' 5' ' ' ASP . 45.3 t -87.07 -46.76 16.21 Favored 'Isoleucine or valine' 0 C--N 1.299 -1.629 0 C-N-CA 119.917 -0.713 . . . . 0.0 110.892 -177.46 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 36' ' ' THR . . . . . . . . . . . . . 19.5 m -61.56 -40.95 96.56 Favored 'General case' 0 C--N 1.312 -1.053 0 CA-C-N 115.972 -0.558 . . . . 0.0 111.769 -177.336 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 37' ' ' CYS . . . . . . . . . . . . . 94.4 m -91.95 10.91 26.92 Favored 'General case' 0 C--N 1.312 -1.058 0 N-CA-C 113.173 0.805 . . . . 0.0 113.173 -179.163 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 38' ' ' GLY . . . . . . . . . . . . . . . 69.87 48.61 40.33 Favored Glycine 0 CA--C 1.524 0.645 0 N-CA-C 115.761 1.064 . . . . 0.0 115.761 172.908 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 39' ' ' PHE . . . . . 0.522 ' CD2' ' HA ' ' A' ' 34' ' ' PRO . 93.1 m-85 -96.32 -40.1 9.3 Favored 'General case' 0 C--N 1.303 -1.424 0 N-CA-C 107.749 -1.204 . . . . 0.0 107.749 173.183 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 40' ' ' CYS . . . . . . . . . . . . . 49.8 t -148.9 89.41 1.67 Allowed 'General case' 0 C--N 1.309 -1.156 0 N-CA-C 107.878 -1.156 . . . . 0.0 107.878 179.868 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 41' ' ' NH2 . . . . . . . . . . . . . . . . . . . . 0 C--N 1.302 -1.479 0 CA-C-N 116.657 -0.247 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 003 nuclear nobuild full ' A' A ' 1' ' ' GLU . . . . . . . . . . . . . 9.7 tp10 . . . . . 0 C--O 1.241 0.624 0 N-CA-C 108.46 -0.941 . . . . 0.0 108.46 . . . . . . . . . 0 0 . 1 . 003 nuclear nobuild full ' A' A ' 2' ' ' HIS . . . . . . . . . . . . . 40.4 m80 -96.42 110.36 22.73 Favored 'General case' 0 N--CA 1.432 -1.344 0 N-CA-C 108.711 -0.848 . . . . 0.0 108.711 178.728 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 3' ' ' CYS . . . . . 0.465 ' HB3' ' O ' ' A' ' 40' ' ' CYS . 60.7 m -87.46 84.9 7.09 Favored 'General case' 0 C--N 1.297 -1.705 0 CA-C-N 115.876 -0.602 . . . . 0.0 110.903 179.571 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 4' ' ' ALA . . . . . . . . . . . . . . . -152.5 133.68 14.28 Favored 'General case' 0 C--N 1.302 -1.486 0 N-CA-C 108.64 -0.874 . . . . 0.0 108.64 178.847 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 5' ' ' ASP . . . . . 0.582 ' HB3' ' SG ' ' A' ' 11' ' ' CYS . 44.4 m-20 -60.69 141.62 56.63 Favored 'General case' 0 C--N 1.317 -0.825 0 O-C-N 123.733 0.645 . . . . 0.0 110.2 178.945 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 13.3 tp10 -64.11 140.39 58.86 Favored 'General case' 0 N--CA 1.443 -0.825 0 C-N-CA 123.682 0.793 . . . . 0.0 111.543 -178.95 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 7' ' ' LYS . . . . . . . . . . . . . 10.3 ptpp? -85.18 -29.97 24.3 Favored 'General case' 0 N--CA 1.441 -0.905 0 C-N-CA 124.353 1.061 . . . . 0.0 111.227 -176.498 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 8' ' ' ASN . . . . . . . . . . . . . 44.9 m-80 -86.74 -9.17 56.52 Favored 'General case' 0 C--N 1.308 -1.208 0 CA-C-O 121.817 0.818 . . . . 0.0 110.83 -178.497 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 9' ' ' PHE . . . . . . . . . . . . . 36.5 t80 -112.16 144.96 40.68 Favored 'General case' 0 C--N 1.287 -2.12 0 N-CA-C 105.524 -2.028 . . . . 0.0 105.524 -178.834 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 10' ' ' ASP . . . . . . . . . . . . . 15.3 t70 -104.49 98.77 8.49 Favored 'General case' 0 C--N 1.304 -1.403 0 C-N-CA 117.779 -1.568 . . . . 0.0 110.417 179.274 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 11' ' ' CYS . . . . . 0.582 ' SG ' ' HB3' ' A' ' 5' ' ' ASP . 76.1 m -68.33 -20.34 64.72 Favored 'General case' 0 C--N 1.304 -1.393 0 CA-C-N 114.51 -1.223 . . . . 0.0 112.274 -177.924 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 12' ' ' ARG . . . . . . . . . . . . . 7.3 mmt180 -76.6 -46.58 25.51 Favored 'General case' 0 C--N 1.315 -0.899 0 N-CA-C 107.628 -1.249 . . . . 0.0 107.628 -176.793 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 54.9 ttp180 -61.91 -40.95 97.25 Favored 'General case' 0 C--O 1.213 -0.846 0 CA-C-N 115.501 -0.772 . . . . 0.0 109.504 175.51 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 14' ' ' SER . . . . . . . . . . . . . 23.4 m -65.84 -28.02 68.67 Favored 'General case' 0 C--N 1.318 -0.773 0 CA-C-O 121.18 0.515 . . . . 0.0 111.252 179.01 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 2.3 tm? -77.56 -39.36 46.04 Favored 'General case' 0 C--N 1.316 -0.87 0 N-CA-C 107.803 -1.184 . . . . 0.0 107.803 177.267 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 16' ' ' ARG . . . . . . . . . . . . . 23.7 mtp180 -68.24 -44.89 74.65 Favored 'General case' 0 C--N 1.323 -0.548 0 CA-C-N 115.633 -0.712 . . . . 0.0 111.817 179.326 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 17' ' ' ASN . . . . . . . . . . . . . 85.3 m-20 -64.96 -37.95 89.35 Favored 'General case' 0 CA--C 1.496 -1.131 0 CA-C-O 121.67 0.747 . . . . 0.0 109.111 177.164 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . 107.74 5.45 33.63 Favored Glycine 0 N--CA 1.416 -2.657 0 CA-C-N 114.652 -1.158 . . . . 0.0 111.5 -179.122 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 19' ' ' ASP . . . . . . . . . . . . . 30.5 m-20 -57.9 -38.22 75.44 Favored 'General case' 0 N--CA 1.494 1.775 0 CA-C-O 121.618 0.723 . . . . 0.0 109.299 179.345 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 20' ' ' CYS . . . . . . . . . . . . . 44.5 t -61.45 -25.55 67.3 Favored 'General case' 0 C--N 1.31 -1.144 0 CA-C-N 114.198 -1.365 . . . . 0.0 111.982 -178.117 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 21' ' ' ASP . . . . . . . . . . . . . 28.5 t70 -111.28 -9.25 14.3 Favored 'General case' 0 C--N 1.319 -0.725 0 CA-C-O 121.646 0.736 . . . . 0.0 110.248 -179.194 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 22' ' ' ASN . . . . . . . . . . . . . 51.8 t-20 -75.54 119.51 19.7 Favored 'General case' 0 C--N 1.313 -0.996 0 CA-C-N 115.317 -0.856 . . . . 0.0 108.904 -177.272 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 23' ' ' ASP . . . . . 0.44 ' HA ' ' HG ' ' A' ' 26' ' ' LEU . 6.1 m-20 -54.06 -36.71 63.4 Favored 'General case' 0 CA--C 1.501 -0.914 0 C-N-CA 123.545 0.738 . . . . 0.0 112.505 -177.906 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 35.8 m-20 -72.62 -21.41 61.11 Favored 'General case' 0 C--N 1.308 -1.205 0 CA-C-N 115.969 -0.56 . . . . 0.0 111.504 -175.549 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 25' ' ' LYS . . . . . 0.525 ' O ' ' HG2' ' A' ' 29' ' ' MET . 13.3 mptt -104.6 -5.19 21.69 Favored 'General case' 0 C--N 1.311 -1.08 0 N-CA-C 112.1 0.407 . . . . 0.0 112.1 178.29 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 26' ' ' LEU . . . . . 0.44 ' HG ' ' HA ' ' A' ' 23' ' ' ASP . 62.8 mt -52.07 -38.88 58.63 Favored 'General case' 0 N--CA 1.479 0.981 0 N-CA-C 114.657 1.354 . . . . 0.0 114.657 -175.162 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 27' ' ' LEU . . . . . . . . . . . . . 29.6 tp -54.81 -52.72 61.82 Favored 'General case' 0 N--CA 1.44 -0.953 0 CA-C-O 121.048 0.451 . . . . 0.0 109.935 178.059 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 28' ' ' GLU . . . . . 0.5 ' HA ' ' CE2' ' A' ' 31' ' ' TYR . 43.6 mt-10 -65.2 -33.2 75.43 Favored 'General case' 0 N--CA 1.442 -0.829 0 CA-C-N 115.296 -0.865 . . . . 0.0 109.685 -178.197 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 29' ' ' MET . . . . . 0.525 ' HG2' ' O ' ' A' ' 25' ' ' LYS . 72.7 mmm -75.75 -26.54 57.5 Favored 'General case' 0 C--N 1.31 -1.151 0 CA-C-N 115.263 -0.88 . . . . 0.0 111.003 -174.71 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 30' ' ' GLY . . . . . 0.458 ' HA2' ' CE2' ' A' ' 39' ' ' PHE . . . -65.63 -37.31 93.45 Favored Glycine 0 CA--C 1.494 -1.232 0 O-C-N 123.944 0.778 . . . . 0.0 112.174 -178.955 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 31' ' ' TYR . . . . . 0.5 ' CE2' ' HA ' ' A' ' 28' ' ' GLU . 52.3 p90 -96.72 -34.74 11.24 Favored 'General case' 0 N--CA 1.433 -1.307 0 C-N-CA 119.697 -0.801 . . . . 0.0 112.755 178.901 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 32' ' ' TYR . . . . . . . . . . . . . 27.5 m-85 -69.71 -50.42 43.79 Favored 'General case' 0 C--N 1.312 -1.024 0 N-CA-C 112.954 0.724 . . . . 0.0 112.954 177.403 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 33' ' ' CYS . . . . . . . . . . . . . 29.8 m -130.45 69.58 82.16 Favored Pre-proline 0 C--O 1.259 1.574 0 C-N-CA 120.128 -0.629 . . . . 0.0 111.388 -175.836 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 34' ' ' PRO . . . . . 0.434 ' HA ' ' HD2' ' A' ' 39' ' ' PHE . 38.2 Cg_endo -65.28 -26.54 56.37 Favored 'Trans proline' 0 C--N 1.362 1.268 0 C-N-CA 122.429 2.086 . . . . 0.0 112.067 -177.944 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 35' ' ' VAL . . . . . . . . . . . . . 33.5 t -86.78 -49.89 14.52 Favored 'Isoleucine or valine' 0 N--CA 1.433 -1.302 0 CA-C-N 116.091 -0.504 . . . . 0.0 110.966 -176.198 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 36' ' ' THR . . . . . . . . . . . . . 29.0 m -55.68 -52.14 64.87 Favored 'General case' 0 C--N 1.316 -0.875 0 C-N-CA 123.28 0.632 . . . . 0.0 112.644 -177.685 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 37' ' ' CYS . . . . . 0.604 ' HB2' ' CE2' ' A' ' 39' ' ' PHE . 59.6 m -76.83 -11.43 59.83 Favored 'General case' 0 C--N 1.305 -1.333 0 N-CA-C 112.659 0.614 . . . . 0.0 112.659 -176.886 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 38' ' ' GLY . . . . . . . . . . . . . . . 88.97 46.78 4.38 Favored Glycine 0 N--CA 1.442 -0.96 0 C-N-CA 120.391 -0.909 . . . . 0.0 113.724 176.827 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 39' ' ' PHE . . . . . 0.604 ' CE2' ' HB2' ' A' ' 37' ' ' CYS . 98.1 m-85 -98.31 -59.88 1.66 Allowed 'General case' 0 C--N 1.308 -1.225 0 N-CA-C 108.51 -0.922 . . . . 0.0 108.51 176.374 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 40' ' ' CYS . . . . . 0.465 ' O ' ' HB3' ' A' ' 3' ' ' CYS . 42.2 t -147.72 101.69 3.35 Favored 'General case' 0 C--N 1.307 -1.271 0 N-CA-C 108.05 -1.093 . . . . 0.0 108.05 -177.065 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 41' ' ' NH2 . . . . . . . . . . . . . . . . . . . . 0 C--N 1.303 -1.417 0 O-C-N 122.369 -0.207 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 004 nuclear nobuild full ' A' A ' 1' ' ' GLU . . . . . . . . . . . . . 7.1 tp10 . . . . . 0 N--CA 1.452 -0.326 0 N-CA-C 109.084 -0.71 . . . . 0.0 109.084 . . . . . . . . . 0 0 . 1 . 004 nuclear nobuild full ' A' A ' 2' ' ' HIS . . . . . . . . . . . . . 21.5 p80 -87.7 116.95 26.19 Favored 'General case' 0 C--N 1.313 -0.99 0 C-N-CA 119.696 -0.802 . . . . 0.0 108.975 176.006 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 3' ' ' CYS . . . . . . . . . . . . . 22.5 p -81.8 112.39 18.9 Favored 'General case' 0 C--N 1.302 -1.469 0 CA-C-N 115.93 -0.577 . . . . 0.0 110.184 -177.296 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 4' ' ' ALA . . . . . . . . . . . . . . . -143.7 135.7 26.59 Favored 'General case' 0 C--N 1.309 -1.175 0 N-CA-C 109.879 -0.415 . . . . 0.0 109.879 -179.861 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 5' ' ' ASP . . . . . 0.458 ' HA ' ' HD2' ' A' ' 34' ' ' PRO . 61.4 m-20 -66.24 149.8 49.79 Favored 'General case' 0 C--O 1.256 1.414 0 N-CA-C 109.174 -0.676 . . . . 0.0 109.174 176.182 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 6' ' ' GLU . . . . . 0.408 ' HB3' ' HB3' ' A' ' 9' ' ' PHE . 10.4 tp10 -65.81 144.64 56.72 Favored 'General case' 0 C--N 1.302 -1.484 0 C-N-CA 123.665 0.786 . . . . 0.0 110.679 -179.243 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 7' ' ' LYS . . . . . . . . . . . . . 11.3 ptpp? -85.45 -25.78 26.72 Favored 'General case' 0 C--N 1.321 -0.631 0 CA-C-O 121.047 0.451 . . . . 0.0 111.927 -174.76 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 8' ' ' ASN . . . . . . . . . . . . . 10.7 p30 -98.05 5.33 48.83 Favored 'General case' 0 C--N 1.313 -0.992 0 CA-C-O 121.471 0.653 . . . . 0.0 111.11 -179.361 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 9' ' ' PHE . . . . . 0.408 ' HB3' ' HB3' ' A' ' 6' ' ' GLU . 39.2 t80 -120.99 141.01 51.11 Favored 'General case' 0 C--N 1.298 -1.659 0 N-CA-C 107.21 -1.404 . . . . 0.0 107.21 -178.731 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 10' ' ' ASP . . . . . . . . . . . . . 14.1 t70 -104.53 107.78 18.88 Favored 'General case' 0 N--CA 1.434 -1.231 0 C-N-CA 118.792 -1.163 . . . . 0.0 110.295 179.026 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 11' ' ' CYS . . . . . . . . . . . . . 72.1 m -78.01 -22.75 48.8 Favored 'General case' 0 C--N 1.278 -2.535 0 CA-C-N 114.748 -1.114 . . . . 0.0 112.997 -177.499 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 12' ' ' ARG . . . . . 0.432 ' O ' ' HG3' ' A' ' 16' ' ' ARG . 18.9 mmm180 -68.84 -45.25 71.62 Favored 'General case' 0 C--N 1.323 -0.545 0 N-CA-C 108.86 -0.793 . . . . 0.0 108.86 177.633 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 39.4 ttm180 -57.45 -48.77 78.29 Favored 'General case' 0 C--N 1.312 -1.037 0 CA-C-N 115.19 -0.914 . . . . 0.0 110.236 176.441 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 14' ' ' SER . . . . . . . . . . . . . 24.0 m -59.96 -35.09 74.21 Favored 'General case' 0 C--N 1.313 -1.0 0 CA-C-N 115.455 -0.793 . . . . 0.0 110.995 178.981 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 15' ' ' LEU . . . . . 0.452 ' HA ' ' HB3' ' A' ' 20' ' ' CYS . 35.0 tp -72.66 -40.87 65.98 Favored 'General case' 0 C--N 1.32 -0.699 0 CA-C-N 116.113 -0.494 . . . . 0.0 110.306 178.769 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 16' ' ' ARG . . . . . 0.432 ' HG3' ' O ' ' A' ' 12' ' ' ARG . 97.8 mtt180 -68.29 -31.45 70.89 Favored 'General case' 0 C--N 1.316 -0.867 0 N-CA-C 112.44 0.533 . . . . 0.0 112.44 -179.889 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 17' ' ' ASN . . . . . . . . . . . . . 40.4 m-80 -88.7 -24.16 22.79 Favored 'General case' 0 CA--C 1.497 -1.088 0 N-CA-C 113.353 0.871 . . . . 0.0 113.353 -177.384 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . 110.42 5.11 28.39 Favored Glycine 0 C--N 1.301 -1.365 0 C-N-CA 119.044 -1.55 . . . . 0.0 112.834 178.654 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 19' ' ' ASP . . . . . . . . . . . . . 21.5 m-20 -70.23 -32.64 70.6 Favored 'General case' 0 CA--C 1.498 -1.025 0 CA-C-O 121.429 0.633 . . . . 0.0 109.564 -179.697 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 20' ' ' CYS . . . . . 0.452 ' HB3' ' HA ' ' A' ' 15' ' ' LEU . 45.4 t -78.5 -11.91 59.98 Favored 'General case' 0 C--N 1.304 -1.388 0 CA-C-N 114.624 -1.171 . . . . 0.0 110.419 -178.694 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 21' ' ' ASP . . . . . . . . . . . . . 26.5 t70 -106.33 -10.26 16.44 Favored 'General case' 0 C--N 1.319 -0.741 0 CA-C-O 121.651 0.739 . . . . 0.0 110.167 -179.531 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 22' ' ' ASN . . . . . 0.414 ' O ' ' HG ' ' A' ' 26' ' ' LEU . 25.9 t-20 -86.13 121.62 28.99 Favored 'General case' 0 C--N 1.302 -1.483 0 CA-C-N 115.237 -0.892 . . . . 0.0 109.984 -175.332 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 23' ' ' ASP . . . . . . . . . . . . . 24.7 t70 -61.18 -38.47 86.62 Favored 'General case' 0 C--N 1.32 -0.704 0 O-C-N 123.576 0.548 . . . . 0.0 112.453 -174.757 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 13.8 m-20 -64.8 -32.67 74.46 Favored 'General case' 0 N--CA 1.482 1.164 0 CA-C-O 121.466 0.651 . . . . 0.0 110.814 179.235 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 25' ' ' LYS . . . . . 0.469 ' O ' ' HG2' ' A' ' 29' ' ' MET . 13.5 mmmm -88.11 -11.49 46.86 Favored 'General case' 0 C--N 1.311 -1.073 0 CA-C-N 115.671 -0.695 . . . . 0.0 111.605 -177.162 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 26' ' ' LEU . . . . . 0.414 ' HG ' ' O ' ' A' ' 22' ' ' ASN . 60.1 mt -58.1 -31.25 66.95 Favored 'General case' 0 C--O 1.221 -0.422 0 N-CA-C 114.132 1.16 . . . . 0.0 114.132 -176.421 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 27' ' ' LEU . . . . . . . . . . . . . 34.3 tp -56.35 -52.03 66.07 Favored 'General case' 0 N--CA 1.44 -0.955 0 CA-C-O 121.441 0.639 . . . . 0.0 109.356 176.445 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 28' ' ' GLU . . . . . 0.544 ' HA ' ' CE2' ' A' ' 31' ' ' TYR . 44.5 mt-10 -65.93 -31.83 72.98 Favored 'General case' 0 N--CA 1.434 -1.246 0 CA-C-N 114.679 -1.146 . . . . 0.0 109.606 179.884 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 29' ' ' MET . . . . . 0.469 ' HG2' ' O ' ' A' ' 25' ' ' LYS . 22.2 mmt -74.21 -24.77 59.38 Favored 'General case' 0 C--O 1.196 -1.754 0 CA-C-N 115.924 -0.58 . . . . 0.0 110.193 -176.623 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 30' ' ' GLY . . . . . . . . . . . . . . . -71.01 -25.47 75.71 Favored Glycine 0 N--CA 1.448 -0.501 0 C-N-CA 120.501 -0.857 . . . . 0.0 112.046 -179.489 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 31' ' ' TYR . . . . . 0.544 ' CE2' ' HA ' ' A' ' 28' ' ' GLU . 52.7 p90 -105.33 -34.65 7.79 Favored 'General case' 0 N--CA 1.429 -1.482 0 C-N-CA 119.342 -0.943 . . . . 0.0 113.142 176.921 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 32' ' ' TYR . . . . . . . . . . . . . 32.8 m-85 -74.11 -43.56 57.12 Favored 'General case' 0 C--N 1.302 -1.49 0 C-N-CA 120.8 -0.36 . . . . 0.0 111.964 176.075 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 33' ' ' CYS . . . . . . . . . . . . . 39.9 m -135.44 57.61 20.92 Favored Pre-proline 0 C--O 1.253 1.243 0 N-CA-C 112.889 0.7 . . . . 0.0 112.889 -172.799 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 34' ' ' PRO . . . . . 0.512 ' HA ' ' CD2' ' A' ' 39' ' ' PHE . 37.5 Cg_endo -64.19 -27.08 64.59 Favored 'Trans proline' 0 C--N 1.364 1.345 0 C-N-CA 121.874 1.716 . . . . 0.0 111.798 -179.041 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 35' ' ' VAL . . . . . . . . . . . . . 44.4 t -86.95 -56.48 5.24 Favored 'Isoleucine or valine' 0 N--CA 1.43 -1.448 0 CA-C-N 115.794 -0.639 . . . . 0.0 110.945 -177.197 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 36' ' ' THR . . . . . . . . . . . . . 97.4 m -59.27 -39.82 84.13 Favored 'General case' 0 CA--C 1.549 0.907 0 N-CA-C 112.738 0.644 . . . . 0.0 112.738 -177.217 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 37' ' ' CYS . . . . . 0.436 ' HB2' ' CE2' ' A' ' 39' ' ' PHE . 90.4 m -81.16 2.2 28.61 Favored 'General case' 0 C--N 1.31 -1.11 0 N-CA-C 113.235 0.828 . . . . 0.0 113.235 -179.843 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 38' ' ' GLY . . . . . . . . . . . . . . . 77.12 23.39 68.86 Favored Glycine 0 N--CA 1.447 -0.584 0 N-CA-C 114.901 0.721 . . . . 0.0 114.901 174.123 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 39' ' ' PHE . . . . . 0.512 ' CD2' ' HA ' ' A' ' 34' ' ' PRO . 97.9 m-85 -72.45 -51.17 21.43 Favored 'General case' 0 C--N 1.317 -0.828 0 N-CA-C 106.917 -1.512 . . . . 0.0 106.917 175.273 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 40' ' ' CYS . . . . . . . . . . . . . 51.3 t -127.07 91.52 3.35 Favored 'General case' 0 N--CA 1.43 -1.467 0 CA-C-N 114.168 -1.378 . . . . 0.0 108.028 178.433 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 41' ' ' NH2 . . . . . . . . . . . . . . . . . . . . 0 C--N 1.302 -1.468 0 CA-C-N 116.48 -0.327 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 005 nuclear nobuild full ' A' A ' 1' ' ' GLU . . . . . . . . . . . . . 41.4 tt0 . . . . . 0 CA--C 1.503 -0.849 0 N-CA-C 109.788 -0.449 . . . . 0.0 109.788 . . . . . . . . . 0 0 . 1 . 005 nuclear nobuild full ' A' A ' 2' ' ' HIS . . . . . . . . . . . . . 4.0 p80 -106.92 116.9 32.73 Favored 'General case' 0 C--N 1.293 -1.851 0 N-CA-C 108.269 -1.012 . . . . 0.0 108.269 173.817 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 3' ' ' CYS . . . . . . . . . . . . . 69.1 m -79.34 83.51 5.36 Favored 'General case' 0 C--N 1.294 -1.81 0 CA-C-O 121.966 0.889 . . . . 0.0 111.409 -178.935 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 4' ' ' ALA . . . . . . . . . . . . . . . -152.24 115.52 4.72 Favored 'General case' 0 N--CA 1.427 -1.585 0 CA-C-N 114.164 -1.38 . . . . 0.0 108.107 177.809 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 5' ' ' ASP . . . . . 0.637 ' OD2' ' HB ' ' A' ' 35' ' ' VAL . 11.0 m-20 -60.89 146.21 47.4 Favored 'General case' 0 C--N 1.316 -0.857 0 N-CA-C 109.407 -0.59 . . . . 0.0 109.407 175.124 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 9.7 tp10 -72.15 142.03 49.1 Favored 'General case' 0 C--N 1.31 -1.15 0 C-N-CA 123.077 0.551 . . . . 0.0 111.006 -178.781 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 7' ' ' LYS . . . . . . . . . . . . . 18.3 ptmt -85.72 -27.87 25.0 Favored 'General case' 0 C--N 1.326 -0.416 0 CA-C-O 122.32 1.057 . . . . 0.0 110.812 179.663 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 8' ' ' ASN . . . . . . . . . . . . . 19.5 m120 -88.06 15.76 6.96 Favored 'General case' 0 C--N 1.305 -1.365 0 CA-C-N 114.819 -1.082 . . . . 0.0 110.616 -178.713 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 9' ' ' PHE . . . . . . . . . . . . . 40.3 t80 -142.17 143.24 32.87 Favored 'General case' 0 N--CA 1.414 -2.255 0 N-CA-C 104.59 -2.374 . . . . 0.0 104.59 179.275 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 10' ' ' ASP . . . . . 0.424 ' OD1' ' HD3' ' A' ' 12' ' ' ARG . 20.1 t70 -104.7 104.0 13.72 Favored 'General case' 0 C--N 1.302 -1.458 0 C-N-CA 118.144 -1.422 . . . . 0.0 111.009 179.062 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 11' ' ' CYS . . . . . 0.503 ' SG ' ' HB3' ' A' ' 5' ' ' ASP . 71.7 m -71.32 -16.2 62.44 Favored 'General case' 0 C--N 1.301 -1.511 0 CA-C-N 115.073 -0.967 . . . . 0.0 113.562 -177.885 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 12' ' ' ARG . . . . . 0.424 ' HD3' ' OD1' ' A' ' 10' ' ' ASP . 3.9 mpt_? -70.5 -51.22 30.44 Favored 'General case' 0 CA--C 1.493 -1.215 0 N-CA-C 106.62 -1.622 . . . . 0.0 106.62 178.533 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 41.3 ttm180 -49.77 -53.01 27.67 Favored 'General case' 0 C--N 1.319 -0.725 0 CA-C-N 114.168 -1.378 . . . . 0.0 110.513 175.905 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 14' ' ' SER . . . . . . . . . . . . . 12.2 m -55.18 -38.76 68.75 Favored 'General case' 0 C--O 1.253 1.283 0 CA-C-N 115.923 -0.581 . . . . 0.0 111.691 179.748 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 15' ' ' LEU . . . . . 0.456 ' HA ' ' HB3' ' A' ' 20' ' ' CYS . 30.6 tp -79.03 -36.94 40.28 Favored 'General case' 0 C--N 1.327 -0.393 0 CA-C-N 116.436 -0.347 . . . . 0.0 111.008 -178.323 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 16' ' ' ARG . . . . . . . . . . . . . 98.4 mtt180 -65.92 -37.23 85.54 Favored 'General case' 0 C--N 1.315 -0.895 0 CA-C-O 121.296 0.569 . . . . 0.0 110.707 177.966 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 17' ' ' ASN . . . . . . . . . . . . . 91.9 m-20 -76.0 -43.32 44.84 Favored 'General case' 0 CA--C 1.494 -1.201 0 CA-C-N 115.771 -0.649 . . . . 0.0 110.531 179.152 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . 112.94 7.36 21.76 Favored Glycine 0 C--N 1.297 -1.635 0 C-N-CA 119.882 -1.151 . . . . 0.0 111.783 177.794 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 19' ' ' ASP . . . . . . . . . . . . . 12.7 m-20 -68.87 -31.81 71.02 Favored 'General case' 0 C--O 1.212 -0.906 0 N-CA-C 108.267 -1.012 . . . . 0.0 108.267 177.918 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 20' ' ' CYS . . . . . 0.456 ' HB3' ' HA ' ' A' ' 15' ' ' LEU . 45.3 t -69.84 -10.06 57.04 Favored 'General case' 0 C--N 1.309 -1.179 0 CA-C-N 114.076 -1.42 . . . . 0.0 111.272 -179.264 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 21' ' ' ASP . . . . . . . . . . . . . 35.1 t70 -116.69 -8.92 11.38 Favored 'General case' 0 N--CA 1.468 0.43 0 CA-C-O 121.446 0.641 . . . . 0.0 110.388 -179.597 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 22' ' ' ASN . . . . . 0.495 ' O ' ' HG ' ' A' ' 26' ' ' LEU . 34.5 t30 -87.83 128.9 35.34 Favored 'General case' 0 C--N 1.324 -0.541 0 CA-C-N 115.575 -0.739 . . . . 0.0 111.706 -175.925 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 23' ' ' ASP . . . . . . . . . . . . . 5.6 p-10 -52.05 -43.94 64.04 Favored 'General case' 0 C--O 1.241 0.622 0 C-N-CA 124.84 1.256 . . . . 0.0 113.826 -176.057 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 2.8 p30 -74.17 -13.86 60.87 Favored 'General case' 0 N--CA 1.473 0.714 0 C-N-CA 120.331 -0.548 . . . . 0.0 112.404 -176.272 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 25' ' ' LYS . . . . . 0.476 ' O ' ' HG2' ' A' ' 29' ' ' MET . 46.5 mmtm -100.05 -13.35 19.07 Favored 'General case' 0 C--N 1.309 -1.17 0 C-N-CA 120.916 -0.314 . . . . 0.0 110.898 179.795 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 26' ' ' LEU . . . . . 0.495 ' HG ' ' O ' ' A' ' 22' ' ' ASN . 84.6 mt -56.67 -40.96 76.46 Favored 'General case' 0 C--O 1.2 -1.528 0 N-CA-C 115.4 1.63 . . . . 0.0 115.4 -171.707 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 27' ' ' LEU . . . . . . . . . . . . . 20.1 tp -61.01 -44.83 96.84 Favored 'General case' 0 N--CA 1.442 -0.851 0 CA-C-N 119.042 0.837 . . . . 0.0 110.007 -179.377 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 28' ' ' GLU . . . . . 0.494 ' HA ' ' CE1' ' A' ' 31' ' ' TYR . 40.1 tt0 -65.6 -34.27 77.84 Favored 'General case' 0 C--O 1.242 0.695 0 CA-C-N 115.431 -0.804 . . . . 0.0 108.969 178.945 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 29' ' ' MET . . . . . 0.476 ' HG2' ' O ' ' A' ' 25' ' ' LYS . 25.0 mmt -75.22 -23.58 57.6 Favored 'General case' 0 C--O 1.202 -1.434 0 CA-C-N 114.844 -1.071 . . . . 0.0 109.488 -178.365 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 30' ' ' GLY . . . . . . . . . . . . . . . -62.45 -40.75 99.48 Favored Glycine 0 N--CA 1.436 -1.325 0 CA-C-N 116.165 -0.471 . . . . 0.0 111.947 -179.678 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 31' ' ' TYR . . . . . 0.494 ' CE1' ' HA ' ' A' ' 28' ' ' GLU . 29.7 p90 -93.29 -35.8 12.89 Favored 'General case' 0 C--N 1.305 -1.367 0 C-N-CA 119.704 -0.799 . . . . 0.0 112.859 179.03 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 32' ' ' TYR . . . . . . . . . . . . . 24.8 m-85 -73.12 -44.54 60.09 Favored 'General case' 0 C--N 1.309 -1.156 0 N-CA-C 114.173 1.175 . . . . 0.0 114.173 178.076 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 33' ' ' CYS . . . . . . . . . . . . . 62.3 m -138.19 60.72 23.42 Favored Pre-proline 0 C--N 1.308 -1.214 0 N-CA-C 111.596 0.221 . . . . 0.0 111.596 -175.602 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 34' ' ' PRO . . . . . 0.477 ' HD2' ' HA ' ' A' ' 5' ' ' ASP . 32.1 Cg_endo -63.22 -29.57 73.61 Favored 'Trans proline' 0 C--N 1.363 1.305 0 C-N-CA 122.008 1.805 . . . . 0.0 112.279 -176.927 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 35' ' ' VAL . . . . . 0.637 ' HB ' ' OD2' ' A' ' 5' ' ' ASP . 43.3 t -87.35 -46.36 16.13 Favored 'Isoleucine or valine' 0 N--CA 1.428 -1.549 0 CA-C-N 116.149 -0.478 . . . . 0.0 111.656 -175.835 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 36' ' ' THR . . . . . . . . . . . . . 22.1 m -65.23 -38.6 90.91 Favored 'General case' 0 C--N 1.315 -0.892 0 CA-C-N 116.119 -0.491 . . . . 0.0 111.228 -178.8 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 37' ' ' CYS . . . . . 0.428 ' SG ' ' HB3' ' A' ' 29' ' ' MET . 76.4 m -84.73 0.99 48.59 Favored 'General case' 0 C--N 1.316 -0.88 0 N-CA-C 112.845 0.683 . . . . 0.0 112.845 -178.978 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 38' ' ' GLY . . . . . . . . . . . . . . . 81.61 21.31 62.16 Favored Glycine 0 N--CA 1.448 -0.533 0 N-CA-C 116.028 1.171 . . . . 0.0 116.028 172.777 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 39' ' ' PHE . . . . . 0.426 ' CD2' ' HA ' ' A' ' 34' ' ' PRO . 97.4 m-85 -73.53 -44.64 57.11 Favored 'General case' 0 CA--C 1.501 -0.904 0 N-CA-C 107.481 -1.303 . . . . 0.0 107.481 175.021 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 40' ' ' CYS . . . . . . . . . . . . . 61.5 m -106.63 97.74 7.5 Favored 'General case' 0 C--N 1.295 -1.765 0 CA-C-N 114.237 -1.347 . . . . 0.0 108.088 176.591 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 41' ' ' NH2 . . . . . . . . . . . . . . . . . . . . 0 C--N 1.31 -1.111 0 CA-C-N 116.755 -0.202 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 006 nuclear nobuild full ' A' A ' 1' ' ' GLU . . . . . . . . . . . . . 9.7 pt-20 . . . . . 0 CA--C 1.509 -0.619 0 N-CA-C 109.522 -0.547 . . . . 0.0 109.522 . . . . . . . . . 0 0 . 1 . 006 nuclear nobuild full ' A' A ' 2' ' ' HIS . . . . . . . . . . . . . 46.9 t-80 -94.58 118.64 32.0 Favored 'General case' 0 C--N 1.307 -1.274 0 N-CA-C 107.779 -1.193 . . . . 0.0 107.779 175.219 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 3' ' ' CYS . . . . . . . . . . . . . 24.6 p -76.58 112.04 12.69 Favored 'General case' 0 C--N 1.303 -1.45 0 CA-C-O 121.518 0.675 . . . . 0.0 111.445 -178.481 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 4' ' ' ALA . . . . . . . . . . . . . . . -141.41 154.54 45.66 Favored 'General case' 0 N--CA 1.429 -1.501 0 N-CA-C 107.487 -1.301 . . . . 0.0 107.487 178.677 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 5' ' ' ASP . . . . . 0.529 ' OD2' ' HB ' ' A' ' 35' ' ' VAL . 11.7 m-20 -65.15 155.63 34.28 Favored 'General case' 0 C--N 1.313 -1.021 0 O-C-N 123.517 0.511 . . . . 0.0 110.476 -179.654 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 0.5 OUTLIER -84.39 151.12 24.89 Favored 'General case' 0 C--N 1.306 -1.317 0 N-CA-C 108.278 -1.008 . . . . 0.0 108.278 179.824 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 7' ' ' LYS . . . . . . . . . . . . . 7.2 ptpp? -85.4 -36.31 20.77 Favored 'General case' 0 C--N 1.316 -0.852 0 N-CA-C 112.89 0.7 . . . . 0.0 112.89 -174.141 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 8' ' ' ASN . . . . . . . . . . . . . 92.3 m-20 -87.12 -29.37 21.88 Favored 'General case' 0 C--N 1.294 -1.825 0 N-CA-C 109.493 -0.558 . . . . 0.0 109.493 -176.58 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 9' ' ' PHE . . . . . . . . . . . . . 29.0 t80 -69.55 137.45 52.43 Favored 'General case' 0 N--CA 1.434 -1.249 0 N-CA-C 108.163 -1.051 . . . . 0.0 108.163 176.861 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 10' ' ' ASP . . . . . . . . . . . . . 45.7 t0 -91.62 92.97 8.71 Favored 'General case' 0 C--N 1.304 -1.394 0 CA-C-O 121.55 0.69 . . . . 0.0 110.082 -178.259 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 11' ' ' CYS . . . . . 0.4 ' SG ' ' HB3' ' A' ' 5' ' ' ASP . 66.3 m -73.08 -34.44 66.23 Favored 'General case' 0 C--N 1.302 -1.491 0 CA-C-N 115.283 -0.871 . . . . 0.0 111.114 -179.108 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 12' ' ' ARG . . . . . . . . . . . . . 21.9 mmt180 -69.03 -49.69 55.37 Favored 'General case' 0 CA--C 1.516 -0.364 0 CA-C-O 120.88 0.371 . . . . 0.0 111.045 -175.761 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 8.7 ttp180 -66.36 -41.26 89.75 Favored 'General case' 0 C--N 1.309 -1.176 0 CA-C-N 116.12 -0.491 . . . . 0.0 110.971 179.637 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 14' ' ' SER . . . . . . . . . . . . . 50.2 m -60.92 -36.46 79.37 Favored 'General case' 0 C--O 1.251 1.156 0 CA-C-O 121.538 0.685 . . . . 0.0 110.594 177.429 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 54.8 tp -66.27 -43.55 86.09 Favored 'General case' 0 C--N 1.325 -0.488 0 CA-C-N 115.478 -0.783 . . . . 0.0 109.975 177.568 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 16' ' ' ARG . . . . . . . . . . . . . 81.7 mtp180 -69.63 -32.99 71.99 Favored 'General case' 0 C--N 1.315 -0.926 0 CA-C-N 116.175 -0.466 . . . . 0.0 112.239 178.965 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 17' ' ' ASN . . . . . . . . . . . . . 88.0 m-20 -68.43 -47.4 67.3 Favored 'General case' 0 CA--C 1.501 -0.911 0 CA-C-O 121.663 0.744 . . . . 0.0 110.547 -179.394 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . 123.66 11.89 4.79 Favored Glycine 0 N--CA 1.429 -1.788 0 N-CA-C 110.67 -0.972 . . . . 0.0 110.67 -174.655 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 19' ' ' ASP . . . . . . . . . . . . . 32.4 m-20 -71.09 -33.0 69.77 Favored 'General case' 0 CA--C 1.505 -0.786 0 N-CA-C 108.861 -0.792 . . . . 0.0 108.861 179.512 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 20' ' ' CYS . . . . . . . . . . . . . 53.4 t -82.81 0.24 44.77 Favored 'General case' 0 C--N 1.31 -1.12 0 CA-C-N 114.589 -1.187 . . . . 0.0 110.345 -178.084 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 21' ' ' ASP . . . . . . . . . . . . . 20.9 t70 -115.85 -10.49 11.68 Favored 'General case' 0 C--N 1.315 -0.932 0 CA-C-N 115.716 -0.674 . . . . 0.0 109.604 178.502 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 22' ' ' ASN . . . . . 0.459 ' O ' ' HG ' ' A' ' 26' ' ' LEU . 37.3 t-20 -87.8 121.78 30.64 Favored 'General case' 0 C--N 1.319 -0.758 0 CA-C-N 115.832 -0.622 . . . . 0.0 110.408 -177.057 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 23' ' ' ASP . . . . . . . . . . . . . 28.6 t70 -50.77 -46.67 59.59 Favored 'General case' 0 C--N 1.317 -0.806 0 C-N-CA 124.821 1.248 . . . . 0.0 113.379 -177.726 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 48.6 m-20 -64.66 -36.13 83.26 Favored 'General case' 0 N--CA 1.476 0.839 0 CA-C-O 121.365 0.602 . . . . 0.0 110.485 -177.927 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 25' ' ' LYS . . . . . . . . . . . . . 13.7 mptt -84.65 -12.38 54.05 Favored 'General case' 0 C--N 1.311 -1.078 0 CA-C-N 115.334 -0.848 . . . . 0.0 112.663 -175.946 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 26' ' ' LEU . . . . . 0.459 ' HG ' ' O ' ' A' ' 22' ' ' ASN . 74.7 mt -58.04 -36.08 72.23 Favored 'General case' 0 C--O 1.22 -0.496 0 N-CA-C 112.264 0.468 . . . . 0.0 112.264 -178.206 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 27' ' ' LEU . . . . . . . . . . . . . 26.2 tp -57.09 -50.64 72.15 Favored 'General case' 0 N--CA 1.437 -1.119 0 N-CA-C 109.906 -0.405 . . . . 0.0 109.906 176.899 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 28' ' ' GLU . . . . . 0.518 ' HA ' ' CE1' ' A' ' 31' ' ' TYR . 43.8 tt0 -64.48 -31.6 72.88 Favored 'General case' 0 C--O 1.244 0.781 0 CA-C-N 115.483 -0.781 . . . . 0.0 109.824 -179.742 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 29' ' ' MET . . . . . 0.408 ' HA ' ' CE ' ' A' ' 29' ' ' MET . 0.3 OUTLIER -73.4 -30.68 63.42 Favored 'General case' 0 C--O 1.207 -1.14 0 CA-C-N 115.009 -0.996 . . . . 0.0 109.84 -177.752 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 30' ' ' GLY . . . . . . . . . . . . . . . -65.15 -29.35 75.11 Favored Glycine 0 N--CA 1.444 -0.779 0 O-C-N 123.621 0.576 . . . . 0.0 112.886 -179.262 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 31' ' ' TYR . . . . . 0.518 ' CE1' ' HA ' ' A' ' 28' ' ' GLU 0.266 39.9 p90 -100.09 -37.51 8.93 Favored 'General case' 0 N--CA 1.438 -1.074 0 N-CA-C 113.791 1.034 . . . . 0.0 113.791 178.432 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 32' ' ' TYR . . . . . . . . . . . . . 29.2 m-85 -74.26 -48.56 27.84 Favored 'General case' 0 C--N 1.303 -1.415 0 N-CA-C 113.765 1.024 . . . . 0.0 113.765 177.472 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 33' ' ' CYS . . . . . . . . . . . . . 36.3 m -135.52 66.78 65.4 Favored Pre-proline 0 C--N 1.308 -1.234 0 C-N-CA 120.436 -0.505 . . . . 0.0 110.871 -177.024 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 34' ' ' PRO . . . . . 0.461 ' HD2' ' HA ' ' A' ' 5' ' ' ASP . 46.7 Cg_endo -65.99 -24.77 52.48 Favored 'Trans proline' 0 C--N 1.362 1.285 0 C-N-CA 122.404 2.07 . . . . 0.0 112.135 -176.624 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 35' ' ' VAL . . . . . 0.529 ' HB ' ' OD2' ' A' ' 5' ' ' ASP . 54.7 t -86.59 -46.87 16.45 Favored 'Isoleucine or valine' 0 C--N 1.302 -1.494 0 C-N-CA 120.479 -0.489 . . . . 0.0 110.787 -177.16 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 36' ' ' THR . . . . . . . . . . . . . 30.8 m -56.75 -39.57 74.23 Favored 'General case' 0 CA--C 1.55 0.946 0 CA-C-O 121.343 0.592 . . . . 0.0 111.587 179.986 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 37' ' ' CYS . . . . . . . . . . . . . 94.7 m -88.73 4.35 47.7 Favored 'General case' 0 C--N 1.309 -1.156 0 N-CA-C 113.251 0.834 . . . . 0.0 113.251 179.239 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 38' ' ' GLY . . . . . . . . . . . . . . . 72.12 35.89 60.64 Favored Glycine 0 C--O 1.222 -0.596 0 N-CA-C 115.599 0.999 . . . . 0.0 115.599 174.375 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 39' ' ' PHE . . . . . . . . . . . . . 98.4 m-85 -86.77 -37.59 17.7 Favored 'General case' 0 C--N 1.311 -1.108 0 N-CA-C 107.713 -1.218 . . . . 0.0 107.713 174.361 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 40' ' ' CYS . . . . . . . . . . . . . 69.3 m -117.95 89.58 3.15 Favored 'General case' 0 C--N 1.304 -1.407 0 CA-C-N 114.167 -1.378 . . . . 0.0 108.775 179.762 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 41' ' ' NH2 . . . . . . . . . . . . . . . . . . . . 0 C--N 1.307 -1.27 0 CA-C-N 116.689 -0.232 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 007 nuclear nobuild full ' A' A ' 1' ' ' GLU . . . . . . . . . . . . . 10.4 tp10 . . . . . 0 CA--C 1.513 -0.452 0 CA-C-O 119.629 -0.224 . . . . 0.0 110.756 . . . . . . . . . 0 0 . 1 . 007 nuclear nobuild full ' A' A ' 2' ' ' HIS . . . . . . . . . . . . . 21.9 t-80 -49.98 111.09 0.46 Allowed 'General case' 0 C--O 1.246 0.898 0 CA-C-O 121.635 0.731 . . . . 0.0 111.523 -175.537 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 3' ' ' CYS . . . . . . . . . . . . . 10.3 p -75.42 136.3 40.72 Favored 'General case' 0 C--N 1.301 -1.541 0 CA-C-N 114.347 -1.297 . . . . 0.0 110.747 179.424 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 4' ' ' ALA . . . . . . . . . . . . . . . -143.03 145.91 33.35 Favored 'General case' 0 C--N 1.31 -1.125 0 N-CA-C 109.595 -0.52 . . . . 0.0 109.595 -179.157 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 5' ' ' ASP . . . . . 0.531 ' HB3' ' SG ' ' A' ' 11' ' ' CYS . 23.7 m-20 -58.83 143.18 48.24 Favored 'General case' 0 C--N 1.314 -0.971 0 O-C-N 124.05 0.843 . . . . 0.0 111.81 178.461 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 10.0 tp10 -70.59 135.67 48.64 Favored 'General case' 0 N--CA 1.443 -0.818 0 C-N-CA 123.495 0.718 . . . . 0.0 110.312 178.004 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 7' ' ' LYS . . . . . . . . . . . . . 9.9 ptpp? -85.71 -20.66 29.01 Favored 'General case' 0 C--N 1.314 -0.977 0 CA-C-O 121.386 0.612 . . . . 0.0 111.041 -178.741 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 8' ' ' ASN . . . . . . . . . . . . . 13.7 m120 -86.71 16.83 4.38 Favored 'General case' 0 C--N 1.311 -1.07 0 CA-C-O 121.789 0.804 . . . . 0.0 110.157 -179.193 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 9' ' ' PHE . . . . . 0.454 ' HD1' ' SG ' ' A' ' 33' ' ' CYS . 36.8 t80 -144.87 144.09 30.93 Favored 'General case' 0 N--CA 1.418 -2.03 0 N-CA-C 105.633 -1.988 . . . . 0.0 105.633 -178.425 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 10' ' ' ASP . . . . . . . . . . . . . 19.7 t70 -100.51 102.62 13.84 Favored 'General case' 0 C--N 1.313 -0.986 0 C-N-CA 118.941 -1.104 . . . . 0.0 110.603 178.088 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 11' ' ' CYS . . . . . 0.531 ' SG ' ' HB3' ' A' ' 5' ' ' ASP . 60.8 m -66.09 -31.79 72.86 Favored 'General case' 0 C--N 1.294 -1.814 0 CA-C-N 114.083 -1.417 . . . . 0.0 112.776 -175.711 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 12' ' ' ARG . . . . . . . . . . . . . 37.6 mmt180 -66.0 -50.46 64.18 Favored 'General case' 0 CA--C 1.514 -0.416 0 N-CA-C 109.711 -0.477 . . . . 0.0 109.711 179.684 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 38.6 ttm180 -53.51 -56.45 16.9 Favored 'General case' 0 C--N 1.322 -0.622 0 C-N-CA 124.741 1.216 . . . . 0.0 111.775 -178.24 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 14' ' ' SER . . . . . . . . . . . . . 20.1 m -61.22 -35.15 76.44 Favored 'General case' 0 C--O 1.249 1.066 0 CA-C-O 120.948 0.404 . . . . 0.0 111.818 -178.101 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 1.3 tm? -68.65 -41.42 79.37 Favored 'General case' 0 CA--C 1.544 0.72 0 N-CA-C 108.098 -1.075 . . . . 0.0 108.098 179.439 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 16' ' ' ARG . . . . . . . . . . . . . 73.8 mtp180 -64.19 -45.99 85.94 Favored 'General case' 0 N--CA 1.467 0.416 0 CA-C-N 115.546 -0.752 . . . . 0.0 111.702 178.593 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 17' ' ' ASN . . . . . . . . . . . . . 73.3 m-20 -61.09 -33.63 73.66 Favored 'General case' 0 N--CA 1.485 1.305 0 CA-C-O 121.652 0.739 . . . . 0.0 110.942 -178.734 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . 103.29 19.07 13.03 Favored Glycine 0 N--CA 1.429 -1.824 0 N-CA-C 110.027 -1.229 . . . . 0.0 110.027 -178.06 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 19' ' ' ASP . . . . . . . . . . . . . 52.6 m-20 -70.04 -28.59 65.59 Favored 'General case' 0 C--O 1.213 -0.827 0 CA-C-O 120.85 0.357 . . . . 0.0 110.549 -178.403 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 20' ' ' CYS . . . . . 0.423 ' HA ' ' HG3' ' A' ' 29' ' ' MET . 23.8 t -84.26 -5.28 59.24 Favored 'General case' 0 C--N 1.317 -0.835 0 CA-C-O 121.578 0.704 . . . . 0.0 109.697 -179.173 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 21' ' ' ASP . . . . . . . . . . . . . 29.7 t70 -98.55 -11.24 22.39 Favored 'General case' 0 C--N 1.314 -0.964 0 N-CA-C 108.686 -0.857 . . . . 0.0 108.686 175.016 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 22' ' ' ASN . . . . . . . . . . . . . 35.5 t30 -88.54 123.64 33.24 Favored 'General case' 0 C--N 1.316 -0.856 0 CA-C-N 115.241 -0.89 . . . . 0.0 110.042 179.242 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 23' ' ' ASP . . . . . 0.467 ' HA ' ' HG ' ' A' ' 26' ' ' LEU . 21.7 t70 -58.68 -36.72 74.66 Favored 'General case' 0 C--N 1.323 -0.581 0 C-N-CA 122.969 0.507 . . . . 0.0 111.957 -178.163 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 27.2 t70 -62.97 -24.81 68.07 Favored 'General case' 0 N--CA 1.475 0.799 0 CA-C-N 115.969 -0.559 . . . . 0.0 111.732 179.5 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 25' ' ' LYS . . . . . . . . . . . . . 69.3 mmtt -111.96 10.24 20.54 Favored 'General case' 0 N--CA 1.442 -0.852 0 N-CA-C 113.101 0.778 . . . . 0.0 113.101 -177.807 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 26' ' ' LEU . . . . . 0.467 ' HG ' ' HA ' ' A' ' 23' ' ' ASP . 65.9 mt -62.76 -46.56 87.49 Favored 'General case' 0 C--N 1.314 -0.941 0 N-CA-C 112.886 0.698 . . . . 0.0 112.886 -179.929 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 27' ' ' LEU . . . . . 0.407 HD22 ' H ' ' A' ' 27' ' ' LEU . 2.7 mm? -65.13 -42.69 93.64 Favored 'General case' 0 CA--C 1.48 -1.714 0 N-CA-C 108.508 -0.923 . . . . 0.0 108.508 -179.237 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 28' ' ' GLU . . . . . 0.527 ' HA ' ' CE1' ' A' ' 31' ' ' TYR . 38.6 tt0 -58.45 -36.97 74.49 Favored 'General case' 0 N--CA 1.442 -0.848 0 O-C-N 124.346 1.029 . . . . 0.0 109.932 -179.492 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 29' ' ' MET . . . . . 0.423 ' HG3' ' HA ' ' A' ' 20' ' ' CYS . 78.2 mmm -80.33 -27.6 38.33 Favored 'General case' 0 N--CA 1.429 -1.512 0 CA-C-N 115.936 -0.575 . . . . 0.0 111.216 -178.204 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 30' ' ' GLY . . . . . . . . . . . . . . . -75.33 -44.64 21.62 Favored Glycine 0 N--CA 1.43 -1.708 0 CA-C-N 115.526 -0.761 . . . . 0.0 111.673 178.065 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 31' ' ' TYR . . . . . 0.527 ' CE1' ' HA ' ' A' ' 28' ' ' GLU 0.265 12.9 p90 -77.58 -32.33 53.62 Favored 'General case' 0 N--CA 1.436 -1.153 0 C-N-CA 119.592 -0.843 . . . . 0.0 113.166 -179.346 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 32' ' ' TYR . . . . . . . . . . . . . 22.6 m-85 -79.07 -54.36 6.09 Favored 'General case' 0 C--N 1.301 -1.505 0 N-CA-C 113.223 0.823 . . . . 0.0 113.223 175.409 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 33' ' ' CYS . . . . . 0.454 ' SG ' ' HD1' ' A' ' 9' ' ' PHE . 53.4 m -129.11 71.68 81.99 Favored Pre-proline 0 C--O 1.264 1.839 0 C-N-CA 120.152 -0.619 . . . . 0.0 111.956 -174.45 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 34' ' ' PRO . . . . . 0.485 ' HB2' ' SG ' ' A' ' 40' ' ' CYS . 48.7 Cg_endo -66.52 -25.91 47.58 Favored 'Trans proline' 0 C--N 1.362 1.285 0 C-N-CA 122.69 2.26 . . . . 0.0 112.163 -176.201 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 35' ' ' VAL . . . . . 0.504 ' HB ' ' OD1' ' A' ' 5' ' ' ASP . 22.0 t -87.04 -40.79 14.24 Favored 'Isoleucine or valine' 0 N--CA 1.425 -1.712 0 CA-C-N 116.162 -0.472 . . . . 0.0 110.844 -176.822 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 36' ' ' THR . . . . . . . . . . . . . 58.9 m -58.1 -43.65 87.21 Favored 'General case' 0 C--N 1.321 -0.662 0 C-N-CA 123.3 0.64 . . . . 0.0 112.097 -179.618 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 37' ' ' CYS . . . . . 0.549 ' HB2' ' CE2' ' A' ' 39' ' ' PHE . 88.7 m -87.51 6.76 32.56 Favored 'General case' 0 C--N 1.313 -0.991 0 C-N-CA 119.696 -0.802 . . . . 0.0 112.007 179.433 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 38' ' ' GLY . . . . . . . . . . . . . . . 64.43 45.91 91.92 Favored Glycine 0 N--CA 1.439 -1.158 0 CA-C-N 116.32 -0.4 . . . . 0.0 114.068 177.045 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 39' ' ' PHE . . . . . 0.549 ' CE2' ' HB2' ' A' ' 37' ' ' CYS . 98.2 m-85 -85.68 -49.89 7.62 Favored 'General case' 0 CA--C 1.498 -1.022 0 N-CA-C 107.247 -1.39 . . . . 0.0 107.247 173.805 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 40' ' ' CYS . . . . . 0.485 ' SG ' ' HB2' ' A' ' 34' ' ' PRO . 25.3 p -136.32 87.93 2.34 Favored 'General case' 0 N--CA 1.424 -1.744 0 CA-C-N 114.771 -1.104 . . . . 0.0 109.528 177.013 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 41' ' ' NH2 . . . . . . . . . . . . . . . . . . . . 0 C--N 1.309 -1.153 0 CA-C-N 116.194 -0.457 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 008 nuclear nobuild full ' A' A ' 1' ' ' GLU . . . . . . . . . . . . . 44.8 tt0 . . . . . 0 N--CA 1.455 -0.206 0 N-CA-C 108.545 -0.909 . . . . 0.0 108.545 . . . . . . . . . 0 0 . 1 . 008 nuclear nobuild full ' A' A ' 2' ' ' HIS . . . . . . . . . . . . . 81.4 m-70 -106.33 126.06 51.77 Favored 'General case' 0 CA--C 1.502 -0.892 0 N-CA-C 109.48 -0.563 . . . . 0.0 109.48 174.299 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 3' ' ' CYS . . . . . . . . . . . . . 21.6 p -86.3 150.9 24.02 Favored 'General case' 0 C--N 1.288 -2.106 0 CA-C-N 116.306 -0.406 . . . . 0.0 110.565 177.478 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 4' ' ' ALA . . . . . . . . . . . . . . . -149.32 137.4 20.6 Favored 'General case' 0 C--N 1.313 -0.983 0 N-CA-C 109.497 -0.557 . . . . 0.0 109.497 178.299 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 5' ' ' ASP . . . . . 0.556 ' HB3' ' SG ' ' A' ' 11' ' ' CYS . 24.0 m-20 -65.49 149.56 49.83 Favored 'General case' 0 C--O 1.248 1.02 0 N-CA-C 108.887 -0.783 . . . . 0.0 108.887 174.683 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 10.8 tp10 -70.03 130.7 42.87 Favored 'General case' 0 C--N 1.301 -1.538 0 N-CA-C 109.409 -0.589 . . . . 0.0 109.409 178.734 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 7' ' ' LYS . . . . . . . . . . . . . 10.8 ptpp? -85.51 -20.02 30.32 Favored 'General case' 0 C--N 1.321 -0.653 0 CA-C-O 121.097 0.475 . . . . 0.0 110.895 -176.845 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 8' ' ' ASN . . . . . . . . . . . . . 89.2 m-20 -84.49 2.64 40.05 Favored 'General case' 0 C--N 1.316 -0.859 0 CA-C-N 115.465 -0.789 . . . . 0.0 110.053 179.16 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 9' ' ' PHE . . . . . . . . . . . . . 45.4 t80 -127.95 154.25 45.78 Favored 'General case' 0 C--N 1.303 -1.433 0 N-CA-C 107.773 -1.195 . . . . 0.0 107.773 -174.986 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 10' ' ' ASP . . . . . . . . . . . . . 9.3 t70 -104.9 101.26 10.85 Favored 'General case' 0 CA--C 1.493 -1.234 0 C-N-CA 118.624 -1.23 . . . . 0.0 110.647 178.195 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 11' ' ' CYS . . . . . 0.556 ' SG ' ' HB3' ' A' ' 5' ' ' ASP . 92.4 m -72.8 -25.52 61.18 Favored 'General case' 0 C--N 1.286 -2.163 0 CA-C-N 115.34 -0.845 . . . . 0.0 112.615 -178.286 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 12' ' ' ARG . . . . . 0.546 ' O ' ' HG2' ' A' ' 16' ' ' ARG . 28.0 mmm180 -70.07 -53.41 17.58 Favored 'General case' 0 C--N 1.318 -0.803 0 N-CA-C 110.045 -0.354 . . . . 0.0 110.045 -178.406 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 43.9 ttp180 -63.13 -37.49 87.4 Favored 'General case' 0 C--N 1.309 -1.166 0 CA-C-N 115.951 -0.568 . . . . 0.0 110.133 179.464 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 14' ' ' SER . . . . . . . . . . . . . 49.6 m -63.61 -32.79 74.37 Favored 'General case' 0 C--O 1.246 0.905 0 CA-C-O 121.261 0.553 . . . . 0.0 110.977 177.258 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 53.6 tp -70.94 -40.73 71.88 Favored 'General case' 0 N--CA 1.442 -0.845 0 N-CA-C 109.177 -0.675 . . . . 0.0 109.177 177.611 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 16' ' ' ARG . . . . . 0.546 ' HG2' ' O ' ' A' ' 12' ' ' ARG . 31.4 mmm180 -70.04 -33.76 72.38 Favored 'General case' 0 C--N 1.314 -0.971 0 CA-C-N 115.546 -0.752 . . . . 0.0 111.193 -178.942 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 17' ' ' ASN . . . . . . . . . . . . . 89.6 m-20 -71.05 -39.14 72.43 Favored 'General case' 0 CA--C 1.489 -1.376 0 CA-C-O 121.522 0.677 . . . . 0.0 110.428 -179.864 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . 114.02 8.61 17.39 Favored Glycine 0 N--CA 1.426 -1.973 0 CA-C-N 114.833 -1.076 . . . . 0.0 111.016 -177.178 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 19' ' ' ASP . . . . . . . . . . . . . 59.9 m-20 -66.92 -38.13 85.63 Favored 'General case' 0 CA--C 1.502 -0.883 0 CA-C-O 121.235 0.541 . . . . 0.0 109.893 -179.406 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 20' ' ' CYS . . . . . . . . . . . . . 42.7 t -73.32 -13.42 61.11 Favored 'General case' 0 C--N 1.311 -1.068 0 CA-C-N 114.997 -1.001 . . . . 0.0 110.752 -178.945 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 21' ' ' ASP . . . . . . . . . . . . . 27.6 t70 -109.78 -4.48 16.04 Favored 'General case' 0 C--N 1.313 -1.019 0 CA-C-O 121.893 0.854 . . . . 0.0 110.46 179.043 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 22' ' ' ASN . . . . . . . . . . . . . 39.8 t-20 -77.64 116.33 18.11 Favored 'General case' 0 C--N 1.314 -0.946 0 N-CA-C 109.2 -0.667 . . . . 0.0 109.2 -178.363 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 23' ' ' ASP . . . . . 0.411 ' HA ' ' HG ' ' A' ' 26' ' ' LEU . 17.6 m-20 -56.99 -43.82 82.09 Favored 'General case' 0 C--N 1.321 -0.642 0 CA-C-N 115.088 -0.96 . . . . 0.0 112.202 -174.611 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 33.7 t70 -66.33 -31.35 72.09 Favored 'General case' 0 C--N 1.324 -0.529 0 CA-C-O 121.023 0.439 . . . . 0.0 111.085 -178.156 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 25' ' ' LYS . . . . . 0.428 ' O ' ' HG2' ' A' ' 29' ' ' MET . 54.3 mtpt -95.89 -4.45 43.54 Favored 'General case' 0 C--O 1.209 -1.048 0 N-CA-C 112.386 0.513 . . . . 0.0 112.386 -177.555 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 26' ' ' LEU . . . . . 0.411 ' HG ' ' HA ' ' A' ' 23' ' ' ASP . 55.6 mt -48.3 -46.83 36.65 Favored 'General case' 0 N--CA 1.483 1.219 0 N-CA-C 114.705 1.372 . . . . 0.0 114.705 -178.602 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 27' ' ' LEU . . . . . . . . . . . . . 22.3 tp -59.17 -45.31 91.33 Favored 'General case' 0 N--CA 1.446 -0.67 0 CA-C-O 121.286 0.565 . . . . 0.0 110.018 178.954 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 28' ' ' GLU . . . . . 0.625 ' HA ' ' CE1' ' A' ' 31' ' ' TYR . 35.2 tt0 -64.04 -35.47 80.82 Favored 'General case' 0 N--CA 1.444 -0.743 0 CA-C-N 114.791 -1.095 . . . . 0.0 109.55 179.696 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 29' ' ' MET . . . . . 0.428 ' HG2' ' O ' ' A' ' 25' ' ' LYS . 79.6 mmm -78.31 -19.42 53.59 Favored 'General case' 0 C--N 1.302 -1.486 0 CA-C-N 114.803 -1.09 . . . . 0.0 110.205 -177.626 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 30' ' ' GLY . . . . . 0.437 ' HA2' ' CE1' ' A' ' 39' ' ' PHE . . . -71.46 -22.27 78.62 Favored Glycine 0 N--CA 1.436 -1.367 0 CA-C-N 115.01 -0.995 . . . . 0.0 111.996 177.762 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 31' ' ' TYR . . . . . 0.625 ' CE1' ' HA ' ' A' ' 28' ' ' GLU . 27.6 p90 -104.54 -34.67 8.13 Favored 'General case' 0 N--CA 1.436 -1.152 0 C-N-CA 119.609 -0.836 . . . . 0.0 112.383 174.82 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 32' ' ' TYR . . . . . . . . . . . . . 37.4 m-85 -67.34 -47.99 68.85 Favored 'General case' 0 C--N 1.309 -1.186 0 CA-C-N 115.918 -0.583 . . . . 0.0 112.179 174.379 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 33' ' ' CYS . . . . . 0.469 ' HB3' ' HB ' ' A' ' 36' ' ' THR . 35.3 m -140.39 64.7 25.4 Favored Pre-proline 0 C--N 1.306 -1.313 0 C-N-CA 120.355 -0.538 . . . . 0.0 111.667 -177.356 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 34' ' ' PRO . . . . . 0.508 ' HD2' ' HA ' ' A' ' 5' ' ' ASP . 31.1 Cg_endo -63.21 -27.63 72.68 Favored 'Trans proline' 0 C--N 1.366 1.489 0 C-N-CA 122.562 2.174 . . . . 0.0 111.817 -178.92 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 35' ' ' VAL . . . . . 0.431 ' HB ' ' OD2' ' A' ' 5' ' ' ASP . 57.8 t -84.9 -47.25 17.22 Favored 'Isoleucine or valine' 0 N--CA 1.419 -1.977 0 CA-C-N 115.473 -0.785 . . . . 0.0 110.255 -176.178 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 36' ' ' THR . . . . . 0.469 ' HB ' ' HB3' ' A' ' 33' ' ' CYS . 23.8 m -59.9 -42.9 94.85 Favored 'General case' 0 C--N 1.317 -0.843 0 CA-C-N 115.859 -0.61 . . . . 0.0 111.248 179.71 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 37' ' ' CYS . . . . . . . . . . . . . 77.9 m -79.05 -8.13 58.69 Favored 'General case' 0 C--N 1.319 -0.749 0 N-CA-C 112.222 0.453 . . . . 0.0 112.222 179.661 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 38' ' ' GLY . . . . . . . . . . . . . . . 77.49 40.08 24.11 Favored Glycine 0 N--CA 1.445 -0.736 0 N-CA-C 114.985 0.754 . . . . 0.0 114.985 174.54 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 39' ' ' PHE . . . . . 0.437 ' CE1' ' HA2' ' A' ' 30' ' ' GLY . 87.3 m-85 -78.35 -32.14 48.94 Favored 'General case' 0 C--N 1.317 -0.843 0 N-CA-C 108.519 -0.919 . . . . 0.0 108.519 175.245 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 40' ' ' CYS . . . . . . . . . . . . . 1.5 p -150.14 89.16 1.57 Allowed 'General case' 0 C--N 1.303 -1.451 0 CA-C-N 114.224 -1.353 . . . . 0.0 109.658 -178.592 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 41' ' ' NH2 . . . . . . . . . . . . . . . . . . . . 0 C--N 1.309 -1.186 0 CA-C-N 116.193 -0.458 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 009 nuclear nobuild full ' A' A ' 1' ' ' GLU . . . . . . . . . . . . . 11.2 pt-20 . . . . . 0 CA--C 1.504 -0.826 0 N-CA-C 109.26 -0.644 . . . . 0.0 109.26 . . . . . . . . . 0 0 . 1 . 009 nuclear nobuild full ' A' A ' 2' ' ' HIS . . . . . . . . . . . . . 18.6 t-80 -88.85 112.36 23.16 Favored 'General case' 0 N--CA 1.432 -1.359 0 N-CA-C 108.818 -0.808 . . . . 0.0 108.818 176.504 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 3' ' ' CYS . . . . . . . . . . . . . 25.7 p -71.8 104.78 3.54 Favored 'General case' 0 C--N 1.299 -1.61 0 CA-C-O 121.517 0.675 . . . . 0.0 110.631 178.803 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 4' ' ' ALA . . . . . . . . . . . . . . . -140.87 143.25 34.6 Favored 'General case' 0 N--CA 1.432 -1.357 0 CA-C-N 116.035 -0.53 . . . . 0.0 109.72 -179.86 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 5' ' ' ASP . . . . . 0.678 ' HB3' ' SG ' ' A' ' 11' ' ' CYS . 43.9 m-20 -64.32 141.44 58.77 Favored 'General case' 0 C--O 1.25 1.106 0 N-CA-C 108.761 -0.829 . . . . 0.0 108.761 175.777 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -70.44 150.0 46.66 Favored 'General case' 0 C--N 1.307 -1.269 0 CA-C-O 121.497 0.665 . . . . 0.0 110.796 -176.992 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 7' ' ' LYS . . . . . . . . . . . . . 9.2 ptpp? -85.51 -25.36 26.87 Favored 'General case' 0 C--N 1.307 -1.244 0 CA-C-N 115.133 -0.94 . . . . 0.0 111.997 -177.222 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 8' ' ' ASN . . . . . . . . . . . . . 42.5 m-80 -95.12 1.99 55.02 Favored 'General case' 0 C--N 1.31 -1.143 0 CA-C-N 115.849 -0.614 . . . . 0.0 110.592 -178.101 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 9' ' ' PHE . . . . . 0.416 ' CD2' ' HB3' ' A' ' 32' ' ' TYR . 34.1 t80 -121.75 137.32 54.81 Favored 'General case' 0 C--N 1.291 -1.966 0 N-CA-C 107.099 -1.445 . . . . 0.0 107.099 -178.731 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 10' ' ' ASP . . . . . . . . . . . . . 8.8 t70 -94.24 103.09 15.12 Favored 'General case' 0 C--N 1.309 -1.177 0 C-N-CA 119.678 -0.809 . . . . 0.0 109.914 -177.884 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 11' ' ' CYS . . . . . 0.678 ' SG ' ' HB3' ' A' ' 5' ' ' ASP . 73.8 m -75.03 -28.71 60.57 Favored 'General case' 0 C--N 1.293 -1.886 0 CA-C-N 115.312 -0.858 . . . . 0.0 112.985 -175.51 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 12' ' ' ARG . . . . . . . . . . . . . 28.2 mmt180 -73.86 -44.44 55.49 Favored 'General case' 0 C--N 1.317 -0.822 0 N-CA-C 109.069 -0.715 . . . . 0.0 109.069 -178.186 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 38.3 ttm180 -60.89 -46.83 89.07 Favored 'General case' 0 C--N 1.318 -0.761 0 CA-C-N 115.238 -0.892 . . . . 0.0 109.874 178.242 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 14' ' ' SER . . . . . . . . . . . . . 44.7 m -61.37 -34.6 75.59 Favored 'General case' 0 C--N 1.319 -0.752 0 CA-C-N 115.746 -0.661 . . . . 0.0 111.48 179.953 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 50.2 tp -72.72 -44.38 61.78 Favored 'General case' 0 C--N 1.312 -1.059 0 C-N-CA 120.688 -0.405 . . . . 0.0 110.968 179.611 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 16' ' ' ARG . . . . . . . . . . . . . 21.9 mtm180 -70.17 -35.56 74.07 Favored 'General case' 0 C--N 1.314 -0.953 0 CA-C-N 116.006 -0.543 . . . . 0.0 112.449 -177.848 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 17' ' ' ASN . . . . . . . . . . . . . 35.5 m-80 -77.1 -26.04 52.91 Favored 'General case' 0 CA--C 1.498 -1.038 0 CA-C-O 121.056 0.455 . . . . 0.0 111.612 178.68 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . 104.56 7.03 40.34 Favored Glycine 0 N--CA 1.433 -1.56 0 C-N-CA 119.685 -1.245 . . . . 0.0 112.469 178.448 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 19' ' ' ASP . . . . . 0.402 ' O ' ' HB2' ' A' ' 25' ' ' LYS . 6.0 m-20 -64.65 -35.97 82.74 Favored 'General case' 0 CA--C 1.499 -1.0 0 N-CA-C 108.779 -0.823 . . . . 0.0 108.779 178.15 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 20' ' ' CYS . . . . . 0.461 ' HA ' ' HG3' ' A' ' 29' ' ' MET . 39.3 t -57.04 -31.16 64.88 Favored 'General case' 0 C--N 1.315 -0.897 0 CA-C-N 114.667 -1.152 . . . . 0.0 111.606 178.904 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 21' ' ' ASP . . . . . . . . . . . . . 17.8 t70 -106.37 -9.3 16.81 Favored 'General case' 0 C--N 1.316 -0.889 0 CA-C-N 115.812 -0.631 . . . . 0.0 111.388 -176.49 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 22' ' ' ASN . . . . . . . . . . . . . 54.7 t30 -77.17 131.35 38.23 Favored 'General case' 0 C--N 1.311 -1.067 0 O-C-N 122.237 -0.289 . . . . 0.0 110.989 -174.535 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 23' ' ' ASP . . . . . . . . . . . . . 26.7 t70 -51.76 -48.14 63.82 Favored 'General case' 0 N--CA 1.473 0.705 0 C-N-CA 123.958 0.903 . . . . 0.0 113.065 -174.233 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 32.4 t70 -61.79 -22.76 65.72 Favored 'General case' 0 N--CA 1.48 1.046 0 N-CA-C 112.304 0.483 . . . . 0.0 112.304 -179.823 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 25' ' ' LYS . . . . . 0.54 ' O ' ' HG2' ' A' ' 29' ' ' MET . 69.8 mmtt -101.58 -16.27 16.81 Favored 'General case' 0 C--N 1.305 -1.369 0 C-N-CA 120.475 -0.49 . . . . 0.0 111.614 -174.174 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 26' ' ' LEU . . . . . . . . . . . . . 83.3 mt -48.18 -50.32 29.44 Favored 'General case' 0 N--CA 1.475 0.785 0 N-CA-C 115.699 1.74 . . . . 0.0 115.699 -172.395 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 27' ' ' LEU . . . . . . . . . . . . . 1.6 tm? -60.51 -43.5 97.01 Favored 'General case' 0 N--CA 1.448 -0.574 0 N-CA-C 109.026 -0.731 . . . . 0.0 109.026 -178.239 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 28' ' ' GLU . . . . . 0.452 ' HA ' ' CZ ' ' A' ' 31' ' ' TYR . 1.2 mp0 -65.05 -34.88 79.48 Favored 'General case' 0 CA--C 1.503 -0.864 0 CA-C-N 114.926 -1.034 . . . . 0.0 110.442 178.988 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 29' ' ' MET . . . . . 0.54 ' HG2' ' O ' ' A' ' 25' ' ' LYS . 70.9 mmm -70.5 -25.64 63.23 Favored 'General case' 0 C--N 1.316 -0.888 0 CA-C-N 116.107 -0.497 . . . . 0.0 110.552 -177.269 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 30' ' ' GLY . . . . . . . . . . . . . . . -68.3 -25.98 74.41 Favored Glycine 0 N--CA 1.448 -0.538 0 CA-C-N 115.586 -0.734 . . . . 0.0 112.36 -179.851 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 31' ' ' TYR . . . . . 0.452 ' CZ ' ' HA ' ' A' ' 28' ' ' GLU . 25.9 p90 -109.48 -33.79 6.7 Favored 'General case' 0 N--CA 1.441 -0.885 0 N-CA-C 113.354 0.872 . . . . 0.0 113.354 177.655 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 32' ' ' TYR . . . . . 0.416 ' HB3' ' CD2' ' A' ' 9' ' ' PHE . 21.3 m-85 -69.74 -48.04 60.86 Favored 'General case' 0 C--N 1.304 -1.382 0 N-CA-C 112.317 0.488 . . . . 0.0 112.317 176.679 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 33' ' ' CYS . . . . . . . . . . . . . 34.8 m -136.57 69.73 60.06 Favored Pre-proline 0 C--N 1.306 -1.305 0 C-N-CA 119.436 -0.905 . . . . 0.0 111.35 -177.55 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 34' ' ' PRO . . . . . 0.462 ' HD2' ' HA ' ' A' ' 5' ' ' ASP . 56.2 Cg_endo -69.96 -23.5 29.83 Favored 'Trans proline' 0 N--CA 1.448 -1.18 0 C-N-CA 121.977 1.785 . . . . 0.0 111.487 -178.416 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 35' ' ' VAL . . . . . 0.403 ' HB ' ' OD2' ' A' ' 5' ' ' ASP . 41.7 t -87.49 -52.45 11.5 Favored 'Isoleucine or valine' 0 C--N 1.296 -1.758 0 CA-C-N 115.696 -0.684 . . . . 0.0 111.015 -177.966 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 36' ' ' THR . . . . . . . . . . . . . 58.4 m -61.95 -35.38 78.28 Favored 'General case' 0 CA--C 1.55 0.973 0 N-CA-C 112.224 0.453 . . . . 0.0 112.224 -178.203 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 37' ' ' CYS . . . . . . . . . . . . . 92.5 m -90.94 2.99 55.81 Favored 'General case' 0 C--N 1.308 -1.196 0 N-CA-C 113.337 0.866 . . . . 0.0 113.337 179.603 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 38' ' ' GLY . . . . . . . . . . . . . . . 72.25 46.49 34.21 Favored Glycine 0 CA--C 1.525 0.701 0 N-CA-C 115.062 0.785 . . . . 0.0 115.062 175.259 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 39' ' ' PHE . . . . . 0.442 ' CD1' ' HA ' ' A' ' 34' ' ' PRO . 96.4 m-85 -95.09 -43.08 8.28 Favored 'General case' 0 C--N 1.306 -1.313 0 N-CA-C 107.864 -1.162 . . . . 0.0 107.864 173.756 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 40' ' ' CYS . . . . . . . . . . . . . 49.5 t -139.11 97.3 3.27 Favored 'General case' 0 N--CA 1.429 -1.505 0 CA-C-N 114.449 -1.25 . . . . 0.0 108.33 -178.613 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 41' ' ' NH2 . . . . . . . . . . . . . . . . . . . . 0 C--N 1.302 -1.483 0 CA-C-N 116.51 -0.313 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 010 nuclear nobuild full ' A' A ' 1' ' ' GLU . . . . . . . . . . . . . 9.5 tp10 . . . . . 0 N--CA 1.453 -0.314 0 N-CA-C 108.686 -0.857 . . . . 0.0 108.686 . . . . . . . . . 0 0 . 1 . 010 nuclear nobuild full ' A' A ' 2' ' ' HIS . . . . . . . . . . . . . 7.6 p80 -103.26 121.51 42.86 Favored 'General case' 0 C--N 1.312 -1.035 0 C-N-CA 119.578 -0.849 . . . . 0.0 108.852 178.234 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 3' ' ' CYS . . . . . . . . . . . . . 27.9 p -62.11 122.6 15.96 Favored 'General case' 0 C--N 1.309 -1.188 0 N-CA-C 108.886 -0.783 . . . . 0.0 108.886 176.0 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 4' ' ' ALA . . . . . . . . . . . . . . . -138.93 141.79 38.48 Favored 'General case' 0 C--N 1.303 -1.448 0 CA-C-N 116.686 -0.233 . . . . 0.0 110.627 -175.507 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 5' ' ' ASP . . . . . 0.413 ' HA ' ' HA ' ' A' ' 33' ' ' CYS . 69.6 m-20 -60.83 147.27 43.34 Favored 'General case' 0 C--N 1.315 -0.916 0 O-C-N 124.009 0.818 . . . . 0.0 110.623 176.773 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 10.7 tp10 -69.02 133.21 47.83 Favored 'General case' 0 C--N 1.308 -1.235 0 CA-C-N 115.922 -0.581 . . . . 0.0 110.058 178.92 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 7' ' ' LYS . . . . . . . . . . . . . 8.8 ptpp? -81.62 -23.55 36.94 Favored 'General case' 0 CA--C 1.512 -0.515 0 CA-C-O 121.298 0.571 . . . . 0.0 110.979 -178.04 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 8' ' ' ASN . . . . . . . . . . . . . 12.7 m120 -86.55 16.8 4.29 Favored 'General case' 0 C--N 1.308 -1.196 0 CA-C-N 115.004 -0.998 . . . . 0.0 110.317 178.594 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 9' ' ' PHE . . . . . . . . . . . . . 0.3 OUTLIER -139.6 138.22 36.0 Favored 'General case' 0 N--CA 1.422 -1.865 0 N-CA-C 105.819 -1.919 . . . . 0.0 105.819 -176.927 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 10' ' ' ASP . . . . . . . . . . . . . 12.3 t70 -104.75 88.71 2.98 Favored 'General case' 0 C--N 1.303 -1.451 0 N-CA-C 108.274 -1.009 . . . . 0.0 108.274 174.518 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 11' ' ' CYS . . . . . . . . . . . . . 95.4 m -79.63 -6.17 56.55 Favored 'General case' 0 C--N 1.301 -1.502 0 N-CA-C 112.732 0.641 . . . . 0.0 112.732 -177.316 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 12' ' ' ARG . . . . . 0.466 ' O ' ' HG2' ' A' ' 16' ' ' ARG . 6.4 mmp_? -65.54 -51.11 62.28 Favored 'General case' 0 N--CA 1.444 -0.753 0 N-CA-C 107.198 -1.408 . . . . 0.0 107.198 173.034 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 58.3 ttp180 -62.0 -44.7 96.18 Favored 'General case' 0 CA--C 1.519 -0.223 0 CA-C-N 115.592 -0.731 . . . . 0.0 110.352 177.135 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 14' ' ' SER . . . . . . . . . . . . . 14.9 m -58.95 -31.73 68.97 Favored 'General case' 0 CA--C 1.543 0.704 0 CA-C-O 120.849 0.357 . . . . 0.0 111.159 178.789 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 15' ' ' LEU . . . . . 0.414 ' HA ' ' HB3' ' A' ' 20' ' ' CYS . 38.8 tp -80.12 -40.14 28.07 Favored 'General case' 0 C--N 1.318 -0.772 0 N-CA-C 110.418 -0.216 . . . . 0.0 110.418 178.921 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 16' ' ' ARG . . . . . 0.466 ' HG2' ' O ' ' A' ' 12' ' ' ARG . 38.8 mmt180 -61.95 -37.9 86.47 Favored 'General case' 0 C--O 1.22 -0.467 0 CA-C-N 115.929 -0.578 . . . . 0.0 110.342 177.121 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 17' ' ' ASN . . . . . . . . . . . . . 0.9 OUTLIER -77.78 -49.97 13.29 Favored 'General case' 0 C--N 1.316 -0.86 0 CA-C-N 115.665 -0.698 . . . . 0.0 111.562 179.884 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . 129.79 -2.05 5.98 Favored Glycine 0 N--CA 1.446 -0.65 0 C-N-CA 120.03 -1.081 . . . . 0.0 112.751 -179.312 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 19' ' ' ASP . . . . . . . . . . . . . 6.2 m-20 -63.11 -37.86 88.87 Favored 'General case' 0 N--CA 1.477 0.897 0 CA-C-O 121.557 0.694 . . . . 0.0 110.237 -179.956 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 20' ' ' CYS . . . . . 0.414 ' HB3' ' HA ' ' A' ' 15' ' ' LEU . 43.8 t -71.3 -9.07 57.53 Favored 'General case' 0 C--N 1.311 -1.071 0 CA-C-N 114.789 -1.096 . . . . 0.0 111.526 -178.699 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 21' ' ' ASP . . . . . . . . . . . . . 32.6 t70 -116.58 -7.67 11.58 Favored 'General case' 0 C--N 1.32 -0.702 0 CA-C-O 121.478 0.656 . . . . 0.0 110.432 -179.768 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 22' ' ' ASN . . . . . . . . . . . . . 33.6 t30 -74.9 118.93 18.41 Favored 'General case' 0 C--N 1.308 -1.201 0 CA-C-N 115.801 -0.636 . . . . 0.0 110.722 -176.563 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 23' ' ' ASP . . . . . . . . . . . . . 11.4 m-20 -52.25 -40.06 61.17 Favored 'General case' 0 N--CA 1.479 0.978 0 C-N-CA 124.396 1.078 . . . . 0.0 111.836 -176.225 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 33.8 t70 -59.29 -38.75 80.95 Favored 'General case' 0 C--N 1.321 -0.652 0 CA-C-N 116.0 -0.546 . . . . 0.0 112.002 -178.692 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 25' ' ' LYS . . . . . 0.465 ' O ' ' HG2' ' A' ' 29' ' ' MET . 72.1 mmtt -100.47 2.11 41.8 Favored 'General case' 0 C--N 1.308 -1.214 0 N-CA-C 112.827 0.677 . . . . 0.0 112.827 -175.659 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 26' ' ' LEU . . . . . 0.401 HD23 ' HA ' ' A' ' 26' ' ' LEU . 55.9 mt -58.3 -35.49 71.92 Favored 'General case' 0 C--O 1.219 -0.525 0 N-CA-C 113.741 1.015 . . . . 0.0 113.741 -176.877 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 27' ' ' LEU . . . . . . . . . . . . . 1.5 tm? -55.31 -51.09 67.82 Favored 'General case' 0 N--CA 1.439 -0.982 0 N-CA-C 108.933 -0.765 . . . . 0.0 108.933 178.748 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 28' ' ' GLU . . . . . 0.548 ' HA ' ' CE2' ' A' ' 31' ' ' TYR . 43.9 mt-10 -64.87 -34.46 78.44 Favored 'General case' 0 CA--C 1.505 -0.752 0 CA-C-N 115.515 -0.766 . . . . 0.0 110.385 -179.704 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 29' ' ' MET . . . . . 0.465 ' HG2' ' O ' ' A' ' 25' ' ' LYS . 72.2 mmm -76.02 -21.82 56.44 Favored 'General case' 0 C--N 1.311 -1.07 0 CA-C-N 115.565 -0.743 . . . . 0.0 111.541 -174.653 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 30' ' ' GLY . . . . . . . . . . . . . . . -68.53 -37.69 85.6 Favored Glycine 0 CA--C 1.5 -0.862 0 C-N-CA 121.008 -0.615 . . . . 0.0 111.728 -179.892 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 31' ' ' TYR . . . . . 0.548 ' CE2' ' HA ' ' A' ' 28' ' ' GLU . 40.2 p90 -91.25 -36.84 13.67 Favored 'General case' 0 N--CA 1.433 -1.304 0 C-N-CA 119.77 -0.772 . . . . 0.0 112.005 177.775 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 32' ' ' TYR . . . . . . . . . . . . . 22.5 m-85 -65.72 -57.77 7.26 Favored 'General case' 0 C--N 1.316 -0.89 0 N-CA-C 113.259 0.837 . . . . 0.0 113.259 177.42 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 33' ' ' CYS . . . . . 0.413 ' HA ' ' HA ' ' A' ' 5' ' ' ASP . 98.5 m -135.05 80.62 47.48 Favored Pre-proline 0 C--N 1.305 -1.362 0 CA-C-O 121.376 0.608 . . . . 0.0 112.429 -177.694 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 34' ' ' PRO . . . . . 0.474 ' HA ' ' CD1' ' A' ' 39' ' ' PHE . 73.5 Cg_endo -72.59 -20.38 23.45 Favored 'Trans proline' 0 N--CA 1.45 -1.083 0 C-N-CA 122.576 2.184 . . . . 0.0 111.616 -178.404 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 35' ' ' VAL . . . . . . . . . . . . . 21.7 t -86.34 -55.93 5.99 Favored 'Isoleucine or valine' 0 C--N 1.295 -1.794 0 C-N-CA 120.431 -0.508 . . . . 0.0 110.178 -177.852 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 36' ' ' THR . . . . . 0.404 HG22 ' SG ' ' A' ' 20' ' ' CYS . 55.4 m -59.98 -40.12 88.04 Favored 'General case' 0 C--N 1.318 -0.79 0 N-CA-C 112.706 0.632 . . . . 0.0 112.706 -179.201 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 37' ' ' CYS . . . . . 0.411 ' SG ' ' HB3' ' A' ' 29' ' ' MET . 71.9 m -86.1 11.2 12.29 Favored 'General case' 0 C--N 1.307 -1.274 0 N-CA-C 113.212 0.819 . . . . 0.0 113.212 -177.429 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 38' ' ' GLY . . . . . . . . . . . . . . . 73.81 40.18 45.62 Favored Glycine 0 C--N 1.33 0.21 0 N-CA-C 115.332 0.893 . . . . 0.0 115.332 172.102 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 39' ' ' PHE . . . . . 0.474 ' CD1' ' HA ' ' A' ' 34' ' ' PRO . 95.5 m-85 -96.43 -37.9 10.25 Favored 'General case' 0 C--N 1.299 -1.62 0 N-CA-C 108.294 -1.002 . . . . 0.0 108.294 174.36 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 40' ' ' CYS . . . . . 0.425 ' SG ' ' HB2' ' A' ' 34' ' ' PRO . 6.5 p -163.04 -101.24 0.02 OUTLIER 'General case' 0 C--N 1.314 -0.972 0 CA-C-N 114.93 -1.032 . . . . 0.0 109.855 178.352 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 41' ' ' NH2 . . . . . . . . . . . . . . . . . . . . 0 C--N 1.315 -0.916 0 O-C-N 121.425 -0.797 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 011 nuclear nobuild full ' A' A ' 1' ' ' GLU . . . . . . . . . . . . . 15.1 pt-20 . . . . . 0 CA--C 1.495 -1.173 0 N-CA-C 109.497 -0.557 . . . . 0.0 109.497 . . . . . . . . . 0 0 . 1 . 011 nuclear nobuild full ' A' A ' 2' ' ' HIS . . . . . . . . . . . . . 69.2 m80 -91.14 130.8 36.99 Favored 'General case' 0 C--N 1.294 -1.841 0 N-CA-C 106.822 -1.547 . . . . 0.0 106.822 173.049 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 3' ' ' CYS . . . . . . . . . . . . . 8.3 p -57.8 114.12 2.16 Favored 'General case' 0 C--N 1.309 -1.17 0 O-C-N 123.696 0.623 . . . . 0.0 110.082 178.194 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 4' ' ' ALA . . . . . . . . . . . . . . . -133.32 156.06 48.28 Favored 'General case' 0 N--CA 1.43 -1.435 0 CA-C-N 115.734 -0.666 . . . . 0.0 109.627 -176.214 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 5' ' ' ASP . . . . . 0.563 ' HB3' ' SG ' ' A' ' 11' ' ' CYS . 14.6 m-20 -63.23 145.43 55.53 Favored 'General case' 0 C--N 1.308 -1.207 0 O-C-N 123.9 0.75 . . . . 0.0 110.654 179.8 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 6' ' ' GLU . . . . . 0.41 ' OE2' ' HB2' ' A' ' 8' ' ' ASN . 0.3 OUTLIER -70.21 124.18 23.48 Favored 'General case' 0 C--N 1.306 -1.283 0 N-CA-C 105.495 -2.039 . . . . 0.0 105.495 176.239 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' A' A ' 7' ' ' LYS . . . . . 0.5 ' H ' ' HD2' ' A' ' 7' ' ' LYS . 0.0 OUTLIER -79.19 -21.37 46.47 Favored 'General case' 0 C--N 1.321 -0.639 0 N-CA-C 113.597 0.962 . . . . 0.0 113.597 -170.687 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' A' A ' 8' ' ' ASN . . . . . 0.41 ' HB2' ' OE2' ' A' ' 6' ' ' GLU . 32.7 m-80 -81.7 -23.03 37.05 Favored 'General case' 0 C--N 1.304 -1.407 0 N-CA-C 108.873 -0.788 . . . . 0.0 108.873 -178.964 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 9' ' ' PHE . . . . . . . . . . . . . 28.7 t80 -81.67 142.32 32.82 Favored 'General case' 0 N--CA 1.428 -1.54 0 CA-C-N 114.593 -1.185 . . . . 0.0 108.362 178.524 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 10' ' ' ASP . . . . . . . . . . . . . 8.9 t70 -92.18 97.14 10.72 Favored 'General case' 0 C--N 1.305 -1.346 0 C-N-CA 118.856 -1.137 . . . . 0.0 109.018 178.759 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 11' ' ' CYS . . . . . 0.563 ' SG ' ' HB3' ' A' ' 5' ' ' ASP . 72.8 m -73.83 -23.06 59.59 Favored 'General case' 0 C--N 1.297 -1.682 0 CA-C-N 115.231 -0.895 . . . . 0.0 111.546 -177.23 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 12' ' ' ARG . . . . . . . . . . . . . 19.9 mmm180 -74.19 -44.56 52.9 Favored 'General case' 0 C--N 1.325 -0.473 0 N-CA-C 109.354 -0.61 . . . . 0.0 109.354 -177.235 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 58.2 ttp180 -56.32 -49.12 75.24 Favored 'General case' 0 C--N 1.321 -0.66 0 C-N-CA 124.253 1.021 . . . . 0.0 108.597 176.083 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 14' ' ' SER . . . . . . . . . . . . . 20.7 m -60.38 -32.73 71.58 Favored 'General case' 0 C--N 1.313 -1.008 0 CA-C-N 114.794 -1.093 . . . . 0.0 111.911 -179.35 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 15' ' ' LEU . . . . . 0.483 ' HA ' ' HB3' ' A' ' 20' ' ' CYS . 29.9 tp -78.08 -39.32 41.93 Favored 'General case' 0 C--N 1.309 -1.174 0 O-C-N 121.973 -0.455 . . . . 0.0 110.559 179.765 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 16' ' ' ARG . . . . . . . . . . . . . 66.6 mtt180 -70.04 -35.93 74.66 Favored 'General case' 0 C--N 1.316 -0.873 0 CA-C-N 115.874 -0.603 . . . . 0.0 111.88 179.663 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 17' ' ' ASN . . . . . . . . . . . . . 95.0 m-20 -70.86 -44.13 67.03 Favored 'General case' 0 CA--C 1.495 -1.136 0 CA-C-O 121.662 0.744 . . . . 0.0 109.533 178.688 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . 118.82 2.65 14.25 Favored Glycine 0 N--CA 1.424 -2.13 0 CA-C-N 114.556 -1.202 . . . . 0.0 110.948 -177.144 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 19' ' ' ASP . . . . . . . . . . . . . 28.0 m-20 -60.16 -41.65 93.27 Favored 'General case' 0 N--CA 1.484 1.256 0 CA-C-O 122.354 1.073 . . . . 0.0 108.518 -179.893 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 20' ' ' CYS . . . . . 0.483 ' HB3' ' HA ' ' A' ' 15' ' ' LEU . 43.2 t -79.6 -3.18 45.9 Favored 'General case' 0 C--N 1.302 -1.46 0 CA-C-N 113.689 -1.596 . . . . 0.0 111.056 -176.548 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 21' ' ' ASP . . . . . . . . . . . . . 32.1 t70 -121.93 -9.75 8.73 Favored 'General case' 0 C--N 1.312 -1.06 0 CA-C-O 121.445 0.641 . . . . 0.0 110.626 -176.275 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 22' ' ' ASN . . . . . 0.437 ' O ' ' HG ' ' A' ' 26' ' ' LEU . 55.0 t-20 -87.26 125.04 33.96 Favored 'General case' 0 C--N 1.31 -1.13 0 N-CA-C 108.909 -0.775 . . . . 0.0 108.909 -177.542 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 23' ' ' ASP . . . . . . . . . . . . . 28.8 t70 -55.22 -36.77 66.33 Favored 'General case' 0 C--N 1.318 -0.767 0 C-N-CA 124.165 0.986 . . . . 0.0 111.782 -179.658 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 31.6 t70 -68.45 -29.51 68.17 Favored 'General case' 0 C--N 1.316 -0.877 0 CA-C-N 115.951 -0.568 . . . . 0.0 111.516 -178.368 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 25' ' ' LYS . . . . . . . . . . . . . 13.2 mptt -100.02 1.55 42.57 Favored 'General case' 0 C--N 1.316 -0.89 0 CA-C-N 116.079 -0.509 . . . . 0.0 112.336 -178.018 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 26' ' ' LEU . . . . . 0.437 ' HG ' ' O ' ' A' ' 22' ' ' ASN . 59.3 mt -62.89 -38.36 90.62 Favored 'General case' 0 C--O 1.214 -0.787 0 N-CA-C 114.737 1.384 . . . . 0.0 114.737 -175.262 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 27' ' ' LEU . . . . . . . . . . . . . 2.0 tm? -59.95 -47.24 86.62 Favored 'General case' 0 N--CA 1.441 -0.921 0 N-CA-C 108.607 -0.886 . . . . 0.0 108.607 -179.285 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 28' ' ' GLU . . . . . 0.58 ' HA ' ' CZ ' ' A' ' 31' ' ' TYR . 34.0 tt0 -64.81 -35.63 81.71 Favored 'General case' 0 C--N 1.311 -1.105 0 CA-C-N 115.401 -0.818 . . . . 0.0 110.139 179.708 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 29' ' ' MET . . . . . 0.511 ' HB3' ' SG ' ' A' ' 37' ' ' CYS . 76.1 mmm -82.64 -12.17 57.84 Favored 'General case' 0 C--N 1.3 -1.563 0 CA-C-N 115.477 -0.783 . . . . 0.0 111.897 -175.03 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 30' ' ' GLY . . . . . . . . . . . . . . . -75.35 -36.96 43.09 Favored Glycine 0 C--N 1.307 -1.037 0 N-CA-C 111.113 -0.795 . . . . 0.0 111.113 177.77 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 31' ' ' TYR . . . . . 0.58 ' CZ ' ' HA ' ' A' ' 28' ' ' GLU . 24.8 p90 -84.78 -27.98 26.5 Favored 'General case' 0 N--CA 1.441 -0.914 0 C-N-CA 119.681 -0.808 . . . . 0.0 112.24 176.408 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 32' ' ' TYR . . . . . . . . . . . . . 30.6 m-85 -77.43 -61.38 2.01 Favored 'General case' 0 C--N 1.295 -1.799 0 N-CA-C 113.737 1.014 . . . . 0.0 113.737 174.961 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 33' ' ' CYS . . . . . . . . . . . . . 31.4 m -132.58 72.86 77.38 Favored Pre-proline 0 C--N 1.303 -1.441 0 C-N-CA 119.734 -0.786 . . . . 0.0 111.466 -175.308 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 34' ' ' PRO . . . . . 0.534 ' HD2' ' HA ' ' A' ' 5' ' ' ASP . 34.6 Cg_endo -62.48 -26.86 76.58 Favored 'Trans proline' 0 C--N 1.363 1.304 0 C-N-CA 122.703 2.269 . . . . 0.0 112.323 -178.549 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 35' ' ' VAL . . . . . . . . . . . . . 38.5 t -85.92 -49.68 15.06 Favored 'Isoleucine or valine' 0 C--N 1.296 -1.754 0 C-N-CA 120.133 -0.627 . . . . 0.0 110.472 -177.45 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 36' ' ' THR . . . . . . . . . . . . . 20.9 m -58.94 -38.51 79.16 Favored 'General case' 0 C--N 1.32 -0.685 0 C-N-CA 123.072 0.549 . . . . 0.0 111.279 -178.917 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 37' ' ' CYS . . . . . 0.511 ' SG ' ' HB3' ' A' ' 29' ' ' MET . 64.6 m -87.91 10.8 17.52 Favored 'General case' 0 C--N 1.312 -1.061 0 CA-C-N 115.9 -0.591 . . . . 0.0 112.246 -178.488 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 38' ' ' GLY . . . . . . . . . . . . . . . 74.73 19.84 79.74 Favored Glycine 0 CA--C 1.522 0.489 0 N-CA-C 116.197 1.239 . . . . 0.0 116.197 172.145 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 39' ' ' PHE . . . . . . . . . . . . . 97.3 m-85 -79.15 -43.01 24.85 Favored 'General case' 0 C--N 1.317 -0.828 0 CA-C-N 118.153 0.976 . . . . 0.0 108.419 176.908 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 40' ' ' CYS . . . . . . . . . . . . . 61.1 m -112.67 86.48 2.37 Favored 'General case' 0 C--N 1.303 -1.424 0 CA-C-N 114.728 -1.124 . . . . 0.0 108.618 178.44 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 41' ' ' NH2 . . . . . . . . . . . . . . . . . . . . 0 C--N 1.307 -1.26 0 CA-C-N 116.586 -0.279 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 012 nuclear nobuild full ' A' A ' 1' ' ' GLU . . . . . . . . . . . . . 6.7 pt-20 . . . . . 0 CA--C 1.508 -0.65 0 CA-C-O 121.084 0.468 . . . . 0.0 110.192 . . . . . . . . . 0 0 . 1 . 012 nuclear nobuild full ' A' A ' 2' ' ' HIS . . . . . . . . . . . . . 76.6 m-70 -102.36 111.98 24.49 Favored 'General case' 0 N--CA 1.428 -1.527 0 N-CA-C 106.864 -1.532 . . . . 0.0 106.864 173.26 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 3' ' ' CYS . . . . . . . . . . . . . 45.2 t -84.32 95.7 8.8 Favored 'General case' 0 C--N 1.3 -1.571 0 CA-C-O 121.899 0.856 . . . . 0.0 109.961 -175.955 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 4' ' ' ALA . . . . . . . . . . . . . . . -149.6 145.7 26.92 Favored 'General case' 0 C--N 1.283 -2.31 0 CA-C-N 114.233 -1.349 . . . . 0.0 108.701 -178.928 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 5' ' ' ASP . . . . . 0.477 ' HB3' ' SG ' ' A' ' 11' ' ' CYS . 24.5 m-20 -56.95 148.83 20.15 Favored 'General case' 0 C--O 1.25 1.129 0 O-C-N 124.095 0.872 . . . . 0.0 110.056 179.907 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 6' ' ' GLU . . . . . 0.468 ' OE1' ' HG2' ' A' ' 7' ' ' LYS . 9.4 tp10 -72.54 145.68 47.28 Favored 'General case' 0 N--CA 1.423 -1.818 0 CA-C-O 121.387 0.613 . . . . 0.0 111.226 -176.562 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 7' ' ' LYS . . . . . 0.468 ' HG2' ' OE1' ' A' ' 6' ' ' GLU . 8.0 ptpp? -84.27 -25.2 29.55 Favored 'General case' 0 C--N 1.315 -0.925 0 CA-C-N 115.085 -0.961 . . . . 0.0 110.885 -175.609 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 8' ' ' ASN . . . . . 0.441 ' H ' ' HG3' ' A' ' 6' ' ' GLU . 15.0 m120 -87.64 4.89 42.16 Favored 'General case' 0 C--N 1.309 -1.187 0 CA-C-N 115.086 -0.961 . . . . 0.0 110.047 -178.001 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 9' ' ' PHE . . . . . . . . . . . . . 20.6 t80 -129.72 143.83 51.0 Favored 'General case' 0 N--CA 1.417 -2.111 0 N-CA-C 107.354 -1.351 . . . . 0.0 107.354 -176.704 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 10' ' ' ASP . . . . . . . . . . . . . 12.1 t70 -103.04 100.9 10.86 Favored 'General case' 0 C--N 1.303 -1.432 0 N-CA-C 108.447 -0.946 . . . . 0.0 108.447 179.617 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 11' ' ' CYS . . . . . 0.477 ' SG ' ' HB3' ' A' ' 5' ' ' ASP . 74.1 m -72.57 -26.38 61.7 Favored 'General case' 0 C--N 1.284 -2.263 0 N-CA-C 113.375 0.88 . . . . 0.0 113.375 -175.004 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 12' ' ' ARG . . . . . . . . . . . . . 37.1 mmt180 -73.17 -49.05 30.28 Favored 'General case' 0 C--N 1.319 -0.728 0 C-N-CA 120.549 -0.461 . . . . 0.0 110.004 -179.792 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 55.2 ttp180 -61.17 -42.72 99.06 Favored 'General case' 0 C--N 1.324 -0.525 0 CA-C-N 115.993 -0.549 . . . . 0.0 110.69 -179.919 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 14' ' ' SER . . . . . . . . . . . . . 16.8 m -66.3 -40.9 90.31 Favored 'General case' 0 C--N 1.312 -1.038 0 CA-C-O 121.185 0.517 . . . . 0.0 110.51 -178.756 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 61.7 tp -63.69 -44.55 93.35 Favored 'General case' 0 C--O 1.238 0.473 0 CA-C-N 115.946 -0.57 . . . . 0.0 110.717 178.704 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 16' ' ' ARG . . . . . . . . . . . . . 78.1 mtp180 -71.56 -28.59 63.96 Favored 'General case' 0 C--N 1.316 -0.89 0 CA-C-N 115.6 -0.727 . . . . 0.0 112.3 -178.786 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 17' ' ' ASN . . . . . . . . . . . . . 13.1 m-80 -77.82 -33.39 52.4 Favored 'General case' 0 CA--C 1.493 -1.22 0 CA-C-O 120.97 0.414 . . . . 0.0 111.89 177.522 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . 116.4 17.19 6.23 Favored Glycine 0 C--N 1.295 -1.728 0 C-N-CA 119.72 -1.228 . . . . 0.0 112.804 177.612 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 19' ' ' ASP . . . . . . . . . . . . . 4.4 m-20 -63.8 -35.45 80.65 Favored 'General case' 0 CA--C 1.505 -0.753 0 CA-C-O 120.99 0.424 . . . . 0.0 111.929 179.203 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 20' ' ' CYS . . . . . . . . . . . . . 11.1 t -85.63 -2.97 58.72 Favored 'General case' 0 C--N 1.309 -1.178 0 CA-C-O 121.851 0.834 . . . . 0.0 109.389 -176.335 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 21' ' ' ASP . . . . . . . . . . . . . 31.2 t70 -105.83 -9.33 17.25 Favored 'General case' 0 C--N 1.319 -0.755 0 CA-C-O 122.404 1.097 . . . . 0.0 108.717 176.692 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 22' ' ' ASN . . . . . . . . . . . . . 49.4 t-20 -87.45 115.07 24.61 Favored 'General case' 0 C--N 1.304 -1.391 0 CA-C-N 114.505 -1.225 . . . . 0.0 108.427 -176.978 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 23' ' ' ASP . . . . . 0.485 ' HA ' ' HG ' ' A' ' 26' ' ' LEU . 7.7 m-20 -56.91 -37.65 71.73 Favored 'General case' 0 N--CA 1.475 0.776 0 N-CA-C 112.607 0.595 . . . . 0.0 112.607 -178.252 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 29.5 m-20 -69.12 -24.15 64.07 Favored 'General case' 0 C--N 1.321 -0.657 0 CA-C-N 116.375 -0.375 . . . . 0.0 111.465 -179.227 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 25' ' ' LYS . . . . . . . . . . . . . 14.0 mptt -107.17 8.7 30.22 Favored 'General case' 0 C--N 1.313 -1.006 0 N-CA-C 113.044 0.757 . . . . 0.0 113.044 -178.825 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 26' ' ' LEU . . . . . 0.485 ' HG ' ' HA ' ' A' ' 23' ' ' ASP . 73.7 mt -59.09 -48.32 82.05 Favored 'General case' 0 N--CA 1.472 0.646 0 N-CA-C 113.502 0.927 . . . . 0.0 113.502 -177.908 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 27' ' ' LEU . . . . . . . . . . . . . 22.1 tp -59.67 -48.52 81.34 Favored 'General case' 0 N--CA 1.44 -0.971 0 N-CA-C 108.952 -0.759 . . . . 0.0 108.952 178.894 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 28' ' ' GLU . . . . . . . . . . . . . 4.7 tp10 -55.74 -37.89 69.06 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 114.055 -1.429 . . . . 0.0 108.935 -177.679 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 29' ' ' MET . . . . . . . . . . . . . 78.5 mmm -84.47 -28.22 26.95 Favored 'General case' 0 C--N 1.309 -1.167 0 CA-C-N 114.997 -1.001 . . . . 0.0 112.4 -173.834 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 30' ' ' GLY . . . . . . . . . . . . . . . -72.69 -32.44 61.54 Favored Glycine 0 N--CA 1.431 -1.638 0 C-N-CA 120.567 -0.825 . . . . 0.0 112.461 -177.76 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 31' ' ' TYR . . . . . . . . . . . . . 47.2 p90 -90.61 -34.79 15.33 Favored 'General case' 0 CA--C 1.5 -0.948 0 C-N-CA 117.935 -1.506 . . . . 0.0 112.349 177.514 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 32' ' ' TYR . . . . . . . . . . . . . 31.4 m-85 -68.69 -41.92 78.51 Favored 'General case' 0 C--N 1.312 -1.022 0 C-N-CA 120.212 -0.595 . . . . 0.0 112.328 176.326 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 33' ' ' CYS . . . . . . . . . . . . . 54.9 m -132.59 64.75 72.64 Favored Pre-proline 0 C--O 1.259 1.553 0 N-CA-C 112.421 0.526 . . . . 0.0 112.421 -176.346 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 34' ' ' PRO . . . . . 0.426 ' HD2' ' HA ' ' A' ' 5' ' ' ASP . 38.6 Cg_endo -67.1 -29.87 39.28 Favored 'Trans proline' 0 N--CA 1.453 -0.908 0 C-N-CA 122.011 1.807 . . . . 0.0 111.718 -178.674 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 35' ' ' VAL . . . . . . . . . . . . . 47.3 t -87.38 -50.08 14.13 Favored 'Isoleucine or valine' 0 N--CA 1.43 -1.455 0 CA-C-N 115.7 -0.682 . . . . 0.0 111.653 -175.379 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 36' ' ' THR . . . . . . . . . . . . . 95.6 m -58.39 -37.69 75.79 Favored 'General case' 0 CA--C 1.545 0.772 0 N-CA-C 112.552 0.575 . . . . 0.0 112.552 -178.683 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 37' ' ' CYS . . . . . 0.416 ' HB2' ' CE2' ' A' ' 39' ' ' PHE . 85.7 m -78.21 -23.62 47.42 Favored 'General case' 0 C--N 1.322 -0.59 0 C-N-CA 119.233 -0.987 . . . . 0.0 111.897 177.668 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 38' ' ' GLY . . . . . . . . . . . . . . . 96.49 41.12 3.73 Favored Glycine 0 N--CA 1.445 -0.727 0 C-N-CA 119.998 -1.096 . . . . 0.0 113.193 179.154 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 39' ' ' PHE . . . . . 0.416 ' CE2' ' HB2' ' A' ' 37' ' ' CYS . 91.4 m-85 -97.47 -38.9 9.41 Favored 'General case' 0 C--N 1.314 -0.943 0 N-CA-C 107.777 -1.194 . . . . 0.0 107.777 174.276 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 40' ' ' CYS . . . . . . . . . . . . . 41.9 t -107.08 94.6 5.18 Favored 'General case' 0 C--N 1.299 -1.591 0 CA-C-N 113.97 -1.468 . . . . 0.0 108.723 -176.416 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 41' ' ' NH2 . . . . . . . . . . . . . . . . . . . . 0 C--N 1.305 -1.334 0 CA-C-N 116.6 -0.273 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 013 nuclear nobuild full ' A' A ' 1' ' ' GLU . . . . . . . . . . . . . 10.2 pt-20 . . . . . 0 C--O 1.236 0.343 0 CA-C-O 119.417 -0.325 . . . . 0.0 111.295 . . . . . . . . . 0 0 . 1 . 013 nuclear nobuild full ' A' A ' 2' ' ' HIS . . . . . . . . . . . . . 20.8 m-70 -60.76 111.5 1.66 Allowed 'General case' 0 CA--C 1.484 -1.559 0 CA-C-O 121.572 0.701 . . . . 0.0 111.197 -172.209 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 3' ' ' CYS . . . . . 0.437 ' SG ' ' HB2' ' A' ' 34' ' ' PRO . 16.0 t -81.66 98.03 8.18 Favored 'General case' 0 C--N 1.279 -2.493 0 CA-C-N 114.486 -1.234 . . . . 0.0 109.307 -178.883 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 4' ' ' ALA . . . . . . . . . . . . . . . -152.03 136.45 16.8 Favored 'General case' 0 C--N 1.292 -1.924 0 CA-C-N 114.479 -1.237 . . . . 0.0 108.781 179.875 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 5' ' ' ASP . . . . . 0.592 ' HB3' ' SG ' ' A' ' 11' ' ' CYS . 54.3 m-20 -67.44 143.25 56.35 Favored 'General case' 0 C--O 1.248 0.995 0 O-C-N 123.473 0.483 . . . . 0.0 111.122 179.04 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 9.8 tp10 -66.86 140.88 57.81 Favored 'General case' 0 C--N 1.316 -0.869 0 C-N-CA 124.054 0.942 . . . . 0.0 109.741 177.563 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 7' ' ' LYS . . . . . . . . . . . . . 20.8 ptmt -85.44 -23.36 27.9 Favored 'General case' 0 N--CA 1.441 -0.89 0 CA-C-O 121.464 0.649 . . . . 0.0 111.101 -178.652 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 8' ' ' ASN . . . . . . . . . . . . . 38.1 m-80 -86.91 14.66 6.92 Favored 'General case' 0 N--CA 1.48 1.057 0 CA-C-N 114.953 -1.021 . . . . 0.0 110.673 -178.565 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 9' ' ' PHE . . . . . . . . . . . . . 15.3 t80 -141.34 132.95 27.07 Favored 'General case' 0 N--CA 1.41 -2.469 0 N-CA-C 105.232 -2.136 . . . . 0.0 105.232 -178.774 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 10' ' ' ASP . . . . . . . . . . . . . 9.1 t70 -91.78 96.79 10.61 Favored 'General case' 0 C--N 1.297 -1.7 0 C-N-CA 118.63 -1.228 . . . . 0.0 108.774 -179.713 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 11' ' ' CYS . . . . . 0.592 ' SG ' ' HB3' ' A' ' 5' ' ' ASP . 60.0 m -68.33 -30.21 69.14 Favored 'General case' 0 C--N 1.3 -1.546 0 CA-C-N 115.706 -0.679 . . . . 0.0 112.215 -175.574 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 12' ' ' ARG . . . . . . . . . . . . . 30.6 mmt180 -69.36 -47.46 64.25 Favored 'General case' 0 CA--C 1.508 -0.635 0 N-CA-C 110.008 -0.368 . . . . 0.0 110.008 179.468 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 54.6 ttp180 -58.71 -42.25 88.21 Favored 'General case' 0 C--N 1.315 -0.894 0 C-N-CA 122.967 0.507 . . . . 0.0 109.918 176.865 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 14' ' ' SER . . . . . . . . . . . . . 26.2 m -64.51 -33.42 75.84 Favored 'General case' 0 C--N 1.316 -0.891 0 CA-C-N 116.006 -0.543 . . . . 0.0 110.749 179.153 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 29.8 tp -74.88 -41.7 59.29 Favored 'General case' 0 N--CA 1.441 -0.912 0 N-CA-C 109.633 -0.506 . . . . 0.0 109.633 179.609 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 16' ' ' ARG . . . . . . . . . . . . . 78.3 mtp180 -64.49 -31.09 72.15 Favored 'General case' 0 C--N 1.321 -0.656 0 C-N-CA 123.699 0.8 . . . . 0.0 111.883 179.51 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 17' ' ' ASN . . . . . . . . . . . . . 30.6 m-80 -85.25 -42.77 14.36 Favored 'General case' 0 CA--C 1.511 -0.531 0 N-CA-C 112.454 0.539 . . . . 0.0 112.454 179.275 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . 130.55 -4.19 5.83 Favored Glycine 0 C--O 1.225 -0.461 0 C-N-CA 119.614 -1.279 . . . . 0.0 112.414 -179.334 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 19' ' ' ASP . . . . . . . . . . . . . 3.5 m-20 -61.79 -38.99 90.1 Favored 'General case' 0 N--CA 1.478 0.972 0 C-N-CA 123.614 0.766 . . . . 0.0 110.701 -177.336 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 20' ' ' CYS . . . . . . . . . . . . . 44.4 t -77.89 -11.21 59.87 Favored 'General case' 0 C--N 1.302 -1.497 0 CA-C-N 114.728 -1.124 . . . . 0.0 111.845 -173.741 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 21' ' ' ASP . . . . . . . . . . . . . 35.3 t70 -114.07 -6.61 13.1 Favored 'General case' 0 C--N 1.312 -1.036 0 CA-C-O 121.768 0.794 . . . . 0.0 110.612 -178.437 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 22' ' ' ASN . . . . . . . . . . . . . 19.1 t-20 -79.53 115.47 19.17 Favored 'General case' 0 C--N 1.309 -1.177 0 CA-C-N 115.378 -0.828 . . . . 0.0 109.681 -177.297 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 23' ' ' ASP . . . . . 0.4 ' HA ' ' HG ' ' A' ' 26' ' ' LEU . 13.2 t70 -55.02 -39.45 69.13 Favored 'General case' 0 N--CA 1.479 0.988 0 C-N-CA 123.972 0.909 . . . . 0.0 112.616 -175.849 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 6.0 m-20 -72.58 -12.93 61.26 Favored 'General case' 0 C--N 1.31 -1.151 0 N-CA-C 112.819 0.674 . . . . 0.0 112.819 -177.053 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 25' ' ' LYS . . . . . . . . . . . . . 43.7 mtpt -113.41 -2.08 14.04 Favored 'General case' 0 C--N 1.315 -0.934 0 CA-C-O 120.963 0.411 . . . . 0.0 110.432 179.655 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 26' ' ' LEU . . . . . 0.412 HD23 ' HA ' ' A' ' 26' ' ' LEU . 45.8 mt -55.54 -35.54 65.79 Favored 'General case' 0 C--N 1.318 -0.785 0 N-CA-C 115.44 1.644 . . . . 0.0 115.44 -177.632 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 27' ' ' LEU . . . . . . . . . . . . . 2.2 tm? -58.08 -50.96 71.67 Favored 'General case' 0 N--CA 1.441 -0.9 0 N-CA-C 107.672 -1.233 . . . . 0.0 107.672 179.071 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 28' ' ' GLU . . . . . 0.631 ' HA ' ' CZ ' ' A' ' 31' ' ' TYR . 40.0 tt0 -65.38 -32.62 74.35 Favored 'General case' 0 N--CA 1.437 -1.076 0 CA-C-N 114.63 -1.168 . . . . 0.0 110.449 179.753 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 29' ' ' MET . . . . . . . . . . . . . 78.5 mmm -80.51 -17.98 49.91 Favored 'General case' 0 C--O 1.208 -1.121 0 CA-C-N 115.901 -0.59 . . . . 0.0 112.081 -175.764 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 30' ' ' GLY . . . . . . . . . . . . . . . -77.06 -39.78 26.64 Favored Glycine 0 C--N 1.303 -1.284 0 C-N-CA 120.419 -0.896 . . . . 0.0 111.658 -179.604 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 31' ' ' TYR . . . . . 0.631 ' CZ ' ' HA ' ' A' ' 28' ' ' GLU . 25.0 p90 -79.44 -31.64 42.62 Favored 'General case' 0 CA--C 1.501 -0.931 0 C-N-CA 119.173 -1.011 . . . . 0.0 112.059 176.581 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 32' ' ' TYR . . . . . . . . . . . . . 17.8 m-85 -73.77 -54.85 7.11 Favored 'General case' 0 C--N 1.297 -1.689 0 N-CA-C 113.384 0.883 . . . . 0.0 113.384 174.913 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 33' ' ' CYS . . . . . . . . . . . . . 30.3 m -134.89 76.9 58.22 Favored Pre-proline 0 C--N 1.307 -1.281 0 C-N-CA 119.892 -0.723 . . . . 0.0 111.863 -175.99 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 34' ' ' PRO . . . . . 0.492 ' HD2' ' HA ' ' A' ' 5' ' ' ASP . 55.7 Cg_endo -68.79 -25.07 33.75 Favored 'Trans proline' 0 C--N 1.352 0.759 0 C-N-CA 122.261 1.974 . . . . 0.0 112.054 -179.266 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 35' ' ' VAL . . . . . 0.431 ' HB ' ' OD1' ' A' ' 5' ' ' ASP . 47.3 t -86.28 -51.65 12.91 Favored 'Isoleucine or valine' 0 C--N 1.306 -1.313 0 CA-C-N 116.261 -0.427 . . . . 0.0 110.491 -177.326 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 36' ' ' THR . . . . . . . . . . . . . 62.0 m -62.41 -37.6 86.42 Favored 'General case' 0 C--O 1.249 1.039 0 CA-C-N 116.159 -0.473 . . . . 0.0 111.958 -178.615 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 37' ' ' CYS . . . . . . . . . . . . . 72.2 m -84.62 6.53 23.59 Favored 'General case' 0 C--N 1.311 -1.091 0 N-CA-C 112.395 0.517 . . . . 0.0 112.395 -179.726 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 38' ' ' GLY . . . . . . . . . . . . . . . 70.09 46.49 50.87 Favored Glycine 0 N--CA 1.446 -0.676 0 N-CA-C 115.451 0.94 . . . . 0.0 115.451 172.238 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 39' ' ' PHE . . . . . 0.437 ' CD2' ' HA ' ' A' ' 34' ' ' PRO . 91.9 m-85 -87.87 -36.18 17.34 Favored 'General case' 0 C--N 1.302 -1.467 0 N-CA-C 108.766 -0.828 . . . . 0.0 108.766 174.145 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 40' ' ' CYS . . . . . . . . . . . . . 15.8 m -116.51 73.6 0.86 Allowed 'General case' 0 C--N 1.315 -0.893 0 N-CA-C 109.178 -0.675 . . . . 0.0 109.178 178.889 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 41' ' ' NH2 . . . . . . . . . . . . . . . . . . . . 0 C--N 1.314 -0.96 0 CA-C-N 116.738 -0.21 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 014 nuclear nobuild full ' A' A ' 1' ' ' GLU . . . . . . . . . . . . . 10.8 pt-20 . . . . . 0 C--O 1.243 0.762 0 CA-C-O 119.739 -0.172 . . . . 0.0 110.901 . . . . . . . . . 0 0 . 1 . 014 nuclear nobuild full ' A' A ' 2' ' ' HIS . . . . . . . . . . . . . 21.7 t-80 -65.4 110.63 2.72 Favored 'General case' 0 N--CA 1.441 -0.887 0 N-CA-C 108.964 -0.754 . . . . 0.0 108.964 -178.562 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 3' ' ' CYS . . . . . . . . . . . . . 26.2 p -86.21 109.71 19.1 Favored 'General case' 0 C--N 1.297 -1.702 0 CA-C-N 115.47 -0.786 . . . . 0.0 110.702 -179.875 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 4' ' ' ALA . . . . . . . . . . . . . . . -142.12 156.01 45.36 Favored 'General case' 0 N--CA 1.433 -1.313 0 N-CA-C 108.419 -0.956 . . . . 0.0 108.419 179.538 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 5' ' ' ASP . . . . . 0.601 ' HB3' ' SG ' ' A' ' 11' ' ' CYS . 31.3 m-20 -60.56 137.31 58.18 Favored 'General case' 0 C--N 1.312 -1.04 0 O-C-N 123.527 0.517 . . . . 0.0 111.41 -177.24 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 9.9 tp10 -69.27 127.48 33.2 Favored 'General case' 0 N--CA 1.427 -1.584 0 N-CA-C 109.466 -0.568 . . . . 0.0 109.466 177.534 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 7' ' ' LYS . . . . . . . . . . . . . 17.3 ptpt -85.25 -12.76 51.76 Favored 'General case' 0 C--N 1.306 -1.293 0 CA-C-O 121.576 0.703 . . . . 0.0 110.652 -178.687 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 8' ' ' ASN . . . . . . . . . . . . . 13.0 m120 -91.64 16.37 10.72 Favored 'General case' 0 C--N 1.315 -0.902 0 CA-C-O 121.91 0.862 . . . . 0.0 109.2 176.398 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 9' ' ' PHE . . . . . 0.431 ' HE2' ' HG ' ' A' ' 14' ' ' SER . 29.6 t80 -136.4 155.98 49.27 Favored 'General case' 0 N--CA 1.427 -1.589 0 N-CA-C 106.748 -1.575 . . . . 0.0 106.748 -177.655 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 10' ' ' ASP . . . . . . . . . . . . . 9.1 t70 -104.49 95.74 6.13 Favored 'General case' 0 C--N 1.311 -1.076 0 N-CA-C 108.501 -0.926 . . . . 0.0 108.501 175.199 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 11' ' ' CYS . . . . . 0.601 ' SG ' ' HB3' ' A' ' 5' ' ' ASP . 81.4 m -67.88 -30.95 70.43 Favored 'General case' 0 C--N 1.301 -1.504 0 CA-C-N 115.61 -0.723 . . . . 0.0 111.727 -175.573 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 12' ' ' ARG . . . . . 0.409 ' O ' ' HG3' ' A' ' 16' ' ' ARG . 28.4 mmm180 -66.93 -43.49 83.11 Favored 'General case' 0 CA--C 1.503 -0.839 0 CA-C-N 116.324 -0.398 . . . . 0.0 110.359 179.496 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 60.7 ttp180 -58.24 -47.59 83.04 Favored 'General case' 0 C--N 1.316 -0.868 0 CA-C-N 115.865 -0.607 . . . . 0.0 110.705 179.333 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 14' ' ' SER . . . . . 0.431 ' HG ' ' HE2' ' A' ' 9' ' ' PHE . 57.0 m -66.66 -28.24 68.31 Favored 'General case' 0 C--N 1.319 -0.743 0 N-CA-C 112.028 0.381 . . . . 0.0 112.028 179.045 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 15' ' ' LEU . . . . . 0.406 HD13 ' SG ' ' A' ' 20' ' ' CYS . 42.3 tp -74.14 -45.2 50.29 Favored 'General case' 0 C--N 1.319 -0.743 0 CA-C-O 120.891 0.377 . . . . 0.0 110.141 177.527 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 16' ' ' ARG . . . . . 0.409 ' HG3' ' O ' ' A' ' 12' ' ' ARG . 48.2 mtm180 -66.5 -34.63 78.36 Favored 'General case' 0 C--N 1.316 -0.849 0 CA-C-N 115.99 -0.55 . . . . 0.0 111.131 179.781 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 17' ' ' ASN . . . . . . . . . . . . . 14.7 m-80 -70.85 -31.08 67.66 Favored 'General case' 0 CA--C 1.496 -1.108 0 CA-C-O 121.167 0.508 . . . . 0.0 111.079 176.318 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . 105.2 -1.66 40.55 Favored Glycine 0 N--CA 1.436 -1.331 0 CA-C-N 115.508 -0.769 . . . . 0.0 112.513 178.489 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 19' ' ' ASP . . . . . . . . . . . . . 18.6 m-20 -63.01 -33.01 74.51 Favored 'General case' 0 N--CA 1.484 1.228 0 CA-C-O 121.657 0.741 . . . . 0.0 109.852 -179.453 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 20' ' ' CYS . . . . . 0.454 ' HA ' ' HG3' ' A' ' 29' ' ' MET . 32.2 t -64.51 -24.14 67.51 Favored 'General case' 0 C--N 1.302 -1.484 0 CA-C-N 114.376 -1.283 . . . . 0.0 110.993 -179.987 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 21' ' ' ASP . . . . . . . . . . . . . 34.6 t70 -112.86 -4.88 13.9 Favored 'General case' 0 N--CA 1.468 0.462 0 CA-C-O 121.585 0.707 . . . . 0.0 110.694 -178.632 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 22' ' ' ASN . . . . . 0.427 ' O ' ' HG ' ' A' ' 26' ' ' LEU . 27.2 t-20 -77.77 126.19 30.48 Favored 'General case' 0 C--N 1.307 -1.246 0 CA-C-N 116.118 -0.492 . . . . 0.0 109.809 -178.602 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 23' ' ' ASP . . . . . 0.483 ' HA ' ' HG ' ' A' ' 26' ' ' LEU . 2.2 m-20 -56.92 -41.74 78.72 Favored 'General case' 0 N--CA 1.474 0.745 0 N-CA-C 113.809 1.04 . . . . 0.0 113.809 -176.333 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 21.9 t70 -67.97 -29.03 67.97 Favored 'General case' 0 C--N 1.314 -0.976 0 CA-C-O 121.408 0.623 . . . . 0.0 110.882 179.824 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 25' ' ' LYS . . . . . 0.41 ' HG2' ' OD1' ' A' ' 22' ' ' ASN . 47.0 mmtm -97.59 -0.63 45.44 Favored 'General case' 0 C--N 1.313 -1.007 0 CA-C-N 116.146 -0.479 . . . . 0.0 111.958 -177.521 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 26' ' ' LEU . . . . . 0.483 ' HG ' ' HA ' ' A' ' 23' ' ' ASP . 74.4 mt -58.46 -44.79 89.38 Favored 'General case' 0 N--CA 1.473 0.684 0 N-CA-C 113.22 0.822 . . . . 0.0 113.22 -177.33 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 27' ' ' LEU . . . . . . . . . . . . . 26.8 tp -60.24 -45.66 92.48 Favored 'General case' 0 N--CA 1.432 -1.346 0 CA-C-O 121.204 0.526 . . . . 0.0 109.747 178.776 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 28' ' ' GLU . . . . . . . . . . . . . 9.5 mm-40 -58.68 -36.67 74.55 Favored 'General case' 0 C--N 1.323 -0.582 0 CA-C-N 114.597 -1.183 . . . . 0.0 109.373 -179.323 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 29' ' ' MET . . . . . 0.466 ' HB3' ' SG ' ' A' ' 37' ' ' CYS . 76.9 mmm -89.29 -16.46 31.1 Favored 'General case' 0 C--N 1.296 -1.737 0 CA-C-N 114.536 -1.211 . . . . 0.0 112.525 -173.271 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 30' ' ' GLY . . . . . . . . . . . . . . . -72.07 -40.23 56.98 Favored Glycine 0 C--N 1.302 -1.307 0 N-CA-C 111.439 -0.665 . . . . 0.0 111.439 178.556 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 31' ' ' TYR . . . . . . . . . . . . . 17.5 p90 -82.66 -29.15 30.19 Favored 'General case' 0 CA--C 1.503 -0.83 0 C-N-CA 119.342 -0.943 . . . . 0.0 112.594 177.618 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 32' ' ' TYR . . . . . . . . . . . . . 15.3 m-85 -76.79 -62.07 1.76 Allowed 'General case' 0 C--N 1.298 -1.669 0 N-CA-C 113.764 1.024 . . . . 0.0 113.764 175.592 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 33' ' ' CYS . . . . . 0.405 ' HA ' ' HA ' ' A' ' 5' ' ' ASP . 56.2 m -131.79 73.4 78.85 Favored Pre-proline 0 C--N 1.309 -1.181 0 C-N-CA 120.294 -0.562 . . . . 0.0 111.445 -175.61 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 34' ' ' PRO . . . . . 0.416 ' HB2' ' SG ' ' A' ' 40' ' ' CYS . 54.3 Cg_endo -67.18 -24.42 44.35 Favored 'Trans proline' 0 C--N 1.351 0.685 0 C-N-CA 122.679 2.253 . . . . 0.0 112.433 -175.683 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 35' ' ' VAL . . . . . 0.43 ' HB ' ' OD2' ' A' ' 5' ' ' ASP . 45.8 t -86.84 -42.86 15.75 Favored 'Isoleucine or valine' 0 C--N 1.301 -1.534 0 CA-C-O 121.077 0.465 . . . . 0.0 110.523 -176.666 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 36' ' ' THR . . . . . . . . . . . . . 31.9 m -63.46 -39.58 94.83 Favored 'General case' 0 C--N 1.308 -1.196 0 CA-C-N 115.75 -0.659 . . . . 0.0 110.985 178.399 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 37' ' ' CYS . . . . . 0.466 ' SG ' ' HB3' ' A' ' 29' ' ' MET . 75.5 m -86.26 5.42 34.46 Favored 'General case' 0 C--N 1.316 -0.876 0 N-CA-C 113.223 0.824 . . . . 0.0 113.223 -178.749 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 38' ' ' GLY . . . . . . . . . . . . . . . 73.11 42.83 42.27 Favored Glycine 0 CA--C 1.52 0.367 0 N-CA-C 115.567 0.987 . . . . 0.0 115.567 173.864 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 39' ' ' PHE . . . . . . . . . . . . . 93.1 m-85 -103.8 -43.59 5.29 Favored 'General case' 0 C--N 1.304 -1.376 0 N-CA-C 107.766 -1.198 . . . . 0.0 107.766 173.316 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 40' ' ' CYS . . . . . 0.416 ' SG ' ' HB2' ' A' ' 34' ' ' PRO . 61.5 m -113.13 101.95 9.93 Favored 'General case' 0 C--N 1.306 -1.284 0 CA-C-N 114.566 -1.197 . . . . 0.0 109.275 -179.463 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 41' ' ' NH2 . . . . . . . . . . . . . . . . . . . . 0 C--N 1.305 -1.335 0 CA-C-N 116.41 -0.359 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 015 nuclear nobuild full ' A' A ' 1' ' ' GLU . . . . . . . . . . . . . 34.3 tt0 . . . . . 0 CA--C 1.493 -1.235 0 CA-C-O 120.352 0.12 . . . . 0.0 110.769 . . . . . . . . . 0 0 . 1 . 015 nuclear nobuild full ' A' A ' 2' ' ' HIS . . . . . . . . . . . . . 49.6 m80 -61.83 111.18 1.77 Allowed 'General case' 0 CA--C 1.481 -1.682 0 N-CA-C 107.703 -1.221 . . . . 0.0 107.703 -178.488 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 3' ' ' CYS . . . . . . . . . . . . . 29.5 p -59.3 88.98 0.01 OUTLIER 'General case' 0 C--N 1.293 -1.851 0 N-CA-C 114.074 1.139 . . . . 0.0 114.074 -178.446 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 4' ' ' ALA . . . . . . . . . . . . . . . -145.86 122.28 10.99 Favored 'General case' 0 N--CA 1.424 -1.748 0 N-CA-C 106.161 -1.792 . . . . 0.0 106.161 174.607 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 5' ' ' ASP . . . . . 0.577 ' OD2' ' HB ' ' A' ' 35' ' ' VAL . 25.9 m-20 -61.56 137.52 58.25 Favored 'General case' 0 C--N 1.315 -0.907 0 O-C-N 123.343 0.402 . . . . 0.0 110.221 -179.506 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER -66.52 136.46 55.69 Favored 'General case' 0 C--N 1.321 -0.671 0 C-N-CA 123.68 0.792 . . . . 0.0 109.558 -175.653 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 7' ' ' LYS . . . . . . . . . . . . . 8.1 ptpp? -73.79 -27.73 61.29 Favored 'General case' 0 C--N 1.309 -1.176 0 N-CA-C 114.986 1.476 . . . . 0.0 114.986 -173.298 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 8' ' ' ASN . . . . . . . . . . . . . 16.2 m120 -98.58 -2.83 37.69 Favored 'General case' 0 C--N 1.285 -2.206 0 C-N-CA 120.436 -0.506 . . . . 0.0 110.933 -178.909 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 9' ' ' PHE . . . . . . . . . . . . . 18.8 t80 -100.7 143.66 30.6 Favored 'General case' 0 C--N 1.302 -1.482 0 N-CA-C 107.499 -1.297 . . . . 0.0 107.499 -179.75 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 10' ' ' ASP . . . . . . . . . . . . . 16.4 t70 -102.82 100.71 10.73 Favored 'General case' 0 C--N 1.307 -1.268 0 C-N-CA 119.064 -1.054 . . . . 0.0 110.788 -179.349 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 11' ' ' CYS . . . . . 0.511 ' SG ' ' HB3' ' A' ' 5' ' ' ASP . 60.1 m -68.32 -27.67 66.49 Favored 'General case' 0 C--N 1.289 -2.03 0 CA-C-N 115.034 -0.984 . . . . 0.0 112.022 -176.1 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 12' ' ' ARG . . . . . . . . . . . . . 38.9 mmt180 -62.2 -48.9 77.97 Favored 'General case' 0 C--O 1.237 0.445 0 N-CA-C 109.575 -0.528 . . . . 0.0 109.575 179.009 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 14.7 ttp180 -59.39 -51.62 69.14 Favored 'General case' 0 C--N 1.325 -0.484 0 CA-C-N 115.394 -0.821 . . . . 0.0 111.092 179.498 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 14' ' ' SER . . . . . . . . . . . . . 25.4 m -63.62 -34.63 78.26 Favored 'General case' 0 C--N 1.311 -1.069 0 N-CA-C 112.048 0.388 . . . . 0.0 112.048 -178.249 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 2.3 tm? -68.34 -43.48 77.43 Favored 'General case' 0 CA--C 1.535 0.386 0 N-CA-C 108.82 -0.807 . . . . 0.0 108.82 179.16 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 16' ' ' ARG . . . . . . . . . . . . . 71.3 mtp180 -70.23 -37.26 74.97 Favored 'General case' 0 C--N 1.319 -0.747 0 N-CA-C 112.824 0.676 . . . . 0.0 112.824 -179.533 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 17' ' ' ASN . . . . . . . . . . . . . 26.4 m-80 -69.99 -36.12 74.92 Favored 'General case' 0 CA--C 1.503 -0.841 0 N-CA-C 111.899 0.333 . . . . 0.0 111.899 178.639 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . 117.79 -1.32 17.71 Favored Glycine 0 N--CA 1.437 -1.283 0 C-N-CA 119.774 -1.203 . . . . 0.0 112.143 179.353 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 19' ' ' ASP . . . . . . . . . . . . . 8.2 m-20 -60.94 -30.46 70.23 Favored 'General case' 0 N--CA 1.482 1.162 0 CA-C-O 121.246 0.546 . . . . 0.0 111.038 -178.38 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 20' ' ' CYS . . . . . . . . . . . . . 52.1 t -82.03 -2.33 51.34 Favored 'General case' 0 C--N 1.304 -1.378 0 CA-C-N 115.411 -0.813 . . . . 0.0 111.001 -176.099 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 21' ' ' ASP . . . . . . . . . . . . . 31.4 t70 -124.32 -9.91 7.51 Favored 'General case' 0 N--CA 1.47 0.554 0 CA-C-O 121.781 0.801 . . . . 0.0 110.065 176.552 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 22' ' ' ASN . . . . . 0.488 ' O ' ' HG ' ' A' ' 26' ' ' LEU . 28.1 t-20 -82.2 121.24 26.37 Favored 'General case' 0 C--N 1.309 -1.153 0 CA-C-N 115.155 -0.93 . . . . 0.0 110.561 -177.041 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 23' ' ' ASP . . . . . . . . . . . . . 13.2 t70 -51.47 -43.32 62.11 Favored 'General case' 0 N--CA 1.483 1.2 0 C-N-CA 124.537 1.135 . . . . 0.0 111.841 -176.904 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 25.4 m-20 -70.2 -14.68 62.73 Favored 'General case' 0 C--N 1.311 -1.093 0 CA-C-N 115.123 -0.944 . . . . 0.0 112.76 -175.911 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 25' ' ' LYS . . . . . . . . . . . . . 14.1 mmmm -115.24 -7.96 12.36 Favored 'General case' 0 C--N 1.313 -1.009 0 N-CA-C 111.56 0.207 . . . . 0.0 111.56 178.894 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 26' ' ' LEU . . . . . 0.488 ' HG ' ' O ' ' A' ' 22' ' ' ASN . 52.3 mt -53.9 -44.55 70.6 Favored 'General case' 0 N--CA 1.473 0.675 0 N-CA-C 114.985 1.476 . . . . 0.0 114.985 -174.329 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 27' ' ' LEU . . . . . . . . . . . . . 26.4 tp -59.27 -46.76 87.66 Favored 'General case' 0 N--CA 1.437 -1.114 0 CA-C-O 121.175 0.512 . . . . 0.0 109.936 -179.309 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 28' ' ' GLU . . . . . 0.513 ' HA ' ' CZ ' ' A' ' 31' ' ' TYR . 46.1 mt-10 -66.14 -32.23 73.56 Favored 'General case' 0 CA--C 1.498 -1.057 0 CA-C-N 114.963 -1.017 . . . . 0.0 110.112 -179.31 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 29' ' ' MET . . . . . 0.433 ' HB3' ' SG ' ' A' ' 37' ' ' CYS . 79.3 mmm -81.51 -19.82 41.39 Favored 'General case' 0 C--N 1.299 -1.616 0 CA-C-N 115.357 -0.838 . . . . 0.0 110.718 -177.901 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 30' ' ' GLY . . . . . 0.453 ' O ' ' HB3' ' A' ' 34' ' ' PRO . . . -74.38 -26.52 67.82 Favored Glycine 0 N--CA 1.43 -1.717 0 CA-C-N 115.259 -0.882 . . . . 0.0 111.216 177.967 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 31' ' ' TYR . . . . . 0.513 ' CZ ' ' HA ' ' A' ' 28' ' ' GLU 0.254 22.2 p90 -98.51 -36.03 10.05 Favored 'General case' 0 N--CA 1.435 -1.194 0 C-N-CA 119.263 -0.975 . . . . 0.0 112.602 173.803 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' A' A ' 32' ' ' TYR . . . . . . . . . . . . . 19.3 m-85 -68.27 -51.71 41.96 Favored 'General case' 0 C--N 1.303 -1.438 0 N-CA-C 113.759 1.022 . . . . 0.0 113.759 176.747 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 33' ' ' CYS . . . . . . . . . . . . . 65.6 m -134.85 66.6 69.07 Favored Pre-proline 0 C--N 1.3 -1.581 0 C-N-CA 119.912 -0.715 . . . . 0.0 111.162 179.684 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 34' ' ' PRO . . . . . 0.453 ' HB3' ' O ' ' A' ' 30' ' ' GLY . 37.1 Cg_endo -64.68 -26.97 60.72 Favored 'Trans proline' 0 C--N 1.352 0.751 0 C-N-CA 122.733 2.289 . . . . 0.0 112.771 -176.566 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 35' ' ' VAL . . . . . 0.577 ' HB ' ' OD2' ' A' ' 5' ' ' ASP . 39.2 t -83.3 -43.38 18.23 Favored 'Isoleucine or valine' 0 C--N 1.307 -1.274 0 C-N-CA 119.796 -0.762 . . . . 0.0 109.617 -178.492 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 36' ' ' THR . . . . . . . . . . . . . 25.2 m -62.61 -40.05 95.72 Favored 'General case' 0 C--N 1.316 -0.851 0 CA-C-N 115.662 -0.699 . . . . 0.0 110.438 178.666 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 37' ' ' CYS . . . . . 0.433 ' SG ' ' HB3' ' A' ' 29' ' ' MET . 79.4 m -81.15 0.18 37.48 Favored 'General case' 0 C--N 1.318 -0.794 0 N-CA-C 112.847 0.684 . . . . 0.0 112.847 178.798 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 38' ' ' GLY . . . . . . . . . . . . . . . 74.21 49.0 13.33 Favored Glycine 0 C--O 1.219 -0.828 0 N-CA-C 115.452 0.941 . . . . 0.0 115.452 173.066 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 39' ' ' PHE . . . . . . . . . . . . . 94.2 m-85 -92.31 -9.58 41.44 Favored 'General case' 0 C--N 1.311 -1.067 0 CA-C-N 117.736 0.768 . . . . 0.0 111.501 175.973 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 40' ' ' CYS . . . . . . . . . . . . . 28.5 p -153.01 104.7 2.85 Favored 'General case' 0 C--N 1.31 -1.141 0 N-CA-C 108.304 -0.998 . . . . 0.0 108.304 173.704 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 41' ' ' NH2 . . . . . . . . . . . . . . . . . . . . 0 C--N 1.306 -1.283 0 O-C-N 122.045 -0.41 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 016 nuclear nobuild full ' A' A ' 1' ' ' GLU . . . . . . . . . . . . . 9.5 tp10 . . . . . 0 N--CA 1.453 -0.312 0 N-CA-C 109.159 -0.682 . . . . 0.0 109.159 . . . . . . . . . 0 0 . 1 . 016 nuclear nobuild full ' A' A ' 2' ' ' HIS . . . . . . . . . . . . . 84.8 m-70 -106.75 112.47 25.46 Favored 'General case' 0 C--N 1.314 -0.965 0 N-CA-C 107.75 -1.204 . . . . 0.0 107.75 177.616 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 3' ' ' CYS . . . . . . . . . . . . . 29.4 p -83.73 117.01 22.95 Favored 'General case' 0 C--N 1.297 -1.715 0 CA-C-O 121.431 0.634 . . . . 0.0 112.683 -173.008 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 4' ' ' ALA . . . . . . . . . . . . . . . -146.48 137.33 24.16 Favored 'General case' 0 C--N 1.32 -0.686 0 N-CA-C 108.489 -0.93 . . . . 0.0 108.489 178.503 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 5' ' ' ASP . . . . . 0.715 ' OD1' ' HB ' ' A' ' 35' ' ' VAL . 11.0 m-20 -59.65 130.39 46.61 Favored 'General case' 0 C--N 1.311 -1.108 0 O-C-N 123.489 0.493 . . . . 0.0 111.844 -179.077 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 8.5 tp10 -66.53 127.12 31.1 Favored 'General case' 0 N--CA 1.44 -0.939 0 C-N-CA 124.015 0.926 . . . . 0.0 110.507 178.426 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 7' ' ' LYS . . . . . . . . . . . . . 10.1 ptpp? -77.09 -21.05 54.94 Favored 'General case' 0 C--N 1.315 -0.893 0 CA-C-N 115.366 -0.834 . . . . 0.0 110.83 -177.608 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 8' ' ' ASN . . . . . . . . . . . . . 15.5 t-20 -87.77 -7.97 56.6 Favored 'General case' 0 C--N 1.302 -1.499 0 CA-C-O 121.961 0.886 . . . . 0.0 109.758 -178.559 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 9' ' ' PHE . . . . . . . . . . . . . 23.2 t80 -108.18 151.23 26.2 Favored 'General case' 0 N--CA 1.43 -1.471 0 N-CA-C 106.983 -1.488 . . . . 0.0 106.983 -179.206 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 10' ' ' ASP . . . . . . . . . . . . . 9.8 t70 -102.55 100.12 10.18 Favored 'General case' 0 C--O 1.253 1.265 0 C-N-CA 118.944 -1.102 . . . . 0.0 109.281 177.483 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 11' ' ' CYS . . . . . 0.482 ' SG ' ' HB3' ' A' ' 5' ' ' ASP . 61.2 m -70.59 -29.3 65.68 Favored 'General case' 0 C--N 1.298 -1.665 0 CA-C-N 114.706 -1.134 . . . . 0.0 111.372 -176.488 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 12' ' ' ARG . . . . . . . . . . . . . 34.1 mmt180 -71.29 -52.32 19.54 Favored 'General case' 0 CA--C 1.506 -0.744 0 CA-C-N 116.03 -0.532 . . . . 0.0 109.896 -175.853 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 38.4 ttm180 -58.31 -46.32 86.38 Favored 'General case' 0 C--N 1.32 -0.69 0 C-N-CA 123.346 0.659 . . . . 0.0 110.42 -179.688 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 14' ' ' SER . . . . . . . . . . . . . 25.9 m -59.83 -38.54 82.34 Favored 'General case' 0 C--O 1.256 1.398 0 CA-C-N 115.875 -0.602 . . . . 0.0 111.142 -178.797 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 41.1 tp -73.26 -46.97 46.88 Favored 'General case' 0 N--CA 1.438 -1.026 0 CA-C-N 116.062 -0.517 . . . . 0.0 110.385 178.016 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 16' ' ' ARG . . . . . . . . . . . . . 97.8 mtt180 -54.28 -47.0 72.85 Favored 'General case' 0 N--CA 1.471 0.583 0 C-N-CA 123.18 0.592 . . . . 0.0 111.504 178.788 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 17' ' ' ASN . . . . . . . . . . . . . 11.0 m120 -65.75 -36.67 84.24 Favored 'General case' 0 CA--C 1.504 -0.789 0 CA-C-O 121.858 0.837 . . . . 0.0 109.576 179.833 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . 109.12 -1.36 31.38 Favored Glycine 0 N--CA 1.432 -1.606 0 CA-C-N 114.376 -1.284 . . . . 0.0 111.863 179.235 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 19' ' ' ASP . . . . . 0.425 ' O ' ' HB2' ' A' ' 25' ' ' LYS . 8.8 m-20 -70.29 -21.44 62.95 Favored 'General case' 0 CA--C 1.49 -1.338 0 N-CA-C 112.554 0.575 . . . . 0.0 112.554 -176.776 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 20' ' ' CYS . . . . . 0.621 ' HA ' ' HG3' ' A' ' 29' ' ' MET . 43.0 t -73.75 -26.38 60.64 Favored 'General case' 0 C--N 1.299 -1.619 0 C-N-CA 120.425 -0.51 . . . . 0.0 111.022 179.912 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 21' ' ' ASP . . . . . . . . . . . . . 33.8 t70 -100.32 -3.33 31.49 Favored 'General case' 0 C--N 1.327 -0.39 0 CA-C-O 122.488 1.137 . . . . 0.0 109.101 -179.814 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 22' ' ' ASN . . . . . . . . . . . . . 19.0 t30 -78.26 130.52 36.34 Favored 'General case' 0 C--N 1.309 -1.18 0 CA-C-N 114.139 -1.391 . . . . 0.0 109.35 178.619 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 23' ' ' ASP . . . . . 0.478 ' HA ' ' HG ' ' A' ' 26' ' ' LEU . 3.1 m-20 -52.9 -34.38 54.64 Favored 'General case' 0 CA--C 1.498 -1.021 0 C-N-CA 124.388 1.075 . . . . 0.0 112.043 -177.118 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 34.2 t70 -59.85 -31.81 70.1 Favored 'General case' 0 C--N 1.307 -1.245 0 CA-C-N 114.974 -1.012 . . . . 0.0 112.133 -179.501 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 25' ' ' LYS . . . . . 0.523 ' O ' ' HG2' ' A' ' 29' ' ' MET . 13.1 mptt -110.81 1.78 17.93 Favored 'General case' 0 C--O 1.204 -1.322 0 N-CA-C 113.624 0.972 . . . . 0.0 113.624 179.794 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 26' ' ' LEU . . . . . 0.478 ' HG ' ' HA ' ' A' ' 23' ' ' ASP . 70.1 mt -50.2 -52.78 32.89 Favored 'General case' 0 N--CA 1.49 1.53 0 N-CA-C 114.655 1.354 . . . . 0.0 114.655 -174.947 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 27' ' ' LEU . . . . . . . . . . . . . 20.0 tp -60.84 -44.62 96.72 Favored 'General case' 0 N--CA 1.44 -0.929 0 CA-C-O 121.17 0.51 . . . . 0.0 109.724 -179.645 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 28' ' ' GLU . . . . . . . . . . . . . 7.5 mm-40 -60.57 -37.12 80.27 Favored 'General case' 0 C--N 1.325 -0.5 0 CA-C-N 114.581 -1.19 . . . . 0.0 108.963 -178.295 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 29' ' ' MET . . . . . 0.621 ' HG3' ' HA ' ' A' ' 20' ' ' CYS . 74.8 mmm -81.14 -20.26 41.71 Favored 'General case' 0 CA--C 1.482 -1.656 0 CA-C-N 115.094 -0.957 . . . . 0.0 111.794 -174.041 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 30' ' ' GLY . . . . . . . . . . . . . . . -64.56 -27.04 71.3 Favored Glycine 0 N--CA 1.436 -1.341 0 O-C-N 124.194 0.934 . . . . 0.0 110.823 177.216 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 31' ' ' TYR . . . . . . . . . . . . . 38.7 p90 -106.16 -31.97 8.44 Favored 'General case' 0 N--CA 1.43 -1.443 0 N-CA-C 112.923 0.712 . . . . 0.0 112.923 176.166 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 32' ' ' TYR . . . . . . . . . . . . . 16.2 m-85 -68.15 -61.59 1.79 Allowed 'General case' 0 C--O 1.21 -1.0 0 N-CA-C 113.232 0.827 . . . . 0.0 113.232 177.482 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 33' ' ' CYS . . . . . . . . . . . . . 61.7 m -136.43 68.55 61.03 Favored Pre-proline 0 C--O 1.265 1.871 0 CA-C-O 121.749 0.785 . . . . 0.0 111.413 -176.846 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 34' ' ' PRO . . . . . 0.66 ' HA ' ' CD2' ' A' ' 39' ' ' PHE . 74.0 Cg_endo -73.09 -23.75 17.89 Favored 'Trans proline' 0 N--CA 1.444 -1.386 0 C-N-CA 122.964 2.443 . . . . 0.0 112.569 -174.955 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 35' ' ' VAL . . . . . 0.715 ' HB ' ' OD1' ' A' ' 5' ' ' ASP . 43.5 t -86.57 -44.48 16.48 Favored 'Isoleucine or valine' 0 C--N 1.289 -2.028 0 C-N-CA 119.51 -0.876 . . . . 0.0 109.506 -179.066 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 36' ' ' THR . . . . . . . . . . . . . 38.3 m -54.61 -51.88 63.94 Favored 'General case' 0 C--N 1.325 -0.472 0 CA-C-N 115.653 -0.703 . . . . 0.0 112.69 -178.49 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 37' ' ' CYS . . . . . . . . . . . . . 85.1 m -91.99 10.88 27.12 Favored 'General case' 0 C--N 1.315 -0.932 0 C-N-CA 118.964 -1.094 . . . . 0.0 113.288 -176.517 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 38' ' ' GLY . . . . . . . . . . . . . . . 78.19 44.14 12.1 Favored Glycine 0 N--CA 1.443 -0.834 0 N-CA-C 115.432 0.933 . . . . 0.0 115.432 171.881 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 39' ' ' PHE . . . . . 0.66 ' CD2' ' HA ' ' A' ' 34' ' ' PRO . 62.2 m-85 -86.19 -50.39 7.02 Favored 'General case' 0 C--N 1.302 -1.496 0 N-CA-C 106.782 -1.562 . . . . 0.0 106.782 174.113 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 40' ' ' CYS . . . . . 0.509 ' SG ' ' HB2' ' A' ' 34' ' ' PRO . 4.0 p -153.82 87.29 1.21 Allowed 'General case' 0 C--N 1.31 -1.125 0 CA-C-N 114.453 -1.249 . . . . 0.0 109.87 -179.71 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 41' ' ' NH2 . . . . . . . . . . . . . . . . . . . . 0 C--N 1.309 -1.158 0 O-C-N 122.049 -0.407 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 017 nuclear nobuild full ' A' A ' 1' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER . . . . . 0 N--CA 1.452 -0.373 0 N-CA-C 108.424 -0.954 . . . . 0.0 108.424 . . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 2' ' ' HIS . . . . . . . . . . . . . 34.4 m80 -91.23 111.96 23.66 Favored 'General case' 0 C--N 1.294 -1.843 0 N-CA-C 106.82 -1.548 . . . . 0.0 106.82 174.656 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 3' ' ' CYS . . . . . . . . . . . . . 30.3 p -82.1 103.92 12.07 Favored 'General case' 0 C--N 1.303 -1.427 0 C-N-CA 118.84 -1.144 . . . . 0.0 108.987 176.617 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 4' ' ' ALA . . . . . . . . . . . . . . . -145.98 142.08 28.32 Favored 'General case' 0 N--CA 1.426 -1.626 0 CA-C-N 115.438 -0.801 . . . . 0.0 108.883 -177.499 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 5' ' ' ASP . . . . . 0.667 ' OD1' ' HB ' ' A' ' 35' ' ' VAL . 5.1 m-20 -58.29 132.5 53.82 Favored 'General case' 0 C--O 1.256 1.406 0 O-C-N 124.395 1.06 . . . . 0.0 109.517 -179.877 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 6' ' ' GLU . . . . . 0.439 ' HG3' ' H ' ' A' ' 8' ' ' ASN . 9.5 tp10 -64.1 131.7 48.31 Favored 'General case' 0 N--CA 1.436 -1.149 0 CA-C-N 115.589 -0.732 . . . . 0.0 110.761 -176.712 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 7' ' ' LYS . . . . . . . . . . . . . 21.1 ptmt -80.22 -13.01 59.56 Favored 'General case' 0 N--CA 1.437 -1.122 0 CA-C-N 115.883 -0.599 . . . . 0.0 112.045 -176.24 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 8' ' ' ASN . . . . . 0.439 ' H ' ' HG3' ' A' ' 6' ' ' GLU . 55.7 m-20 -93.81 4.1 54.43 Favored 'General case' 0 C--N 1.313 -1.018 0 CA-C-O 121.657 0.741 . . . . 0.0 109.367 178.814 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 9' ' ' PHE . . . . . . . . . . . . . 26.8 t80 -128.49 149.52 50.55 Favored 'General case' 0 C--N 1.298 -1.665 0 N-CA-C 106.384 -1.71 . . . . 0.0 106.384 -175.53 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 10' ' ' ASP . . . . . . . . . . . . . 10.0 t70 -105.14 98.73 8.39 Favored 'General case' 0 C--N 1.302 -1.466 0 C-N-CA 119.378 -0.929 . . . . 0.0 108.899 177.172 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 11' ' ' CYS . . . . . 0.417 ' SG ' ' HB3' ' A' ' 5' ' ' ASP . 96.9 m -73.37 -25.08 60.43 Favored 'General case' 0 C--N 1.287 -2.137 0 N-CA-C 113.194 0.813 . . . . 0.0 113.194 -177.19 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 12' ' ' ARG . . . . . 0.457 ' O ' ' HG2' ' A' ' 16' ' ' ARG . 43.8 mmt-85 -69.83 -48.0 60.64 Favored 'General case' 0 C--N 1.32 -0.678 0 N-CA-C 109.502 -0.555 . . . . 0.0 109.502 179.108 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 58.3 ttp180 -64.17 -44.36 92.3 Favored 'General case' 0 C--N 1.311 -1.073 0 CA-C-N 115.54 -0.754 . . . . 0.0 110.355 178.474 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 14' ' ' SER . . . . . . . . . . . . . 25.3 m -60.53 -34.06 73.57 Favored 'General case' 0 C--O 1.25 1.129 0 CA-C-O 121.393 0.616 . . . . 0.0 110.949 179.432 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 65.3 tp -63.35 -46.57 85.94 Favored 'General case' 0 N--CA 1.439 -0.986 0 CA-C-N 115.611 -0.722 . . . . 0.0 109.306 174.956 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 16' ' ' ARG . . . . . 0.457 ' HG2' ' O ' ' A' ' 12' ' ' ARG . 31.0 mmt180 -71.75 -32.74 68.04 Favored 'General case' 0 C--N 1.315 -0.892 0 CA-C-N 115.957 -0.565 . . . . 0.0 112.236 -177.441 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 17' ' ' ASN . . . . . . . . . . . . . 77.0 m-20 -65.57 -35.53 81.12 Favored 'General case' 0 CA--C 1.494 -1.207 0 CA-C-O 121.301 0.572 . . . . 0.0 109.533 179.412 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . 110.77 11.81 18.09 Favored Glycine 0 N--CA 1.426 -1.999 0 CA-C-N 115.11 -0.95 . . . . 0.0 111.483 -178.805 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 19' ' ' ASP . . . . . . . . . . . . . 9.0 m-20 -67.49 -35.05 78.39 Favored 'General case' 0 CA--C 1.501 -0.934 0 N-CA-C 108.782 -0.821 . . . . 0.0 108.782 178.126 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 20' ' ' CYS . . . . . 0.456 ' HA ' ' HG3' ' A' ' 29' ' ' MET . 52.5 t -83.26 -4.48 58.47 Favored 'General case' 0 C--N 1.306 -1.306 0 CA-C-N 114.41 -1.268 . . . . 0.0 110.533 -179.934 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 21' ' ' ASP . . . . . . . . . . . . . 17.2 t70 -104.54 -11.85 16.78 Favored 'General case' 0 C--N 1.318 -0.77 0 CA-C-O 121.77 0.795 . . . . 0.0 109.887 -178.547 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 22' ' ' ASN . . . . . . . . . . . . . 54.1 t-20 -89.3 125.03 34.94 Favored 'General case' 0 C--N 1.311 -1.087 0 CA-C-N 115.127 -0.942 . . . . 0.0 109.243 -179.934 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 23' ' ' ASP . . . . . . . . . . . . . 5.3 p-10 -61.23 -34.34 74.96 Favored 'General case' 0 C--N 1.32 -0.708 0 O-C-N 123.434 0.459 . . . . 0.0 111.673 179.976 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 34.8 t70 -68.46 -28.76 67.33 Favored 'General case' 0 C--N 1.308 -1.209 0 CA-C-O 121.318 0.58 . . . . 0.0 111.67 -177.658 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 25' ' ' LYS . . . . . 0.418 ' O ' ' HG2' ' A' ' 29' ' ' MET . 92.3 mttt -97.18 -2.28 43.25 Favored 'General case' 0 C--N 1.309 -1.181 0 N-CA-C 112.532 0.568 . . . . 0.0 112.532 -177.462 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 26' ' ' LEU . . . . . . . . . . . . . 87.4 mt -55.84 -36.83 67.94 Favored 'General case' 0 C--N 1.312 -1.038 0 N-CA-C 113.269 0.841 . . . . 0.0 113.269 179.806 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 27' ' ' LEU . . . . . . . . . . . . . 1.3 tm? -62.71 -42.22 99.54 Favored 'General case' 0 N--CA 1.44 -0.957 0 N-CA-C 109.02 -0.734 . . . . 0.0 109.02 178.508 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 28' ' ' GLU . . . . . . . . . . . . . 8.3 mm-40 -60.74 -37.24 81.1 Favored 'General case' 0 CA--C 1.514 -0.407 0 N-CA-C 109.062 -0.718 . . . . 0.0 109.062 177.572 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 29' ' ' MET . . . . . 0.456 ' HG3' ' HA ' ' A' ' 20' ' ' CYS . 22.1 mmt -75.68 -22.29 56.82 Favored 'General case' 0 C--O 1.204 -1.29 0 CA-C-N 114.95 -1.023 . . . . 0.0 109.827 -176.744 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 30' ' ' GLY . . . . . . . . . . . . . . . -64.31 -28.03 72.45 Favored Glycine 0 C--O 1.24 0.518 0 CA-C-N 116.227 -0.442 . . . . 0.0 112.338 179.931 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 31' ' ' TYR . . . . . . . . . . . . . 20.6 p90 -113.67 -36.24 4.94 Favored 'General case' 0 N--CA 1.433 -1.318 0 N-CA-C 113.033 0.753 . . . . 0.0 113.033 177.543 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 32' ' ' TYR . . . . . . . . . . . . . 33.4 m-85 -70.0 -47.38 62.41 Favored 'General case' 0 C--N 1.306 -1.307 0 N-CA-C 113.234 0.828 . . . . 0.0 113.234 176.808 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 33' ' ' CYS . . . . . . . . . . . . . 60.4 m -136.4 58.49 21.29 Favored Pre-proline 0 C--O 1.251 1.151 0 C-N-CA 121.053 -0.259 . . . . 0.0 111.678 -173.838 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 34' ' ' PRO . . . . . 0.426 ' HA ' ' CD2' ' A' ' 39' ' ' PHE . 57.3 Cg_endo -67.35 -27.95 39.94 Favored 'Trans proline' 0 C--N 1.359 1.105 0 C-N-CA 122.012 1.808 . . . . 0.0 112.523 -174.66 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 35' ' ' VAL . . . . . 0.667 ' HB ' ' OD1' ' A' ' 5' ' ' ASP . 43.8 t -87.27 -42.9 15.58 Favored 'Isoleucine or valine' 0 C--N 1.301 -1.536 0 C-N-CA 119.971 -0.692 . . . . 0.0 110.433 -177.224 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 36' ' ' THR . . . . . . . . . . . . . 28.0 m -61.24 -40.06 92.64 Favored 'General case' 0 C--N 1.316 -0.88 0 CA-C-N 115.999 -0.546 . . . . 0.0 111.211 179.066 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 37' ' ' CYS . . . . . . . . . . . . . 74.8 m -88.18 -1.45 58.02 Favored 'General case' 0 C--N 1.311 -1.082 0 N-CA-C 113.727 1.01 . . . . 0.0 113.727 -178.954 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 38' ' ' GLY . . . . . . . . . . . . . . . 78.13 43.72 13.05 Favored Glycine 0 CA--C 1.524 0.656 0 N-CA-C 115.325 0.89 . . . . 0.0 115.325 174.908 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 39' ' ' PHE . . . . . 0.426 ' CD2' ' HA ' ' A' ' 34' ' ' PRO . 74.6 m-85 -91.32 -31.4 16.1 Favored 'General case' 0 C--N 1.315 -0.92 0 N-CA-C 108.475 -0.935 . . . . 0.0 108.475 173.886 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 40' ' ' CYS . . . . . . . . . . . . . 58.3 m -117.27 102.62 9.42 Favored 'General case' 0 C--N 1.306 -1.299 0 CA-C-N 114.956 -1.02 . . . . 0.0 109.45 -178.42 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 41' ' ' NH2 . . . . . . . . . . . . . . . . . . . . 0 C--N 1.31 -1.127 0 CA-C-N 116.402 -0.363 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 018 nuclear nobuild full ' A' A ' 1' ' ' GLU . . . . . . . . . . . . . 35.7 tt0 . . . . . 0 CA--C 1.506 -0.733 0 N-CA-C 110.046 -0.353 . . . . 0.0 110.046 . . . . . . . . . 0 0 . 1 . 018 nuclear nobuild full ' A' A ' 2' ' ' HIS . . . . . . . . . . . . . 16.7 t60 -101.47 111.56 23.84 Favored 'General case' 0 N--CA 1.429 -1.512 0 N-CA-C 106.319 -1.734 . . . . 0.0 106.319 172.652 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 3' ' ' CYS . . . . . . . . . . . . . 16.0 p -87.1 125.35 34.08 Favored 'General case' 0 C--N 1.285 -2.21 0 N-CA-C 109.962 -0.385 . . . . 0.0 109.962 179.26 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 4' ' ' ALA . . . . . . . . . . . . . . . -144.05 158.09 43.93 Favored 'General case' 0 C--N 1.304 -1.371 0 N-CA-C 107.835 -1.172 . . . . 0.0 107.835 178.832 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 5' ' ' ASP . . . . . 0.432 ' HA ' ' HD2' ' A' ' 34' ' ' PRO . 56.2 m-20 -69.51 147.54 50.7 Favored 'General case' 0 C--N 1.31 -1.121 0 N-CA-C 109.311 -0.626 . . . . 0.0 109.311 178.705 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 9.3 tp10 -67.35 128.55 36.84 Favored 'General case' 0 C--N 1.311 -1.087 0 N-CA-C 109.069 -0.715 . . . . 0.0 109.069 177.744 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 7' ' ' LYS . . . . . . . . . . . . . 19.4 ptpt -77.24 -16.93 58.82 Favored 'General case' 0 C--N 1.307 -1.257 0 CA-C-N 116.348 -0.387 . . . . 0.0 112.008 -177.527 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 8' ' ' ASN . . . . . . . . . . . . . 38.7 m-80 -94.5 4.36 53.95 Favored 'General case' 0 C--N 1.302 -1.488 0 CA-C-O 121.352 0.596 . . . . 0.0 110.321 179.353 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 9' ' ' PHE . . . . . . . . . . . . . 41.5 t80 -123.45 144.32 49.59 Favored 'General case' 0 C--N 1.299 -1.623 0 N-CA-C 106.341 -1.726 . . . . 0.0 106.341 -178.53 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 10' ' ' ASP . . . . . . . . . . . . . 8.3 t70 -102.18 91.76 4.44 Favored 'General case' 0 C--N 1.304 -1.411 0 C-N-CA 118.705 -1.198 . . . . 0.0 109.544 179.859 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 11' ' ' CYS . . . . . 0.421 ' SG ' ' HB3' ' A' ' 5' ' ' ASP . 98.3 m -69.55 -19.93 63.68 Favored 'General case' 0 C--N 1.297 -1.701 0 CA-C-N 114.799 -1.091 . . . . 0.0 112.251 -177.095 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 12' ' ' ARG . . . . . . . . . . . . . 13.8 mmt180 -74.04 -43.5 57.63 Favored 'General case' 0 C--N 1.313 -1.0 0 N-CA-C 107.653 -1.24 . . . . 0.0 107.653 -177.734 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 39.4 ttm180 -59.48 -50.3 74.47 Favored 'General case' 0 C--O 1.238 0.462 0 CA-C-N 114.905 -1.043 . . . . 0.0 110.092 175.472 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 14' ' ' SER . . . . . . . . . . . . . 50.6 m -62.14 -30.82 71.3 Favored 'General case' 0 CA--C 1.546 0.822 0 CA-C-N 116.178 -0.464 . . . . 0.0 111.591 179.633 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 15' ' ' LEU . . . . . 0.432 ' HA ' ' HB3' ' A' ' 20' ' ' CYS . 58.1 tp -67.29 -49.51 63.97 Favored 'General case' 0 N--CA 1.449 -0.522 0 N-CA-C 110.097 -0.334 . . . . 0.0 110.097 176.726 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 16' ' ' ARG . . . . . . . . . . . . . 65.7 mtp180 -62.67 -38.1 89.02 Favored 'General case' 0 C--N 1.321 -0.633 0 CA-C-N 115.434 -0.803 . . . . 0.0 112.228 -179.06 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 17' ' ' ASN . . . . . . . . . . . . . 42.0 m-80 -81.77 -14.56 56.26 Favored 'General case' 0 CA--C 1.506 -0.749 0 CA-C-O 121.017 0.437 . . . . 0.0 111.975 -178.502 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . 95.94 9.93 56.8 Favored Glycine 0 C--O 1.213 -1.201 0 C-N-CA 119.938 -1.125 . . . . 0.0 113.743 173.566 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 19' ' ' ASP . . . . . . . . . . . . . 2.6 m-20 -67.73 -34.65 77.27 Favored 'General case' 0 CA--C 1.498 -1.046 0 N-CA-C 108.072 -1.085 . . . . 0.0 108.072 178.225 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 20' ' ' CYS . . . . . 0.432 ' HB3' ' HA ' ' A' ' 15' ' ' LEU . 42.8 t -72.66 -9.46 58.63 Favored 'General case' 0 C--N 1.309 -1.193 0 CA-C-N 113.711 -1.586 . . . . 0.0 110.787 -179.046 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 21' ' ' ASP . . . . . . . . . . . . . 26.2 t70 -113.64 -10.02 13.15 Favored 'General case' 0 C--N 1.319 -0.742 0 CA-C-O 121.656 0.741 . . . . 0.0 109.672 -179.874 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 22' ' ' ASN . . . . . 0.502 ' OD1' ' HG2' ' A' ' 25' ' ' LYS . 23.5 t-20 -83.4 114.62 21.57 Favored 'General case' 0 C--N 1.298 -1.631 0 CA-C-N 115.713 -0.676 . . . . 0.0 109.958 -174.217 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 23' ' ' ASP . . . . . . . . . . . . . 18.1 t70 -49.66 -45.21 48.31 Favored 'General case' 0 N--CA 1.477 0.904 0 C-N-CA 124.231 1.012 . . . . 0.0 111.708 -176.065 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 24' ' ' ASP . . . . . 0.438 ' HB3' ' OD1' ' A' ' 22' ' ' ASN . 27.4 t70 -60.28 -32.91 71.64 Favored 'General case' 0 C--N 1.31 -1.143 0 CA-C-N 115.278 -0.874 . . . . 0.0 112.441 -178.897 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 25' ' ' LYS . . . . . 0.502 ' HG2' ' OD1' ' A' ' 22' ' ' ASN . 44.3 mmtm -94.63 -7.01 42.13 Favored 'General case' 0 C--N 1.312 -1.029 0 CA-C-N 116.301 -0.409 . . . . 0.0 111.063 -175.727 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 26' ' ' LEU . . . . . . . . . . . . . 64.8 mt -56.81 -34.79 68.04 Favored 'General case' 0 C--O 1.218 -0.553 0 N-CA-C 114.886 1.439 . . . . 0.0 114.886 -174.485 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 27' ' ' LEU . . . . . . . . . . . . . 1.3 tm? -57.52 -50.0 74.49 Favored 'General case' 0 N--CA 1.44 -0.945 0 N-CA-C 108.758 -0.83 . . . . 0.0 108.758 178.539 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 28' ' ' GLU . . . . . . . . . . . . . 1.5 mp0 -63.57 -33.81 76.42 Favored 'General case' 0 N--CA 1.449 -0.508 0 CA-C-N 115.175 -0.921 . . . . 0.0 110.424 178.583 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 29' ' ' MET . . . . . . . . . . . . . 21.7 mmt -74.15 -25.32 59.68 Favored 'General case' 0 C--O 1.2 -1.527 0 CA-C-N 116.154 -0.476 . . . . 0.0 109.856 -177.341 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 30' ' ' GLY . . . . . . . . . . . . . . . -64.44 -34.78 90.83 Favored Glycine 0 N--CA 1.446 -0.664 0 C-N-CA 121.4 -0.429 . . . . 0.0 112.375 179.64 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 31' ' ' TYR . . . . . . . . . . . . . 33.0 p90 -99.03 -36.53 9.69 Favored 'General case' 0 N--CA 1.439 -1.003 0 N-CA-C 113.35 0.87 . . . . 0.0 113.35 178.042 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 32' ' ' TYR . . . . . . . . . . . . . 37.2 m-85 -70.86 -46.61 62.34 Favored 'General case' 0 C--N 1.309 -1.169 0 N-CA-C 112.859 0.689 . . . . 0.0 112.859 177.052 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 33' ' ' CYS . . . . . . . . . . . . . 47.7 m -136.45 61.03 35.72 Favored Pre-proline 0 C--O 1.254 1.335 0 N-CA-C 112.266 0.469 . . . . 0.0 112.266 -173.324 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 34' ' ' PRO . . . . . 0.499 ' HA ' ' CD1' ' A' ' 39' ' ' PHE . 46.0 Cg_endo -65.35 -25.67 56.43 Favored 'Trans proline' 0 C--N 1.359 1.126 0 C-N-CA 121.825 1.683 . . . . 0.0 111.948 -178.567 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 35' ' ' VAL . . . . . . . . . . . . . 61.7 t -86.41 -49.64 14.89 Favored 'Isoleucine or valine' 0 C--N 1.299 -1.607 0 C-N-CA 120.573 -0.451 . . . . 0.0 111.134 -177.725 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 36' ' ' THR . . . . . . . . . . . . . 56.5 m -59.78 -42.22 92.85 Favored 'General case' 0 C--N 1.316 -0.879 0 CA-C-O 121.049 0.452 . . . . 0.0 111.615 -178.945 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 37' ' ' CYS . . . . . 0.414 ' HB2' ' CE1' ' A' ' 39' ' ' PHE . 77.4 m -85.02 1.57 47.04 Favored 'General case' 0 C--N 1.309 -1.183 0 N-CA-C 113.12 0.785 . . . . 0.0 113.12 -178.072 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 38' ' ' GLY . . . . . . . . . . . . . . . 74.26 45.38 25.08 Favored Glycine 0 CA--C 1.521 0.419 0 C-N-CA 120.546 -0.835 . . . . 0.0 114.879 174.913 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 39' ' ' PHE . . . . . 0.499 ' CD1' ' HA ' ' A' ' 34' ' ' PRO . 95.4 m-85 -94.11 -16.87 23.37 Favored 'General case' 0 C--N 1.309 -1.155 0 N-CA-C 108.581 -0.896 . . . . 0.0 108.581 174.07 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 40' ' ' CYS . . . . . 0.475 ' SG ' ' HB2' ' A' ' 34' ' ' PRO . 40.0 m -124.21 89.41 3.07 Favored 'General case' 0 C--N 1.313 -1.001 0 CA-C-N 115.048 -0.978 . . . . 0.0 110.132 -176.803 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 41' ' ' NH2 . . . . . . . . . . . . . . . . . . . . 0 C--N 1.306 -1.31 0 CA-C-N 116.633 -0.258 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 019 nuclear nobuild full ' A' A ' 1' ' ' GLU . . . . . . . . . . . . . 9.2 tp10 . . . . . 0 CA--C 1.505 -0.788 0 N-CA-C 109.008 -0.738 . . . . 0.0 109.008 . . . . . . . . . 0 0 . 1 . 019 nuclear nobuild full ' A' A ' 2' ' ' HIS . . . . . . . . . . . . . 61.1 m-70 -94.24 111.92 23.69 Favored 'General case' 0 N--CA 1.432 -1.332 0 N-CA-C 107.312 -1.366 . . . . 0.0 107.312 177.248 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 3' ' ' CYS . . . . . . . . . . . . . 16.5 p -83.75 100.87 11.18 Favored 'General case' 0 C--N 1.295 -1.779 0 CA-C-O 121.627 0.727 . . . . 0.0 111.812 -174.631 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 4' ' ' ALA . . . . . . . . . . . . . . . -135.67 141.56 44.99 Favored 'General case' 0 N--CA 1.427 -1.617 0 N-CA-C 108.2 -1.037 . . . . 0.0 108.2 179.415 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 5' ' ' ASP . . . . . 0.639 ' HB3' ' SG ' ' A' ' 11' ' ' CYS . 18.5 m-20 -55.91 131.33 46.82 Favored 'General case' 0 C--N 1.309 -1.155 0 O-C-N 123.96 0.787 . . . . 0.0 109.764 178.633 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 9.6 tp10 -61.71 139.39 58.31 Favored 'General case' 0 C--N 1.312 -1.049 0 C-N-CA 123.654 0.782 . . . . 0.0 110.854 -177.545 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 7' ' ' LYS . . . . . . . . . . . . . 18.6 ptpt -85.18 -26.56 26.71 Favored 'General case' 0 C--N 1.309 -1.162 0 N-CA-C 112.932 0.715 . . . . 0.0 112.932 -174.215 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 8' ' ' ASN . . . . . . . . . . . . . 10.5 p30 -92.62 7.38 43.62 Favored 'General case' 0 C--N 1.306 -1.305 0 CA-C-O 121.745 0.783 . . . . 0.0 110.415 178.453 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 9' ' ' PHE . . . . . . . . . . . . . 47.6 t80 -118.57 139.45 51.45 Favored 'General case' 0 N--CA 1.43 -1.464 0 N-CA-C 106.594 -1.632 . . . . 0.0 106.594 178.168 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 10' ' ' ASP . . . . . . . . . . . . . 10.2 t70 -96.96 105.05 17.11 Favored 'General case' 0 C--N 1.301 -1.519 0 C-N-CA 119.369 -0.932 . . . . 0.0 109.534 178.945 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 11' ' ' CYS . . . . . 0.639 ' SG ' ' HB3' ' A' ' 5' ' ' ASP . 73.9 m -74.94 -29.22 60.89 Favored 'General case' 0 C--N 1.292 -1.926 0 CA-C-N 115.642 -0.708 . . . . 0.0 112.866 -177.502 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 12' ' ' ARG . . . . . . . . . . . . . 20.0 mmm180 -72.07 -46.19 57.8 Favored 'General case' 0 CA--C 1.511 -0.536 0 C-N-CA 120.305 -0.558 . . . . 0.0 109.519 -176.09 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 41.0 ttp180 -59.08 -52.15 66.96 Favored 'General case' 0 C--O 1.205 -1.281 0 CA-C-N 114.851 -1.068 . . . . 0.0 109.421 177.996 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 14' ' ' SER . . . . . . . . . . . . . 40.6 m -58.33 -36.27 73.16 Favored 'General case' 0 C--N 1.32 -0.715 0 CA-C-N 116.066 -0.516 . . . . 0.0 111.742 -177.839 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 41.9 tp -69.73 -45.98 66.96 Favored 'General case' 0 N--CA 1.442 -0.846 0 CA-C-O 121.059 0.457 . . . . 0.0 110.065 178.987 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 16' ' ' ARG . . . . . 0.402 ' O ' ' HD2' ' A' ' 16' ' ' ARG . 2.4 tmm_? -68.54 -37.3 79.85 Favored 'General case' 0 N--CA 1.437 -1.095 0 CA-C-N 115.815 -0.63 . . . . 0.0 110.275 -179.349 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 17' ' ' ASN . . . . . . . . . . . . . 0.9 OUTLIER -68.37 -40.55 81.39 Favored 'General case' 0 CA--C 1.501 -0.92 0 CA-C-N 116.125 -0.488 . . . . 0.0 111.405 -178.535 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . 120.78 8.99 7.84 Favored Glycine 0 N--CA 1.435 -1.414 0 C-N-CA 119.869 -1.158 . . . . 0.0 112.252 -179.874 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 19' ' ' ASP . . . . . . . . . . . . . 3.5 m-20 -65.97 -29.1 69.44 Favored 'General case' 0 C--N 1.32 -0.715 0 CA-C-O 121.064 0.459 . . . . 0.0 110.811 -179.808 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 20' ' ' CYS . . . . . 0.416 ' HA ' ' HG3' ' A' ' 29' ' ' MET . 45.6 t -92.69 0.28 57.4 Favored 'General case' 0 C--N 1.31 -1.121 0 CA-C-O 121.447 0.641 . . . . 0.0 110.331 -178.535 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 21' ' ' ASP . . . . . . . . . . . . . 31.8 t70 -113.09 -11.07 13.38 Favored 'General case' 0 C--N 1.317 -0.83 0 CA-C-O 122.036 0.922 . . . . 0.0 109.238 177.638 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 22' ' ' ASN . . . . . . . . . . . . . 8.6 t30 -87.98 117.33 26.77 Favored 'General case' 0 C--N 1.301 -1.539 0 CA-C-N 114.919 -1.037 . . . . 0.0 109.784 -178.382 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 23' ' ' ASP . . . . . . . . . . . . . 18.1 t70 -50.98 -45.55 61.01 Favored 'General case' 0 N--CA 1.477 0.888 0 N-CA-C 114.073 1.138 . . . . 0.0 114.073 -172.105 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 3.8 p30 -72.22 -10.02 59.23 Favored 'General case' 0 C--N 1.315 -0.915 0 N-CA-C 113.371 0.878 . . . . 0.0 113.371 -176.468 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 25' ' ' LYS . . . . . . . . . . . . . 87.8 mttt -107.67 -7.04 16.55 Favored 'General case' 0 C--N 1.322 -0.602 0 O-C-N 122.039 -0.413 . . . . 0.0 111.683 178.954 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 26' ' ' LEU . . . . . . . . . . . . . 92.8 mt -52.85 -51.89 59.26 Favored 'General case' 0 N--CA 1.472 0.633 0 N-CA-C 113.858 1.059 . . . . 0.0 113.858 -175.271 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 27' ' ' LEU . . . . . . . . . . . . . 2.3 tm? -58.5 -41.78 86.14 Favored 'General case' 0 N--CA 1.436 -1.149 0 C-N-CA 122.688 0.395 . . . . 0.0 109.965 -179.306 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 28' ' ' GLU . . . . . 0.588 ' HA ' ' CZ ' ' A' ' 31' ' ' TYR . 80.8 mt-10 -62.96 -37.16 85.99 Favored 'General case' 0 CA--C 1.511 -0.526 0 CA-C-N 116.021 -0.536 . . . . 0.0 110.038 179.309 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 29' ' ' MET . . . . . 0.416 ' HG3' ' HA ' ' A' ' 20' ' ' CYS . 81.3 mmm -72.94 -24.84 60.86 Favored 'General case' 0 C--N 1.309 -1.186 0 CA-C-N 115.252 -0.885 . . . . 0.0 110.765 -178.22 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 30' ' ' GLY . . . . . 0.471 ' HA2' ' CE1' ' A' ' 39' ' ' PHE . . . -68.74 -24.84 75.42 Favored Glycine 0 C--N 1.312 -0.787 0 CA-C-N 115.365 -0.834 . . . . 0.0 112.55 178.182 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 31' ' ' TYR . . . . . 0.588 ' CZ ' ' HA ' ' A' ' 28' ' ' GLU 0.255 22.5 p90 -101.52 -37.67 8.3 Favored 'General case' 0 CA--C 1.5 -0.942 0 C-N-CA 119.628 -0.829 . . . . 0.0 112.787 174.883 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild full ' A' A ' 32' ' ' TYR . . . . . . . . . . . . . 28.2 m-85 -65.38 -49.28 69.91 Favored 'General case' 0 C--N 1.308 -1.226 0 N-CA-C 112.959 0.725 . . . . 0.0 112.959 176.61 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 33' ' ' CYS . . . . . . . . . . . . . 36.7 m -135.25 72.6 65.83 Favored Pre-proline 0 C--N 1.308 -1.222 0 C-N-CA 119.938 -0.705 . . . . 0.0 111.1 -177.074 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 34' ' ' PRO . . . . . 0.405 ' HD2' ' HA ' ' A' ' 5' ' ' ASP . 60.1 Cg_endo -69.26 -24.17 32.24 Favored 'Trans proline' 0 N--CA 1.45 -1.031 0 C-N-CA 122.261 1.974 . . . . 0.0 112.053 -177.436 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 35' ' ' VAL . . . . . 0.584 ' HB ' ' OD1' ' A' ' 5' ' ' ASP . 49.6 t -87.2 -46.13 16.21 Favored 'Isoleucine or valine' 0 C--N 1.301 -1.528 0 C-N-CA 119.907 -0.717 . . . . 0.0 110.571 -178.432 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 36' ' ' THR . . . . . . . . . . . . . 21.1 m -62.37 -37.18 84.73 Favored 'General case' 0 C--N 1.314 -0.955 0 CA-C-N 115.58 -0.737 . . . . 0.0 111.295 179.424 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 37' ' ' CYS . . . . . . . . . . . . . 84.4 m -92.37 11.18 26.89 Favored 'General case' 0 C--N 1.313 -0.98 0 N-CA-C 112.921 0.712 . . . . 0.0 112.921 -179.831 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 38' ' ' GLY . . . . . . . . . . . . . . . 68.85 45.5 64.02 Favored Glycine 0 CA--C 1.519 0.337 0 N-CA-C 116.002 1.161 . . . . 0.0 116.002 171.827 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 39' ' ' PHE . . . . . 0.471 ' CE1' ' HA2' ' A' ' 30' ' ' GLY . 96.8 m-85 -100.24 -30.98 11.6 Favored 'General case' 0 C--N 1.302 -1.488 0 N-CA-C 108.825 -0.805 . . . . 0.0 108.825 174.051 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 40' ' ' CYS . . . . . . . . . . . . . 75.6 m -127.83 88.29 2.75 Favored 'General case' 0 C--N 1.311 -1.095 0 CA-C-N 115.339 -0.846 . . . . 0.0 109.366 178.601 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 41' ' ' NH2 . . . . . . . . . . . . . . . . . . . . 0 C--N 1.306 -1.287 0 CA-C-N 116.373 -0.376 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 020 nuclear nobuild full ' A' A ' 1' ' ' GLU . . . . . . . . . . . . . 9.8 tp10 . . . . . 0 CA--C 1.506 -0.747 0 N-CA-C 110.409 -0.219 . . . . 0.0 110.409 . . . . . . . . . 0 0 . 1 . 020 nuclear nobuild full ' A' A ' 2' ' ' HIS . . . . . . . . . . . . . 20.7 t60 -51.46 111.43 0.58 Allowed 'General case' 0 C--O 1.242 0.668 0 O-C-N 124.525 1.141 . . . . 0.0 111.435 -173.368 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 3' ' ' CYS . . . . . . . . . . . . . 7.1 p -74.93 110.69 9.43 Favored 'General case' 0 C--N 1.288 -2.106 0 CA-C-N 114.173 -1.376 . . . . 0.0 111.75 179.649 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 4' ' ' ALA . . . . . . . . . . . . . . . -133.26 161.18 35.15 Favored 'General case' 0 N--CA 1.44 -0.934 0 N-CA-C 108.361 -0.977 . . . . 0.0 108.361 -179.907 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 5' ' ' ASP . . . . . 0.566 ' OD2' ' HB ' ' A' ' 35' ' ' VAL . 7.7 m-20 -70.11 148.68 48.45 Favored 'General case' 0 C--N 1.316 -0.859 0 N-CA-C 109.189 -0.671 . . . . 0.0 109.189 179.82 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 0.6 OUTLIER -72.52 152.08 42.09 Favored 'General case' 0 C--N 1.307 -1.259 0 N-CA-C 108.28 -1.007 . . . . 0.0 108.28 -179.095 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 7' ' ' LYS . . . . . . . . . . . . . 9.1 ptpp? -82.03 -35.32 28.94 Favored 'General case' 0 C--N 1.316 -0.879 0 N-CA-C 112.723 0.638 . . . . 0.0 112.723 -172.786 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 8' ' ' ASN . . . . . . . . . . . . . 30.7 m-80 -84.64 -31.21 24.32 Favored 'General case' 0 CA--C 1.486 -1.487 0 N-CA-C 109.29 -0.633 . . . . 0.0 109.29 -175.727 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 9' ' ' PHE . . . . . . . . . . . . . 26.6 t80 -75.12 129.05 36.9 Favored 'General case' 0 N--CA 1.424 -1.758 0 CA-C-N 114.901 -1.045 . . . . 0.0 108.744 -178.76 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 10' ' ' ASP . . . . . . . . . . . . . 9.1 t70 -89.43 102.65 15.32 Favored 'General case' 0 C--N 1.304 -1.385 0 N-CA-C 108.97 -0.752 . . . . 0.0 108.97 -179.461 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 11' ' ' CYS . . . . . 0.465 ' SG ' ' HB3' ' A' ' 5' ' ' ASP . 83.8 m -77.87 -28.55 50.04 Favored 'General case' 0 C--N 1.29 -2.018 0 CA-C-N 115.972 -0.558 . . . . 0.0 111.261 -177.299 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 12' ' ' ARG . . . . . . . . . . . . . 37.5 mmt180 -61.95 -50.27 72.82 Favored 'General case' 0 C--O 1.24 0.579 0 CA-C-O 120.998 0.428 . . . . 0.0 110.074 179.229 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 34.3 ttm180 -59.64 -55.11 38.55 Favored 'General case' 0 C--O 1.208 -1.107 0 CA-C-N 115.026 -0.988 . . . . 0.0 109.236 178.074 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 14' ' ' SER . . . . . . . . . . . . . 18.5 m -60.48 -36.61 78.71 Favored 'General case' 0 C--N 1.307 -1.26 0 CA-C-N 115.599 -0.728 . . . . 0.0 112.747 -174.094 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 45.8 tp -68.86 -47.77 65.1 Favored 'General case' 0 C--N 1.32 -0.68 0 C-N-CA 120.406 -0.517 . . . . 0.0 110.101 178.161 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 16' ' ' ARG . . . . . . . . . . . . . 60.7 mtp180 -71.78 -31.16 66.32 Favored 'General case' 0 C--N 1.324 -0.511 0 CA-C-N 115.923 -0.581 . . . . 0.0 112.008 -177.395 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 17' ' ' ASN . . . . . . . . . . . . . 0.9 OUTLIER -71.73 -33.2 68.51 Favored 'General case' 0 CA--C 1.494 -1.173 0 CA-C-N 116.424 -0.353 . . . . 0.0 111.467 -179.72 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . 116.81 10.2 10.31 Favored Glycine 0 N--CA 1.431 -1.671 0 C-N-CA 119.587 -1.292 . . . . 0.0 112.393 178.75 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 19' ' ' ASP . . . . . . . . . . . . . 4.1 m-20 -65.83 -35.5 80.84 Favored 'General case' 0 CA--C 1.494 -1.183 0 CA-C-O 121.156 0.503 . . . . 0.0 110.769 -179.018 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 20' ' ' CYS . . . . . . . . . . . . . 39.1 t -79.93 -12.45 59.73 Favored 'General case' 0 C--N 1.301 -1.513 0 CA-C-N 115.729 -0.668 . . . . 0.0 110.253 -176.758 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 21' ' ' ASP . . . . . . . . . . . . . 38.3 t70 -107.58 -0.36 22.08 Favored 'General case' 0 C--N 1.318 -0.797 0 CA-C-O 122.249 1.023 . . . . 0.0 109.146 177.108 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 22' ' ' ASN . . . . . . . . . . . . . 47.8 t-20 -87.83 118.77 27.58 Favored 'General case' 0 C--N 1.304 -1.379 0 CA-C-N 115.286 -0.87 . . . . 0.0 108.657 -179.509 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 23' ' ' ASP . . . . . 0.471 ' HA ' ' HG ' ' A' ' 26' ' ' LEU . 2.7 m-20 -53.08 -44.09 67.25 Favored 'General case' 0 C--N 1.32 -0.702 0 C-N-CA 123.694 0.798 . . . . 0.0 112.499 -177.566 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 23.0 t70 -64.69 -31.48 72.73 Favored 'General case' 0 C--N 1.318 -0.779 0 N-CA-C 112.122 0.416 . . . . 0.0 112.122 -178.737 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 25' ' ' LYS . . . . . . . . . . . . . 88.8 mttt -98.31 -5.29 33.25 Favored 'General case' 0 C--N 1.305 -1.326 0 N-CA-C 112.917 0.71 . . . . 0.0 112.917 -176.024 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 26' ' ' LEU . . . . . 0.471 ' HG ' ' HA ' ' A' ' 23' ' ' ASP . 83.9 mt -49.2 -54.36 16.92 Favored 'General case' 0 N--CA 1.482 1.172 0 N-CA-C 113.651 0.982 . . . . 0.0 113.651 -176.941 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 27' ' ' LEU . . . . . . . . . . . . . 2.2 tm? -57.71 -45.46 85.7 Favored 'General case' 0 N--CA 1.434 -1.251 0 N-CA-C 109.736 -0.468 . . . . 0.0 109.736 -177.503 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 28' ' ' GLU . . . . . . . . . . . . . 13.2 mm-40 -61.76 -37.66 85.14 Favored 'General case' 0 C--N 1.327 -0.402 0 CA-C-N 115.4 -0.818 . . . . 0.0 110.277 -178.047 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 29' ' ' MET . . . . . . . . . . . . . 80.2 mmm -73.76 -26.18 60.53 Favored 'General case' 0 C--N 1.307 -1.252 0 CA-C-N 114.907 -1.042 . . . . 0.0 111.609 -174.342 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 30' ' ' GLY . . . . . 0.471 ' HA2' ' CE2' ' A' ' 39' ' ' PHE . . . -68.07 -33.21 78.28 Favored Glycine 0 N--CA 1.439 -1.138 0 CA-C-N 115.46 -0.791 . . . . 0.0 112.758 -179.678 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 31' ' ' TYR . . . . . . . . . . . . . 44.8 p90 -96.98 -33.32 11.61 Favored 'General case' 0 CA--C 1.498 -1.028 0 C-N-CA 118.86 -1.136 . . . . 0.0 113.207 178.46 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 32' ' ' TYR . . . . . . . . . . . . . 36.5 m-85 -69.13 -42.99 75.27 Favored 'General case' 0 C--N 1.304 -1.413 0 N-CA-C 112.717 0.636 . . . . 0.0 112.717 175.96 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 33' ' ' CYS . . . . . . . . . . . . . 44.8 m -135.45 68.35 67.5 Favored Pre-proline 0 C--O 1.246 0.917 0 C-N-CA 120.194 -0.602 . . . . 0.0 112.007 -179.165 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 34' ' ' PRO . . . . . 0.532 ' HD2' ' HA ' ' A' ' 5' ' ' ASP . 58.4 Cg_endo -69.72 -23.65 30.73 Favored 'Trans proline' 0 C--N 1.355 0.889 0 C-N-CA 122.026 1.818 . . . . 0.0 111.931 -178.777 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 35' ' ' VAL . . . . . 0.566 ' HB ' ' OD2' ' A' ' 5' ' ' ASP . 66.1 t -86.54 -52.36 11.95 Favored 'Isoleucine or valine' 0 C--N 1.295 -1.797 0 C-N-CA 120.144 -0.622 . . . . 0.0 110.544 -178.086 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 36' ' ' THR . . . . . . . . . . . . . 23.3 m -60.41 -27.11 67.2 Favored 'General case' 0 CA--C 1.556 1.176 0 C-N-CA 123.188 0.595 . . . . 0.0 111.887 -178.195 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 37' ' ' CYS . . . . . . . . . . . . . 67.4 m -99.73 5.39 45.69 Favored 'General case' 0 C--N 1.319 -0.719 0 N-CA-C 113.792 1.034 . . . . 0.0 113.792 179.736 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 38' ' ' GLY . . . . . . . . . . . . . . . 76.93 34.72 41.57 Favored Glycine 0 CA--C 1.525 0.683 0 N-CA-C 115.426 0.931 . . . . 0.0 115.426 174.624 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 39' ' ' PHE . . . . . 0.488 ' CD2' ' HA ' ' A' ' 34' ' ' PRO . 90.2 m-85 -88.89 -44.37 10.51 Favored 'General case' 0 C--N 1.311 -1.079 0 N-CA-C 108.252 -1.018 . . . . 0.0 108.252 175.102 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 40' ' ' CYS . . . . . . . . . . . . . 57.9 m -117.99 95.63 5.0 Favored 'General case' 0 C--N 1.305 -1.359 0 CA-C-N 114.737 -1.119 . . . . 0.0 109.024 -179.266 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 41' ' ' NH2 . . . . . . . . . . . . . . . . . . . . 0 C--N 1.307 -1.266 0 CA-C-N 116.412 -0.358 . . . . 0.0 . . . . . . . . . . 0 0 . 1 stop_ save_