data_2kts_residue save_MolProbity _Software.Sf_category software _Software.Sf_framecode MolProbity _Software.Entry_ID ? _Software.ID 1 _Software.Name MolProbity _Software.Version 4.0 _Software.Details . save_ save_CYRANGE _Software.Sf_category software _Software.Sf_framecode CYRANGE _Software.Entry_ID ? _Software.ID 2 _Software.Name CYRANGE _Software.Version 2.0 _Software.Details . save_ save_Structure_validation_residue _Structure_validation_residue.Sf_category structure_validation _Structure_validation_residue.Sf_framecode Structure_validation_residue _Structure_validation_residue.Entry_ID ? _Structure_validation_residue.List_ID 1 _Structure_validation_residue.PDB_accession_code 2kts _Structure_validation_residue.Date_analyzed 2016-10-07 loop_ _Residue_analysis_software.Software_ID _Residue_analysis_software.Software_label _Residue_analysis_software.Method_ID _Residue_analysis_software.Method_label _Residue_analysis_software.Entry_ID _Residue_analysis_software.Structure_validation_oneline_list_ID 1 MolProbity . . ? 1 2 CYRANGE . . ? 1 stop_ loop_ _Residue_analysis.ID _Residue_analysis.PDB_model_num _Residue_analysis.Hydrogen_positions _Residue_analysis.MolProbity_flips _Residue_analysis.Cyrange_core_flag _Residue_analysis.Two_letter_chain_ID _Residue_analysis.PDB_strand_ID _Residue_analysis.PDB_residue_no _Residue_analysis.PDB_ins_code _Residue_analysis.PDB_residue_name _Residue_analysis.Assembly_ID _Residue_analysis.Entity_assembly_ID _Residue_analysis.Entity_ID _Residue_analysis.Comp_ID _Residue_analysis.Comp_index_ID _Residue_analysis.Clash_value _Residue_analysis.Clash_source_PDB_atom_name _Residue_analysis.Clash_destination_PDB_atom_name _Residue_analysis.Clash_destination_PDB_strand_ID _Residue_analysis.Clash_destination_PDB_residue_no _Residue_analysis.Clash_destination_PDB_ins_code _Residue_analysis.Clash_destination_PDB_residue_name _Residue_analysis.Cbeta_deviation_value _Residue_analysis.Rotamer_score _Residue_analysis.Rotamer_name _Residue_analysis.Ramachandran_phi _Residue_analysis.Ramachandran_psi _Residue_analysis.Ramachandran_score _Residue_analysis.Ramachandran_evaluation _Residue_analysis.Ramachandran_type _Residue_analysis.Bond_outlier_count _Residue_analysis.Worst_bond _Residue_analysis.Worst_bond_value _Residue_analysis.Worst_bond_sigma _Residue_analysis.Angle_outlier_count _Residue_analysis.Worst_angle _Residue_analysis.Worst_angle_value _Residue_analysis.Worst_angle_sigma _Residue_analysis.RNA_phosphate_perpendicular_outlier _Residue_analysis.RNA_suitness_score _Residue_analysis.RNA_suite_conformer _Residue_analysis.RNA_suite_triage _Residue_analysis.Max_b_factor _Residue_analysis.Tau_angle _Residue_analysis.Omega_dihedral _Residue_analysis.Disulfide_chi1 _Residue_analysis.Disulfide_chi2 _Residue_analysis.Disulfide_chi3 _Residue_analysis.Disulfide_ss_angle _Residue_analysis.Disulfide_ss _Residue_analysis.Disulfide_ss_angle_prime _Residue_analysis.Disulfide_chi2prime _Residue_analysis.Disulfide_chi1prime _Residue_analysis.Outlier_count_separate_geometry _Residue_analysis.Outlier_count _Residue_analysis.Entry_ID _Residue_analysis.Structure_validation_residue_list_ID . 001 nuclear orig core ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 9.6 ttt . . . . . 0 C--O 1.234 0.252 0 N-CA-C 109.506 -0.553 . . . . 0.0 109.506 . . . . . . . . . 0 0 . 1 . 001 nuclear orig core ' A' A ' 2' ' ' VAL . . . . . . . . . . . . . 74.9 t -59.69 137.3 22.3 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.448 0 N-CA-C 108.382 -0.97 . . . . 0.0 108.382 173.403 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 3' ' ' THR . . . . . . . . . . . . . 0.1 OUTLIER -124.75 162.38 43.32 Favored Pre-proline 0 CA--C 1.537 0.444 0 C-N-CA 122.494 0.318 . . . . 0.0 110.98 177.107 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 4' ' ' PRO . . . . . . . . . . . . . 9.2 Cg_endo -71.22 -41.74 2.38 Favored 'Trans proline' 0 CA--C 1.532 0.41 0 C-N-CA 122.833 2.356 . . . . 0.0 112.58 -179.312 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 5' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -61.01 -44.59 97.19 Favored 'General case' 0 C--N 1.325 -0.48 0 C-N-CA 124.231 1.012 . . . . 0.0 110.576 -173.516 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 6' ' ' GLN . . . . . . . . . . . . . 12.7 pt20 -65.5 12.63 0.05 OUTLIER 'General case' 0 CA--C 1.541 0.612 0 C-N-CA 125.803 1.641 . . . . 0.0 114.678 175.135 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 7' ' ' LEU . . . . . . . . . . . . . 77.0 mt -130.97 -45.57 1.03 Allowed 'General case' 0 C--O 1.225 -0.187 0 C-N-CA 125.488 1.515 . . . . 0.0 110.354 -177.34 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 8' ' ' GLN . . . . . . . . . . . . . 19.3 mt-30 -62.12 -3.08 1.12 Allowed 'General case' 0 N--CA 1.469 0.487 0 N-CA-C 115.534 1.679 . . . . 0.0 115.534 -171.956 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 9' ' ' HIS . . . . . . . . . . . . . 97.7 m-70 -135.41 13.68 3.49 Favored 'General case' 0 C--N 1.326 -0.414 0 C-N-CA 125.181 1.393 . . . . 0.0 111.488 177.128 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 10' ' ' HIS . . . . . . . . . . . . . 94.7 m-70 -131.13 108.21 9.58 Favored 'General case' 0 N--CA 1.451 -0.404 0 C-N-CA 124.753 1.221 . . . . 0.0 109.353 -172.119 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 11' ' ' ARG . . . . . . . . . . . . . 9.5 ptt180 -74.83 163.34 27.77 Favored 'General case' 0 C--O 1.235 0.311 0 N-CA-C 108.976 -0.75 . . . . 0.0 108.976 174.617 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 12' ' ' PHE . . . . . . . . . . . . . 46.7 m-85 -139.19 146.8 40.98 Favored 'General case' 0 N--CA 1.448 -0.568 0 N-CA-C 108.416 -0.957 . . . . 0.0 108.416 173.137 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 13' ' ' VAL . . . . . 0.44 ' HA ' ' HA ' ' A' ' 30' ' ' GLU . 7.2 p -112.3 137.17 46.11 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.478 0 O-C-N 121.267 -0.895 . . . . 0.0 109.686 178.622 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 14' ' ' LEU . . . . . . . . . . . . . 26.7 tp -64.22 121.97 15.51 Favored 'General case' 0 N--CA 1.466 0.375 0 N-CA-C 107.254 -1.387 . . . . 0.0 107.254 178.669 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 1.6 tm-20 -105.63 -50.22 3.25 Favored 'General case' 0 C--N 1.326 -0.454 0 N-CA-C 108.134 -1.061 . . . . 0.0 108.134 -174.429 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 5.3 p -146.11 124.23 12.16 Favored 'General case' 0 N--CA 1.446 -0.663 0 CA-C-O 121.995 0.902 . . . . 0.0 110.713 179.833 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 17' ' ' VAL . . . . . . . . . . . . . 2.4 t -64.93 160.04 3.57 Favored 'Isoleucine or valine' 0 C--O 1.239 0.531 0 N-CA-C 107.137 -1.431 . . . . 0.0 107.137 161.776 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 18' ' ' ASN . . . . . . . . . . . . . 1.5 t30 -44.97 -43.31 8.97 Favored 'General case' 0 CA--C 1.53 0.203 0 C-N-CA 123.77 0.828 . . . . 0.0 111.864 165.115 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . -90.43 -33.67 8.49 Favored Glycine 0 CA--C 1.526 0.756 0 CA-C-O 117.686 -1.619 . . . . 0.0 114.389 -170.235 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 10.5 mttt -161.67 165.7 15.93 Favored Pre-proline 0 N--CA 1.469 0.496 0 CA-C-N 119.806 1.803 . . . . 0.0 110.321 -174.357 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 21' ' ' PRO . . . . . . . . . . . . . 97.0 Cg_endo -64.01 -179.96 0.94 Allowed 'Trans proline' 0 CA--C 1.537 0.639 0 C-N-CA 122.614 2.209 . . . . 0.0 110.953 163.121 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 22' ' ' VAL . . . . . . . . . . . . . 3.8 t -130.1 145.37 35.74 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.426 0 N-CA-C 107.909 -1.145 . . . . 0.0 107.909 169.837 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 23' ' ' THR . . . . . . . . . . . . . 0.1 OUTLIER -143.65 111.79 6.24 Favored 'General case' 0 C--O 1.233 0.213 0 C-N-CA 124.877 1.271 . . . . 0.0 108.273 178.107 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 24' ' ' SER . . . . . . . . . . . . . 2.9 m -134.16 45.12 2.64 Favored 'General case' 0 CA--C 1.535 0.378 0 CA-C-N 118.668 0.667 . . . . 0.0 112.244 -163.989 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 25' ' ' ASP . . . . . . . . . . . . . 1.0 OUTLIER 65.14 -81.17 0.03 OUTLIER 'General case' 0 N--CA 1.463 0.178 0 C-N-CA 128.695 2.798 . . . . 0.0 110.171 172.27 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 26' ' ' LYS . . . . . . . . . . . . . 21.3 ttpp -143.63 5.23 1.38 Allowed 'General case' 0 CA--C 1.535 0.373 0 C-N-CA 124.653 1.181 . . . . 0.0 112.008 171.085 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 27' ' ' ASN . . . . . . . . . . . . . 70.0 m-80 -122.41 70.05 33.32 Favored Pre-proline 0 C--O 1.233 0.202 0 C-N-CA 125.514 1.525 . . . . 0.0 108.158 -174.238 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 28' ' ' PRO . . . . . . . . . . . . . 93.0 Cg_endo -72.91 160.68 45.46 Favored 'Trans proline' 0 N--CA 1.454 -0.811 0 C-N-CA 121.986 1.791 . . . . 0.0 111.214 -178.623 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 29' ' ' PRO . . . . . . . . . . . . . 39.6 Cg_endo -68.17 64.84 1.04 Allowed 'Trans proline' 0 N--CA 1.458 -0.568 0 C-N-CA 123.864 3.043 . . . . 0.0 111.392 164.022 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 30' ' ' GLU . . . . . 0.44 ' HA ' ' HA ' ' A' ' 13' ' ' VAL . 14.7 pt-20 -72.71 170.07 15.33 Favored 'General case' 0 N--CA 1.446 -0.635 0 O-C-N 120.316 -1.49 . . . . 0.0 109.408 166.705 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 31' ' ' ILE . . . . . . . . . . . . . 20.0 tt -141.77 149.26 20.05 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.483 0 N-CA-C 106.983 -1.488 . . . . 0.0 106.983 178.475 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 32' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER -134.75 164.35 27.74 Favored 'General case' 0 N--CA 1.442 -0.829 0 CA-C-O 122.856 1.312 . . . . 0.0 109.083 172.929 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 33' ' ' PHE . . . . . . . . . . . . . 95.2 m-85 -133.02 167.13 20.85 Favored 'General case' 0 C--N 1.323 -0.58 0 CA-C-N 113.74 -1.573 . . . . 0.0 107.609 -177.233 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 34' ' ' GLY . . . . . . . . . . . . . . . -166.47 -170.69 31.7 Favored Glycine 0 N--CA 1.447 -0.615 0 N-CA-C 110.007 -1.237 . . . . 0.0 110.007 172.354 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 35' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -44.31 149.15 0.39 Allowed 'General case' 0 C--O 1.234 0.282 0 C-N-CA 126.707 2.003 . . . . 0.0 111.383 -173.261 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 32.7 mmtm 65.01 15.66 10.12 Favored 'General case' 0 CA--C 1.536 0.43 0 C-N-CA 125.574 1.549 . . . . 0.0 111.727 -170.919 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 37' ' ' MET . . . . . . . . . . . . . 11.5 mmm 59.7 20.97 9.68 Favored 'General case' 0 CA--C 1.54 0.576 0 C-N-CA 126.12 1.768 . . . . 0.0 113.272 -171.839 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 38' ' ' MET . . . . . . . . . . . . . 0.8 OUTLIER -61.19 160.01 11.1 Favored 'General case' 0 N--CA 1.452 -0.328 0 O-C-N 121.171 -0.956 . . . . 0.0 112.011 178.911 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 39' ' ' ILE . . . . . . . . . . . . . 10.4 mt -131.7 138.45 52.85 Favored 'Isoleucine or valine' 0 C--O 1.236 0.375 0 C-N-CA 124.851 1.26 . . . . 0.0 108.625 -168.473 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 40' ' ' SER . . . . . . . . . . . . . 13.7 m -135.89 132.83 37.03 Favored 'General case' 0 CA--C 1.531 0.232 0 N-CA-C 106.389 -1.708 . . . . 0.0 106.389 166.47 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 41' ' ' GLY . . . . . . . . . . . . . . . -157.91 172.35 35.08 Favored Glycine 0 C--N 1.334 0.439 0 CA-C-N 119.109 0.868 . . . . 0.0 111.49 -177.965 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 42' ' ' SER . . . . . . . . . . . . . 15.1 p -149.57 72.17 1.13 Allowed 'General case' 0 N--CA 1.452 -0.336 0 O-C-N 121.861 -0.788 . . . . 0.0 112.068 -165.283 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 43' ' ' MET . . . . . . . . . . . . . 6.3 mmt -66.48 -58.42 5.28 Favored 'General case' 0 CA--C 1.537 0.445 0 N-CA-C 109.315 -0.624 . . . . 0.0 109.315 178.207 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 44' ' ' CYS . . . . . 1.293 ' SG ' ' SG ' ' A' ' 70' ' ' CYS . 3.8 t -145.4 -57.32 0.32 Allowed 'General case' 0 N--CA 1.462 0.17 0 N-CA-C 107.128 -1.434 . . . . 0.0 107.128 161.247 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 45' ' ' ASN . . . . . . . . . . . . . 16.1 m-80 -74.42 7.17 3.06 Favored 'General case' 0 C--N 1.331 -0.211 0 C-N-CA 127.363 2.265 . . . . 0.0 113.267 -171.327 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 46' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER 57.9 150.1 0.01 OUTLIER 'General case' 0 C--O 1.225 -0.2 0 C-N-CA 126.831 2.052 . . . . 0.0 112.23 -166.115 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 47' ' ' PHE . . . . . . . . . . . . . 38.4 p90 -146.02 170.14 17.24 Favored 'General case' 0 N--CA 1.445 -0.706 0 CA-C-O 122.63 1.205 . . . . 0.0 109.392 167.963 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 48' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -161.66 161.9 29.71 Favored 'General case' 0 C--N 1.324 -0.531 0 C-N-CA 126.032 1.733 . . . . 0.0 106.83 174.996 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 49' ' ' GLY . . . . . . . . . . . . . . . 174.15 168.04 34.49 Favored Glycine 0 CA--C 1.523 0.591 0 CA-C-N 119.364 0.984 . . . . 0.0 111.976 166.178 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 50' ' ' GLU . . . . . . . . . . . . . 31.1 mt-10 -80.2 94.93 6.14 Favored 'General case' 0 C--O 1.236 0.368 0 C-N-CA 123.514 0.726 . . . . 0.0 109.874 -178.964 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 51' ' ' GLY . . . . . . . . . . . . . . . -69.71 173.37 37.79 Favored Glycine 0 CA--C 1.528 0.857 0 CA-C-O 122.797 1.221 . . . . 0.0 113.135 174.147 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 52' ' ' LYS . . . . . . . . . . . . . 1.4 ttmp? -151.63 154.28 36.09 Favored 'General case' 0 N--CA 1.454 -0.268 0 C-N-CA 126.205 1.802 . . . . 0.0 107.635 -179.66 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 53' ' ' LEU . . . . . . . . . . . . . 1.5 tm? -149.44 117.73 6.44 Favored 'General case' 0 N--CA 1.453 -0.29 0 N-CA-C 106.247 -1.76 . . . . 0.0 106.247 169.231 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 1.3 t -144.06 -26.15 0.54 Allowed 'General case' 0 CA--C 1.535 0.392 0 C-N-CA 124.431 1.092 . . . . 0.0 112.126 -179.341 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 55' ' ' ASN . . . . . . . . . . . . . 0.5 OUTLIER -140.19 -10.75 1.11 Allowed 'General case' 0 N--CA 1.473 0.678 0 CA-C-N 119.924 1.238 . . . . 0.0 113.489 177.246 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 56' ' ' GLY . . . . . . . . . . . . . . . 126.3 6.23 5.82 Favored Glycine 0 CA--C 1.532 1.095 0 O-C-N 121.242 -0.911 . . . . 0.0 112.069 -173.063 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 57' ' ' GLU . . . . . . . . . . . . . 28.1 tt0 -114.26 113.71 24.98 Favored 'General case' 0 C--O 1.237 0.426 0 C-N-CA 125.419 1.488 . . . . 0.0 108.387 -169.535 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 58' ' ' LEU . . . . . . . . . . . . . 47.6 tp -94.36 97.4 10.18 Favored 'General case' 0 CA--C 1.533 0.305 0 C-N-CA 122.878 0.471 . . . . 0.0 110.439 175.354 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 59' ' ' THR . . . . . . . . . . . . . 6.4 p -99.29 139.01 35.57 Favored 'General case' 0 C--O 1.237 0.422 0 C-N-CA 124.171 0.988 . . . . 0.0 110.057 168.66 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 60' ' ' ALA . . . . . . . . . . . . . . . -94.34 108.73 20.62 Favored 'General case' 0 C--O 1.234 0.253 0 C-N-CA 124.799 1.239 . . . . 0.0 109.594 171.523 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 61' ' ' LYS . . . . . . . . . . . . . 11.0 tttt -75.36 72.0 2.37 Favored 'General case' 0 C--O 1.235 0.338 0 C-N-CA 124.916 1.286 . . . . 0.0 108.786 170.06 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 62' ' ' GLY . . . . . . . . . . . . . . . 102.86 104.47 2.86 Favored Glycine 0 N--CA 1.451 -0.349 0 N-CA-C 107.721 -2.152 . . . . 0.0 107.721 -174.433 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 63' ' ' LEU . . . . . . . . . . . . . 1.8 tp -90.42 161.79 15.4 Favored 'General case' 0 N--CA 1.447 -0.619 0 N-CA-C 108.506 -0.924 . . . . 0.0 108.506 160.352 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 64' ' ' ALA . . . . . . . . . . . . . . . -153.8 144.14 22.26 Favored 'General case' 0 C--O 1.235 0.299 0 C-N-CA 124.363 1.065 . . . . 0.0 109.858 165.848 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 65' ' ' MET . . . . . . . . . . . . . 8.5 mtt -145.48 169.31 18.6 Favored 'General case' 0 N--CA 1.472 0.628 0 C-N-CA 127.014 2.126 . . . . 0.0 111.752 -172.313 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 66' ' ' THR . . . . . . . . . . . . . 6.7 p -105.33 -172.37 2.08 Favored 'General case' 0 CA--C 1.544 0.748 0 C-N-CA 124.781 1.232 . . . . 0.0 110.78 177.003 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 67' ' ' ARG . . . . . . . . . . . . . 64.9 mtm-85 -121.48 76.14 1.23 Allowed 'General case' 0 N--CA 1.47 0.571 0 C-N-CA 124.728 1.211 . . . . 0.0 109.604 169.943 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 68' ' ' MET . . . . . . . . . . . . . 78.6 mtm -102.79 178.33 4.6 Favored 'General case' 0 CA--C 1.533 0.322 0 C-N-CA 124.924 1.29 . . . . 0.0 110.81 171.95 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 69' ' ' MET . . . . . . . . . . . . . 0.4 OUTLIER -137.24 171.7 14.09 Favored 'General case' 0 C--O 1.237 0.434 0 C-N-CA 127.058 2.143 . . . . 0.0 105.233 166.54 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 70' ' ' CYS . . . . . 1.293 ' SG ' ' SG ' ' A' ' 44' ' ' CYS . 97.0 m -141.51 9.03 2.01 Favored 'General case' 0 C--N 1.328 -0.327 0 N-CA-C 115.251 1.574 . . . . 0.0 115.251 -168.438 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 71' ' ' ALA . . . . . . . . . . . . . . . 62.19 2.23 0.8 Allowed 'General case' 0 CA--C 1.536 0.43 0 C-N-CA 126.72 2.008 . . . . 0.0 115.037 179.088 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 72' ' ' ASN . . . . . . . . . . . . . 0.1 OUTLIER -121.83 157.12 58.2 Favored Pre-proline 0 N--CA 1.476 0.867 0 N-CA-C 106.53 -1.655 . . . . 0.0 106.53 156.368 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 73' ' ' PRO . . . . . . . . . . . . . 64.7 Cg_endo -77.38 -41.85 0.32 Allowed 'Trans proline' 0 N--CA 1.459 -0.519 0 C-N-CA 122.236 1.957 . . . . 0.0 111.817 -178.487 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 74' ' ' GLN . . . . . . . . . . . . . 40.1 tt0 -47.52 -60.57 2.44 Favored 'General case' 0 CA--C 1.532 0.271 0 C-N-CA 126.972 2.109 . . . . 0.0 110.609 -173.959 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 75' ' ' LEU . . . . . . . . . . . . . 82.4 mt -55.44 -40.65 71.81 Favored 'General case' 0 CA--C 1.536 0.42 0 C-N-CA 125.126 1.37 . . . . 0.0 110.537 -177.786 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 76' ' ' ASN . . . . . . . . . . . . . 23.7 t-20 -75.14 -19.93 59.64 Favored 'General case' 0 N--CA 1.467 0.384 0 C-N-CA 125.309 1.444 . . . . 0.0 112.379 -176.05 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 77' ' ' GLU . . . . . . . . . . . . . 0.3 OUTLIER -92.48 -31.35 15.28 Favored 'General case' 0 CA--C 1.535 0.376 0 C-N-CA 124.501 1.12 . . . . 0.0 111.821 174.338 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 78' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -61.21 -25.48 67.08 Favored 'General case' 0 CA--C 1.534 0.347 0 C-N-CA 126.503 1.921 . . . . 0.0 111.787 -176.982 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 79' ' ' ASP . . . . . . . . . . . . . 20.2 m-20 -56.58 -43.44 80.03 Favored 'General case' 0 C--O 1.237 0.395 0 C-N-CA 125.549 1.54 . . . . 0.0 111.254 170.959 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 80' ' ' ASN . . . . . . . . . . . . . 49.1 m-20 -72.85 -32.07 65.21 Favored 'General case' 0 N--CA 1.453 -0.294 0 C-N-CA 119.288 -0.965 . . . . 0.0 110.261 -177.193 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 81' ' ' THR . . . . . . . . . . . . . 0.9 OUTLIER -58.04 -54.1 50.79 Favored 'General case' 0 N--CA 1.452 -0.367 0 CA-C-N 118.835 0.743 . . . . 0.0 110.264 172.567 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 82' ' ' ILE . . . . . . . . . . . . . 7.3 tp -65.06 -36.46 77.86 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.277 0 C-N-CA 119.77 -0.772 . . . . 0.0 110.143 -175.321 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 83' ' ' SER . . . . . . . . . . . . . 6.4 m -56.61 -51.62 67.96 Favored 'General case' 0 N--CA 1.449 -0.525 0 C-N-CA 122.974 0.51 . . . . 0.0 111.474 176.681 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 84' ' ' GLU . . . . . . . . . . . . . 3.3 mm-40 -56.75 -54.92 40.71 Favored 'General case' 0 N--CA 1.452 -0.355 0 C-N-CA 126.059 1.744 . . . . 0.0 110.083 176.414 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 85' ' ' MET . . . . . . . . . . . . . 87.8 mtp -60.95 -41.66 96.72 Favored 'General case' 0 C--N 1.341 0.233 0 CA-C-O 121.863 0.839 . . . . 0.0 108.762 -169.721 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 86' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -77.35 -20.57 54.64 Favored 'General case' 0 C--N 1.331 -0.223 0 O-C-N 121.361 -0.837 . . . . 0.0 112.407 -177.289 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 87' ' ' LYS . . . . . . . . . . . . . 5.4 tttm -72.66 -54.77 8.12 Favored 'General case' 0 N--CA 1.452 -0.364 0 N-CA-C 108.195 -1.039 . . . . 0.0 108.195 170.304 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 88' ' ' GLU . . . . . . . . . . . . . 15.4 pt-20 -73.95 -33.87 64.07 Favored 'General case' 0 CA--C 1.534 0.362 0 CA-C-O 118.667 -0.682 . . . . 0.0 111.918 -168.433 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 89' ' ' GLY . . . . . . . . . . . . . . . 120.33 87.4 1.01 Allowed Glycine 0 C--N 1.335 0.519 0 N-CA-C 108.616 -1.794 . . . . 0.0 108.616 178.509 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 90' ' ' ALA . . . . . . . . . . . . . . . -69.07 119.3 13.15 Favored 'General case' 0 N--CA 1.443 -0.823 0 N-CA-C 107.535 -1.283 . . . . 0.0 107.535 -173.26 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 91' ' ' GLN . . . . . . . . . . . . . 58.9 mm-40 -79.76 116.02 19.69 Favored 'General case' 0 N--CA 1.447 -0.579 0 N-CA-C 105.48 -2.044 . . . . 0.0 105.48 -177.083 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 92' ' ' VAL . . . . . . . . . . . . . 24.2 t -103.55 108.69 25.06 Favored 'Isoleucine or valine' 0 N--CA 1.448 -0.536 0 C-N-CA 127.422 2.289 . . . . 0.0 109.201 -168.787 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 93' ' ' ASP . . . . . . . . . . . . . 5.1 t0 -107.54 68.59 0.72 Allowed 'General case' 0 C--O 1.238 0.489 0 C-N-CA 126.508 1.923 . . . . 0.0 109.051 174.674 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 94' ' ' LEU . . . . . . . . . . . . . 1.7 tm? -75.55 109.93 9.52 Favored 'General case' 0 N--CA 1.452 -0.327 0 N-CA-C 106.882 -1.525 . . . . 0.0 106.882 168.944 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 95' ' ' THR . . . . . . . . . . . . . 7.7 t -89.52 -163.74 1.05 Allowed 'General case' 0 C--N 1.326 -0.42 0 C-N-CA 125.539 1.536 . . . . 0.0 108.387 175.766 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 96' ' ' ALA . . . . . . . . . . . . . . . -44.76 -40.87 6.41 Favored 'General case' 0 CA--C 1.54 0.584 0 C-N-CA 124.609 1.164 . . . . 0.0 113.791 -174.357 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 97' ' ' ASN . . . . . . . . . . . . . 6.2 p30 -162.91 14.52 0.07 Allowed 'General case' 0 N--CA 1.47 0.536 0 C-N-CA 124.681 1.193 . . . . 0.0 113.207 -173.752 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 98' ' ' GLN . . . . . . . . . . . . . 6.0 tt0 -128.83 130.42 46.91 Favored 'General case' 0 C--N 1.333 -0.143 0 N-CA-C 106.555 -1.646 . . . . 0.0 106.555 174.913 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 99' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -81.3 136.13 35.75 Favored 'General case' 0 C--N 1.327 -0.409 0 N-CA-C 107.17 -1.418 . . . . 0.0 107.17 169.465 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 100' ' ' THR . . . . . . . . . . . . . 0.3 OUTLIER -128.84 137.91 51.75 Favored 'General case' 0 N--CA 1.45 -0.456 0 N-CA-C 106.12 -1.807 . . . . 0.0 106.12 165.228 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 101' ' ' LEU . . . . . . . . . . . . . 4.5 mm? -106.63 157.33 17.77 Favored 'General case' 0 N--CA 1.449 -0.502 0 N-CA-C 107.861 -1.163 . . . . 0.0 107.861 164.753 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 102' ' ' ALA . . . . . . . . . . . . . . . -155.31 109.47 2.89 Favored 'General case' 0 C--N 1.329 -0.283 0 N-CA-C 108.321 -0.992 . . . . 0.0 108.321 159.06 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 103' ' ' THR . . . . . . . . . . . . . 0.5 OUTLIER -121.37 -172.66 2.46 Favored 'General case' 0 C--O 1.238 0.476 0 N-CA-C 108.608 -0.886 . . . . 0.0 108.608 -175.687 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 104' ' ' ALA . . . . . . . . . . . . . . . -53.09 -44.17 67.35 Favored 'General case' 0 N--CA 1.454 -0.26 0 O-C-N 121.102 -0.998 . . . . 0.0 110.202 168.728 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 105' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -59.57 -66.7 0.47 Allowed 'General case' 0 C--O 1.234 0.265 0 N-CA-C 113.277 0.843 . . . . 0.0 113.277 -173.758 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 106' ' ' GLN . . . . . . . . . . . . . 7.8 pt20 -166.22 -172.77 2.36 Favored 'General case' 0 CA--C 1.535 0.393 0 C-N-CA 127.114 2.165 . . . . 0.0 108.139 178.76 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 107' ' ' THR . . . . . . . . . . . . . 4.5 t -100.2 157.45 16.57 Favored 'General case' 0 C--O 1.24 0.57 0 C-N-CA 125.441 1.497 . . . . 0.0 108.186 163.267 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 108' ' ' LEU . . . . . . . . . . . . . 76.6 mt -146.95 141.56 26.62 Favored 'General case' 0 C--N 1.332 -0.173 0 C-N-CA 127.071 2.148 . . . . 0.0 105.968 176.757 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 109' ' ' THR . . . . . . . . . . . . . 27.9 m -130.14 126.5 37.67 Favored 'General case' 0 C--O 1.237 0.411 0 N-CA-C 107.959 -1.126 . . . . 0.0 107.959 -174.147 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 110' ' ' TYR . . . . . . . . . . . . . 12.4 m-85 -124.43 158.58 32.43 Favored 'General case' 0 CA--C 1.531 0.237 0 C-N-CA 124.215 1.006 . . . . 0.0 109.375 -176.04 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 111' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -108.75 145.32 35.31 Favored 'General case' 0 CA--C 1.516 -0.362 0 C-N-CA 124.14 0.976 . . . . 0.0 109.905 -178.931 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 112' ' ' LEU . . . . . . . . . . . . . 25.7 tp -75.61 58.56 1.07 Allowed 'General case' 0 CA--C 1.54 0.582 0 C-N-CA 124.816 1.246 . . . . 0.0 108.515 166.917 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 113' ' ' ALA . . . . . . . . . . . . . . . -78.94 64.5 3.89 Favored 'General case' 0 CA--C 1.529 0.163 0 O-C-N 120.534 -1.354 . . . . 0.0 108.102 170.66 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 114' ' ' ASP . . . . . . . . . . . . . 25.2 t0 . . . . . 0 N--CA 1.465 0.316 0 CA-C-O 122.04 0.924 . . . . 0.0 113.322 -161.526 . . . . . . . . 0 0 . 1 . 002 nuclear orig core ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 48.5 ttp . . . . . 0 N--CA 1.454 -0.239 0 N-CA-C 109.253 -0.647 . . . . 0.0 109.253 . . . . . . . . . 0 0 . 1 . 002 nuclear orig core ' A' A ' 2' ' ' VAL . . . . . . . . . . . . . 12.2 p -58.07 142.8 13.3 Favored 'Isoleucine or valine' 0 C--O 1.241 0.649 0 C-N-CA 124.197 0.999 . . . . 0.0 111.336 177.126 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 3' ' ' THR . . . . . . . . . . . . . 51.8 p -126.65 165.67 26.92 Favored Pre-proline 0 CA--C 1.535 0.371 0 C-N-CA 124.54 1.136 . . . . 0.0 110.223 179.467 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 4' ' ' PRO . . . . . . . . . . . . . 45.2 Cg_endo -69.91 -34.45 14.05 Favored 'Trans proline' 0 CA--C 1.533 0.445 0 C-N-CA 122.672 2.248 . . . . 0.0 113.662 175.893 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 5' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -49.18 -59.97 3.2 Favored 'General case' 0 N--CA 1.477 0.88 0 C-N-CA 125.747 1.619 . . . . 0.0 110.121 -179.964 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 6' ' ' GLN . . . . . . . . . . . . . 19.9 pt20 -64.32 14.83 0.02 OUTLIER 'General case' 0 CA--C 1.542 0.64 0 C-N-CA 127.957 2.503 . . . . 0.0 114.789 176.946 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 7' ' ' LEU . . . . . . . . . . . . . 95.5 mt -132.77 -48.74 0.88 Allowed 'General case' 0 CA--C 1.518 -0.259 0 C-N-CA 124.758 1.223 . . . . 0.0 110.633 -175.734 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 8' ' ' GLN . . . . . . . . . . . . . 5.9 mt-30 -56.83 -5.76 0.27 Allowed 'General case' 0 CA--C 1.536 0.429 0 C-N-CA 126.024 1.73 . . . . 0.0 114.699 -175.725 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 9' ' ' HIS . . . . . . . . . . . . . 95.9 m-70 -125.11 0.63 7.87 Favored 'General case' 0 CA--C 1.532 0.27 0 CA-C-O 118.022 -0.99 . . . . 0.0 113.486 178.534 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 10' ' ' HIS . . . . . . . . . . . . . 98.2 m-70 -120.91 126.59 50.4 Favored 'General case' 0 C--O 1.234 0.253 0 CA-C-N 119.595 1.088 . . . . 0.0 111.919 -170.29 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 11' ' ' ARG . . . . . . . . . . . . . 32.8 ttt180 -70.4 154.38 41.96 Favored 'General case' 0 C--N 1.331 -0.212 0 C-N-CA 124.884 1.274 . . . . 0.0 109.06 162.929 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 12' ' ' PHE . . . . . . . . . . . . . 41.4 m-85 -130.83 165.83 22.15 Favored 'General case' 0 N--CA 1.444 -0.76 0 C-N-CA 125.727 1.611 . . . . 0.0 107.982 164.581 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 13' ' ' VAL . . . . . 0.431 ' HA ' ' HA ' ' A' ' 30' ' ' GLU . 7.3 p -128.86 145.83 35.11 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.436 0 O-C-N 120.924 -1.11 . . . . 0.0 108.562 174.495 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 14' ' ' LEU . . . . . . . . . . . . . 4.9 tp -77.86 86.93 4.08 Favored 'General case' 0 C--O 1.233 0.23 0 N-CA-C 107.452 -1.314 . . . . 0.0 107.452 176.838 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 15' ' ' GLU . . . . . 0.41 ' HG2' ' HE2' ' A' ' 111' ' ' LYS . 17.7 tp10 -70.49 -49.86 43.97 Favored 'General case' 0 C--N 1.323 -0.546 0 CA-C-N 115.718 -0.674 . . . . 0.0 109.455 -176.465 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 63.2 p -147.51 136.2 21.92 Favored 'General case' 0 N--CA 1.446 -0.642 0 CA-C-O 122.363 1.078 . . . . 0.0 111.386 176.408 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 17' ' ' VAL . . . . . . . . . . . . . 3.2 t -77.68 169.04 1.81 Allowed 'Isoleucine or valine' 0 C--O 1.238 0.486 0 C-N-CA 125.71 1.604 . . . . 0.0 107.355 174.324 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 18' ' ' ASN . . . . . . . . . . . . . 0.5 OUTLIER -51.23 -34.68 33.25 Favored 'General case' 0 CA--C 1.534 0.329 0 C-N-CA 123.469 0.707 . . . . 0.0 112.205 165.063 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . -93.01 -45.35 3.61 Favored Glycine 0 CA--C 1.527 0.788 0 CA-C-O 118.395 -1.225 . . . . 0.0 113.875 -170.892 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 13.9 mttt -160.28 166.09 16.39 Favored Pre-proline 0 N--CA 1.469 0.488 0 C-N-CA 126.145 1.778 . . . . 0.0 109.819 -173.261 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 21' ' ' PRO . . . . . . . . . . . . . 91.1 Cg_endo -63.5 -178.78 0.54 Allowed 'Trans proline' 0 CA--C 1.542 0.893 0 C-N-CA 122.718 2.279 . . . . 0.0 111.358 163.477 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 22' ' ' VAL . . . . . . . . . . . . . 4.0 t -131.59 154.74 40.93 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.377 0 C-N-CA 124.107 0.963 . . . . 0.0 108.445 172.881 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 23' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -148.63 112.91 5.25 Favored 'General case' 0 C--O 1.234 0.27 0 N-CA-C 105.791 -1.929 . . . . 0.0 105.791 170.832 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 24' ' ' SER . . . . . . . . . . . . . 15.3 m -121.33 48.94 1.58 Allowed 'General case' 0 N--CA 1.469 0.497 0 CA-C-N 119.505 1.048 . . . . 0.0 108.348 174.769 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 25' ' ' ASP . . . . . . . . . . . . . 38.4 t0 51.35 -83.77 0.01 OUTLIER 'General case' 0 N--CA 1.453 -0.308 0 C-N-CA 128.671 2.788 . . . . 0.0 110.852 -169.787 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 26' ' ' LYS . . . . . . . . . . . . . 32.6 tttm -130.5 -4.71 4.23 Favored 'General case' 0 CA--C 1.537 0.465 0 C-N-CA 125.698 1.599 . . . . 0.0 111.214 -172.121 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 27' ' ' ASN . . . . . . . . . . . . . 6.2 p30 -118.8 58.38 3.68 Favored Pre-proline 0 CA--C 1.545 0.753 0 C-N-CA 126.26 1.824 . . . . 0.0 112.885 177.735 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 28' ' ' PRO . . . . . . . . . . . . . 54.1 Cg_endo -71.09 168.07 24.3 Favored 'Trans proline' 0 CA--C 1.548 1.215 0 C-N-CA 123.72 2.947 . . . . 0.0 112.627 -176.6 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 29' ' ' PRO . . . . . . . . . . . . . 20.6 Cg_endo -73.2 63.71 4.3 Favored 'Trans proline' 0 C--N 1.355 0.873 0 C-N-CA 123.59 2.86 . . . . 0.0 113.525 179.067 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 30' ' ' GLU . . . . . 0.431 ' HA ' ' HA ' ' A' ' 13' ' ' VAL . 8.7 pt-20 -72.15 169.44 16.09 Favored 'General case' 0 CA--C 1.537 0.469 0 O-C-N 120.228 -1.545 . . . . 0.0 111.638 175.148 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 31' ' ' ILE . . . . . . . . . . . . . 16.6 tt -143.46 146.46 21.27 Favored 'Isoleucine or valine' 0 CA--C 1.529 0.166 0 N-CA-C 107.909 -1.145 . . . . 0.0 107.909 -179.39 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 32' ' ' SER . . . . . . . . . . . . . 14.7 p -137.48 157.26 46.94 Favored 'General case' 0 C--O 1.237 0.441 0 O-C-N 120.962 -1.086 . . . . 0.0 109.669 170.986 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 33' ' ' PHE . . . . . . . . . . . . . 86.5 m-85 -121.99 155.92 34.56 Favored 'General case' 0 N--CA 1.442 -0.857 0 N-CA-C 107.207 -1.405 . . . . 0.0 107.207 177.681 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 34' ' ' GLY . . . . . . . . . . . . . . . -149.87 -165.12 12.24 Favored Glycine 0 CA--C 1.516 0.12 0 N-CA-C 109.271 -1.532 . . . . 0.0 109.271 177.189 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 35' ' ' GLU . . . . . . . . . . . . . 0.2 OUTLIER -44.1 154.57 0.11 Allowed 'General case' 0 C--O 1.235 0.337 0 C-N-CA 126.745 2.018 . . . . 0.0 111.577 177.774 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 37.8 mtpt 55.92 13.92 1.24 Allowed 'General case' 0 CA--C 1.532 0.275 0 C-N-CA 124.778 1.231 . . . . 0.0 112.311 -171.659 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 37' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER 59.36 25.99 14.78 Favored 'General case' 0 CA--C 1.542 0.653 0 C-N-CA 124.872 1.269 . . . . 0.0 110.903 -175.135 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 38' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -61.86 164.54 6.27 Favored 'General case' 0 N--CA 1.444 -0.748 0 O-C-N 120.449 -1.407 . . . . 0.0 111.575 173.015 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 39' ' ' ILE . . . . . . . . . . . . . 10.6 mt -134.05 139.26 48.72 Favored 'Isoleucine or valine' 0 C--O 1.238 0.455 0 N-CA-C 106.732 -1.581 . . . . 0.0 106.732 -172.108 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 40' ' ' SER . . . . . . . . . . . . . 58.8 m -136.29 152.82 51.1 Favored 'General case' 0 C--O 1.234 0.266 0 N-CA-C 109.591 -0.522 . . . . 0.0 109.591 156.067 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 41' ' ' GLY . . . . . . . . . . . . . . . -164.98 -175.26 35.55 Favored Glycine 0 CA--C 1.527 0.835 0 C-N-CA 124.645 1.117 . . . . 0.0 110.323 172.532 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 42' ' ' SER . . . . . . . . . . . . . 22.1 p -151.27 87.43 1.39 Allowed 'General case' 0 N--CA 1.445 -0.713 0 C-N-CA 124.69 1.196 . . . . 0.0 110.02 177.737 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 43' ' ' MET . . . . . . . . . . . . . 6.2 mmt -61.11 -66.95 0.45 Allowed 'General case' 0 C--N 1.341 0.236 0 N-CA-C 108.455 -0.942 . . . . 0.0 108.455 169.601 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 44' ' ' CYS . . . . . 1.288 ' SG ' ' SG ' ' A' ' 70' ' ' CYS . 17.1 t -138.01 -57.04 0.67 Allowed 'General case' 0 N--CA 1.447 -0.586 0 N-CA-C 106.446 -1.687 . . . . 0.0 106.446 164.571 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 45' ' ' ASN . . . . . . . . . . . . . 5.8 m-80 -76.68 8.28 3.78 Favored 'General case' 0 N--CA 1.464 0.259 0 C-N-CA 127.4 2.28 . . . . 0.0 115.854 -168.394 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 46' ' ' ARG . . . . . . . . . . . . . 8.7 mtm180 53.37 160.24 0.01 OUTLIER 'General case' 0 CA--C 1.52 -0.176 0 C-N-CA 126.78 2.032 . . . . 0.0 112.362 -155.936 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 47' ' ' PHE . . . . . . . . . . . . . 48.8 p90 -159.32 153.1 23.01 Favored 'General case' 0 C--N 1.321 -0.657 0 CA-C-N 113.653 -1.612 . . . . 0.0 107.672 164.83 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 48' ' ' SER . . . . . . . . . . . . . 3.3 m -154.26 156.93 37.93 Favored 'General case' 0 N--CA 1.444 -0.754 0 C-N-CA 125.696 1.598 . . . . 0.0 106.823 176.391 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 49' ' ' GLY . . . . . . . . . . . . . . . 174.57 163.86 28.5 Favored Glycine 0 N--CA 1.448 -0.543 0 N-CA-C 111.193 -0.763 . . . . 0.0 111.193 167.994 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 50' ' ' GLU . . . . . . . . . . . . . 34.0 tt0 -64.66 100.12 0.36 Allowed 'General case' 0 N--CA 1.445 -0.685 0 C-N-CA 125.437 1.495 . . . . 0.0 108.985 171.985 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 51' ' ' GLY . . . . . . . . . . . . . . . -72.18 177.45 39.25 Favored Glycine 0 CA--C 1.527 0.79 0 N-CA-C 111.483 -0.647 . . . . 0.0 111.483 161.027 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 52' ' ' LYS . . . . . . . . . . . . . 16.6 tttp -162.77 151.24 14.38 Favored 'General case' 0 N--CA 1.455 -0.201 0 N-CA-C 106.985 -1.487 . . . . 0.0 106.985 171.281 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 53' ' ' LEU . . . . . . . . . . . . . 42.7 tp -146.9 119.36 8.45 Favored 'General case' 0 CA--C 1.517 -0.299 0 N-CA-C 107.436 -1.32 . . . . 0.0 107.436 173.808 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 2.1 t -157.64 14.63 0.23 Allowed 'General case' 0 CA--C 1.541 0.608 0 C-N-CA 123.158 0.583 . . . . 0.0 110.768 166.945 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 55' ' ' ASN . . . . . . . . . . . . . 18.2 p-10 -154.87 26.68 0.43 Allowed 'General case' 0 CA--C 1.537 0.446 0 C-N-CA 125.178 1.391 . . . . 0.0 111.528 -169.743 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 56' ' ' GLY . . . . . . . . . . . . . . . 63.62 17.08 59.69 Favored Glycine 0 CA--C 1.531 1.044 0 O-C-N 121.609 -0.682 . . . . 0.0 113.62 -179.605 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 57' ' ' GLU . . . . . . . . . . . . . 33.9 tt0 -129.74 151.12 50.67 Favored 'General case' 0 N--CA 1.451 -0.394 0 C-N-CA 125.633 1.573 . . . . 0.0 107.271 -174.24 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 58' ' ' LEU . . . . . . . . . . . . . 59.0 tp -131.6 107.91 9.17 Favored 'General case' 0 N--CA 1.455 -0.203 0 C-N-CA 125.717 1.607 . . . . 0.0 108.012 175.932 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 59' ' ' THR . . . . . . . . . . . . . 4.5 p -107.57 160.01 16.01 Favored 'General case' 0 CA--C 1.536 0.416 0 C-N-CA 125.726 1.611 . . . . 0.0 110.171 176.594 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 60' ' ' ALA . . . . . . . . . . . . . . . -110.14 102.37 11.08 Favored 'General case' 0 C--O 1.234 0.27 0 C-N-CA 124.851 1.26 . . . . 0.0 111.713 168.569 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 61' ' ' LYS . . . . . . . . . . . . . 0.3 OUTLIER -79.23 5.4 12.35 Favored 'General case' 0 CA--C 1.539 0.526 0 N-CA-C 112.755 0.65 . . . . 0.0 112.755 168.639 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 62' ' ' GLY . . . . . . . . . . . . . . . -167.91 48.68 0.24 Allowed Glycine 0 C--N 1.331 0.303 0 CA-C-N 121.384 1.902 . . . . 0.0 111.487 -177.567 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 63' ' ' LEU . . . . . . . . . . . . . 0.9 OUTLIER -61.29 140.03 58.05 Favored 'General case' 0 N--CA 1.45 -0.457 0 N-CA-C 108.351 -0.981 . . . . 0.0 108.351 171.438 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 64' ' ' ALA . . . . . . . . . . . . . . . -144.12 134.81 24.96 Favored 'General case' 0 N--CA 1.454 -0.25 0 N-CA-C 109.024 -0.732 . . . . 0.0 109.024 171.457 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 65' ' ' MET . . . . . . . . . . . . . 68.4 mtp -139.98 179.49 6.58 Favored 'General case' 0 C--O 1.24 0.604 0 C-N-CA 124.656 1.182 . . . . 0.0 110.094 -170.179 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 66' ' ' THR . . . . . . . . . . . . 0.282 3.3 p -120.4 -163.04 0.98 Allowed 'General case' 0 CA--C 1.551 0.992 0 C-N-CA 125.508 1.523 . . . . 0.0 112.671 -176.306 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 67' ' ' ARG . . . . . . . . . . . . . 17.7 mmt180 -130.15 62.25 1.57 Allowed 'General case' 0 N--CA 1.475 0.813 0 C-N-CA 126.6 1.96 . . . . 0.0 111.715 173.741 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 68' ' ' MET . . . . . . . . . . . . . 77.2 mtm -99.53 171.53 7.87 Favored 'General case' 0 N--CA 1.468 0.429 0 C-N-CA 125.837 1.655 . . . . 0.0 111.684 172.901 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 69' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -129.28 161.81 29.36 Favored 'General case' 0 C--O 1.237 0.402 0 C-N-CA 127.627 2.371 . . . . 0.0 108.489 -176.42 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 70' ' ' CYS . . . . . 1.288 ' SG ' ' SG ' ' A' ' 44' ' ' CYS . 66.2 m -145.74 13.08 1.32 Allowed 'General case' 0 N--CA 1.474 0.773 0 N-CA-C 116.585 2.069 . . . . 0.0 116.585 -170.125 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 71' ' ' ALA . . . . . . . . . . . . . . . 68.39 -28.04 0.15 Allowed 'General case' 0 N--CA 1.473 0.697 0 C-N-CA 127.741 2.416 . . . . 0.0 116.182 166.301 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 72' ' ' ASN . . . . . . . . . . . . . 1.1 t-20 -88.73 163.42 35.52 Favored Pre-proline 0 C--O 1.24 0.564 0 C-N-CA 127.235 2.214 . . . . 0.0 105.844 159.634 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 73' ' ' PRO . . . . . . . . . . . . . 24.6 Cg_endo -92.55 -19.68 0.6 Allowed 'Trans proline' 0 N--CA 1.451 -0.98 0 C-N-CA 121.596 1.531 . . . . 0.0 110.951 169.917 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 74' ' ' GLN . . . . . . . . . . . . . 63.3 tt0 -52.65 -62.62 1.53 Allowed 'General case' 0 C--N 1.343 0.312 0 C-N-CA 125.135 1.374 . . . . 0.0 110.586 -176.657 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 75' ' ' LEU . . . . . . . . . . . . . 19.9 mt -62.93 -28.0 69.76 Favored 'General case' 0 CA--C 1.538 0.481 0 C-N-CA 122.959 0.504 . . . . 0.0 110.451 -173.45 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 76' ' ' ASN . . . . . . . . . . . . . 2.0 t-20 -72.52 -34.64 67.73 Favored 'General case' 0 CA--C 1.532 0.27 0 C-N-CA 126.284 1.834 . . . . 0.0 111.811 -179.867 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 77' ' ' GLU . . . . . . . . . . . . . 1.1 mm-40 -78.99 -30.96 44.67 Favored 'General case' 0 C--O 1.234 0.24 0 C-N-CA 123.757 0.823 . . . . 0.0 110.694 172.451 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 78' ' ' LEU . . . . . . . . . . . . . 3.0 mp -62.68 -35.63 80.3 Favored 'General case' 0 N--CA 1.456 -0.155 0 C-N-CA 124.778 1.231 . . . . 0.0 110.442 -179.688 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 79' ' ' ASP . . . . . . . . . . . . . 74.2 m-20 -53.17 -47.55 68.7 Favored 'General case' 0 CA--C 1.517 -0.312 0 C-N-CA 124.207 1.003 . . . . 0.0 110.699 171.514 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 80' ' ' ASN . . . . . . . . . . . . . 37.4 m-20 -78.16 -35.08 49.26 Favored 'General case' 0 N--CA 1.452 -0.328 0 N-CA-C 108.801 -0.815 . . . . 0.0 108.801 -171.482 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 81' ' ' THR . . . . . . . . . . . . . 12.8 m -58.41 -56.22 24.88 Favored 'General case' 0 N--CA 1.445 -0.719 0 C-N-CA 123.814 0.846 . . . . 0.0 109.701 172.316 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 82' ' ' ILE . . . . . . . . . . . . . 10.2 tp -65.25 -34.35 69.91 Favored 'Isoleucine or valine' 0 C--N 1.34 0.195 0 CA-C-N 120.093 1.315 . . . . 0.0 110.905 -174.089 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 83' ' ' SER . . . . . . . . . . . . . 11.2 t -62.35 -54.25 43.13 Favored 'General case' 0 N--CA 1.446 -0.649 0 N-CA-C 109.249 -0.648 . . . . 0.0 109.249 -179.0 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 84' ' ' GLU . . . . . . . . . . . . . 4.5 mm-40 -57.56 -44.83 85.57 Favored 'General case' 0 N--CA 1.449 -0.484 0 C-N-CA 124.864 1.266 . . . . 0.0 110.127 174.99 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 85' ' ' MET . . . . . . . . . . . . . 95.4 mtp -73.02 -1.1 15.85 Favored 'General case' 0 CA--C 1.518 -0.284 0 CA-C-N 119.175 0.898 . . . . 0.0 112.665 -173.86 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 86' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -112.73 -16.19 12.82 Favored 'General case' 0 C--N 1.327 -0.398 0 CA-C-N 119.686 1.13 . . . . 0.0 110.786 170.941 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 87' ' ' LYS . . . . . . . . . . . . . 1.8 mptp? -79.3 -26.84 42.21 Favored 'General case' 0 N--CA 1.453 -0.286 0 CA-C-O 117.861 -1.066 . . . . 0.0 112.385 -173.578 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 88' ' ' GLU . . . . . . . . . . . . . 22.7 pt-20 -110.23 0.77 18.29 Favored 'General case' 0 CA--C 1.54 0.573 0 C-N-CA 124.977 1.311 . . . . 0.0 113.476 -170.778 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 89' ' ' GLY . . . . . . . . . . . . . . . 86.04 99.78 0.75 Allowed Glycine 0 C--N 1.338 0.679 0 C-N-CA 126.862 2.173 . . . . 0.0 110.256 -173.276 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 90' ' ' ALA . . . . . . . . . . . . . . . -71.87 139.68 48.95 Favored 'General case' 0 N--CA 1.465 0.309 0 N-CA-C 107.591 -1.263 . . . . 0.0 107.591 164.988 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 91' ' ' GLN . . . . . . . . . . . . . 78.1 mm-40 -74.17 145.89 43.87 Favored 'General case' 0 N--CA 1.445 -0.677 0 N-CA-C 105.771 -1.937 . . . . 0.0 105.771 158.359 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 92' ' ' VAL . . . . . . . . . . . . . 7.9 p -135.02 124.51 43.19 Favored 'Isoleucine or valine' 0 N--CA 1.449 -0.476 0 N-CA-C 106.645 -1.613 . . . . 0.0 106.645 -172.346 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 93' ' ' ASP . . . . . . . . . . . . . 4.1 m-20 -142.21 85.97 1.94 Allowed 'General case' 0 C--O 1.232 0.169 0 N-CA-C 107.893 -1.151 . . . . 0.0 107.893 -174.098 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 94' ' ' LEU . . . . . . . . . . . . . 42.7 tp -77.9 111.08 13.38 Favored 'General case' 0 N--CA 1.461 0.118 0 N-CA-C 107.474 -1.306 . . . . 0.0 107.474 169.891 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 95' ' ' THR . . . . . . . . . . . . . 8.9 t -77.73 -176.38 4.34 Favored 'General case' 0 CA--C 1.535 0.402 0 N-CA-C 109.292 -0.633 . . . . 0.0 109.292 165.258 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 96' ' ' ALA . . . . . . . . . . . . . . . -44.17 -41.1 5.49 Favored 'General case' 0 CA--C 1.532 0.27 0 C-N-CA 126.58 1.952 . . . . 0.0 113.053 -171.999 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 97' ' ' ASN . . . . . . . . . . . . . 12.9 p30 -161.41 70.25 0.35 Allowed 'General case' 0 N--CA 1.449 -0.516 0 C-N-CA 124.474 1.11 . . . . 0.0 108.174 168.532 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 98' ' ' GLN . . . . . . . . . . . . . 0.3 OUTLIER -170.25 135.31 1.28 Allowed 'General case' 0 N--CA 1.472 0.654 0 C-N-CA 125.836 1.654 . . . . 0.0 107.501 157.582 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 99' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -85.5 112.13 20.63 Favored 'General case' 0 N--CA 1.451 -0.383 0 C-N-CA 123.681 0.792 . . . . 0.0 109.736 174.775 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 100' ' ' THR . . . . . . . . . . . . . 53.4 m -89.42 115.66 27.03 Favored 'General case' 0 C--N 1.324 -0.504 0 N-CA-C 106.338 -1.727 . . . . 0.0 106.338 166.751 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 101' ' ' LEU . . . . . . . . . . . . . 1.7 mm? -109.7 141.67 41.95 Favored 'General case' 0 CA--C 1.507 -0.7 0 C-N-CA 124.656 1.182 . . . . 0.0 108.661 171.892 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 102' ' ' ALA . . . . . . . . . . . . . . . -145.0 143.55 30.56 Favored 'General case' 0 C--O 1.234 0.277 0 O-C-N 124.504 1.128 . . . . 0.0 110.351 178.573 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 103' ' ' THR . . . . . . . . . . . . . 0.6 OUTLIER -158.65 171.84 19.37 Favored 'General case' 0 N--CA 1.443 -0.818 0 C-N-CA 126.868 2.067 . . . . 0.0 108.278 174.35 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 104' ' ' ALA . . . . . . . . . . . . . . . -58.24 -35.39 71.65 Favored 'General case' 0 CA--C 1.533 0.326 0 O-C-N 121.34 -0.85 . . . . 0.0 111.275 178.117 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 105' ' ' LYS . . . . . . . . . . . . . 1.4 mmpt? -55.76 -72.58 0.07 Allowed 'General case' 0 CA--C 1.534 0.337 0 CA-C-O 118.424 -0.798 . . . . 0.0 113.005 170.992 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 106' ' ' GLN . . . . . . . . . . . . . 3.0 pt20 -159.8 -165.12 1.45 Allowed 'General case' 0 CA--C 1.536 0.41 0 C-N-CA 124.215 1.006 . . . . 0.0 110.129 -174.301 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 107' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -134.26 134.22 41.7 Favored 'General case' 0 CA--C 1.537 0.449 0 C-N-CA 126.564 1.945 . . . . 0.0 106.445 -179.5 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 108' ' ' LEU . . . . . . . . . . . . . 3.8 mm? -112.14 156.65 21.93 Favored 'General case' 0 C--O 1.235 0.315 0 C-N-CA 124.867 1.267 . . . . 0.0 109.065 174.585 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 109' ' ' THR . . . . . . . . . . . . . 3.3 m -127.52 87.77 2.68 Favored 'General case' 0 C--O 1.237 0.408 0 N-CA-C 105.946 -1.872 . . . . 0.0 105.946 -177.097 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 110' ' ' TYR . . . . . . . . . . . . . 91.4 m-85 -91.54 139.01 31.12 Favored 'General case' 0 CA--C 1.531 0.217 0 N-CA-C 109.42 -0.585 . . . . 0.0 109.42 -175.344 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 111' ' ' LYS . . . . . 0.41 ' HE2' ' HG2' ' A' ' 15' ' ' GLU . 2.5 tppt? -94.61 141.69 28.32 Favored 'General case' 0 N--CA 1.464 0.234 0 C-N-CA 123.733 0.813 . . . . 0.0 108.894 -178.47 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 112' ' ' LEU . . . . . . . . . . . . . 19.8 tp -75.07 49.67 0.45 Allowed 'General case' 0 CA--C 1.544 0.713 0 C-N-CA 126.572 1.949 . . . . 0.0 110.078 173.48 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 113' ' ' ALA . . . . . . . . . . . . . . . -84.25 78.46 9.78 Favored 'General case' 0 C--O 1.234 0.261 0 O-C-N 119.771 -1.83 . . . . 0.0 108.709 177.366 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 114' ' ' ASP . . . . . . . . . . . . . 1.9 p-10 . . . . . 0 C--N 1.328 -0.341 0 C-N-CA 124.098 0.959 . . . . 0.0 113.231 -170.759 . . . . . . . . 0 0 . 1 . 003 nuclear orig core ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 C--O 1.234 0.239 0 N-CA-C 114.106 1.15 . . . . 0.0 114.106 . . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 2' ' ' VAL . . . . . . . . . . . . 0.267 10.0 p 54.68 165.7 0.0 OUTLIER 'Isoleucine or valine' 0 CA--C 1.547 0.857 0 C-N-CA 129.588 3.155 . . . . 0.0 111.705 -170.223 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 3' ' ' THR . . . . . . . . . . . . . 25.3 p -130.01 155.77 80.14 Favored Pre-proline 0 CA--C 1.533 0.307 0 O-C-N 119.628 -1.92 . . . . 0.0 109.774 170.942 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 4' ' ' PRO . . . . . . . . . . . . . 58.2 Cg_endo -62.28 -33.11 81.66 Favored 'Trans proline' 0 C--N 1.345 0.386 0 C-N-CA 124.139 3.226 . . . . 0.0 112.221 178.217 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 5' ' ' GLU . . . . . . . . . . . . . 11.8 tt0 -51.68 -36.29 45.89 Favored 'General case' 0 C--N 1.318 -0.778 0 C-N-CA 125.2 1.4 . . . . 0.0 112.197 171.343 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 6' ' ' GLN . . . . . . . . . . . . . 6.4 mt-30 -73.04 10.67 0.86 Allowed 'General case' 0 CA--C 1.545 0.783 0 C-N-CA 123.7 0.8 . . . . 0.0 112.265 173.725 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 7' ' ' LEU . . . . . . . . . . . . . 97.7 mt -136.54 -50.61 0.68 Allowed 'General case' 0 C--O 1.223 -0.335 0 C-N-CA 125.103 1.361 . . . . 0.0 112.56 -172.503 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 8' ' ' GLN . . . . . . . . . . . . . 1.8 mt-30 -53.01 -8.32 0.1 Allowed 'General case' 0 N--CA 1.481 1.106 0 C-N-CA 126.163 1.785 . . . . 0.0 115.748 -174.993 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 9' ' ' HIS . . . . . . . . . . . . . 98.1 m-70 -131.09 7.14 4.63 Favored 'General case' 0 CA--C 1.537 0.48 0 C-N-CA 125.017 1.327 . . . . 0.0 112.763 177.581 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 10' ' ' HIS . . . . . . . . . . . . . 95.1 m-70 -130.57 116.8 18.64 Favored 'General case' 0 C--O 1.233 0.212 0 C-N-CA 125.247 1.419 . . . . 0.0 110.464 -169.537 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 11' ' ' ARG . . . . . . . . . . . . . 32.3 ttm-85 -70.15 155.12 41.08 Favored 'General case' 0 CA--C 1.518 -0.263 0 C-N-CA 124.406 1.082 . . . . 0.0 108.64 169.656 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 12' ' ' PHE . . . . . . . . . . . . . 74.9 m-85 -139.06 153.87 48.12 Favored 'General case' 0 CA--C 1.501 -0.923 0 CA-C-O 122.732 1.253 . . . . 0.0 109.233 163.809 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 13' ' ' VAL . . . . . . . . . . . . . 0.0 OUTLIER -130.3 135.13 61.37 Favored 'Isoleucine or valine' 0 CA--C 1.494 -1.187 0 CA-C-N 113.286 -1.779 . . . . 0.0 114.99 -173.81 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 14' ' ' LEU . . . . . . . . . . . . . 2.2 tt -65.09 110.84 2.65 Favored 'General case' 0 CA--C 1.497 -1.091 0 O-C-N 126.135 2.147 . . . . 0.0 109.135 -173.144 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 0.9 OUTLIER -94.3 -52.46 4.34 Favored 'General case' 0 N--CA 1.426 -1.665 0 O-C-N 125.576 1.797 . . . . 0.0 108.446 -168.913 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 16' ' ' SER . . . . . 0.429 ' HA ' ' HA ' ' A' ' 21' ' ' PRO . 87.1 p -139.94 150.41 44.5 Favored 'General case' 0 N--CA 1.444 -0.738 0 CA-C-N 115.523 -0.762 . . . . 0.0 110.569 166.536 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 17' ' ' VAL . . . . . . . . . . . . . 2.7 t -83.8 178.35 0.55 Allowed 'Isoleucine or valine' 0 N--CA 1.443 -0.779 0 N-CA-C 107.251 -1.389 . . . . 0.0 107.251 176.334 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 18' ' ' ASN . . . . . . . . . . . . . 0.0 OUTLIER -50.44 -28.65 8.63 Favored 'General case' 0 N--CA 1.464 0.273 0 N-CA-C 114.633 1.346 . . . . 0.0 114.633 -178.812 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . -104.31 -76.96 1.13 Allowed Glycine 0 N--CA 1.445 -0.712 0 N-CA-C 109.652 -1.379 . . . . 0.0 109.652 171.167 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 16.3 mttt -125.07 165.73 24.28 Favored Pre-proline 0 N--CA 1.466 0.345 0 C-N-CA 124.702 1.201 . . . . 0.0 112.318 -167.473 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 21' ' ' PRO . . . . . 0.429 ' HA ' ' HA ' ' A' ' 16' ' ' SER . 56.1 Cg_endo -61.8 167.85 9.59 Favored 'Trans proline' 0 N--CA 1.458 -0.617 0 C-N-CA 123.607 2.871 . . . . 0.0 113.142 170.126 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 22' ' ' VAL . . . . . . . . . . . . . 7.9 p -141.1 157.47 22.52 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.357 0 C-N-CA 127.733 2.413 . . . . 0.0 105.731 -178.419 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 23' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -145.89 91.82 2.13 Favored 'General case' 0 C--O 1.236 0.38 0 N-CA-C 108.571 -0.9 . . . . 0.0 108.571 176.539 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 24' ' ' SER . . . . . . . . . . . . . 61.1 m -77.64 49.2 0.73 Allowed 'General case' 0 CA--C 1.533 0.29 0 C-N-CA 125.284 1.434 . . . . 0.0 110.271 178.467 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 25' ' ' ASP . . . . . . . . . . . . . 0.7 OUTLIER 56.8 -84.46 0.02 OUTLIER 'General case' 0 CA--C 1.514 -0.408 0 C-N-CA 127.728 2.411 . . . . 0.0 110.536 -169.602 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 26' ' ' LYS . . . . . . . . . . . . . 35.5 tttt -142.74 3.91 1.47 Allowed 'General case' 0 C--N 1.325 -0.483 0 C-N-CA 127.957 2.503 . . . . 0.0 110.29 -168.342 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 27' ' ' ASN . . . . . . . . . . . . . 70.6 m-80 -122.05 62.98 15.77 Favored Pre-proline 0 N--CA 1.453 -0.281 0 C-N-CA 127.156 2.182 . . . . 0.0 107.207 -173.165 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 28' ' ' PRO . . . . . . . . . . . . . 65.7 Cg_endo -64.54 159.14 46.06 Favored 'Trans proline' 0 C--O 1.24 0.622 0 C-N-CA 122.615 2.21 . . . . 0.0 110.864 -172.657 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 29' ' ' PRO . . . . . . . . . . . . . 28.0 Cg_endo -71.99 63.99 3.31 Favored 'Trans proline' 0 N--CA 1.456 -0.682 0 C-N-CA 122.829 2.352 . . . . 0.0 110.048 166.818 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 30' ' ' GLU . . . . . . . . . . . . . 1.6 pt-20 -72.09 166.23 22.71 Favored 'General case' 0 CA--C 1.542 0.664 0 N-CA-C 108.31 -0.996 . . . . 0.0 108.31 177.439 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 31' ' ' ILE . . . . . . . . . . . . . 10.6 tt -138.31 150.66 24.45 Favored 'Isoleucine or valine' 0 N--CA 1.445 -0.711 0 N-CA-C 105.627 -1.99 . . . . 0.0 105.627 172.789 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 32' ' ' SER . . . . . . . . . . . . . 78.0 p -144.97 174.3 11.14 Favored 'General case' 0 N--CA 1.432 -1.359 0 CA-C-O 122.691 1.234 . . . . 0.0 108.907 165.919 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 33' ' ' PHE . . . . . . . . . . . . . 77.0 m-85 -136.31 164.43 28.11 Favored 'General case' 0 N--CA 1.434 -1.246 0 N-CA-C 106.372 -1.714 . . . . 0.0 106.372 -173.371 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 34' ' ' GLY . . . . . . . . . . . . . . . 165.08 -168.83 39.42 Favored Glycine 0 N--CA 1.445 -0.765 0 N-CA-C 110.073 -1.211 . . . . 0.0 110.073 176.918 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 35' ' ' GLU . . . . . . . . . . . . . 3.4 mt-10 63.69 -86.14 0.02 OUTLIER 'General case' 0 C--N 1.331 -0.202 0 C-N-CA 125.813 1.645 . . . . 0.0 110.064 -178.396 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 29.7 mtpt -154.42 72.31 0.86 Allowed 'General case' 0 N--CA 1.44 -0.965 0 C-N-CA 126.926 2.09 . . . . 0.0 110.67 -176.277 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 37' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER 55.72 26.68 9.69 Favored 'General case' 0 CA--C 1.539 0.543 0 C-N-CA 123.998 0.919 . . . . 0.0 109.428 -178.036 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 38' ' ' MET . . . . . . . . . . . . . 10.4 mtp -73.82 164.89 26.04 Favored 'General case' 0 N--CA 1.448 -0.557 0 N-CA-C 108.246 -1.02 . . . . 0.0 108.246 172.279 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 39' ' ' ILE . . . . . . . . . . . . . 34.1 mt -135.93 134.4 50.85 Favored 'Isoleucine or valine' 0 C--O 1.235 0.323 0 N-CA-C 108.163 -1.051 . . . . 0.0 108.163 -178.428 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 40' ' ' SER . . . . . . . . . . . . . 34.5 t -142.02 144.83 33.83 Favored 'General case' 0 CA--C 1.536 0.405 0 C-N-CA 125.051 1.34 . . . . 0.0 108.824 177.377 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 41' ' ' GLY . . . . . . . . . . . . . . . -177.64 -176.35 45.6 Favored Glycine 0 CA--C 1.528 0.845 0 N-CA-C 111.333 -0.707 . . . . 0.0 111.333 177.98 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 42' ' ' SER . . . . . . . . . . . . . 34.0 p -143.81 80.3 1.65 Allowed 'General case' 0 CA--C 1.538 0.497 0 C-N-CA 123.007 0.523 . . . . 0.0 111.829 -171.89 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 43' ' ' MET . . . . . . . . . . . . . 3.1 mmt -63.79 -59.75 4.16 Favored 'General case' 0 N--CA 1.472 0.662 0 O-C-N 121.107 -0.996 . . . . 0.0 109.918 173.76 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 44' ' ' CYS . . . . . 1.288 ' SG ' ' SG ' ' A' ' 70' ' ' CYS . 41.9 t -129.06 -66.0 0.84 Allowed 'General case' 0 N--CA 1.451 -0.383 0 N-CA-C 108.156 -1.053 . . . . 0.0 108.156 151.298 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 45' ' ' ASN . . . . . . . . . . . . . 0.6 OUTLIER -87.84 19.78 3.36 Favored 'General case' 0 C--N 1.33 -0.259 0 N-CA-C 114.215 1.191 . . . . 0.0 114.215 -152.242 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 46' ' ' ARG . . . . . . . . . . . . . 17.4 mmm-85 57.46 162.74 0.03 OUTLIER 'General case' 0 CA--C 1.52 -0.178 0 C-N-CA 128.823 2.849 . . . . 0.0 112.025 -158.385 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 47' ' ' PHE . . . . . . . . . . . . . 53.9 p90 -158.28 162.4 37.77 Favored 'General case' 0 C--O 1.242 0.678 0 C-N-CA 125.513 1.525 . . . . 0.0 107.163 172.361 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 48' ' ' SER . . . . . . . . . . . . . 2.5 p -167.87 142.24 3.55 Favored 'General case' 0 C--O 1.236 0.381 0 C-N-CA 123.747 0.819 . . . . 0.0 109.073 -178.01 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 49' ' ' GLY . . . . . . . . . . . . . . . -171.12 169.63 42.62 Favored Glycine 0 C--N 1.337 0.633 0 CA-C-N 119.979 1.263 . . . . 0.0 110.648 -177.661 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 50' ' ' GLU . . . . . . . . . . . . . 36.7 mt-10 -83.01 102.55 11.83 Favored 'General case' 0 N--CA 1.446 -0.632 0 N-CA-C 106.412 -1.699 . . . . 0.0 106.412 177.767 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 51' ' ' GLY . . . . . . . . . . . . . . . -64.16 167.08 27.8 Favored Glycine 0 CA--C 1.528 0.85 0 CA-C-O 122.705 1.169 . . . . 0.0 112.859 165.312 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 52' ' ' LYS . . . . . . . . . . . . . 60.6 tttm -152.97 140.36 19.62 Favored 'General case' 0 C--N 1.331 -0.232 0 N-CA-C 105.543 -2.021 . . . . 0.0 105.543 164.538 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 53' ' ' LEU . . . . . . . . . . . . . 15.2 tp -142.37 133.23 25.65 Favored 'General case' 0 CA--C 1.52 -0.173 0 C-N-CA 123.968 0.907 . . . . 0.0 108.745 179.09 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER -149.52 -38.62 0.15 Allowed 'General case' 0 CA--C 1.541 0.616 0 C-N-CA 125.54 1.536 . . . . 0.0 110.144 177.489 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 55' ' ' ASN . . . . . . . . . . . . . 2.6 t30 -124.38 7.0 8.36 Favored 'General case' 0 N--CA 1.471 0.583 0 N-CA-C 115.49 1.663 . . . . 0.0 115.49 -157.115 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 56' ' ' GLY . . . . . . . . . . . . . . . 90.22 13.16 60.67 Favored Glycine 0 N--CA 1.468 0.769 0 O-C-N 121.185 -0.947 . . . . 0.0 112.148 -166.013 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 57' ' ' GLU . . . . . . . . . . . . . 42.3 tt0 -130.16 144.4 51.34 Favored 'General case' 0 N--CA 1.446 -0.663 0 C-N-CA 124.652 1.181 . . . . 0.0 109.036 179.326 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 58' ' ' LEU . . . . . . . . . . . . . 5.1 tp -127.99 159.11 36.02 Favored 'General case' 0 N--CA 1.447 -0.618 0 C-N-CA 126.376 1.87 . . . . 0.0 108.788 178.878 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 59' ' ' THR . . . . . . . . . . . . . 0.7 OUTLIER -141.61 174.98 10.05 Favored 'General case' 0 C--N 1.321 -0.649 0 C-N-CA 125.936 1.695 . . . . 0.0 106.988 171.201 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 60' ' ' ALA . . . . . . . . . . . . . . . -134.39 99.91 4.51 Favored 'General case' 0 CA--C 1.516 -0.337 0 N-CA-C 108.043 -1.095 . . . . 0.0 108.043 160.085 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 61' ' ' LYS . . . . . 0.409 ' HE2' ' N ' ' A' ' 62' ' ' GLY . 0.2 OUTLIER -55.74 123.19 13.32 Favored 'General case' 0 C--O 1.234 0.27 0 N-CA-C 107.06 -1.459 . . . . 0.0 107.06 172.017 . . . . . . . . 3 3 . 1 . 003 nuclear orig core ' A' A ' 62' ' ' GLY . . . . . 0.409 ' N ' ' HE2' ' A' ' 61' ' ' LYS . . . 96.23 -59.67 1.37 Allowed Glycine 0 CA--C 1.525 0.664 0 C-N-CA 124.981 1.276 . . . . 0.0 111.586 166.109 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 63' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER 47.07 90.69 0.02 OUTLIER 'General case' 0 CA--C 1.537 0.447 0 C-N-CA 129.187 2.995 . . . . 0.0 114.425 -178.003 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 64' ' ' ALA . . . . . . . . . . . . . . . -88.48 104.53 16.89 Favored 'General case' 0 C--O 1.237 0.411 0 C-N-CA 124.126 0.97 . . . . 0.0 111.026 -178.462 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 65' ' ' MET . . . . . . . . . . . . . 54.8 mtp -97.48 176.47 5.85 Favored 'General case' 0 N--CA 1.471 0.599 0 C-N-CA 123.622 0.769 . . . . 0.0 110.188 172.487 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 66' ' ' THR . . . . . . . . . . . . 0.348 1.5 p -113.77 -164.92 0.96 Allowed 'General case' 0 CA--C 1.556 1.193 0 C-N-CA 124.101 0.96 . . . . 0.0 110.171 178.214 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 67' ' ' ARG . . . . . . . . . . . . . 16.2 mtt180 -136.52 30.94 2.86 Favored 'General case' 0 N--CA 1.489 1.476 0 CA-C-N 120.816 1.644 . . . . 0.0 114.429 -170.808 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 68' ' ' MET . . . . . . . . . . . . . 44.1 mtm -77.81 176.71 8.8 Favored 'General case' 0 CA--C 1.537 0.471 0 O-C-N 120.265 -1.522 . . . . 0.0 111.206 176.646 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 69' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -86.01 170.17 12.52 Favored 'General case' 0 C--O 1.243 0.758 0 C-N-CA 128.693 2.797 . . . . 0.0 108.479 165.842 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 70' ' ' CYS . . . . . 1.288 ' SG ' ' SG ' ' A' ' 44' ' ' CYS . 0.1 OUTLIER -110.02 -177.86 3.37 Favored 'General case' 0 N--CA 1.454 -0.267 0 C-N-CA 125.847 1.659 . . . . 0.0 112.83 -177.869 . . . . . . . . 3 3 . 1 . 003 nuclear orig core ' A' A ' 71' ' ' ALA . . . . . . . . . . . . . . . -104.24 -12.45 16.65 Favored 'General case' 0 N--CA 1.466 0.328 0 N-CA-C 112.163 0.431 . . . . 0.0 112.163 165.5 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 72' ' ' ASN . . . . . . . . . . . . . 52.7 t30 -156.07 143.12 13.64 Favored Pre-proline 0 N--CA 1.466 0.357 0 N-CA-C 107.503 -1.295 . . . . 0.0 107.503 -174.353 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 73' ' ' PRO . . . . . . . . . . . . . 38.9 Cg_endo -75.67 -33.52 3.9 Favored 'Trans proline' 0 C--N 1.345 0.342 0 C-N-CA 121.736 1.624 . . . . 0.0 111.447 -167.627 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 74' ' ' GLN . . . . . . . . . . . . . 20.7 tt0 -57.92 -32.91 68.23 Favored 'General case' 0 CA--C 1.535 0.377 0 C-N-CA 124.638 1.175 . . . . 0.0 112.065 177.952 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 75' ' ' LEU . . . . . 0.472 ' HB2' ' SG ' ' A' ' 70' ' ' CYS . 82.3 mt -70.03 -43.34 71.5 Favored 'General case' 0 N--CA 1.465 0.301 0 O-C-N 121.83 -0.544 . . . . 0.0 110.129 172.648 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 76' ' ' ASN . . . . . . . . . . . . . 3.3 t-20 -68.24 -8.02 35.59 Favored 'General case' 0 CA--C 1.532 0.278 0 C-N-CA 125.681 1.592 . . . . 0.0 112.017 -178.913 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 77' ' ' GLU . . . . . . . . . . . . . 32.8 tt0 -102.46 -48.13 4.25 Favored 'General case' 0 N--CA 1.45 -0.459 0 C-N-CA 127.227 2.211 . . . . 0.0 109.295 178.39 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 78' ' ' LEU . . . . . . . . . . . . . 0.9 OUTLIER -58.02 -25.04 60.61 Favored 'General case' 0 N--CA 1.468 0.443 0 C-N-CA 124.083 0.953 . . . . 0.0 112.762 171.095 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 79' ' ' ASP . . . . . . . . . . . . . 13.4 t70 -46.0 -54.98 7.47 Favored 'General case' 0 N--CA 1.443 -0.777 0 C-N-CA 126.464 1.906 . . . . 0.0 111.236 166.952 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 80' ' ' ASN . . . . . . . . . . . . . 76.8 m-20 -78.77 -34.44 45.62 Favored 'General case' 0 N--CA 1.453 -0.312 0 CA-C-O 118.743 -0.646 . . . . 0.0 109.499 -174.093 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 81' ' ' THR . . . . . . . . . . . . . 13.7 m -49.72 -59.32 3.92 Favored 'General case' 0 CA--C 1.535 0.391 0 C-N-CA 123.898 0.879 . . . . 0.0 110.334 171.088 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 82' ' ' ILE . . . . . . . . . . . . . 7.8 tp -63.49 -35.79 73.82 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.393 0 CA-C-N 119.608 1.095 . . . . 0.0 110.667 -174.291 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 83' ' ' SER . . . . . . . . . . . . . 0.5 OUTLIER -66.78 -12.56 59.29 Favored 'General case' 0 C--O 1.234 0.277 0 C-N-CA 127.345 2.258 . . . . 0.0 113.939 179.128 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 84' ' ' GLU . . . . . . . . . . . . . 89.3 tt0 -114.79 -22.47 9.65 Favored 'General case' 0 C--N 1.324 -0.512 0 C-N-CA 124.888 1.275 . . . . 0.0 111.351 179.902 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 85' ' ' MET . . . . . . . . . . . . . 87.9 mtp -73.04 -55.17 6.88 Favored 'General case' 0 C--O 1.23 0.056 0 CA-C-O 122.682 1.23 . . . . 0.0 108.81 178.375 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 86' ' ' LEU . . . . . . . . . . . . . 1.4 mm? -73.92 -17.56 61.01 Favored 'General case' 0 N--CA 1.454 -0.233 0 C-N-CA 124.979 1.312 . . . . 0.0 111.654 -167.791 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 87' ' ' LYS . . . . . . . . . . . . . 25.1 tttt -72.14 -48.79 41.02 Favored 'General case' 0 N--CA 1.447 -0.603 0 C-N-CA 124.201 1.0 . . . . 0.0 109.156 177.667 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 88' ' ' GLU . . . . . . . . . . . . . 1.9 mm-40 -69.84 -62.9 1.2 Allowed 'General case' 0 N--CA 1.448 -0.548 0 O-C-N 124.254 0.971 . . . . 0.0 108.426 -178.806 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 89' ' ' GLY . . . . . . . . . . . . . . . 144.72 110.27 0.69 Allowed Glycine 0 C--N 1.336 0.557 0 N-CA-C 109.179 -1.568 . . . . 0.0 109.179 -176.276 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 90' ' ' ALA . . . . . . . . . . . . . . . -91.45 142.99 27.08 Favored 'General case' 0 C--N 1.333 -0.119 0 C-N-CA 124.061 0.945 . . . . 0.0 109.06 -178.807 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 91' ' ' GLN . . . . . . . . . . . . . 6.8 mm-40 -74.49 142.33 44.85 Favored 'General case' 0 N--CA 1.443 -0.824 0 N-CA-C 105.752 -1.944 . . . . 0.0 105.752 161.098 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 92' ' ' VAL . . . . . . . . . . . . . 26.6 t -137.45 107.71 5.17 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.491 0 N-CA-C 105.068 -2.197 . . . . 0.0 105.068 -170.761 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 93' ' ' ASP . . . . . . . . . . . . . 2.1 t0 -127.19 97.61 4.99 Favored 'General case' 0 N--CA 1.448 -0.527 0 N-CA-C 108.085 -1.08 . . . . 0.0 108.085 -157.148 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 94' ' ' LEU . . . . . . . . . . . . . 55.9 tp -98.24 104.15 16.16 Favored 'General case' 0 CA--C 1.511 -0.535 0 CA-C-O 122.046 0.927 . . . . 0.0 109.247 -175.045 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 95' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -65.67 174.19 2.43 Favored 'General case' 0 C--N 1.319 -0.726 0 CA-C-N 113.633 -1.621 . . . . 0.0 109.569 167.605 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 96' ' ' ALA . . . . . . . . . . . . . . . -48.51 -33.24 9.18 Favored 'General case' 0 CA--C 1.539 0.55 0 O-C-N 120.826 -1.172 . . . . 0.0 113.856 -172.565 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 97' ' ' ASN . . . . . . . . . . . . . 23.8 p30 -151.41 17.94 0.73 Allowed 'General case' 0 CA--C 1.539 0.526 0 C-N-CA 125.145 1.378 . . . . 0.0 113.559 172.324 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 98' ' ' GLN . . . . . . . . . . . . . 21.5 tt0 -137.32 121.04 17.39 Favored 'General case' 0 N--CA 1.461 0.119 0 O-C-N 120.821 -1.174 . . . . 0.0 110.654 177.323 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 99' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -69.19 140.86 54.62 Favored 'General case' 0 N--CA 1.451 -0.408 0 C-N-CA 126.019 1.728 . . . . 0.0 109.183 169.479 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 100' ' ' THR . . . . . . . . . . . . . 2.5 m -133.65 130.65 38.55 Favored 'General case' 0 C--N 1.323 -0.567 0 N-CA-C 106.795 -1.558 . . . . 0.0 106.795 167.789 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 101' ' ' LEU . . . . . . . . . . . . . 2.6 mp -108.97 158.67 17.48 Favored 'General case' 0 CA--C 1.509 -0.609 0 C-N-CA 125.209 1.404 . . . . 0.0 110.458 174.856 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 102' ' ' ALA . . . . . . . . . . . . . . . -152.18 158.56 43.07 Favored 'General case' 0 C--N 1.327 -0.385 0 C-N-CA 124.559 1.144 . . . . 0.0 108.228 164.558 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 103' ' ' THR . . . . . . . . . . . . . 1.3 m -157.24 -172.08 3.87 Favored 'General case' 0 N--CA 1.441 -0.916 0 C-N-CA 127.484 2.314 . . . . 0.0 105.659 167.141 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 104' ' ' ALA . . . . . . . . . . . . . . . -62.3 -35.48 79.17 Favored 'General case' 0 C--N 1.34 0.196 0 CA-C-N 119.918 1.235 . . . . 0.0 111.536 168.623 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 105' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -59.74 -79.83 0.03 OUTLIER 'General case' 0 C--N 1.339 0.123 0 C-N-CA 123.59 0.756 . . . . 0.0 110.712 -178.03 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 106' ' ' GLN . . . . . . . . . . . . . 26.0 mt-30 -151.53 -176.88 5.78 Favored 'General case' 0 CA--C 1.536 0.424 0 C-N-CA 125.89 1.676 . . . . 0.0 107.301 -169.672 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 107' ' ' THR . . . . . . . . . . . . . 0.1 OUTLIER -138.56 134.47 33.9 Favored 'General case' 0 N--CA 1.453 -0.314 0 C-N-CA 125.943 1.697 . . . . 0.0 106.571 -177.222 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 108' ' ' LEU . . . . . . . . . . . . . 1.5 mm? -125.75 158.48 34.81 Favored 'General case' 0 C--O 1.233 0.197 0 C-N-CA 124.345 1.058 . . . . 0.0 108.401 179.413 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 109' ' ' THR . . . . . . . . . . . . . 27.8 m -122.63 137.52 54.88 Favored 'General case' 0 C--O 1.236 0.356 0 N-CA-C 107.797 -1.186 . . . . 0.0 107.797 177.086 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 110' ' ' TYR . . . . . . . . . . . . . 4.4 m-85 -135.92 145.19 46.0 Favored 'General case' 0 CA--C 1.535 0.395 0 C-N-CA 124.107 0.963 . . . . 0.0 111.761 -178.815 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 111' ' ' LYS . . . . . . . . . . . . . 4.1 tppt? -90.23 150.78 21.82 Favored 'General case' 0 N--CA 1.474 0.764 0 O-C-N 120.82 -1.175 . . . . 0.0 110.806 -179.367 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 112' ' ' LEU . . . . . . . . . . . . . 35.7 tp -74.6 46.47 0.28 Allowed 'General case' 0 CA--C 1.541 0.626 0 C-N-CA 124.792 1.237 . . . . 0.0 109.881 158.653 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 113' ' ' ALA . . . . . . . . . . . . . . . -84.02 102.34 12.42 Favored 'General case' 0 N--CA 1.444 -0.775 0 N-CA-C 104.383 -2.451 . . . . 0.0 104.383 162.147 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 114' ' ' ASP . . . . . . . . . . . . . 57.2 t0 . . . . . 0 CA--C 1.516 -0.331 0 CA-C-O 122.287 1.041 . . . . 0.0 109.495 170.278 . . . . . . . . 0 0 . 1 . 004 nuclear orig core ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 10.0 tpt . . . . . 0 C--O 1.235 0.326 0 N-CA-C 107.325 -1.361 . . . . 0.0 107.325 . . . . . . . . . 0 0 . 1 . 004 nuclear orig core ' A' A ' 2' ' ' VAL . . . . . . . . . . . . . 2.3 p -59.87 144.56 12.7 Favored 'Isoleucine or valine' 0 C--O 1.234 0.243 0 N-CA-C 108.399 -0.963 . . . . 0.0 108.399 170.227 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 3' ' ' THR . . . . . . . . . . . . . 0.6 OUTLIER -110.42 153.83 43.27 Favored Pre-proline 0 N--CA 1.445 -0.723 0 C-N-CA 123.163 0.585 . . . . 0.0 110.756 172.521 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 4' ' ' PRO . . . . . . . . . . . . . 52.7 Cg_endo -64.95 -33.73 50.66 Favored 'Trans proline' 0 N--CA 1.461 -0.386 0 C-N-CA 123.825 3.017 . . . . 0.0 111.91 -179.263 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 5' ' ' GLU . . . . . . . . . . . . . 65.3 tt0 -49.77 -35.32 22.08 Favored 'General case' 0 CA--C 1.549 0.928 0 C-N-CA 124.216 1.006 . . . . 0.0 111.647 169.759 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 6' ' ' GLN . . . . . . . . . . . . . 11.3 mt-30 -72.46 5.62 2.87 Favored 'General case' 0 CA--C 1.539 0.543 0 O-C-N 120.955 -1.091 . . . . 0.0 112.886 176.08 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 7' ' ' LEU . . . . . . . . . . . . . 93.6 mt -131.52 -54.91 1.02 Allowed 'General case' 0 C--O 1.225 -0.229 0 C-N-CA 125.533 1.533 . . . . 0.0 110.368 -171.615 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 8' ' ' GLN . . . . . . . . . . . . . 4.9 mt-30 -55.41 -6.72 0.19 Allowed 'General case' 0 N--CA 1.479 0.992 0 C-N-CA 127.686 2.394 . . . . 0.0 115.736 -172.815 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 9' ' ' HIS . . . . . . . . . . . . . 76.1 m-70 -139.38 30.31 2.16 Favored 'General case' 0 CA--C 1.54 0.558 0 C-N-CA 125.428 1.491 . . . . 0.0 111.491 178.394 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 10' ' ' HIS . . . . . . . . . . . . . 94.4 m-70 -140.87 142.18 34.55 Favored 'General case' 0 CA--C 1.534 0.344 0 C-N-CA 124.636 1.174 . . . . 0.0 110.917 176.891 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 11' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -88.5 149.03 23.85 Favored 'General case' 0 N--CA 1.463 0.19 0 C-N-CA 124.452 1.101 . . . . 0.0 108.824 167.669 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 12' ' ' PHE . . . . . . . . . . . . . 82.9 m-85 -139.91 154.57 47.27 Favored 'General case' 0 CA--C 1.494 -1.176 0 CA-C-O 122.525 1.155 . . . . 0.0 108.841 169.712 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 13' ' ' VAL . . . . . 0.426 ' HA ' ' HA ' ' A' ' 30' ' ' GLU . 0.0 OUTLIER -127.84 139.46 51.84 Favored 'Isoleucine or valine' 0 N--CA 1.434 -1.242 0 CA-C-N 113.983 -1.462 . . . . 0.0 107.059 -174.103 . . . . . . . . 3 3 . 1 . 004 nuclear orig core ' A' A ' 14' ' ' LEU . . . . . . . . . . . . . 19.1 tp -73.11 97.52 2.39 Favored 'General case' 0 N--CA 1.453 -0.321 0 N-CA-C 106.97 -1.493 . . . . 0.0 106.97 174.463 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 2.9 mm-40 -64.04 -54.88 27.28 Favored 'General case' 0 N--CA 1.451 -0.415 0 N-CA-C 108.434 -0.95 . . . . 0.0 108.434 176.962 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 10.1 m -156.14 153.24 28.99 Favored 'General case' 0 N--CA 1.451 -0.425 0 CA-C-O 121.927 0.87 . . . . 0.0 110.85 -174.011 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 17' ' ' VAL . . . . . . . . . . . . . 1.9 t -111.03 169.24 4.04 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.317 0 C-N-CA 126.097 1.759 . . . . 0.0 107.108 -171.832 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 18' ' ' ASN . . . . . . . . . . . . . 1.7 p-10 -57.32 -2.38 0.11 Allowed 'General case' 0 CA--C 1.54 0.578 0 N-CA-C 116.494 2.035 . . . . 0.0 116.494 179.949 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . -146.67 -2.64 0.55 Allowed Glycine 0 CA--C 1.527 0.793 0 CA-C-N 120.496 1.498 . . . . 0.0 115.8 -178.312 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 10.9 pttm 179.67 162.24 0.81 Allowed Pre-proline 0 N--CA 1.469 0.495 0 CA-C-N 119.952 1.876 . . . . 0.0 109.71 175.245 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 21' ' ' PRO . . . . . . . . . . . . . 55.3 Cg_endo -67.94 179.48 2.74 Favored 'Trans proline' 0 N--CA 1.459 -0.541 0 C-N-CA 123.753 2.969 . . . . 0.0 110.775 170.551 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 22' ' ' VAL . . . . . . . . . . . . . 90.1 t -110.15 153.5 11.91 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.384 0 N-CA-C 109.804 -0.443 . . . . 0.0 109.804 169.638 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 23' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -129.89 105.08 7.76 Favored 'General case' 0 CA--C 1.534 0.345 0 C-N-CA 126.548 1.939 . . . . 0.0 107.515 174.424 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 24' ' ' SER . . . . . . . . . . . . . 10.3 t -163.36 94.01 0.79 Allowed 'General case' 0 C--O 1.234 0.244 0 N-CA-C 108.55 -0.907 . . . . 0.0 108.55 168.633 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 25' ' ' ASP . . . . . . . . . . . . . 11.5 m-20 -79.24 -6.31 56.35 Favored 'General case' 0 CA--C 1.535 0.377 0 O-C-N 121.793 -0.567 . . . . 0.0 111.149 -172.748 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 26' ' ' LYS . . . . . . . . . . . . . 13.6 tttp -116.69 -32.88 5.02 Favored 'General case' 0 N--CA 1.471 0.59 0 CA-C-N 119.621 1.1 . . . . 0.0 113.225 -179.091 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 27' ' ' ASN . . . . . . . . . . . . . 1.4 p30 -138.3 77.41 35.68 Favored Pre-proline 0 C--N 1.323 -0.546 0 C-N-CA 123.848 0.859 . . . . 0.0 109.944 175.157 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 28' ' ' PRO . . . . . . . . . . . . . 70.6 Cg_endo -64.3 155.56 64.86 Favored 'Trans proline' 0 N--CA 1.455 -0.791 0 C-N-CA 121.689 1.592 . . . . 0.0 110.052 174.176 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 29' ' ' PRO . . . . . . . . . . . . . 18.1 Cg_endo -69.24 74.92 1.02 Allowed 'Trans proline' 0 N--CA 1.453 -0.883 0 C-N-CA 123.008 2.472 . . . . 0.0 108.505 159.606 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 30' ' ' GLU . . . . . 0.426 ' HA ' ' HA ' ' A' ' 13' ' ' VAL . 0.1 OUTLIER -87.86 163.98 16.12 Favored 'General case' 0 N--CA 1.446 -0.669 0 N-CA-C 108.391 -0.966 . . . . 0.0 108.391 168.445 . . . . . . . . 3 3 . 1 . 004 nuclear orig core ' A' A ' 31' ' ' ILE . . . . . . . . . . . . . 19.1 tt -130.69 142.4 43.76 Favored 'Isoleucine or valine' 0 N--CA 1.437 -1.082 0 C-N-CA 126.79 2.036 . . . . 0.0 105.534 172.658 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 32' ' ' SER . . . . . . . . . . . . . 19.9 m -138.65 163.91 30.87 Favored 'General case' 0 N--CA 1.443 -0.815 0 N-CA-C 106.294 -1.743 . . . . 0.0 106.294 171.347 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 33' ' ' PHE . . . . . . . . . . . . . 96.6 m-85 -144.64 143.28 30.68 Favored 'General case' 0 N--CA 1.439 -0.998 0 N-CA-C 106.043 -1.836 . . . . 0.0 106.043 -167.421 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 34' ' ' GLY . . . . . . . . . . . . . . . -166.39 152.22 21.11 Favored Glycine 0 CA--C 1.518 0.263 0 N-CA-C 109.746 -1.342 . . . . 0.0 109.746 160.958 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 35' ' ' GLU . . . . . . . . . . . . . 3.0 pt-20 44.94 145.93 0.0 OUTLIER 'General case' 0 C--O 1.219 -0.508 1 C-N-CA 134.756 5.222 . . . . 0.0 113.556 -171.864 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 52.8 mtpt 51.19 17.38 0.47 Allowed 'General case' 0 N--CA 1.475 0.818 0 O-C-N 120.002 -1.687 . . . . 0.0 114.852 170.387 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 37' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER 62.57 26.74 15.87 Favored 'General case' 0 CA--C 1.544 0.731 0 CA-C-N 120.432 1.469 . . . . 0.0 113.515 -167.837 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 38' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -63.01 158.75 18.63 Favored 'General case' 0 C--N 1.34 0.185 0 O-C-N 119.702 -1.873 . . . . 0.0 110.326 173.589 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 39' ' ' ILE . . . . . . . . . . . . . 37.8 mt -134.2 129.3 53.48 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.493 0 N-CA-C 107.261 -1.385 . . . . 0.0 107.261 -167.32 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 40' ' ' SER . . . . . . . . . . . . . 22.5 m -131.32 114.07 14.56 Favored 'General case' 0 N--CA 1.454 -0.251 0 C-N-CA 124.86 1.264 . . . . 0.0 107.928 176.181 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 41' ' ' GLY . . . . . . . . . . . . . . . -154.09 178.94 30.68 Favored Glycine 0 CA--C 1.523 0.576 0 N-CA-C 110.311 -1.116 . . . . 0.0 110.311 -179.226 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 42' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -161.47 92.86 0.91 Allowed 'General case' 0 N--CA 1.451 -0.376 0 O-C-N 121.302 -1.117 . . . . 0.0 108.961 -176.19 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 43' ' ' MET . . . . . . . . . . . . . 34.1 mmm -69.89 -53.0 19.97 Favored 'General case' 0 C--O 1.224 -0.238 0 N-CA-C 108.649 -0.871 . . . . 0.0 108.649 174.92 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 44' ' ' CYS . . . . . 1.287 ' SG ' ' SG ' ' A' ' 70' ' ' CYS . 11.6 t -152.79 -61.74 0.15 Allowed 'General case' 0 CA--C 1.517 -0.304 0 N-CA-C 107.959 -1.126 . . . . 0.0 107.959 176.336 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 45' ' ' ASN . . . . . . . . . . . . . 13.7 m120 -75.25 14.02 0.63 Allowed 'General case' 0 CA--C 1.536 0.41 0 C-N-CA 125.213 1.405 . . . . 0.0 113.109 -174.242 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 46' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER 53.35 169.15 0.02 OUTLIER 'General case' 0 N--CA 1.468 0.454 0 C-N-CA 127.278 2.231 . . . . 0.0 112.073 -157.675 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 47' ' ' PHE . . . . . . . . . . . . . 33.8 p90 -161.81 172.97 15.25 Favored 'General case' 0 C--O 1.24 0.579 0 C-N-CA 124.357 1.063 . . . . 0.0 110.922 164.162 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 48' ' ' SER . . . . . . . . . . . . . 1.7 p -179.89 150.07 0.37 Allowed 'General case' 0 N--CA 1.444 -0.733 0 C-N-CA 126.871 2.068 . . . . 0.0 109.086 178.142 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 49' ' ' GLY . . . . . . . . . . . . . . . 179.71 166.02 34.67 Favored Glycine 0 CA--C 1.525 0.697 0 N-CA-C 110.446 -1.062 . . . . 0.0 110.446 172.486 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 50' ' ' GLU . . . . . . . . . . . . . 19.2 mt-10 -80.17 97.26 6.83 Favored 'General case' 0 C--N 1.332 -0.18 0 C-N-CA 123.967 0.907 . . . . 0.0 108.97 176.451 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 51' ' ' GLY . . . . . . . . . . . . . . . -63.15 177.71 6.71 Favored Glycine 0 CA--C 1.53 0.983 0 C-N-CA 123.976 0.798 . . . . 0.0 112.263 163.689 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 52' ' ' LYS . . . . . . . . . . . . . 78.6 tttt -156.16 159.75 39.28 Favored 'General case' 0 CA--C 1.536 0.413 0 C-N-CA 125.026 1.33 . . . . 0.0 107.949 166.028 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 53' ' ' LEU . . . . . . . . . . . . . 18.6 tp -156.51 90.15 1.15 Allowed 'General case' 0 N--CA 1.466 0.337 0 C-N-CA 124.681 1.193 . . . . 0.0 109.127 175.306 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 16.3 t -139.53 35.46 2.03 Favored 'General case' 0 CA--C 1.534 0.363 0 C-N-CA 124.449 1.1 . . . . 0.0 108.726 -178.119 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 55' ' ' ASN . . . . . . . . . . . . . 3.7 p30 -165.11 -80.5 0.03 OUTLIER 'General case' 0 N--CA 1.452 -0.347 0 C-N-CA 127.597 2.359 . . . . 0.0 105.676 -167.549 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 56' ' ' GLY . . . . . . . . . . . . . . . 163.11 15.66 0.03 OUTLIER Glycine 0 CA--C 1.534 1.224 0 C-N-CA 128.966 3.174 . . . . 0.0 109.686 -173.124 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 57' ' ' GLU . . . . . . . . . . . . . 51.1 tt0 -135.33 131.57 36.58 Favored 'General case' 0 C--N 1.343 0.293 0 N-CA-C 108.026 -1.101 . . . . 0.0 108.026 -166.869 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 58' ' ' LEU . . . . . . . . . . . . . 65.5 tp -111.35 90.31 3.3 Favored 'General case' 0 CA--C 1.533 0.307 0 C-N-CA 126.692 1.997 . . . . 0.0 108.929 -177.102 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 59' ' ' THR . . . . . . . . . . . . . 17.7 p -95.37 131.36 41.58 Favored 'General case' 0 C--O 1.236 0.387 0 C-N-CA 124.29 1.036 . . . . 0.0 108.59 171.244 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 60' ' ' ALA . . . . . . . . . . . . . . . -76.87 137.34 39.1 Favored 'General case' 0 N--CA 1.454 -0.252 0 N-CA-C 108.742 -0.836 . . . . 0.0 108.742 167.27 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 61' ' ' LYS . . . . . . . . . . . . . 72.9 tttt -66.59 -22.86 66.13 Favored 'General case' 0 C--N 1.329 -0.304 0 O-C-N 121.913 -0.492 . . . . 0.0 112.003 172.622 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 62' ' ' GLY . . . . . . . . . . . . . . . 168.93 111.89 0.25 Allowed Glycine 0 C--N 1.332 0.316 0 N-CA-C 107.989 -2.044 . . . . 0.0 107.989 -178.523 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 63' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -77.75 112.81 14.98 Favored 'General case' 0 N--CA 1.454 -0.239 0 N-CA-C 107.621 -1.251 . . . . 0.0 107.621 175.735 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 64' ' ' ALA . . . . . . . . . . . . . . . -90.31 90.77 8.21 Favored 'General case' 0 C--N 1.326 -0.456 0 C-N-CA 124.802 1.241 . . . . 0.0 111.25 168.408 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 65' ' ' MET . . . . . . . . . . . . . 51.7 mtp -94.58 -179.73 4.98 Favored 'General case' 0 CA--C 1.539 0.54 0 O-C-N 120.842 -1.161 . . . . 0.0 109.314 179.513 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 66' ' ' THR . . . . . . . . . . . . . 16.9 p -121.32 -164.51 1.14 Allowed 'General case' 0 CA--C 1.54 0.571 0 O-C-N 120.973 -1.08 . . . . 0.0 109.683 -172.211 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 67' ' ' ARG . . . . . . . . . . . . . 10.9 mmm180 -128.13 51.2 1.99 Allowed 'General case' 0 CA--C 1.542 0.645 0 C-N-CA 125.929 1.692 . . . . 0.0 109.732 -176.049 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 68' ' ' MET . . . . . . . . . . . . . 19.6 ptp -113.17 -176.44 2.9 Favored 'General case' 0 CA--C 1.54 0.563 0 C-N-CA 127.451 2.3 . . . . 0.0 111.292 -179.889 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 69' ' ' MET . . . . . . . . . . . . . 0.4 OUTLIER -140.9 175.67 9.43 Favored 'General case' 0 C--O 1.235 0.308 0 C-N-CA 126.717 2.007 . . . . 0.0 108.905 -178.942 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 70' ' ' CYS . . . . . 1.287 ' SG ' ' SG ' ' A' ' 44' ' ' CYS . 1.1 p -140.33 152.97 46.26 Favored 'General case' 0 C--N 1.33 -0.254 0 C-N-CA 126.544 1.938 . . . . 0.0 109.633 -168.179 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 71' ' ' ALA . . . . . . . . . . . . . . . -79.44 6.63 9.74 Favored 'General case' 0 CA--C 1.534 0.329 0 C-N-CA 124.747 1.219 . . . . 0.0 113.963 -178.202 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 72' ' ' ASN . . . . . . . . . . . . . 24.8 t30 -135.79 143.34 44.19 Favored Pre-proline 0 C--O 1.233 0.192 0 CA-C-N 119.885 1.221 . . . . 0.0 108.023 172.427 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 73' ' ' PRO . . . . . . . . . . . . . 36.7 Cg_endo -75.56 -34.94 3.03 Favored 'Trans proline' 0 N--CA 1.463 -0.314 0 C-N-CA 122.103 1.869 . . . . 0.0 113.071 -169.888 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 74' ' ' GLN . . . . . . . . . . . . . 34.8 tt0 -60.35 -37.34 80.39 Favored 'General case' 0 CA--C 1.537 0.475 0 C-N-CA 123.746 0.818 . . . . 0.0 110.61 175.788 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 75' ' ' LEU . . . . . . . . . . . . . 91.1 mt -59.09 -41.24 87.58 Favored 'General case' 0 N--CA 1.467 0.384 0 CA-C-N 119.421 1.01 . . . . 0.0 109.407 176.461 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 76' ' ' ASN . . . . . . . . . . . . . 0.6 OUTLIER -68.1 -22.11 64.92 Favored 'General case' 0 N--CA 1.466 0.366 0 C-N-CA 124.204 1.002 . . . . 0.0 111.683 -179.661 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 77' ' ' GLU . . . . . . . . . . . . . 1.6 mt-10 -80.36 -41.39 24.82 Favored 'General case' 0 CA--C 1.53 0.187 0 C-N-CA 123.704 0.802 . . . . 0.0 110.51 173.001 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 78' ' ' LEU . . . . . . . . . . . . . 27.5 mt -62.76 -13.01 27.92 Favored 'General case' 0 N--CA 1.464 0.258 0 C-N-CA 124.839 1.256 . . . . 0.0 113.204 -174.098 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 79' ' ' ASP . . . . . . . . . . . . . 4.6 t70 -44.59 -58.58 2.93 Favored 'General case' 0 C--O 1.232 0.135 0 C-N-CA 125.309 1.444 . . . . 0.0 111.18 162.653 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 80' ' ' ASN . . . . . . . . . . . . . 0.7 OUTLIER -68.7 -37.44 79.54 Favored 'General case' 0 CA--C 1.516 -0.36 0 C-N-CA 120.394 -0.522 . . . . 0.0 109.882 -175.469 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 81' ' ' THR . . . . . . . . . . . . . 7.1 m -58.5 -52.97 63.41 Favored 'General case' 0 N--CA 1.447 -0.625 0 N-CA-C 108.689 -0.856 . . . . 0.0 108.689 -175.958 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 82' ' ' ILE . . . . . . . . . . . . . 11.1 tp -68.85 -39.48 80.05 Favored 'Isoleucine or valine' 0 N--CA 1.456 -0.128 0 CA-C-N 119.107 0.867 . . . . 0.0 111.062 -177.319 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 83' ' ' SER . . . . . . . . . . . . . 5.4 t -60.42 -53.02 62.61 Favored 'General case' 0 N--CA 1.451 -0.378 0 N-CA-C 108.915 -0.772 . . . . 0.0 108.915 -175.138 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 84' ' ' GLU . . . . . . . . . . . . . 5.9 mm-40 -61.03 -44.79 96.87 Favored 'General case' 0 N--CA 1.446 -0.671 0 C-N-CA 124.835 1.254 . . . . 0.0 111.142 179.8 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 85' ' ' MET . . . . . . . . . . . . . 90.8 mtp -66.98 -17.51 64.95 Favored 'General case' 0 N--CA 1.451 -0.41 0 CA-C-N 118.023 0.374 . . . . 0.0 110.798 -175.269 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 86' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -105.79 -25.43 12.19 Favored 'General case' 0 N--CA 1.456 -0.137 0 C-N-CA 124.12 0.968 . . . . 0.0 111.754 -177.309 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 87' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -72.81 -55.38 6.79 Favored 'General case' 0 CA--C 1.518 -0.256 0 N-CA-C 108.466 -0.939 . . . . 0.0 108.466 172.456 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 88' ' ' GLU . . . . . . . . . . . . . 54.9 mt-10 -72.72 -28.13 62.47 Favored 'General case' 0 CA--C 1.53 0.184 0 C-N-CA 119.315 -0.954 . . . . 0.0 112.244 -170.788 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 89' ' ' GLY . . . . . . . . . . . . . . . 120.37 95.56 1.51 Allowed Glycine 0 C--N 1.338 0.681 0 C-N-CA 124.361 0.982 . . . . 0.0 110.685 173.996 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 90' ' ' ALA . . . . . . . . . . . . . . . -62.51 134.21 56.07 Favored 'General case' 0 N--CA 1.451 -0.392 0 CA-C-O 118.12 -0.943 . . . . 0.0 108.508 177.286 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 91' ' ' GLN . . . . . . . . . . . . . 11.6 mm-40 -73.87 140.94 46.05 Favored 'General case' 0 C--O 1.239 0.52 0 N-CA-C 104.801 -2.296 . . . . 0.0 104.801 154.998 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 92' ' ' VAL . . . . . . . . . . . . . 7.2 p -132.73 120.3 41.14 Favored 'Isoleucine or valine' 0 N--CA 1.448 -0.546 0 N-CA-C 105.522 -2.029 . . . . 0.0 105.522 -174.134 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 93' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -142.13 90.14 2.23 Favored 'General case' 0 C--N 1.332 -0.184 0 N-CA-C 107.284 -1.376 . . . . 0.0 107.284 -171.23 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 94' ' ' LEU . . . . . . . . . . . . . 1.1 tm? -97.79 110.36 22.94 Favored 'General case' 0 N--CA 1.464 0.252 0 N-CA-C 107.254 -1.387 . . . . 0.0 107.254 -179.29 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 95' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -76.91 -164.68 0.46 Allowed 'General case' 0 CA--C 1.542 0.669 0 C-N-CA 125.162 1.385 . . . . 0.0 109.278 175.313 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 96' ' ' ALA . . . . . . . . . . . . . . . -62.28 -7.25 4.0 Favored 'General case' 0 CA--C 1.541 0.624 0 O-C-N 119.864 -1.772 . . . . 0.0 115.266 -178.106 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 97' ' ' ASN . . . . . . . . . . . . . 2.0 p30 -173.9 4.49 0.01 OUTLIER 'General case' 0 N--CA 1.476 0.844 0 C-N-CA 125.904 1.681 . . . . 0.0 114.521 169.882 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 98' ' ' GLN . . . . . . . . . . . . . 8.6 tt0 -120.28 132.56 55.37 Favored 'General case' 0 N--CA 1.472 0.634 0 CA-C-N 121.011 1.732 . . . . 0.0 108.976 -178.877 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 99' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -98.91 116.25 30.72 Favored 'General case' 0 C--O 1.233 0.231 0 C-N-CA 124.529 1.132 . . . . 0.0 109.385 176.694 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 100' ' ' THR . . . . . . . . . . . . . 26.7 m -93.27 117.66 30.34 Favored 'General case' 0 C--N 1.322 -0.601 0 C-N-CA 125.386 1.474 . . . . 0.0 107.381 170.363 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 101' ' ' LEU . . . . . . . . . . . . . 3.2 mm? -111.19 120.32 41.9 Favored 'General case' 0 N--CA 1.464 0.239 0 N-CA-C 106.803 -1.554 . . . . 0.0 106.803 166.678 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 102' ' ' ALA . . . . . . . . . . . . . . . -123.82 145.9 48.74 Favored 'General case' 0 N--CA 1.467 0.378 0 C-N-CA 124.676 1.19 . . . . 0.0 109.37 169.375 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 103' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -150.99 174.51 13.06 Favored 'General case' 0 N--CA 1.448 -0.53 0 C-N-CA 125.063 1.345 . . . . 0.0 109.796 178.125 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 104' ' ' ALA . . . . . . . . . . . . . . . -51.34 -29.51 15.46 Favored 'General case' 0 CA--C 1.537 0.467 0 C-N-CA 124.948 1.299 . . . . 0.0 113.032 171.846 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 105' ' ' LYS . . . . . . . . . . . . . 3.7 mtpt -80.93 -73.67 0.36 Allowed 'General case' 0 C--N 1.342 0.258 0 O-C-N 121.343 -0.848 . . . . 0.0 110.721 173.95 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 106' ' ' GLN . . . . . . . . . . . . . 29.1 mt-30 -144.26 177.56 8.52 Favored 'General case' 0 C--N 1.329 -0.325 0 C-N-CA 124.103 0.961 . . . . 0.0 108.6 -156.692 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 107' ' ' THR . . . . . . . . . . . . . 1.0 OUTLIER -130.42 142.31 50.51 Favored 'General case' 0 CA--C 1.531 0.222 0 N-CA-C 108.132 -1.062 . . . . 0.0 108.132 170.332 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 108' ' ' LEU . . . . . . . . . . . . . 6.4 mp -126.61 161.89 27.0 Favored 'General case' 0 N--CA 1.447 -0.609 0 C-N-CA 127.657 2.383 . . . . 0.0 108.488 -179.357 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 109' ' ' THR . . . . . . . . . . . . . 1.3 m -131.51 110.06 10.71 Favored 'General case' 0 C--O 1.238 0.46 0 N-CA-C 108.07 -1.085 . . . . 0.0 108.07 174.732 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 110' ' ' TYR . . . . . . . . . . . . . 37.0 m-85 -98.15 163.98 12.51 Favored 'General case' 0 C--O 1.235 0.29 0 N-CA-C 109.143 -0.688 . . . . 0.0 109.143 174.093 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 111' ' ' LYS . . . . . . . . . . . . . 0.7 OUTLIER -131.05 137.61 49.23 Favored 'General case' 0 CA--C 1.521 -0.138 0 C-N-CA 125.371 1.468 . . . . 0.0 109.347 -173.898 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 112' ' ' LEU . . . . . . . . . . . . . 25.6 tp -67.84 62.84 0.08 Allowed 'General case' 0 CA--C 1.542 0.66 0 C-N-CA 128.309 2.644 . . . . 0.0 110.382 168.527 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 113' ' ' ALA . . . . . . . . . . . . . . . -88.46 79.75 7.58 Favored 'General case' 0 CA--C 1.528 0.134 0 N-CA-C 105.909 -1.886 . . . . 0.0 105.909 165.018 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 114' ' ' ASP . . . . . . . . . . . . . 23.4 t0 . . . . . 0 CA--C 1.538 0.489 0 C-N-CA 125.324 1.45 . . . . 0.0 112.163 -167.807 . . . . . . . . 0 0 . 1 . 005 nuclear orig core ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 22.5 ttm . . . . . 0 C--O 1.237 0.424 0 N-CA-C 109.086 -0.709 . . . . 0.0 109.086 . . . . . . . . . 0 0 . 1 . 005 nuclear orig core ' A' A ' 2' ' ' VAL . . . . . . . . . . . . . 11.3 p -67.47 146.21 13.24 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.419 0 N-CA-C 109.517 -0.549 . . . . 0.0 109.517 177.794 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 3' ' ' THR . . . . . . . . . . . . . 6.1 p -135.34 162.57 56.6 Favored Pre-proline 0 CA--C 1.53 0.205 0 O-C-N 121.99 -0.444 . . . . 0.0 110.989 -173.977 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 4' ' ' PRO . . . . . . . . . . . . . 6.2 Cg_endo -59.68 -51.0 6.76 Favored 'Trans proline' 0 N--CA 1.454 -0.814 0 C-N-CA 122.059 1.839 . . . . 0.0 112.886 175.141 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 5' ' ' GLU . . . . . . . . . . . . . 6.5 mt-10 -58.73 -28.51 65.92 Favored 'General case' 0 CA--C 1.534 0.363 0 N-CA-C 113.74 1.015 . . . . 0.0 113.74 -170.747 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 6' ' ' GLN . . . . . . . . . . . . . 17.5 pt20 -79.89 9.08 5.72 Favored 'General case' 0 CA--C 1.533 0.31 0 N-CA-C 113.622 0.971 . . . . 0.0 113.622 175.939 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 7' ' ' LEU . . . . . . . . . . . . . 78.5 mt -127.17 -50.06 1.43 Allowed 'General case' 0 CA--C 1.52 -0.188 0 CA-C-N 119.272 0.942 . . . . 0.0 109.971 -170.322 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 8' ' ' GLN . . . . . . . . . . . . . 2.2 mp0 -55.38 -17.04 4.2 Favored 'General case' 0 N--CA 1.47 0.538 0 N-CA-C 114.985 1.476 . . . . 0.0 114.985 -175.977 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 9' ' ' HIS . . . . . . . . . . . . . 5.8 m170 -124.65 8.11 8.24 Favored 'General case' 0 CA--C 1.54 0.582 0 C-N-CA 124.234 1.014 . . . . 0.0 110.849 -172.582 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 10' ' ' HIS . . . . . . . . . . . . . 73.7 m-70 -131.75 108.68 9.63 Favored 'General case' 0 CA--C 1.533 0.299 0 C-N-CA 125.465 1.506 . . . . 0.0 109.454 -168.564 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 11' ' ' ARG . . . . . . . . . . . . . 1.5 ttt85 -65.61 154.37 38.95 Favored 'General case' 0 N--CA 1.465 0.276 0 C-N-CA 123.156 0.582 . . . . 0.0 110.674 176.676 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 12' ' ' PHE . . . . . . . . . . . . . 59.4 m-85 -131.87 158.0 42.5 Favored 'General case' 0 N--CA 1.447 -0.594 0 C-N-CA 124.47 1.108 . . . . 0.0 109.731 167.882 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 13' ' ' VAL . . . . . 0.408 ' HA ' ' HA ' ' A' ' 30' ' ' GLU . 7.6 p -129.44 136.52 59.14 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.373 0 N-CA-C 108.876 -0.787 . . . . 0.0 108.876 171.128 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 14' ' ' LEU . . . . . . . . . . . . . 20.2 tp -71.26 85.78 0.78 Allowed 'General case' 0 C--O 1.232 0.162 0 N-CA-C 106.784 -1.561 . . . . 0.0 106.784 176.654 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 15' ' ' GLU . . . . . 0.403 ' C ' ' HG ' ' A' ' 16' ' ' SER . 2.7 mm-40 -67.9 -47.26 69.3 Favored 'General case' 0 C--N 1.325 -0.48 0 C-N-CA 124.098 0.959 . . . . 0.0 109.277 179.059 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 16' ' ' SER . . . . . 0.403 ' HG ' ' C ' ' A' ' 15' ' ' GLU . 69.8 m -154.08 140.86 19.08 Favored 'General case' 0 N--CA 1.452 -0.35 0 O-C-N 121.139 -0.976 . . . . 0.0 112.184 -176.762 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 17' ' ' VAL . . . . . . . . . . . . . 85.8 t -98.98 171.12 1.31 Allowed 'Isoleucine or valine' 0 C--N 1.328 -0.328 0 C-N-CA 125.952 1.701 . . . . 0.0 108.601 -174.082 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 18' ' ' ASN . . . . . . . . . . . . . 1.3 t30 -44.36 -49.98 9.33 Favored 'General case' 0 C--N 1.337 0.059 0 C-N-CA 125.81 1.644 . . . . 0.0 112.02 -178.551 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . -79.65 -69.14 1.42 Allowed Glycine 0 CA--C 1.526 0.725 0 O-C-N 123.856 0.722 . . . . 0.0 111.459 177.269 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 30.2 mttm -136.72 165.68 33.3 Favored Pre-proline 0 CA--C 1.529 0.142 0 C-N-CA 125.728 1.611 . . . . 0.0 111.035 -164.273 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 21' ' ' PRO . . . . . . . . . . . . . 91.9 Cg_endo -67.37 176.41 4.85 Favored 'Trans proline' 0 N--CA 1.454 -0.852 0 C-N-CA 121.596 1.53 . . . . 0.0 110.045 162.728 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 22' ' ' VAL . . . . . . . . . . . . . 7.7 p -131.47 162.31 39.6 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.513 0 C-N-CA 124.834 1.254 . . . . 0.0 108.336 177.429 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 23' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -141.9 142.46 33.06 Favored 'General case' 0 CA--C 1.535 0.392 0 CA-C-N 119.008 0.822 . . . . 0.0 108.794 172.568 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 24' ' ' SER . . . . . . . . . . . . . 16.2 m -146.06 35.25 1.0 Allowed 'General case' 0 CA--C 1.537 0.448 0 C-N-CA 125.64 1.576 . . . . 0.0 110.483 -175.647 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 25' ' ' ASP . . . . . . . . . . . . . 18.0 m-20 53.13 52.68 13.24 Favored 'General case' 0 N--CA 1.47 0.563 0 C-N-CA 125.088 1.355 . . . . 0.0 110.801 -179.715 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 26' ' ' LYS . . . . . . . . . . . . . 5.0 tmtt? 64.71 9.24 5.05 Favored 'General case' 0 N--CA 1.45 -0.437 0 C-N-CA 124.456 1.102 . . . . 0.0 112.406 178.227 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 27' ' ' ASN . . . . . . . . . . . . . 73.3 m-20 -113.55 58.4 0.74 Allowed Pre-proline 0 CA--C 1.542 0.664 0 C-N-CA 125.151 1.38 . . . . 0.0 110.428 172.524 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 28' ' ' PRO . . . . . . . . . . . . . 23.2 Cg_endo -76.76 171.66 17.6 Favored 'Trans proline' 0 CA--C 1.543 0.936 0 C-N-CA 124.502 3.468 . . . . 0.0 113.457 -166.84 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 29' ' ' PRO . . . . . . . . . . . . . 19.5 Cg_endo -66.02 64.91 0.45 Allowed 'Trans proline' 0 C--N 1.357 0.978 0 C-N-CA 124.974 3.783 . . . . 0.0 111.811 170.984 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 30' ' ' GLU . . . . . 0.408 ' HA ' ' HA ' ' A' ' 13' ' ' VAL . 1.9 pt-20 -70.15 164.54 23.97 Favored 'General case' 0 C--O 1.239 0.525 0 O-C-N 120.222 -1.549 . . . . 0.0 109.339 172.28 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 31' ' ' ILE . . . . . . . . . . . . . 12.9 tt -139.94 147.63 23.57 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.474 0 CA-C-O 122.336 1.065 . . . . 0.0 108.492 176.935 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 32' ' ' SER . . . . . . . . . . . . . 5.0 p -138.75 154.29 48.52 Favored 'General case' 0 N--CA 1.443 -0.775 0 N-CA-C 107.064 -1.458 . . . . 0.0 107.064 -179.276 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 33' ' ' PHE . . . . . . . . . . . . . 91.7 m-85 -126.37 168.38 14.25 Favored 'General case' 0 N--CA 1.446 -0.638 0 N-CA-C 106.84 -1.541 . . . . 0.0 106.84 178.03 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 34' ' ' GLY . . . . . . . . . . . . . . . 157.85 170.49 22.69 Favored Glycine 0 CA--C 1.522 0.524 0 N-CA-C 109.197 -1.561 . . . . 0.0 109.197 -178.284 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 35' ' ' GLU . . . . . . . . . . . . . 25.1 mt-10 43.57 88.38 0.01 OUTLIER 'General case' 0 N--CA 1.467 0.406 0 C-N-CA 126.796 2.038 . . . . 0.0 113.38 163.647 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 29.3 mttm 69.67 24.42 5.49 Favored 'General case' 0 N--CA 1.466 0.369 0 C-N-CA 125.429 1.492 . . . . 0.0 112.609 -177.224 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 37' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER 64.98 21.66 12.34 Favored 'General case' 0 CA--C 1.542 0.673 0 CA-C-N 120.178 1.353 . . . . 0.0 109.878 -177.828 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 38' ' ' MET . . . . . . . . . . . . . 14.9 mtp -62.42 157.49 19.92 Favored 'General case' 0 N--CA 1.45 -0.445 0 O-C-N 120.959 -1.088 . . . . 0.0 110.006 171.406 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 39' ' ' ILE . . . . . . . . . . . . . 7.3 mt -119.26 131.22 72.56 Favored 'Isoleucine or valine' 0 N--CA 1.447 -0.587 0 C-N-CA 125.443 1.497 . . . . 0.0 107.2 -177.988 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 40' ' ' SER . . . . . . . . . . . . . 55.5 m -129.0 116.02 18.69 Favored 'General case' 0 N--CA 1.452 -0.363 0 C-N-CA 126.377 1.871 . . . . 0.0 107.182 178.78 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 41' ' ' GLY . . . . . . . . . . . . . . . -167.75 179.47 41.09 Favored Glycine 0 CA--C 1.526 0.738 0 N-CA-C 109.631 -1.388 . . . . 0.0 109.631 -179.395 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 42' ' ' SER . . . . . . . . . . . . . 1.0 OUTLIER -154.54 103.28 2.46 Favored 'General case' 0 N--CA 1.453 -0.283 0 O-C-N 121.989 -0.712 . . . . 0.0 109.257 -176.605 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 43' ' ' MET . . . . . . . . . . . . . 6.9 mmt -71.25 -43.55 67.02 Favored 'General case' 0 C--O 1.223 -0.335 0 N-CA-C 108.998 -0.741 . . . . 0.0 108.998 175.248 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 44' ' ' CYS . . . . . 1.275 ' SG ' ' SG ' ' A' ' 70' ' ' CYS . 38.7 t -153.84 -75.32 0.12 Allowed 'General case' 0 N--CA 1.453 -0.284 0 N-CA-C 104.61 -2.367 . . . . 0.0 104.61 172.878 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 45' ' ' ASN . . . . . . . . . . . . . 2.7 m120 -78.48 17.66 0.64 Allowed 'General case' 0 C--N 1.329 -0.3 0 C-N-CA 126.463 1.905 . . . . 0.0 112.494 -163.703 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 46' ' ' ARG . . . . . . . . . . . . . 3.9 mmm180 55.48 158.94 0.01 OUTLIER 'General case' 0 N--CA 1.465 0.299 0 C-N-CA 128.248 2.619 . . . . 0.0 112.631 -161.744 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 47' ' ' PHE . . . . . . . . . . . . . 47.3 p90 -152.69 171.74 17.73 Favored 'General case' 0 N--CA 1.448 -0.556 0 C-N-CA 125.352 1.461 . . . . 0.0 108.199 165.835 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 48' ' ' SER . . . . . . . . . . . . . 7.0 p -163.6 158.87 21.12 Favored 'General case' 0 N--CA 1.444 -0.765 0 N-CA-C 107.031 -1.47 . . . . 0.0 107.031 176.258 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 49' ' ' GLY . . . . . . . . . . . . . . . 173.62 169.17 35.64 Favored Glycine 0 C--N 1.34 0.756 0 CA-C-N 119.951 1.251 . . . . 0.0 112.265 164.7 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 50' ' ' GLU . . . . . . . . . . . . . 23.1 mt-10 -72.84 96.8 2.13 Favored 'General case' 0 C--O 1.239 0.503 0 C-N-CA 125.395 1.478 . . . . 0.0 108.884 171.607 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 51' ' ' GLY . . . . . . . . . . . . . . . -71.97 176.55 40.03 Favored Glycine 0 CA--C 1.527 0.818 0 CA-C-N 115.414 -0.812 . . . . 0.0 111.255 156.965 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 52' ' ' LYS . . . . . . . . . . . . . 29.9 ttpt -167.25 150.33 6.31 Favored 'General case' 0 CA--C 1.529 0.15 0 C-N-CA 126.21 1.804 . . . . 0.0 107.605 179.688 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 53' ' ' LEU . . . . . . . . . . . . . 46.7 tp -155.26 120.53 4.93 Favored 'General case' 0 C--O 1.232 0.142 0 C-N-CA 123.667 0.787 . . . . 0.0 109.345 177.132 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 1.2 t -162.21 39.56 0.12 Allowed 'General case' 0 CA--C 1.538 0.507 0 C-N-CA 123.639 0.776 . . . . 0.0 108.992 174.176 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 55' ' ' ASN . . . . . . . . . . . . . 15.8 p-10 -174.01 -51.4 0.01 OUTLIER 'General case' 0 N--CA 1.462 0.162 0 C-N-CA 124.779 1.232 . . . . 0.0 111.372 -161.497 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 56' ' ' GLY . . . . . . . . . . . . . . . 131.57 10.18 2.42 Favored Glycine 0 CA--C 1.529 0.91 0 C-N-CA 125.102 1.334 . . . . 0.0 113.128 -176.694 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 57' ' ' GLU . . . . . . . . . . . . . 51.7 tt0 -132.05 134.89 46.04 Favored 'General case' 0 C--O 1.233 0.233 0 CA-C-N 118.657 1.228 . . . . 0.0 109.118 -175.019 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 58' ' ' LEU . . . . . . . . . . . . . 38.1 tp -115.71 82.19 1.72 Allowed 'General case' 0 CA--C 1.535 0.393 0 C-N-CA 126.221 1.809 . . . . 0.0 110.685 -171.928 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 59' ' ' THR . . . . . . . . . . . . . 16.9 p -82.45 141.23 32.89 Favored 'General case' 0 C--O 1.237 0.427 0 O-C-N 121.445 -0.784 . . . . 0.0 110.931 177.366 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 60' ' ' ALA . . . . . . . . . . . . . . . -89.87 117.05 28.41 Favored 'General case' 0 CA--C 1.517 -0.309 0 C-N-CA 125.011 1.325 . . . . 0.0 110.584 173.604 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 61' ' ' LYS . . . . . . . . . . . . . 16.2 tttt -67.11 -9.47 40.03 Favored 'General case' 0 CA--C 1.543 0.683 0 N-CA-C 113.453 0.908 . . . . 0.0 113.453 176.05 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 62' ' ' GLY . . . . . . . . . . . . . . . 159.25 116.08 0.43 Allowed Glycine 0 CA--C 1.523 0.535 0 N-CA-C 108.606 -1.798 . . . . 0.0 108.606 179.597 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 63' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -97.59 108.54 21.28 Favored 'General case' 0 N--CA 1.452 -0.367 0 C-N-CA 124.227 1.011 . . . . 0.0 110.396 -173.07 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 64' ' ' ALA . . . . . . . . . . . . . . . -96.18 108.71 21.2 Favored 'General case' 0 C--N 1.324 -0.517 0 CA-C-N 115.634 -0.712 . . . . 0.0 110.114 -177.083 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 65' ' ' MET . . . . . . . . . . . . . 50.4 mtp -111.43 -178.72 3.52 Favored 'General case' 0 C--O 1.241 0.61 0 C-N-CA 126.091 1.756 . . . . 0.0 109.972 -174.588 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 66' ' ' THR . . . . . . . . . . . . . 10.1 p -122.6 -175.25 3.1 Favored 'General case' 0 CA--C 1.537 0.444 0 C-N-CA 123.625 0.77 . . . . 0.0 112.94 178.937 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 67' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -124.68 74.05 1.31 Allowed 'General case' 0 C--O 1.237 0.418 0 C-N-CA 126.727 2.011 . . . . 0.0 110.044 -174.622 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 68' ' ' MET . . . . . . . . . . . . . 2.0 ptt? -142.93 158.37 43.67 Favored 'General case' 0 N--CA 1.452 -0.343 0 C-N-CA 124.638 1.175 . . . . 0.0 111.694 172.824 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 69' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -104.92 134.67 47.65 Favored 'General case' 0 N--CA 1.448 -0.566 0 C-N-CA 127.388 2.275 . . . . 0.0 109.234 179.827 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 70' ' ' CYS . . . . . 1.275 ' SG ' ' SG ' ' A' ' 44' ' ' CYS . 60.0 m -100.05 -6.72 25.97 Favored 'General case' 0 N--CA 1.467 0.408 0 C-N-CA 125.611 1.564 . . . . 0.0 114.499 -173.489 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 71' ' ' ALA . . . . . . . . . . . . . . . 67.81 -45.04 0.49 Allowed 'General case' 0 C--O 1.234 0.248 0 C-N-CA 127.324 2.25 . . . . 0.0 113.936 -168.29 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 72' ' ' ASN . . . . . . . . . . . . . 43.4 t30 -68.38 142.71 94.81 Favored Pre-proline 0 C--O 1.234 0.26 0 CA-C-O 117.503 -1.237 . . . . 0.0 108.697 -177.598 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 73' ' ' PRO . . . . . . . . . . . . . 44.3 Cg_endo -78.92 -41.32 0.24 Allowed 'Trans proline' 0 N--CA 1.455 -0.756 0 C-N-CA 121.957 1.772 . . . . 0.0 110.999 178.414 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 74' ' ' GLN . . . . . . . . . . . . . 23.7 tt0 -61.58 -44.98 96.02 Favored 'General case' 0 CA--C 1.534 0.358 0 C-N-CA 123.126 0.57 . . . . 0.0 110.76 -169.506 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 75' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -52.31 -52.65 51.78 Favored 'General case' 0 N--CA 1.447 -0.605 0 C-N-CA 125.139 1.376 . . . . 0.0 110.583 169.543 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 76' ' ' ASN . . . . . . . . . . . . . 1.2 m-20 -71.18 -0.89 10.8 Favored 'General case' 0 N--CA 1.47 0.53 0 C-N-CA 126.657 1.983 . . . . 0.0 113.144 -174.767 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 77' ' ' GLU . . . . . . . . . . . . . 3.3 mm-40 -101.93 -40.31 6.95 Favored 'General case' 0 C--O 1.235 0.328 0 C-N-CA 126.214 1.806 . . . . 0.0 109.708 171.075 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 78' ' ' LEU . . . . . . . . . . . . . 4.9 mp -67.49 -24.24 65.56 Favored 'General case' 0 N--CA 1.456 -0.167 0 C-N-CA 125.589 1.556 . . . . 0.0 112.103 -178.58 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 79' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -58.24 -34.35 70.35 Favored 'General case' 0 C--O 1.232 0.171 0 C-N-CA 123.4 0.68 . . . . 0.0 111.695 175.233 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 80' ' ' ASN . . . . . . . . . . . . . 91.1 m-20 -87.17 -36.41 18.05 Favored 'General case' 0 CA--C 1.512 -0.496 0 CA-C-O 117.893 -1.051 . . . . 0.0 109.862 177.753 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 81' ' ' THR . . . . . . . . . . . . . 3.8 m -52.38 -55.33 22.41 Favored 'General case' 0 CA--C 1.531 0.246 0 CA-C-N 118.646 0.657 . . . . 0.0 109.985 174.657 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 82' ' ' ILE . . . . . . . . . . . . . 9.8 tp -66.56 -37.61 79.93 Favored 'Isoleucine or valine' 0 N--CA 1.454 -0.27 0 C-N-CA 119.808 -0.757 . . . . 0.0 111.361 -174.382 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 83' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER -59.75 -49.55 77.29 Favored 'General case' 0 N--CA 1.443 -0.802 0 N-CA-C 109.283 -0.636 . . . . 0.0 109.283 179.495 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 84' ' ' GLU . . . . . . . . . . . . . 36.8 tt0 -66.41 -46.31 76.99 Favored 'General case' 0 N--CA 1.449 -0.5 0 C-N-CA 125.065 1.346 . . . . 0.0 111.219 -176.725 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 85' ' ' MET . . . . . . . . . . . . . 85.0 mtp -58.21 -52.26 66.31 Favored 'General case' 0 C--N 1.342 0.265 0 C-N-CA 124.413 1.085 . . . . 0.0 109.318 -177.766 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 86' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -75.27 -22.97 57.39 Favored 'General case' 0 N--CA 1.453 -0.311 0 CA-C-N 115.906 -0.588 . . . . 0.0 111.329 -171.41 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 87' ' ' LYS . . . . . . . . . . . . . 9.5 mttt -67.14 -47.05 72.26 Favored 'General case' 0 N--CA 1.456 -0.172 0 N-CA-C 108.164 -1.05 . . . . 0.0 108.164 -178.797 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 88' ' ' GLU . . . . . . . . . . . . . 69.5 mt-10 -72.07 -51.45 21.54 Favored 'General case' 0 N--CA 1.454 -0.255 0 O-C-N 123.738 0.649 . . . . 0.0 110.077 177.567 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 89' ' ' GLY . . . . . . . . . . . . . . . 134.26 97.57 0.59 Allowed Glycine 0 C--N 1.337 0.597 0 N-CA-C 108.509 -1.836 . . . . 0.0 108.509 -169.732 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 90' ' ' ALA . . . . . . . . . . . . . . . -74.11 130.72 40.34 Favored 'General case' 0 N--CA 1.451 -0.387 0 N-CA-C 107.423 -1.325 . . . . 0.0 107.423 171.813 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 91' ' ' GLN . . . . . . . . . . . . . 82.1 mm-40 -62.64 130.91 47.14 Favored 'General case' 0 N--CA 1.442 -0.833 0 N-CA-C 106.109 -1.812 . . . . 0.0 106.109 159.239 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 92' ' ' VAL . . . . . . . . . . . . . 4.2 p -118.27 124.67 73.46 Favored 'Isoleucine or valine' 0 N--CA 1.44 -0.927 0 N-CA-C 104.069 -2.567 . . . . 0.0 104.069 -179.008 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 93' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -138.69 138.48 37.78 Favored 'General case' 0 N--CA 1.444 -0.739 0 N-CA-C 106.316 -1.735 . . . . 0.0 106.316 173.37 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 94' ' ' LEU . . . . . . . . . . . . . 10.8 tp -133.23 116.22 15.93 Favored 'General case' 0 N--CA 1.445 -0.687 0 N-CA-C 106.543 -1.651 . . . . 0.0 106.543 -178.923 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 95' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -82.59 -164.62 0.87 Allowed 'General case' 0 C--N 1.322 -0.619 0 CA-C-N 114.417 -1.265 . . . . 0.0 110.112 172.62 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 96' ' ' ALA . . . . . . . . . . . . . . . -49.59 -40.82 40.12 Favored 'General case' 0 CA--C 1.538 0.501 0 C-N-CA 124.611 1.164 . . . . 0.0 113.079 -178.004 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 97' ' ' ASN . . . . . . . . . . . . . 42.8 p30 -156.38 23.47 0.35 Allowed 'General case' 0 CA--C 1.541 0.63 0 N-CA-C 113.683 0.994 . . . . 0.0 113.683 -178.876 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 98' ' ' GLN . . . . . . . . . . . . . 13.7 tt0 -137.11 122.79 19.83 Favored 'General case' 0 N--CA 1.467 0.381 0 C-N-CA 124.45 1.1 . . . . 0.0 108.568 -177.735 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 99' ' ' LEU . . . . . . . . . . . . . 3.7 tp -82.38 130.81 35.19 Favored 'General case' 0 C--O 1.235 0.306 0 N-CA-C 107.709 -1.219 . . . . 0.0 107.709 170.723 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 100' ' ' THR . . . . . . . . . . . . . 5.0 m -117.73 114.32 23.15 Favored 'General case' 0 C--N 1.325 -0.471 0 C-N-CA 126.506 1.923 . . . . 0.0 106.743 171.371 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 101' ' ' LEU . . . . . . . . . . . . . 0.7 OUTLIER -115.54 123.82 49.47 Favored 'General case' 0 CA--C 1.505 -0.777 0 N-CA-C 106.832 -1.544 . . . . 0.0 106.832 -179.073 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 102' ' ' ALA . . . . . . . . . . . . . . . -139.14 158.48 44.1 Favored 'General case' 0 C--N 1.325 -0.488 0 C-N-CA 123.655 0.782 . . . . 0.0 108.97 178.577 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 103' ' ' THR . . . . . . . . . . . . . 0.6 OUTLIER -154.61 -179.95 8.47 Favored 'General case' 0 N--CA 1.443 -0.815 0 C-N-CA 126.438 1.895 . . . . 0.0 106.214 176.838 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 104' ' ' ALA . . . . . . . . . . . . . . . -60.53 -26.24 66.72 Favored 'General case' 0 C--O 1.236 0.363 0 O-C-N 120.992 -1.067 . . . . 0.0 112.284 174.613 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 105' ' ' LYS . . . . . . . . . . . . . 13.0 mmtt -77.63 -71.7 0.4 Allowed 'General case' 0 CA--C 1.512 -0.504 0 O-C-N 121.962 -0.461 . . . . 0.0 111.048 -179.992 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 106' ' ' GLN . . . . . . . . . . . . . 1.4 tt0 -154.07 -169.87 3.38 Favored 'General case' 0 N--CA 1.45 -0.446 0 N-CA-C 109.719 -0.475 . . . . 0.0 109.719 -166.435 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 107' ' ' THR . . . . . . . . . . . . . 10.0 t -143.74 164.13 31.35 Favored 'General case' 0 C--O 1.24 0.601 0 C-N-CA 123.431 0.692 . . . . 0.0 110.281 -173.682 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 108' ' ' LEU . . . . . . . . . . . . . 75.6 mt -150.05 134.05 16.99 Favored 'General case' 0 CA--C 1.536 0.434 0 C-N-CA 128.399 2.679 . . . . 0.0 106.123 -170.688 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 109' ' ' THR . . . . . . . . . . . . . 82.6 m -115.21 116.21 27.97 Favored 'General case' 0 C--O 1.237 0.398 0 N-CA-C 107.022 -1.473 . . . . 0.0 107.022 174.721 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 110' ' ' TYR . . . . . . . . . . . . . 21.7 m-85 -106.99 168.57 9.11 Favored 'General case' 0 C--O 1.237 0.424 0 CA-C-O 121.637 0.732 . . . . 0.0 109.811 176.652 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 111' ' ' LYS . . . . . . . . . . . . . 0.9 OUTLIER -130.03 143.71 50.94 Favored 'General case' 0 CA--C 1.519 -0.225 0 C-N-CA 126.013 1.725 . . . . 0.0 108.343 -170.847 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 112' ' ' LEU . . . . . . . . . . . . . 21.2 tp -70.71 60.63 0.23 Allowed 'General case' 0 CA--C 1.54 0.581 0 C-N-CA 126.222 1.809 . . . . 0.0 111.575 171.152 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 113' ' ' ALA . . . . . . . . . . . . . . . -88.04 103.34 15.63 Favored 'General case' 0 N--CA 1.453 -0.303 0 N-CA-C 105.297 -2.112 . . . . 0.0 105.297 163.251 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 114' ' ' ASP . . . . . . . . . . . . . 46.5 t0 . . . . . 0 C--N 1.33 -0.241 0 CA-C-O 122.918 1.342 . . . . 0.0 109.39 174.357 . . . . . . . . 0 0 . 1 . 006 nuclear orig core ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 21.1 ttm . . . . . 0 N--CA 1.455 -0.181 0 N-CA-C 108.321 -0.992 . . . . 0.0 108.321 . . . . . . . . . 0 0 . 1 . 006 nuclear orig core ' A' A ' 2' ' ' VAL . . . . . . . . . . . . . 8.2 p -57.64 142.3 13.51 Favored 'Isoleucine or valine' 0 CA--C 1.542 0.648 0 CA-C-N 115.951 -0.568 . . . . 0.0 110.251 173.237 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 3' ' ' THR . . . . . . . . . . . . . 21.5 p -123.03 163.9 30.61 Favored Pre-proline 0 C--O 1.226 -0.153 0 O-C-N 121.353 -0.842 . . . . 0.0 109.956 172.724 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 4' ' ' PRO . . . . . . . . . . . . . 31.1 Cg_endo -63.89 -36.63 49.05 Favored 'Trans proline' 0 N--CA 1.461 -0.427 0 C-N-CA 122.227 1.951 . . . . 0.0 112.183 174.377 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 5' ' ' GLU . . . . . 0.446 ' C ' ' H ' ' A' ' 7' ' ' LEU . 13.3 tt0 -57.27 -56.67 18.84 Favored 'General case' 0 CA--C 1.534 0.333 0 C-N-CA 123.524 0.729 . . . . 0.0 111.25 -172.721 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 6' ' ' GLN . . . . . . . . . . . . . 20.0 pt20 -64.05 18.3 0.01 OUTLIER 'General case' 0 CA--C 1.543 0.691 0 C-N-CA 128.174 2.59 . . . . 0.0 114.252 178.877 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 7' ' ' LEU . . . . . 0.446 ' H ' ' C ' ' A' ' 5' ' ' GLU . 72.9 mt -134.95 -50.3 0.76 Allowed 'General case' 0 N--CA 1.453 -0.313 0 C-N-CA 126.272 1.829 . . . . 0.0 109.58 -176.649 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 8' ' ' GLN . . . . . . . . . . . . . 5.4 mt-30 -57.65 -21.31 39.17 Favored 'General case' 0 N--CA 1.472 0.652 0 N-CA-C 114.114 1.153 . . . . 0.0 114.114 -177.182 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 9' ' ' HIS . . . . . . . . . . . . . 8.3 m170 -110.76 11.46 22.57 Favored 'General case' 0 CA--C 1.537 0.475 0 C-N-CA 123.421 0.688 . . . . 0.0 111.218 -179.916 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 10' ' ' HIS . . . . . . . . . . . . . 60.5 m-70 -136.33 112.25 9.57 Favored 'General case' 0 CA--C 1.535 0.39 0 C-N-CA 124.686 1.195 . . . . 0.0 109.223 -165.754 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 11' ' ' ARG . . . . . . . . . . . . . 4.6 ttt85 -69.11 152.61 44.95 Favored 'General case' 0 N--CA 1.466 0.351 0 O-C-N 121.304 -0.873 . . . . 0.0 108.961 172.159 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 12' ' ' PHE . . . . . . . . . . . . . 21.3 m-85 -139.11 156.6 47.03 Favored 'General case' 0 CA--C 1.512 -0.513 0 N-CA-C 108.387 -0.968 . . . . 0.0 108.387 173.676 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 13' ' ' VAL . . . . . . . . . . . . . 1.8 p -140.5 128.68 24.59 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.583 0 N-CA-C 113.135 0.791 . . . . 0.0 113.135 -179.339 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 14' ' ' LEU . . . . . . . . . . . . . 6.4 tt -57.32 119.91 7.25 Favored 'General case' 0 CA--C 1.508 -0.666 0 N-CA-C 107.512 -1.292 . . . . 0.0 107.512 178.055 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 15' ' ' GLU . . . . . 0.46 ' HG3' ' HE2' ' A' ' 111' ' ' LYS . 0.1 OUTLIER -106.12 -45.23 4.38 Favored 'General case' 0 N--CA 1.439 -0.978 0 CA-C-N 115.092 -0.958 . . . . 0.0 108.996 -173.229 . . . . . . . . 3 3 . 1 . 006 nuclear orig core ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -143.56 152.18 41.11 Favored 'General case' 0 N--CA 1.443 -0.79 0 CA-C-O 121.972 0.891 . . . . 0.0 111.406 174.242 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 17' ' ' VAL . . . . . . . . . . . . . 10.5 t -76.93 175.68 0.73 Allowed 'Isoleucine or valine' 0 C--O 1.242 0.673 0 N-CA-C 106.871 -1.529 . . . . 0.0 106.871 173.1 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 18' ' ' ASN . . . . . . . . . . . . . 0.2 OUTLIER -44.79 -34.49 2.32 Favored 'General case' 0 CA--C 1.535 0.374 0 C-N-CA 126.773 2.029 . . . . 0.0 113.103 169.6 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . -115.3 -54.31 0.38 Allowed Glycine 0 CA--C 1.525 0.687 0 CA-C-O 118.937 -0.924 . . . . 0.0 113.339 -168.198 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 12.9 mttm -134.07 160.76 67.3 Favored Pre-proline 0 N--CA 1.466 0.331 0 CA-C-N 118.694 1.247 . . . . 0.0 111.702 178.08 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 21' ' ' PRO . . . . . . . . . . . . . 59.8 Cg_endo -67.06 160.72 46.0 Favored 'Trans proline' 0 N--CA 1.45 -1.029 0 C-N-CA 122.012 1.808 . . . . 0.0 110.321 162.468 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 22' ' ' VAL . . . . . . . . . . . . . 13.3 p -139.74 165.52 22.16 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.41 0 C-N-CA 124.536 1.134 . . . . 0.0 109.166 -179.265 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 23' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -130.07 157.98 40.89 Favored 'General case' 0 C--O 1.235 0.338 0 CA-C-O 121.528 0.68 . . . . 0.0 111.465 -179.166 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 24' ' ' SER . . . . . . . . . . . . . 32.2 t -150.9 47.88 0.85 Allowed 'General case' 0 CA--C 1.536 0.435 0 C-N-CA 126.462 1.905 . . . . 0.0 106.624 -178.397 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 25' ' ' ASP . . . . . . . . . . . . . 32.6 m-20 44.54 54.59 6.33 Favored 'General case' 0 N--CA 1.469 0.506 0 C-N-CA 126.044 1.737 . . . . 0.0 112.466 -176.391 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 26' ' ' LYS . . . . . . . . . . . . . 7.1 tmtm? 69.99 -2.57 2.01 Favored 'General case' 0 N--CA 1.471 0.605 0 O-C-N 120.91 -1.119 . . . . 0.0 112.664 176.619 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 27' ' ' ASN . . . . . . . . . . . . . 82.5 m-20 -113.43 71.03 1.56 Allowed Pre-proline 0 CA--C 1.537 0.471 0 C-N-CA 125.761 1.624 . . . . 0.0 107.471 175.455 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 28' ' ' PRO . . . . . . . . . . . . . 60.2 Cg_endo -67.99 170.35 14.48 Favored 'Trans proline' 0 C--N 1.349 0.6 0 C-N-CA 124.664 3.576 . . . . 0.0 113.412 -173.335 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 29' ' ' PRO . . . . . . . . . . . . . 12.2 Cg_endo -61.46 69.49 0.1 OUTLIER 'Trans proline' 0 CA--C 1.544 1.013 0 C-N-CA 125.167 3.911 . . . . 0.0 112.042 164.569 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 30' ' ' GLU . . . . . . . . . . . . . 11.7 pt-20 -95.74 168.95 10.35 Favored 'General case' 0 C--N 1.327 -0.379 0 O-C-N 119.768 -1.833 . . . . 0.0 111.105 177.512 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 31' ' ' ILE . . . . . . . . . . . . . 14.4 tt -147.64 165.62 5.83 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.399 0 C-N-CA 124.392 1.077 . . . . 0.0 108.307 -168.854 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 32' ' ' SER . . . . . . . . . . . . . 5.9 p -145.92 161.67 39.53 Favored 'General case' 0 N--CA 1.443 -0.824 0 N-CA-C 107.985 -1.117 . . . . 0.0 107.985 165.884 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 33' ' ' PHE . . . . . . . . . . . . . 84.6 m-85 -127.57 167.43 16.35 Favored 'General case' 0 N--CA 1.442 -0.874 0 N-CA-C 106.619 -1.623 . . . . 0.0 106.619 175.357 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 34' ' ' GLY . . . . . . . . . . . . . . . 165.57 -167.28 38.92 Favored Glycine 0 N--CA 1.447 -0.596 0 N-CA-C 105.815 -2.914 . . . . 0.0 105.815 -177.189 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 35' ' ' GLU . . . . . . . . . . . . . 37.7 mt-10 44.38 72.51 0.19 Allowed 'General case' 0 C--N 1.33 -0.242 0 C-N-CA 124.952 1.301 . . . . 0.0 112.41 161.658 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 24.9 mtmt 60.33 28.31 17.92 Favored 'General case' 0 CA--C 1.541 0.633 0 CA-C-N 115.182 -0.917 . . . . 0.0 112.224 174.635 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 37' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER 75.23 15.92 2.81 Favored 'General case' 0 N--CA 1.469 0.521 0 C-N-CA 128.152 2.581 . . . . 0.0 112.649 -175.867 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 38' ' ' MET . . . . . . . . . . . . . 19.6 mtp -55.92 147.44 19.48 Favored 'General case' 0 C--O 1.237 0.395 0 O-C-N 120.697 -1.252 . . . . 0.0 110.664 167.451 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 39' ' ' ILE . . . . . . . . . . . . . 7.5 mt -108.61 135.47 47.33 Favored 'Isoleucine or valine' 0 N--CA 1.447 -0.588 0 N-CA-C 107.158 -1.423 . . . . 0.0 107.158 -177.428 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 40' ' ' SER . . . . . . . . . . . . . 4.4 m -136.18 135.57 39.27 Favored 'General case' 0 N--CA 1.452 -0.36 0 N-CA-C 107.584 -1.265 . . . . 0.0 107.584 171.757 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 41' ' ' GLY . . . . . . . . . . . . . . . -178.08 -175.46 45.25 Favored Glycine 0 C--O 1.237 0.325 0 CA-C-N 119.179 0.9 . . . . 0.0 111.114 -178.474 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 42' ' ' SER . . . . . . . . . . . . . 15.7 t -143.54 167.62 21.79 Favored 'General case' 0 N--CA 1.444 -0.75 0 N-CA-C 108.197 -1.038 . . . . 0.0 108.197 165.548 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 43' ' ' MET . . . . . . . . . . . . . 36.4 mmm -126.79 -45.33 1.61 Allowed 'General case' 0 N--CA 1.447 -0.614 0 N-CA-C 107.86 -1.163 . . . . 0.0 107.86 162.014 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 44' ' ' CYS . . . . . 1.283 ' SG ' ' SG ' ' A' ' 70' ' ' CYS . 41.6 t -149.16 -51.21 0.15 Allowed 'General case' 0 CA--C 1.542 0.664 0 C-N-CA 126.112 1.765 . . . . 0.0 108.009 167.706 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 45' ' ' ASN . . . . . . . . . . . . . 8.0 m-80 -88.95 10.34 21.74 Favored 'General case' 0 N--CA 1.467 0.4 0 N-CA-C 115.898 1.814 . . . . 0.0 115.898 -174.203 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 46' ' ' ARG . . . . . . . . . . . . . 0.4 OUTLIER 60.99 164.78 0.08 Allowed 'General case' 0 N--CA 1.474 0.774 0 C-N-CA 125.809 1.644 . . . . 0.0 111.661 -169.737 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 47' ' ' PHE . . . . . . . . . . . . . 51.6 p90 -162.76 169.09 20.5 Favored 'General case' 0 C--O 1.238 0.492 0 C-N-CA 124.954 1.301 . . . . 0.0 108.887 167.852 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 48' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -157.23 162.21 39.25 Favored 'General case' 0 CA--C 1.541 0.608 0 C-N-CA 124.656 1.182 . . . . 0.0 108.673 164.731 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 49' ' ' GLY . . . . . . . . . . . . . . . -179.1 167.96 38.45 Favored Glycine 0 CA--C 1.532 1.109 0 CA-C-N 120.572 1.533 . . . . 0.0 113.156 171.104 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 50' ' ' GLU . . . . . . . . . . . . . 40.4 mt-10 -68.81 95.35 0.67 Allowed 'General case' 0 CA--C 1.534 0.329 0 C-N-CA 125.013 1.325 . . . . 0.0 110.193 170.473 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 51' ' ' GLY . . . . . . . . . . . . . . . -76.85 165.01 53.4 Favored Glycine 0 CA--C 1.529 0.951 0 N-CA-C 110.296 -1.122 . . . . 0.0 110.296 161.242 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 52' ' ' LYS . . . . . . . . . . . . . 62.3 tttt -168.85 137.01 2.03 Favored 'General case' 0 CA--C 1.517 -0.289 0 C-N-CA 126.833 2.053 . . . . 0.0 106.036 174.837 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 53' ' ' LEU . . . . . . . . . . . . . 16.1 tp -130.77 128.96 41.81 Favored 'General case' 0 CA--C 1.517 -0.316 0 CA-C-O 122.317 1.055 . . . . 0.0 110.391 -177.441 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 21.1 t -144.94 -37.18 0.29 Allowed 'General case' 0 N--CA 1.443 -0.796 0 C-N-CA 125.433 1.493 . . . . 0.0 109.903 174.729 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 55' ' ' ASN . . . . . . . . . . . . . 65.9 t30 -121.64 23.23 10.31 Favored 'General case' 0 CA--C 1.538 0.502 0 C-N-CA 124.175 0.99 . . . . 0.0 113.647 -164.66 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 56' ' ' GLY . . . . . . . . . . . . . . . 78.03 5.28 86.9 Favored Glycine 0 CA--C 1.532 1.095 0 O-C-N 120.606 -1.309 . . . . 0.0 113.512 -176.089 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 57' ' ' GLU . . . . . . . . . . . . . 40.3 tt0 -123.67 148.6 46.36 Favored 'General case' 0 C--O 1.237 0.399 0 CA-C-N 118.612 1.206 . . . . 0.0 108.589 -174.13 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 58' ' ' LEU . . . . . . . . . . . . . 8.4 tp -132.51 138.83 47.67 Favored 'General case' 0 C--N 1.33 -0.251 0 C-N-CA 125.364 1.466 . . . . 0.0 110.54 178.421 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 59' ' ' THR . . . . . . . . . . . . . 1.6 p -125.82 167.11 15.66 Favored 'General case' 0 C--O 1.237 0.429 0 C-N-CA 125.76 1.624 . . . . 0.0 111.17 -176.66 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 60' ' ' ALA . . . . . . . . . . . . . . . -139.45 107.32 5.67 Favored 'General case' 0 CA--C 1.53 0.18 0 C-N-CA 125.505 1.522 . . . . 0.0 111.706 168.381 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 61' ' ' LYS . . . . . . . . . . . . . 24.7 tttt -72.55 77.23 1.07 Allowed 'General case' 0 CA--C 1.542 0.636 0 C-N-CA 124.027 0.931 . . . . 0.0 111.027 178.273 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 62' ' ' GLY . . . . . . . . . . . . . . . 124.29 -65.29 0.54 Allowed Glycine 0 N--CA 1.466 0.674 0 C-N-CA 125.68 1.61 . . . . 0.0 111.397 172.801 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 63' ' ' LEU . . . . . . . . . . . . . 6.0 tt 65.51 103.39 0.04 OUTLIER 'General case' 0 CA--C 1.535 0.4 0 C-N-CA 128.578 2.751 . . . . 0.0 114.243 174.003 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 64' ' ' ALA . . . . . . . . . . . . . . . -84.22 97.48 9.42 Favored 'General case' 0 CA--C 1.533 0.32 0 C-N-CA 126.759 2.024 . . . . 0.0 112.635 -169.693 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 65' ' ' MET . . . . . . . . . . . . . 3.0 mtt -98.2 -179.66 4.45 Favored 'General case' 0 CA--C 1.543 0.675 0 C-N-CA 124.684 1.194 . . . . 0.0 111.127 176.064 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 66' ' ' THR . . . . . . . . . . . . . 9.2 p -118.2 -163.89 0.98 Allowed 'General case' 0 CA--C 1.552 1.028 0 C-N-CA 125.989 1.715 . . . . 0.0 111.822 -179.744 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 67' ' ' ARG . . . . . . . . . . . . . 28.9 mmt180 -133.21 49.12 2.33 Favored 'General case' 0 CA--C 1.553 1.089 0 C-N-CA 126.296 1.838 . . . . 0.0 111.474 172.985 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 68' ' ' MET . . . . . . . . . . . . . 59.4 mtm -84.12 -175.0 5.59 Favored 'General case' 0 CA--C 1.544 0.743 0 C-N-CA 128.113 2.565 . . . . 0.0 110.612 167.942 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 69' ' ' MET . . . . . . . . . . . . . 1.4 pmm? -151.01 173.83 13.86 Favored 'General case' 0 N--CA 1.466 0.341 0 C-N-CA 126.255 1.822 . . . . 0.0 111.449 171.058 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 70' ' ' CYS . . . . . 1.283 ' SG ' ' SG ' ' A' ' 44' ' ' CYS . 86.0 m -141.36 148.05 39.04 Favored 'General case' 0 C--O 1.234 0.263 0 CA-C-O 122.041 0.924 . . . . 0.0 112.028 -169.74 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 71' ' ' ALA . . . . . . . . . . . . . . . -71.9 26.92 0.05 OUTLIER 'General case' 0 CA--C 1.543 0.705 0 C-N-CA 128.374 2.669 . . . . 0.0 112.265 175.927 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 72' ' ' ASN . . . . . . . . . . . . . 53.3 t-20 -146.96 141.38 15.92 Favored Pre-proline 0 CA--C 1.535 0.4 0 N-CA-C 103.859 -2.645 . . . . 0.0 103.859 156.114 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 73' ' ' PRO . . . . . . . . . . . . . 56.1 Cg_endo -83.94 -26.84 1.79 Allowed 'Trans proline' 0 N--CA 1.465 -0.158 0 C-N-CA 122.271 1.981 . . . . 0.0 111.759 -176.968 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 74' ' ' GLN . . . . . . . . . . . . . 11.2 tt0 -63.14 -26.18 68.7 Favored 'General case' 0 CA--C 1.538 0.508 0 O-C-N 121.669 -0.645 . . . . 0.0 110.852 179.807 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 75' ' ' LEU . . . . . . . . . . . . . 62.1 mt -69.45 -32.14 70.9 Favored 'General case' 0 N--CA 1.47 0.542 0 C-N-CA 123.71 0.804 . . . . 0.0 111.728 173.121 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 76' ' ' ASN . . . . . . . . . . . . . 2.1 t-20 -79.79 -20.87 45.17 Favored 'General case' 0 CA--C 1.531 0.237 0 C-N-CA 124.177 0.991 . . . . 0.0 111.261 -177.555 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 77' ' ' GLU . . . . . . . . . . . . . 4.3 mm-40 -78.49 -34.08 47.76 Favored 'General case' 0 CA--C 1.536 0.41 0 C-N-CA 123.944 0.898 . . . . 0.0 110.114 169.591 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 78' ' ' LEU . . . . . . . . . . . . . 0.9 OUTLIER -57.05 -24.83 56.66 Favored 'General case' 0 C--N 1.345 0.407 0 O-C-N 121.513 -0.742 . . . . 0.0 111.869 176.369 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 79' ' ' ASP . . . . . . . . . . . . . 69.3 m-20 -64.35 -27.32 68.94 Favored 'General case' 0 N--CA 1.454 -0.273 0 C-N-CA 122.977 0.511 . . . . 0.0 111.991 -176.708 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 80' ' ' ASN . . . . . . . . . . . . . 10.7 p30 -101.76 -29.82 11.66 Favored 'General case' 0 N--CA 1.437 -1.106 0 CA-C-O 116.613 -1.661 . . . . 0.0 111.77 174.961 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 81' ' ' THR . . . . . . . . . . . . . 25.2 m -44.94 -74.42 0.04 OUTLIER 'General case' 0 CA--C 1.535 0.403 0 CA-C-N 119.164 0.893 . . . . 0.0 108.82 161.818 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 82' ' ' ILE . . . . . . . . . . . . . 5.2 tp -66.62 -34.58 71.02 Favored 'Isoleucine or valine' 0 N--CA 1.455 -0.205 0 O-C-N 121.012 -1.055 . . . . 0.0 111.448 -167.589 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 83' ' ' SER . . . . . . . . . . . . . 4.3 m -61.91 -45.07 95.34 Favored 'General case' 0 N--CA 1.445 -0.701 0 O-C-N 122.155 -0.341 . . . . 0.0 110.646 -177.662 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 84' ' ' GLU . . . . . . . . . . . . . 31.9 tt0 -77.94 -34.51 51.16 Favored 'General case' 0 N--CA 1.446 -0.669 0 CA-C-O 118.03 -0.986 . . . . 0.0 110.173 -178.032 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 85' ' ' MET . . . . . . . . . . . . . 86.8 mtp -54.64 -48.64 72.03 Favored 'General case' 0 C--N 1.343 0.297 0 CA-C-O 121.956 0.884 . . . . 0.0 108.728 174.709 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 86' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -76.63 -26.62 55.11 Favored 'General case' 0 N--CA 1.45 -0.457 0 CA-C-O 118.612 -0.708 . . . . 0.0 111.566 -176.648 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 87' ' ' LYS . . . . . . . . . . . . . 31.5 mttt -70.89 -38.14 73.03 Favored 'General case' 0 CA--C 1.532 0.284 0 CA-C-N 119.94 1.245 . . . . 0.0 108.938 178.203 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 88' ' ' GLU . . . . . . . . . . . . . 31.8 mm-40 -66.47 -63.79 1.0 Allowed 'General case' 0 CA--C 1.532 0.283 0 C-N-CA 125.274 1.43 . . . . 0.0 109.494 173.168 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 89' ' ' GLY . . . . . . . . . . . . . . . 135.55 99.22 0.58 Allowed Glycine 0 C--N 1.335 0.523 0 N-CA-C 107.517 -2.233 . . . . 0.0 107.517 -161.873 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 90' ' ' ALA . . . . . . . . . . . . . . . -90.47 139.88 30.26 Favored 'General case' 0 N--CA 1.455 -0.221 0 N-CA-C 108.996 -0.742 . . . . 0.0 108.996 -179.327 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 91' ' ' GLN . . . . . . . . . . . . . 41.9 mm-40 -78.63 134.99 37.11 Favored 'General case' 0 N--CA 1.442 -0.865 0 N-CA-C 106.075 -1.824 . . . . 0.0 106.075 174.916 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 92' ' ' VAL . . . . . . . . . . . . . 24.2 t -130.14 98.0 3.6 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.476 0 C-N-CA 127.444 2.297 . . . . 0.0 106.144 -167.133 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 93' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -116.71 94.19 4.51 Favored 'General case' 0 C--O 1.235 0.335 0 CA-C-O 121.225 0.536 . . . . 0.0 110.317 -175.736 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 94' ' ' LEU . . . . . . . . . . . . . 1.5 tm? -93.2 106.66 18.6 Favored 'General case' 0 C--O 1.233 0.213 0 N-CA-C 108.479 -0.934 . . . . 0.0 108.479 174.856 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 95' ' ' THR . . . . . . . . . . . . . 5.8 t -85.55 -164.81 1.07 Allowed 'General case' 0 CA--C 1.543 0.69 0 C-N-CA 125.932 1.693 . . . . 0.0 108.724 171.108 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 96' ' ' ALA . . . . . . . . . . . . . . . -55.33 -22.74 20.38 Favored 'General case' 0 CA--C 1.545 0.775 0 N-CA-C 115.638 1.718 . . . . 0.0 115.638 -172.953 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 97' ' ' ASN . . . . . . . . . . . . . 0.0 OUTLIER -152.83 2.63 0.31 Allowed 'General case' 0 N--CA 1.477 0.922 0 CA-C-N 120.313 1.415 . . . . 0.0 113.941 176.395 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 98' ' ' GLN . . . . . . . . . . . . . 6.5 tt0 -140.14 136.37 33.44 Favored 'General case' 0 CA--C 1.53 0.211 0 O-C-N 120.423 -1.423 . . . . 0.0 109.525 -163.551 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 99' ' ' LEU . . . . . . . . . . . . . 20.2 tp -113.99 115.3 27.41 Favored 'General case' 0 N--CA 1.464 0.272 0 C-N-CA 126.84 2.056 . . . . 0.0 108.455 -172.468 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 100' ' ' THR . . . . . . . . . . . . . 0.9 OUTLIER -89.73 149.68 22.63 Favored 'General case' 0 CA--C 1.541 0.61 0 N-CA-C 104.787 -2.301 . . . . 0.0 104.787 177.044 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 101' ' ' LEU . . . . . . . . . . . . . 1.2 mm? -120.74 117.29 27.1 Favored 'General case' 0 N--CA 1.455 -0.189 0 C-N-CA 127.211 2.204 . . . . 0.0 106.583 163.125 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 102' ' ' ALA . . . . . . . . . . . . . . . -129.17 140.78 51.38 Favored 'General case' 0 N--CA 1.464 0.233 0 CA-C-N 119.406 1.003 . . . . 0.0 109.603 174.526 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 103' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -160.33 175.49 12.77 Favored 'General case' 0 N--CA 1.448 -0.554 0 C-N-CA 126.636 1.975 . . . . 0.0 108.336 171.599 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 104' ' ' ALA . . . . . . . . . . . . . . . -47.64 -36.34 10.82 Favored 'General case' 0 N--CA 1.453 -0.283 0 CA-C-O 117.549 -1.215 . . . . 0.0 112.855 173.391 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 105' ' ' LYS . . . . . 0.426 ' HE3' ' HA ' ' A' ' 105' ' ' LYS . 0.0 OUTLIER -55.98 -69.04 0.16 Allowed 'General case' 0 C--N 1.344 0.355 0 CA-C-N 120.004 1.274 . . . . 0.0 111.588 178.716 . . . . . . . . 3 3 . 1 . 006 nuclear orig core ' A' A ' 106' ' ' GLN . . . . . . . . . . . . . 10.2 pt20 -176.62 -164.95 0.12 Allowed 'General case' 0 C--N 1.329 -0.325 0 C-N-CA 127.303 2.241 . . . . 0.0 106.526 -174.69 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 107' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -135.42 138.9 43.7 Favored 'General case' 0 N--CA 1.443 -0.786 0 N-CA-C 107.663 -1.236 . . . . 0.0 107.663 -163.459 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 108' ' ' LEU . . . . . . . . . . . . . 1.1 mm? -133.58 162.84 30.81 Favored 'General case' 0 C--N 1.331 -0.226 0 C-N-CA 125.73 1.612 . . . . 0.0 107.401 174.039 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 109' ' ' THR . . . . . . . . . . . . . 81.1 m -139.64 116.7 11.07 Favored 'General case' 0 C--O 1.237 0.435 0 N-CA-C 108.307 -0.998 . . . . 0.0 108.307 174.746 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 110' ' ' TYR . . . . . . . . . . . . . 0.8 OUTLIER -94.68 157.04 16.14 Favored 'General case' 0 CA--C 1.536 0.409 0 C-N-CA 126.498 1.919 . . . . 0.0 109.012 177.731 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 111' ' ' LYS . . . . . 0.46 ' HE2' ' HG3' ' A' ' 15' ' ' GLU . 3.7 tppt? -102.02 150.69 22.98 Favored 'General case' 0 C--O 1.237 0.41 0 C-N-CA 126.795 2.038 . . . . 0.0 108.994 176.05 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 112' ' ' LEU . . . . . . . . . . . . . 44.4 tp -72.95 59.34 0.5 Allowed 'General case' 0 CA--C 1.54 0.58 0 C-N-CA 124.968 1.307 . . . . 0.0 108.649 158.967 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 113' ' ' ALA . . . . . . . . . . . . . . . -96.63 83.83 3.54 Favored 'General case' 0 C--N 1.328 -0.351 0 N-CA-C 106.112 -1.811 . . . . 0.0 106.112 164.97 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 114' ' ' ASP . . . . . . . . . . . . . 3.2 p-10 . . . . . 0 CA--C 1.53 0.183 0 C-N-CA 125.271 1.429 . . . . 0.0 111.886 -176.89 . . . . . . . . 0 0 . 1 . 007 nuclear orig core ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 0.2 OUTLIER . . . . . 0 N--CA 1.451 -0.389 0 N-CA-C 109.099 -0.704 . . . . 0.0 109.099 . . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 2' ' ' VAL . . . . . . . . . . . . . 7.6 p -59.5 144.76 12.18 Favored 'Isoleucine or valine' 0 C--O 1.237 0.418 0 CA-C-O 120.879 0.371 . . . . 0.0 110.877 175.713 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 3' ' ' THR . . . . . . . . . . . . . 4.3 p -132.39 164.48 43.1 Favored Pre-proline 0 N--CA 1.453 -0.301 0 C-N-CA 124.508 1.123 . . . . 0.0 110.297 -178.064 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 4' ' ' PRO . . . . . . . . . . . . . 29.6 Cg_endo -66.15 -38.99 19.61 Favored 'Trans proline' 0 N--CA 1.462 -0.368 0 C-N-CA 122.559 2.173 . . . . 0.0 113.032 178.121 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 5' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -58.48 -47.48 83.92 Favored 'General case' 0 C--N 1.328 -0.353 0 C-N-CA 123.433 0.693 . . . . 0.0 110.907 -174.857 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 6' ' ' GLN . . . . . . . . . . . . . 15.8 pt20 -69.75 15.55 0.08 Allowed 'General case' 0 CA--C 1.541 0.603 0 C-N-CA 124.975 1.31 . . . . 0.0 114.048 176.161 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 7' ' ' LEU . . . . . . . . . . . . . 94.4 mt -130.3 -47.02 1.09 Allowed 'General case' 0 CA--C 1.529 0.17 0 C-N-CA 125.475 1.51 . . . . 0.0 110.882 -178.149 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 8' ' ' GLN . . . . . . . . . . . . . 7.1 mt-30 -60.77 -6.34 1.7 Allowed 'General case' 0 N--CA 1.479 1.012 0 N-CA-C 114.945 1.461 . . . . 0.0 114.945 -175.356 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 9' ' ' HIS . . . . . . . . . . . . . 10.7 m170 -126.94 13.29 7.32 Favored 'General case' 0 C--N 1.323 -0.554 0 C-N-CA 124.701 1.2 . . . . 0.0 111.359 -175.667 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 10' ' ' HIS . . . . . . . . . . . . . 73.8 m-70 -137.82 106.4 5.86 Favored 'General case' 0 CA--C 1.542 0.636 0 C-N-CA 124.466 1.107 . . . . 0.0 110.583 -161.341 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 11' ' ' ARG . . . . . . . . . . . . . 1.8 ttt180 -69.65 144.73 52.83 Favored 'General case' 0 N--CA 1.472 0.659 0 O-C-N 121.241 -0.912 . . . . 0.0 109.909 173.87 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 12' ' ' PHE . . . . . . . . . . . . . 39.4 m-85 -133.84 117.6 17.02 Favored 'General case' 0 N--CA 1.454 -0.26 0 C-N-CA 125.571 1.548 . . . . 0.0 107.709 177.584 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 13' ' ' VAL . . . . . 0.419 ' HA ' ' HA ' ' A' ' 30' ' ' GLU . 11.8 p -89.73 146.22 6.45 Favored 'Isoleucine or valine' 0 C--O 1.237 0.423 0 O-C-N 120.939 -1.101 . . . . 0.0 109.53 171.836 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 14' ' ' LEU . . . . . . . . . . . . . 25.0 tp -71.59 94.79 1.35 Allowed 'General case' 0 N--CA 1.453 -0.291 0 N-CA-C 107.572 -1.27 . . . . 0.0 107.572 173.078 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 4.3 mm-40 -61.89 -57.27 12.41 Favored 'General case' 0 N--CA 1.452 -0.327 0 N-CA-C 107.68 -1.23 . . . . 0.0 107.68 168.822 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 16' ' ' SER . . . . . 0.404 ' HA ' ' HA ' ' A' ' 21' ' ' PRO . 40.8 p -144.11 134.68 24.82 Favored 'General case' 0 N--CA 1.45 -0.457 0 N-CA-C 114.023 1.12 . . . . 0.0 114.023 -170.38 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 17' ' ' VAL . . . . . . . . . . . . . 65.9 t -72.52 165.07 3.16 Favored 'Isoleucine or valine' 0 C--O 1.24 0.577 0 N-CA-C 107.148 -1.427 . . . . 0.0 107.148 168.916 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 18' ' ' ASN . . . . . . . . . . . . . 0.0 OUTLIER -44.81 -39.56 5.4 Favored 'General case' 0 CA--C 1.534 0.33 0 C-N-CA 124.701 1.2 . . . . 0.0 112.185 174.776 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . -79.68 -81.11 0.76 Allowed Glycine 0 CA--C 1.526 0.734 0 C-N-CA 124.848 1.213 . . . . 0.0 110.609 177.565 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 37.7 mttt -141.99 166.29 22.46 Favored Pre-proline 0 CA--C 1.534 0.354 0 C-N-CA 127.057 2.143 . . . . 0.0 109.771 -173.517 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 21' ' ' PRO . . . . . 0.404 ' HA ' ' HA ' ' A' ' 16' ' ' SER . 30.8 Cg_endo -58.14 168.54 3.54 Favored 'Trans proline' 0 N--CA 1.453 -0.865 0 C-N-CA 122.283 1.989 . . . . 0.0 113.042 172.58 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 22' ' ' VAL . . . . . . . . . . . . . 10.1 p -117.36 166.79 11.34 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.48 0 C-N-CA 127.31 2.244 . . . . 0.0 107.747 -179.45 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 23' ' ' THR . . . . . . . . . . . . . 39.7 m -131.14 156.35 45.42 Favored 'General case' 0 C--O 1.238 0.454 0 O-C-N 120.019 -1.676 . . . . 0.0 110.09 -177.772 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 24' ' ' SER . . . . . . . . . . . . . 1.7 p -154.98 136.15 13.94 Favored 'General case' 0 N--CA 1.435 -1.216 0 C-N-CA 125.806 1.642 . . . . 0.0 108.783 -162.379 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 25' ' ' ASP . . . . . . . . . . . . . 3.2 m-20 -71.14 63.33 0.33 Allowed 'General case' 0 C--N 1.32 -0.713 0 C-N-CA 124.936 1.295 . . . . 0.0 108.472 165.049 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 26' ' ' LYS . . . . . . . . . . . . . 31.0 tttp 62.79 4.9 1.57 Allowed 'General case' 0 CA--C 1.546 0.802 0 C-N-CA 124.329 1.052 . . . . 0.0 113.487 -179.554 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 27' ' ' ASN . . . . . . . . . . . . . 84.7 m-20 -127.2 76.54 76.26 Favored Pre-proline 0 C--O 1.239 0.525 0 C-N-CA 125.89 1.676 . . . . 0.0 108.306 -178.213 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 28' ' ' PRO . . . . . . . . . . . . . 85.4 Cg_endo -77.67 165.88 26.32 Favored 'Trans proline' 0 N--CA 1.461 -0.434 0 C-N-CA 124.078 3.186 . . . . 0.0 111.791 -176.42 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 29' ' ' PRO . . . . . . . . . . . . . 38.5 Cg_endo -66.89 83.41 0.32 Allowed 'Trans proline' 0 N--CA 1.452 -0.938 0 C-N-CA 122.789 2.326 . . . . 0.0 108.392 161.946 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 30' ' ' GLU . . . . . 0.419 ' HA ' ' HA ' ' A' ' 13' ' ' VAL . 12.9 pt-20 -91.67 163.73 13.99 Favored 'General case' 0 C--O 1.239 0.54 0 O-C-N 120.725 -1.235 . . . . 0.0 108.763 163.17 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 31' ' ' ILE . . . . . . . . . . . . . 12.1 tt -130.42 153.97 39.83 Favored 'Isoleucine or valine' 0 N--CA 1.449 -0.49 0 N-CA-C 106.06 -1.83 . . . . 0.0 106.06 171.806 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 32' ' ' SER . . . . . . . . . . . . . 3.6 t -144.86 172.46 13.0 Favored 'General case' 0 N--CA 1.445 -0.722 0 N-CA-C 107.074 -1.454 . . . . 0.0 107.074 167.765 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 33' ' ' PHE . . . . . . . . . . . . . 66.1 m-85 -136.12 163.07 31.19 Favored 'General case' 0 N--CA 1.445 -0.687 0 N-CA-C 107.027 -1.472 . . . . 0.0 107.027 -179.328 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 34' ' ' GLY . . . . . . . . . . . . . . . 167.54 113.95 0.29 Allowed Glycine 0 CA--C 1.495 -1.164 0 C-N-CA 118.226 -1.94 . . . . 0.0 114.639 172.263 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 35' ' ' GLU . . . . . . . . . . . . . 2.4 pt-20 77.12 140.57 0.07 Allowed 'General case' 0 N--CA 1.443 -0.787 1 C-N-CA 134.381 5.073 . . . . 0.0 106.845 -169.121 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 8.8 mtpm? 47.12 20.27 0.13 Allowed 'General case' 0 CA--C 1.544 0.733 0 N-CA-C 116.245 1.943 . . . . 0.0 116.245 176.167 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 37' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER 53.56 33.97 17.49 Favored 'General case' 0 C--N 1.331 -0.235 0 C-N-CA 126.418 1.887 . . . . 0.0 113.155 -167.964 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 38' ' ' MET . . . . . 0.46 ' HA ' ' H ' ' A' ' 51' ' ' GLY . 0.1 OUTLIER -62.83 166.17 5.88 Favored 'General case' 0 N--CA 1.45 -0.451 0 N-CA-C 108.943 -0.762 . . . . 0.0 108.943 168.342 . . . . . . . . 3 3 . 1 . 007 nuclear orig core ' A' A ' 39' ' ' ILE . . . . . . . . . . . . . 9.1 mt -134.97 128.27 49.56 Favored 'Isoleucine or valine' 0 C--O 1.239 0.51 0 N-CA-C 107.471 -1.307 . . . . 0.0 107.471 -168.288 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 40' ' ' SER . . . . . . . . . . . . . 27.6 m -119.82 148.0 43.98 Favored 'General case' 0 CA--C 1.532 0.274 0 C-N-CA 124.735 1.214 . . . . 0.0 108.082 166.734 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 41' ' ' GLY . . . . . . . . . . . . . . . 173.23 178.61 43.34 Favored Glycine 0 CA--C 1.522 0.493 0 N-CA-C 109.725 -1.35 . . . . 0.0 109.725 -177.817 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 42' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -163.27 96.09 0.86 Allowed 'General case' 0 CA--C 1.536 0.418 0 O-C-N 121.942 -0.74 . . . . 0.0 110.863 -176.566 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 43' ' ' MET . . . . . . . . . . . . . 13.0 mmt -71.47 -68.73 0.43 Allowed 'General case' 0 N--CA 1.469 0.481 0 CA-C-N 118.456 0.571 . . . . 0.0 110.391 173.862 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 44' ' ' CYS . . . . . 1.286 ' SG ' ' SG ' ' A' ' 70' ' ' CYS . 45.6 t -135.59 -58.97 0.77 Allowed 'General case' 0 CA--C 1.527 0.089 0 N-CA-C 106.469 -1.678 . . . . 0.0 106.469 171.452 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 45' ' ' ASN . . . . . . . . . . . . . 25.7 m-20 -78.38 22.74 0.32 Allowed 'General case' 0 C--O 1.233 0.214 0 C-N-CA 126.811 2.044 . . . . 0.0 114.315 -175.118 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 46' ' ' ARG . . . . . . . . . . . . . 5.7 mpt_? 53.64 -173.85 0.04 OUTLIER 'General case' 0 C--O 1.225 -0.214 0 C-N-CA 124.028 0.931 . . . . 0.0 109.447 -163.737 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 47' ' ' PHE . . . . . . . . . . . . . 6.7 p90 -178.09 145.76 0.38 Allowed 'General case' 0 C--O 1.238 0.456 0 C-N-CA 126.399 1.88 . . . . 0.0 107.309 156.854 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 48' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -153.36 146.18 24.38 Favored 'General case' 0 C--N 1.324 -0.521 0 N-CA-C 107.749 -1.204 . . . . 0.0 107.749 177.23 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 49' ' ' GLY . . . . . . . . . . . . . . . -179.34 163.91 31.68 Favored Glycine 0 C--N 1.336 0.572 0 C-N-CA 120.398 -0.906 . . . . 0.0 112.615 179.133 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 50' ' ' GLU . . . . . . . . . . . . . 35.6 mt-10 -70.16 97.14 1.16 Allowed 'General case' 0 C--O 1.238 0.475 0 C-N-CA 124.809 1.244 . . . . 0.0 108.041 166.965 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 51' ' ' GLY . . . . . 0.46 ' H ' ' HA ' ' A' ' 38' ' ' MET . . . -72.08 175.58 41.97 Favored Glycine 0 CA--C 1.523 0.579 0 N-CA-C 110.416 -1.074 . . . . 0.0 110.416 155.888 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 52' ' ' LYS . . . . . . . . . . . . . 50.8 tttm -164.16 152.65 13.09 Favored 'General case' 0 C--N 1.332 -0.189 0 C-N-CA 125.795 1.638 . . . . 0.0 106.739 168.025 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 53' ' ' LEU . . . . . . . . . . . . . 46.2 tp -131.26 130.63 43.1 Favored 'General case' 0 C--O 1.232 0.179 0 C-N-CA 124.505 1.122 . . . . 0.0 109.169 170.813 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 40.1 t -139.37 -27.24 0.8 Allowed 'General case' 0 CA--C 1.535 0.399 0 C-N-CA 125.04 1.336 . . . . 0.0 111.292 177.832 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 55' ' ' ASN . . . . . . . . . . . . . 16.7 p-10 -146.41 17.96 1.34 Allowed 'General case' 0 CA--C 1.534 0.331 0 C-N-CA 124.486 1.114 . . . . 0.0 113.397 -153.319 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 56' ' ' GLY . . . . . . . . . . . . . . . 81.12 22.69 60.5 Favored Glycine 0 CA--C 1.525 0.692 0 CA-C-N 118.818 0.736 . . . . 0.0 112.958 -177.266 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 57' ' ' GLU . . . . . . . . . . . . . 35.8 tt0 -146.58 142.4 27.93 Favored 'General case' 0 C--O 1.237 0.425 0 C-N-CA 124.954 1.302 . . . . 0.0 109.183 -174.084 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 58' ' ' LEU . . . . . . . . . . . . . 57.9 tp -122.77 102.17 7.88 Favored 'General case' 0 CA--C 1.53 0.181 0 C-N-CA 127.115 2.166 . . . . 0.0 110.668 176.706 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 59' ' ' THR . . . . . . . . . . . . . 13.6 p -88.18 167.35 13.68 Favored 'General case' 0 CA--C 1.54 0.564 0 C-N-CA 124.611 1.164 . . . . 0.0 109.898 164.692 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 60' ' ' ALA . . . . . . . . . . . . . . . -132.23 107.54 8.65 Favored 'General case' 0 CA--C 1.528 0.131 0 C-N-CA 124.934 1.294 . . . . 0.0 109.574 163.069 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 61' ' ' LYS . . . . . . . . . . . . . 12.8 mttt -67.24 6.78 0.51 Allowed 'General case' 0 CA--C 1.54 0.585 0 N-CA-C 115.355 1.613 . . . . 0.0 115.355 -173.016 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 62' ' ' GLY . . . . . . . . . . . . . . . -150.35 -71.11 0.01 OUTLIER Glycine 0 CA--C 1.522 0.48 0 CA-C-N 120.818 1.645 . . . . 0.0 109.417 179.877 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 63' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER 60.55 89.75 0.07 Allowed 'General case' 0 N--CA 1.444 -0.728 0 C-N-CA 129.993 3.317 . . . . 0.0 113.261 179.304 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 64' ' ' ALA . . . . . . . . . . . . . . . -75.97 103.37 6.0 Favored 'General case' 0 C--O 1.236 0.393 0 C-N-CA 124.88 1.272 . . . . 0.0 111.239 -178.141 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 65' ' ' MET . . . . . . . . . . . . . 5.2 mtt -108.21 168.67 9.14 Favored 'General case' 0 N--CA 1.466 0.361 0 C-N-CA 124.0 0.92 . . . . 0.0 112.211 172.523 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 66' ' ' THR . . . . . . . . . . . . . 72.5 p -107.34 -163.96 0.94 Allowed 'General case' 0 CA--C 1.54 0.57 0 C-N-CA 126.392 1.877 . . . . 0.0 111.167 -176.474 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 67' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -141.01 84.26 1.92 Allowed 'General case' 0 N--CA 1.467 0.378 0 C-N-CA 124.282 1.033 . . . . 0.0 109.685 172.604 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 68' ' ' MET . . . . . . . . . . . . . 51.0 mtm -134.79 176.83 8.29 Favored 'General case' 0 C--N 1.324 -0.529 0 C-N-CA 129.566 3.147 . . . . 0.0 108.536 -178.641 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 69' ' ' MET . . . . . . . . . . . . . 1.6 pmm? -134.31 177.57 7.66 Favored 'General case' 0 N--CA 1.451 -0.392 0 C-N-CA 126.766 2.026 . . . . 0.0 109.872 170.114 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 70' ' ' CYS . . . . . 1.286 ' SG ' ' SG ' ' A' ' 44' ' ' CYS . 65.6 m -143.57 149.48 37.46 Favored 'General case' 0 C--N 1.33 -0.265 0 C-N-CA 126.37 1.868 . . . . 0.0 109.081 -170.037 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 71' ' ' ALA . . . . . . . . . . . . . . . -77.73 20.68 0.33 Allowed 'General case' 0 CA--C 1.539 0.524 0 N-CA-C 114.098 1.147 . . . . 0.0 114.098 -169.188 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 72' ' ' ASN . . . . . . . . . . . . . 21.8 t30 -147.22 142.26 16.73 Favored Pre-proline 0 C--O 1.236 0.393 0 N-CA-C 106.087 -1.82 . . . . 0.0 106.087 162.425 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 73' ' ' PRO . . . . . . . . . . . . . 30.4 Cg_endo -70.85 -21.98 27.71 Favored 'Trans proline' 0 C--N 1.346 0.399 0 C-N-CA 122.329 2.019 . . . . 0.0 112.621 -172.089 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 74' ' ' GLN . . . . . . . . . . . . . 39.0 tt0 -52.97 -38.3 62.04 Favored 'General case' 0 CA--C 1.534 0.332 0 C-N-CA 124.001 0.921 . . . . 0.0 111.581 -179.111 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 75' ' ' LEU . . . . . . . . . . . . . 32.5 mt -76.58 -31.37 57.46 Favored 'General case' 0 CA--C 1.533 0.312 0 C-N-CA 123.677 0.791 . . . . 0.0 111.732 -178.768 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 76' ' ' ASN . . . . . . . . . . . . . 3.2 t-20 -79.82 -14.34 58.75 Favored 'General case' 0 N--CA 1.469 0.52 0 C-N-CA 125.25 1.42 . . . . 0.0 110.991 179.975 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 77' ' ' GLU . . . . . . . . . . . . . 5.5 mm-40 -80.99 -44.83 17.53 Favored 'General case' 0 C--O 1.236 0.372 0 C-N-CA 126.265 1.826 . . . . 0.0 109.867 163.101 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 78' ' ' LEU . . . . . . . . . . . . . 23.9 mt -66.06 -36.21 82.61 Favored 'General case' 0 CA--C 1.51 -0.562 0 O-C-N 121.658 -0.651 . . . . 0.0 112.482 -171.822 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 79' ' ' ASP . . . . . . . . . . . . . 0.0 OUTLIER -61.65 -34.99 76.66 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-O 119.155 -0.45 . . . . 0.0 111.49 176.033 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 80' ' ' ASN . . . . . . . . . . . . . 11.2 t30 -75.61 -48.59 21.55 Favored 'General case' 0 N--CA 1.447 -0.591 0 N-CA-C 108.595 -0.891 . . . . 0.0 108.595 179.618 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 81' ' ' THR . . . . . . . . . . . . . 36.6 m -46.79 -59.8 2.82 Favored 'General case' 0 N--CA 1.449 -0.511 0 C-N-CA 125.175 1.39 . . . . 0.0 109.212 176.976 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 82' ' ' ILE . . . . . . . . . . . . . 4.6 tp -69.33 -34.77 64.25 Favored 'Isoleucine or valine' 0 C--O 1.237 0.407 0 O-C-N 121.615 -0.678 . . . . 0.0 111.914 -172.865 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 83' ' ' SER . . . . . . . . . . . . . 0.6 OUTLIER -58.94 -47.36 85.34 Favored 'General case' 0 N--CA 1.452 -0.365 0 N-CA-C 109.166 -0.679 . . . . 0.0 109.166 179.594 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 84' ' ' GLU . . . . . . . . . . . . . 16.8 tt0 -67.21 -42.8 83.51 Favored 'General case' 0 N--CA 1.447 -0.591 0 C-N-CA 124.453 1.101 . . . . 0.0 110.689 -179.163 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 85' ' ' MET . . . . . . . . . . . . . 48.4 mtp -59.66 -47.91 83.73 Favored 'General case' 0 C--N 1.343 0.317 0 CA-C-N 119.611 1.096 . . . . 0.0 110.115 -174.89 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 86' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -76.57 -20.3 56.96 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-O 118.824 -0.608 . . . . 0.0 112.114 -175.702 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 87' ' ' LYS . . . . . . . . . . . . . 3.3 tptt -71.93 -37.36 70.05 Favored 'General case' 0 N--CA 1.45 -0.43 0 N-CA-C 109.027 -0.731 . . . . 0.0 109.027 174.462 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 88' ' ' GLU . . . . . . . . . . . . . 89.2 mt-10 -89.24 -28.74 19.73 Favored 'General case' 0 C--O 1.233 0.218 0 CA-C-O 117.76 -1.114 . . . . 0.0 112.895 -173.106 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 89' ' ' GLY . . . . . . . . . . . . . . . 112.52 97.25 2.32 Favored Glycine 0 C--N 1.337 0.603 0 N-CA-C 109.483 -1.447 . . . . 0.0 109.483 -176.472 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 90' ' ' ALA . . . . . . . . . . . . . . . -78.89 128.86 33.88 Favored 'General case' 0 N--CA 1.449 -0.489 0 N-CA-C 108.02 -1.104 . . . . 0.0 108.02 174.514 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 91' ' ' GLN . . . . . . . . . . . . . 2.6 mp0 -62.8 140.65 58.78 Favored 'General case' 0 C--N 1.327 -0.402 0 N-CA-C 107.334 -1.358 . . . . 0.0 107.334 169.015 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 92' ' ' VAL . . . . . . . . . . . . . 25.4 t -126.45 114.6 38.85 Favored 'Isoleucine or valine' 0 N--CA 1.444 -0.753 0 C-N-CA 125.623 1.569 . . . . 0.0 108.14 -172.399 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 93' ' ' ASP . . . . . . . . . . . . . 14.4 m-20 -137.37 72.21 1.42 Allowed 'General case' 0 CA--C 1.538 0.486 0 C-N-CA 126.568 1.947 . . . . 0.0 106.709 -179.213 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 94' ' ' LEU . . . . . . . . . . . . . 0.9 OUTLIER -74.93 107.82 7.26 Favored 'General case' 0 N--CA 1.464 0.265 0 N-CA-C 106.694 -1.595 . . . . 0.0 106.694 168.311 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 95' ' ' THR . . . . . . . . . . . . . 2.2 t -71.93 -164.51 0.13 Allowed 'General case' 0 CA--C 1.54 0.564 0 C-N-CA 125.062 1.345 . . . . 0.0 108.313 172.127 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 96' ' ' ALA . . . . . . . . . . . . . . . -44.56 -49.26 10.2 Favored 'General case' 0 CA--C 1.543 0.68 0 O-C-N 121.26 -0.9 . . . . 0.0 112.725 -177.665 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 97' ' ' ASN . . . . . . . . . . . . . 31.3 p30 -157.66 28.44 0.28 Allowed 'General case' 0 CA--C 1.542 0.662 0 C-N-CA 125.707 1.603 . . . . 0.0 113.28 -174.529 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 98' ' ' GLN . . . . . . . . . . . . . 11.4 tt0 -137.72 121.91 18.05 Favored 'General case' 0 N--CA 1.466 0.329 0 C-N-CA 124.924 1.289 . . . . 0.0 107.953 173.822 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 99' ' ' LEU . . . . . . . . . . . . . 6.8 tp -69.43 123.63 21.77 Favored 'General case' 0 N--CA 1.451 -0.378 0 N-CA-C 105.793 -1.928 . . . . 0.0 105.793 172.666 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 100' ' ' THR . . . . . . . . . . . . . 3.7 m -121.64 113.82 20.29 Favored 'General case' 0 N--CA 1.452 -0.336 0 N-CA-C 105.698 -1.964 . . . . 0.0 105.698 172.478 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 101' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -121.01 150.76 40.64 Favored 'General case' 0 C--O 1.234 0.271 0 N-CA-C 107.345 -1.354 . . . . 0.0 107.345 -177.387 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 102' ' ' ALA . . . . . . . . . . . . . . . -144.86 161.37 39.47 Favored 'General case' 0 C--N 1.33 -0.277 0 C-N-CA 124.988 1.315 . . . . 0.0 108.595 172.745 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 103' ' ' THR . . . . . . . . . . . . . 2.9 m -155.78 -168.14 2.7 Favored 'General case' 0 N--CA 1.446 -0.656 0 C-N-CA 127.404 2.282 . . . . 0.0 105.331 170.178 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 104' ' ' ALA . . . . . . . . . . . . . . . -57.42 -46.56 83.37 Favored 'General case' 0 CA--C 1.535 0.396 0 O-C-N 120.313 -1.492 . . . . 0.0 110.971 161.874 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 105' ' ' LYS . . . . . . . . . . . . . 3.3 tmtt? -49.61 -64.8 0.7 Allowed 'General case' 0 N--CA 1.465 0.298 0 C-N-CA 125.257 1.423 . . . . 0.0 113.056 -170.685 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 106' ' ' GLN . . . . . . . . . . . . . 3.5 pt20 -166.83 -167.78 1.02 Allowed 'General case' 0 CA--C 1.536 0.411 0 C-N-CA 126.092 1.757 . . . . 0.0 108.437 -175.838 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 107' ' ' THR . . . . . . . . . . . . . 0.5 OUTLIER -124.0 149.05 46.47 Favored 'General case' 0 CA--C 1.533 0.324 0 N-CA-C 107.504 -1.295 . . . . 0.0 107.504 168.672 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 108' ' ' LEU . . . . . . . . . . . . . 9.5 mp -120.35 157.16 29.84 Favored 'General case' 0 C--O 1.239 0.53 0 C-N-CA 126.362 1.865 . . . . 0.0 108.979 178.307 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 109' ' ' THR . . . . . . . . . . . . . 3.5 m -136.69 93.4 2.86 Favored 'General case' 0 C--O 1.238 0.479 0 N-CA-C 108.935 -0.765 . . . . 0.0 108.935 176.14 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 110' ' ' TYR . . . . . . . . . . . . . 34.5 m-85 -90.21 155.92 18.68 Favored 'General case' 0 CA--C 1.534 0.337 0 CA-C-O 121.168 0.509 . . . . 0.0 109.795 172.451 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 111' ' ' LYS . . . . . . . . . . . . . 0.3 OUTLIER -108.83 143.66 37.73 Favored 'General case' 0 CA--C 1.518 -0.271 0 C-N-CA 124.857 1.263 . . . . 0.0 108.145 178.426 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 112' ' ' LEU . . . . . . . . . . . . . 45.8 tp -70.45 68.17 0.36 Allowed 'General case' 0 CA--C 1.543 0.689 0 C-N-CA 125.155 1.382 . . . . 0.0 109.578 168.158 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 113' ' ' ALA . . . . . . . . . . . . . . . -100.26 75.24 1.8 Allowed 'General case' 0 N--CA 1.464 0.265 0 N-CA-C 106.571 -1.64 . . . . 0.0 106.571 -179.956 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 114' ' ' ASP . . . . . . . . . . . . . 42.6 t0 . . . . . 0 C--N 1.326 -0.414 0 CA-C-O 121.539 0.685 . . . . 0.0 110.802 -160.256 . . . . . . . . 0 0 . 1 . 008 nuclear orig core ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 1.4 pmm? . . . . . 0 CA--C 1.536 0.427 0 N-CA-C 109.437 -0.579 . . . . 0.0 109.437 . . . . . . . . . 0 0 . 1 . 008 nuclear orig core ' A' A ' 2' ' ' VAL . . . . . . . . . . . . . 6.7 p -72.34 153.37 7.74 Favored 'Isoleucine or valine' 0 C--O 1.236 0.357 0 N-CA-C 109.363 -0.606 . . . . 0.0 109.363 174.202 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 3' ' ' THR . . . . . . . . . . . . . 0.5 OUTLIER -132.79 159.15 73.74 Favored Pre-proline 0 CA--C 1.532 0.25 0 C-N-CA 124.053 0.941 . . . . 0.0 109.976 171.829 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 4' ' ' PRO . . . . . . . . . . . . . 55.4 Cg_endo -64.77 -34.28 50.63 Favored 'Trans proline' 0 C--N 1.345 0.358 0 C-N-CA 123.102 2.534 . . . . 0.0 111.341 -176.728 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 5' ' ' GLU . . . . . . . . . . . . . 19.2 tt0 -52.21 -55.31 21.94 Favored 'General case' 0 N--CA 1.449 -0.476 0 C-N-CA 125.471 1.508 . . . . 0.0 110.146 175.636 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 6' ' ' GLN . . . . . . . . . . . . . 11.8 pt20 -70.14 20.79 0.04 OUTLIER 'General case' 0 CA--C 1.543 0.694 0 N-CA-C 114.243 1.201 . . . . 0.0 114.243 176.039 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 7' ' ' LEU . . . . . . . . . . . . . 76.0 mt -129.54 -56.1 1.15 Allowed 'General case' 0 N--CA 1.461 0.119 0 C-N-CA 124.87 1.268 . . . . 0.0 110.922 178.435 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 8' ' ' GLN . . . . . . . . . . . . . 6.3 mt-30 -44.59 -8.73 0.01 OUTLIER 'General case' 0 N--CA 1.474 0.759 0 C-N-CA 129.257 3.023 . . . . 0.0 117.969 -178.159 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 9' ' ' HIS . . . . . . . . . . . . . 19.4 p80 -148.88 35.72 0.77 Allowed 'General case' 0 C--N 1.325 -0.473 0 C-N-CA 123.531 0.733 . . . . 0.0 112.276 177.651 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 10' ' ' HIS . . . . . . . . . . . . . 91.5 m-70 -130.86 165.1 23.77 Favored 'General case' 0 C--O 1.235 0.3 0 CA-C-O 121.626 0.727 . . . . 0.0 110.695 174.972 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 11' ' ' ARG . . . . . . . . . . . . . 60.3 ttt180 -128.94 139.46 52.1 Favored 'General case' 0 C--O 1.235 0.317 0 C-N-CA 126.252 1.821 . . . . 0.0 107.057 -173.606 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 12' ' ' PHE . . . . . . . . . . . . . 45.0 m-85 -137.43 112.28 8.93 Favored 'General case' 0 N--CA 1.441 -0.883 0 C-N-CA 125.181 1.392 . . . . 0.0 107.341 -164.684 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 13' ' ' VAL . . . . . . . . . . . . . 2.8 t -103.67 144.31 14.31 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.482 0 N-CA-C 106.709 -1.589 . . . . 0.0 106.709 -174.401 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 14' ' ' LEU . . . . . . . . . . . . . 11.5 tp -79.08 96.08 5.71 Favored 'General case' 0 N--CA 1.449 -0.494 0 N-CA-C 109.513 -0.551 . . . . 0.0 109.513 -169.834 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 1.4 mm-40 -76.3 -39.14 54.95 Favored 'General case' 0 N--CA 1.452 -0.344 0 CA-C-O 118.46 -0.781 . . . . 0.0 111.292 -170.943 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 2.6 t -156.03 156.73 34.92 Favored 'General case' 0 C--O 1.237 0.417 0 CA-C-N 119.721 1.146 . . . . 0.0 111.126 161.126 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 17' ' ' VAL . . . . . . . . . . . . . 21.3 t -86.3 171.66 1.12 Allowed 'Isoleucine or valine' 0 CA--C 1.534 0.331 0 C-N-CA 126.017 1.727 . . . . 0.0 107.504 172.519 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 18' ' ' ASN . . . . . . . . . . . . . 20.6 t30 -53.16 -35.59 59.95 Favored 'General case' 0 CA--C 1.53 0.195 0 C-N-CA 124.304 1.041 . . . . 0.0 112.494 166.393 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . -93.97 -54.16 1.67 Allowed Glycine 0 CA--C 1.525 0.659 0 C-N-CA 123.755 0.693 . . . . 0.0 112.806 -170.336 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 16.6 ptpt -160.0 163.83 21.45 Favored Pre-proline 0 N--CA 1.465 0.307 0 C-N-CA 125.665 1.586 . . . . 0.0 108.806 -174.723 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 21' ' ' PRO . . . . . . . . . . . . . 59.1 Cg_endo -70.93 171.21 16.2 Favored 'Trans proline' 0 N--CA 1.454 -0.815 0 CA-C-N 120.806 1.324 . . . . 0.0 110.973 170.67 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 22' ' ' VAL . . . . . . . . . . . . . 2.7 p -135.56 136.31 50.73 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.369 0 C-N-CA 126.552 1.941 . . . . 0.0 107.155 -178.155 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 23' ' ' THR . . . . . . . . . . . . . 0.8 OUTLIER -144.92 123.99 12.83 Favored 'General case' 0 C--O 1.238 0.459 0 N-CA-C 107.005 -1.48 . . . . 0.0 107.005 -175.398 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 24' ' ' SER . . . . . . . . . . . . . 14.7 m -123.26 41.25 3.52 Favored 'General case' 0 C--O 1.235 0.333 0 C-N-CA 124.957 1.303 . . . . 0.0 110.146 -163.958 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 25' ' ' ASP . . . . . . . . . . . . . 38.7 m-20 62.45 -78.46 0.03 OUTLIER 'General case' 0 C--O 1.234 0.254 0 C-N-CA 127.972 2.509 . . . . 0.0 108.582 -167.953 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 26' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -131.4 -8.58 3.72 Favored 'General case' 0 CA--C 1.523 -0.067 0 N-CA-C 115.684 1.735 . . . . 0.0 115.684 178.198 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 27' ' ' ASN . . . . . . . . . . . . . 13.2 m120 -115.41 75.91 4.92 Favored Pre-proline 0 N--CA 1.471 0.595 0 CA-C-N 120.167 1.349 . . . . 0.0 111.328 -175.624 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 28' ' ' PRO . . . . . . . . . . . . . 49.0 Cg_endo -66.53 162.41 36.93 Favored 'Trans proline' 0 CA--C 1.539 0.769 0 C-N-CA 123.392 2.728 . . . . 0.0 113.051 -177.611 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 29' ' ' PRO . . . . . . . . . . . . . 19.5 Cg_endo -66.04 64.85 0.45 Allowed 'Trans proline' 0 CA--C 1.54 0.802 0 C-N-CA 125.088 3.859 . . . . 0.0 113.443 170.833 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 30' ' ' GLU . . . . . . . . . . . . . 10.8 pt-20 -76.38 169.77 17.62 Favored 'General case' 0 CA--C 1.544 0.733 0 O-C-N 119.709 -1.869 . . . . 0.0 111.301 177.779 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 31' ' ' ILE . . . . . . . . . . . . . 16.8 tt -139.04 159.77 29.54 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.406 0 C-N-CA 127.212 2.205 . . . . 0.0 107.013 170.96 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 32' ' ' SER . . . . . . . . . . . . . 45.4 p -149.33 177.02 10.04 Favored 'General case' 0 N--CA 1.444 -0.773 0 C-N-CA 125.747 1.619 . . . . 0.0 107.345 167.453 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 33' ' ' PHE . . . . . . . . . . . . . 39.8 m-85 -134.65 148.8 50.45 Favored 'General case' 0 N--CA 1.447 -0.575 0 N-CA-C 106.458 -1.682 . . . . 0.0 106.458 175.284 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 34' ' ' GLY . . . . . . . . . . . . . . . -163.68 -176.23 35.4 Favored Glycine 0 N--CA 1.445 -0.749 0 N-CA-C 107.453 -2.259 . . . . 0.0 107.453 178.419 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 35' ' ' GLU . . . . . . . . . . . . 0.275 1.9 mt-10 47.36 -162.95 0.03 OUTLIER 'General case' 0 CA--C 1.538 0.506 0 C-N-CA 124.569 1.148 . . . . 0.0 110.083 -171.329 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 6.6 mmpt? -69.29 56.15 0.11 Allowed 'General case' 0 CA--C 1.546 0.791 0 O-C-N 119.207 -2.183 . . . . 0.0 112.644 -174.499 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 37' ' ' MET . . . . . . . . . . . . . 79.4 mmm 46.89 86.69 0.02 OUTLIER 'General case' 0 CA--C 1.539 0.549 0 C-N-CA 126.055 1.742 . . . . 0.0 110.401 -156.698 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 38' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -123.6 4.29 8.94 Favored 'General case' 0 N--CA 1.476 0.836 0 N-CA-C 114.062 1.134 . . . . 0.0 114.062 -175.489 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 39' ' ' ILE . . . . . . . . . . . . . 24.2 mt 46.92 133.47 0.0 OUTLIER 'Isoleucine or valine' 0 CA--C 1.539 0.555 1 C-N-CA 133.135 4.574 . . . . 0.0 111.963 179.888 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 40' ' ' SER . . . . . . . . . . . . . 8.3 m -140.2 101.95 4.26 Favored 'General case' 0 C--N 1.329 -0.31 0 O-C-N 120.163 -1.585 . . . . 0.0 107.227 178.792 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 41' ' ' GLY . . . . . . . . . . . . . . . -145.2 174.2 25.33 Favored Glycine 0 C--N 1.336 0.579 0 CA-C-N 118.841 0.746 . . . . 0.0 112.558 179.286 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 42' ' ' SER . . . . . . . . . . . . . 13.3 p -149.79 85.44 1.42 Allowed 'General case' 0 N--CA 1.451 -0.388 0 C-N-CA 123.108 0.563 . . . . 0.0 110.665 -178.635 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 43' ' ' MET . . . . . . . . . . . . . 3.4 mmt -59.52 -46.5 88.66 Favored 'General case' 0 N--CA 1.462 0.158 0 CA-C-O 122.081 0.943 . . . . 0.0 108.61 167.675 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 44' ' ' CYS . . . . . 1.305 ' SG ' ' SG ' ' A' ' 70' ' ' CYS . 36.5 t -149.32 -66.87 0.22 Allowed 'General case' 0 N--CA 1.442 -0.869 0 C-N-CA 125.178 1.391 . . . . 0.0 107.311 161.363 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 45' ' ' ASN . . . . . . . . . . . . . 3.0 m120 -87.23 22.42 2.11 Favored 'General case' 0 C--N 1.327 -0.387 0 C-N-CA 124.244 1.018 . . . . 0.0 111.884 -155.792 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 46' ' ' ARG . . . . . . . . . . . . . 7.0 mmm180 51.41 162.26 0.0 OUTLIER 'General case' 0 N--CA 1.465 0.291 0 C-N-CA 127.461 2.304 . . . . 0.0 113.09 -162.853 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 47' ' ' PHE . . . . . . . . . . . . . 49.6 p90 -163.64 163.74 24.26 Favored 'General case' 0 C--N 1.324 -0.521 0 C-N-CA 124.826 1.251 . . . . 0.0 109.521 170.03 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 48' ' ' SER . . . . . . . . . . . . . 6.2 m -158.79 165.66 33.75 Favored 'General case' 0 N--CA 1.44 -0.94 0 C-N-CA 126.866 2.066 . . . . 0.0 108.113 173.134 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 49' ' ' GLY . . . . . . . . . . . . . . . -178.59 167.71 38.32 Favored Glycine 0 CA--C 1.519 0.31 0 N-CA-C 110.354 -1.098 . . . . 0.0 110.354 166.981 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 50' ' ' GLU . . . . . . . . . . . . . 32.6 mt-10 -61.69 98.46 0.09 Allowed 'General case' 0 C--N 1.33 -0.253 0 N-CA-C 109.3 -0.629 . . . . 0.0 109.3 176.621 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 51' ' ' GLY . . . . . . . . . . . . . . . -60.14 -67.91 1.93 Allowed Glycine 0 C--N 1.335 0.475 0 O-C-N 124.485 1.116 . . . . 0.0 110.998 -176.94 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 52' ' ' LYS . . . . . . . . . . . . . 0.4 OUTLIER 64.49 164.27 0.14 Allowed 'General case' 0 N--CA 1.453 -0.282 0 C-N-CA 125.173 1.389 . . . . 0.0 109.187 -166.73 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 53' ' ' LEU . . . . . . . . . . . . . 5.9 tp -164.58 111.08 1.02 Allowed 'General case' 0 N--CA 1.45 -0.435 0 N-CA-C 107.429 -1.322 . . . . 0.0 107.429 164.065 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 1.4 t -148.95 -11.59 0.32 Allowed 'General case' 0 C--O 1.234 0.282 0 CA-C-O 117.561 -1.209 . . . . 0.0 112.701 178.087 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 55' ' ' ASN . . . . . . . . . . . . . 0.8 OUTLIER -156.96 46.87 0.42 Allowed 'General case' 0 CA--C 1.538 0.501 0 C-N-CA 124.897 1.279 . . . . 0.0 109.347 -170.201 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 56' ' ' GLY . . . . . . . . . . . . . . . 66.65 5.87 32.87 Favored Glycine 0 CA--C 1.533 1.192 0 N-CA-C 115.968 1.147 . . . . 0.0 115.968 170.425 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 57' ' ' GLU . . . . . . . . . . . . . 18.3 tt0 -132.6 110.61 10.56 Favored 'General case' 0 C--O 1.239 0.504 0 CA-C-N 118.579 1.189 . . . . 0.0 109.183 -164.633 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 58' ' ' LEU . . . . . . . . . . . . . 27.2 tp -89.69 104.44 17.0 Favored 'General case' 0 C--O 1.234 0.267 0 C-N-CA 126.364 1.866 . . . . 0.0 108.148 177.912 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 59' ' ' THR . . . . . . . . . . . . . 0.8 OUTLIER -91.72 168.91 11.14 Favored 'General case' 0 C--N 1.327 -0.393 0 CA-C-O 121.809 0.814 . . . . 0.0 110.302 169.706 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 60' ' ' ALA . . . . . . . . . . . . . . . -123.52 131.62 53.68 Favored 'General case' 0 N--CA 1.45 -0.426 0 N-CA-C 107.173 -1.417 . . . . 0.0 107.173 148.593 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 61' ' ' LYS . . . . . . . . . . . . . 24.3 ttmt -79.54 82.6 5.64 Favored 'General case' 0 N--CA 1.454 -0.24 0 N-CA-C 107.841 -1.17 . . . . 0.0 107.841 173.909 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 62' ' ' GLY . . . . . . . . . . . . . . . 103.99 -48.68 0.98 Allowed Glycine 0 CA--C 1.529 0.958 0 CA-C-O 118.827 -0.985 . . . . 0.0 113.044 174.402 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 63' ' ' LEU . . . . . . . . . . . . . 3.5 tp 64.88 106.29 0.03 OUTLIER 'General case' 0 N--CA 1.442 -0.86 0 C-N-CA 130.804 3.642 . . . . 0.0 113.777 -176.789 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 64' ' ' ALA . . . . . . . . . . . . . . . -77.69 146.25 36.13 Favored 'General case' 0 CA--C 1.533 0.291 0 N-CA-C 108.961 -0.755 . . . . 0.0 108.961 171.206 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 65' ' ' MET . . . . . . . . . . . . . 76.0 mtp -140.83 -164.91 1.83 Allowed 'General case' 0 CA--C 1.542 0.668 0 C-N-CA 126.58 1.952 . . . . 0.0 108.491 179.261 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 66' ' ' THR . . . . . . . . . . . . . 27.2 p -130.76 -165.89 1.62 Allowed 'General case' 0 N--CA 1.472 0.625 0 CA-C-N 120.062 1.301 . . . . 0.0 109.909 168.149 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 67' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -136.55 76.92 1.62 Allowed 'General case' 0 C--O 1.233 0.188 0 C-N-CA 126.167 1.787 . . . . 0.0 108.822 -179.199 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 68' ' ' MET . . . . . . . . . . . . . 15.3 ptp -124.51 158.23 33.41 Favored 'General case' 0 CA--C 1.533 0.323 0 C-N-CA 124.297 1.039 . . . . 0.0 111.97 -177.028 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 69' ' ' MET . . . . . . . . . . . . . 0.1 OUTLIER -73.97 162.31 29.18 Favored 'General case' 0 CA--C 1.533 0.305 0 C-N-CA 123.643 0.777 . . . . 0.0 109.424 171.432 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 70' ' ' CYS . . . . . 1.305 ' SG ' ' SG ' ' A' ' 44' ' ' CYS . 1.2 m -119.01 -179.53 3.85 Favored 'General case' 0 CA--C 1.537 0.476 0 C-N-CA 126.284 1.834 . . . . 0.0 108.692 161.551 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 71' ' ' ALA . . . . . . . . . . . . . . . -82.79 -26.6 31.65 Favored 'General case' 0 CA--C 1.535 0.393 0 C-N-CA 124.555 1.142 . . . . 0.0 111.615 166.012 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 72' ' ' ASN . . . . . . . . . . . . . 1.2 m-20 -119.97 152.67 54.43 Favored Pre-proline 0 N--CA 1.467 0.397 0 C-N-CA 123.962 0.905 . . . . 0.0 110.474 -172.167 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 73' ' ' PRO . . . . . . . . . . . . . 49.0 Cg_endo -70.39 -46.2 1.04 Allowed 'Trans proline' 0 N--CA 1.458 -0.585 0 C-N-CA 124.008 3.138 . . . . 0.0 111.198 173.146 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 74' ' ' GLN . . . . . . . . . . . . . 64.3 tt0 -51.31 -35.34 37.38 Favored 'General case' 0 C--O 1.221 -0.424 0 C-N-CA 123.569 0.748 . . . . 0.0 110.85 -174.172 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 75' ' ' LEU . . . . . . . . . . . . . 87.5 mt -66.33 -38.88 88.7 Favored 'General case' 0 CA--C 1.538 0.519 0 C-N-CA 123.686 0.794 . . . . 0.0 111.701 -177.373 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 76' ' ' ASN . . . . . . . . . . . . . 3.0 m-80 -79.07 -20.46 48.74 Favored 'General case' 0 N--CA 1.475 0.791 0 CA-C-N 119.506 1.048 . . . . 0.0 111.478 174.994 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 77' ' ' GLU . . . . . . . . . . . . . 0.7 OUTLIER -65.48 -38.18 89.02 Favored 'General case' 0 CA--C 1.545 0.766 0 O-C-N 121.056 -1.027 . . . . 0.0 109.48 164.918 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 78' ' ' LEU . . . . . . . . . . . . . 32.4 mt -80.34 -17.62 51.47 Favored 'General case' 0 N--CA 1.453 -0.3 0 CA-C-O 118.039 -0.982 . . . . 0.0 113.364 -174.847 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 79' ' ' ASP . . . . . . . . . . . . . 4.8 t70 -46.72 -57.52 4.76 Favored 'General case' 0 N--CA 1.469 0.476 0 C-N-CA 125.165 1.386 . . . . 0.0 109.406 162.511 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 80' ' ' ASN . . . . . . . . . . . . . 69.8 m-80 -74.48 -36.8 63.3 Favored 'General case' 0 N--CA 1.448 -0.544 0 CA-C-N 115.258 -0.883 . . . . 0.0 108.973 -171.818 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 81' ' ' THR . . . . . . . . . . . . . 28.0 m -54.49 -51.03 66.36 Favored 'General case' 0 CA--C 1.54 0.579 0 C-N-CA 124.052 0.941 . . . . 0.0 110.117 177.679 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 82' ' ' ILE . . . . . . . . . . . . . 7.0 tp -73.86 -33.27 36.7 Favored 'Isoleucine or valine' 0 C--N 1.345 0.385 0 CA-C-N 119.719 1.145 . . . . 0.0 111.015 -179.251 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 83' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -58.4 -53.24 60.58 Favored 'General case' 0 C--O 1.236 0.371 0 N-CA-C 108.832 -0.803 . . . . 0.0 108.832 178.713 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 84' ' ' GLU . . . . . . . . . . . . . 14.2 tp10 -75.6 -3.01 31.97 Favored 'General case' 0 CA--C 1.542 0.64 0 C-N-CA 124.873 1.269 . . . . 0.0 112.07 -174.667 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 85' ' ' MET . . . . . . . . . . . . . 84.7 mtp -107.45 -5.16 17.83 Favored 'General case' 0 CA--C 1.535 0.383 0 C-N-CA 124.338 1.055 . . . . 0.0 113.212 174.307 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 86' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -105.55 -22.86 12.9 Favored 'General case' 0 N--CA 1.475 0.802 0 CA-C-N 120.639 1.563 . . . . 0.0 111.628 173.818 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 87' ' ' LYS . . . . . . . . . . . . . 8.1 tttm -68.36 -44.6 74.88 Favored 'General case' 0 CA--C 1.543 0.707 0 N-CA-C 110.172 -0.307 . . . . 0.0 110.172 -169.035 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 88' ' ' GLU . . . . . . . . . . . . . 35.4 mt-10 -82.36 -14.67 54.89 Favored 'General case' 0 N--CA 1.468 0.425 0 C-N-CA 126.562 1.945 . . . . 0.0 112.265 177.581 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 89' ' ' GLY . . . . . . . . . . . . . . . 98.54 105.03 2.49 Favored Glycine 0 C--N 1.337 0.617 0 N-CA-C 110.572 -1.011 . . . . 0.0 110.572 -175.934 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 90' ' ' ALA . . . . . . . . . . . . . . . -74.16 138.08 43.58 Favored 'General case' 0 C--O 1.232 0.15 0 N-CA-C 108.596 -0.89 . . . . 0.0 108.596 171.57 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 91' ' ' GLN . . . . . . . . . . . . . 0.4 OUTLIER -64.81 129.05 38.3 Favored 'General case' 0 C--O 1.239 0.542 0 N-CA-C 105.231 -2.137 . . . . 0.0 105.231 161.039 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 92' ' ' VAL . . . . . . . . . . . . . 7.6 p -125.53 107.69 18.31 Favored 'Isoleucine or valine' 0 N--CA 1.447 -0.588 0 N-CA-C 106.762 -1.57 . . . . 0.0 106.762 -170.235 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 93' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -122.17 81.63 1.86 Allowed 'General case' 0 C--N 1.324 -0.521 0 N-CA-C 106.716 -1.587 . . . . 0.0 106.716 -179.213 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 94' ' ' LEU . . . . . . . . . . . . . 2.3 tm? -82.9 98.52 9.24 Favored 'General case' 0 CA--C 1.51 -0.572 0 N-CA-C 106.034 -1.839 . . . . 0.0 106.034 166.961 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 95' ' ' THR . . . . . . . . . . . . . 3.1 m -83.05 170.87 14.38 Favored 'General case' 0 C--N 1.316 -0.868 0 CA-C-N 112.195 -2.275 . . . . 0.0 106.182 172.501 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 96' ' ' ALA . . . . . . . . . . . . . . . -44.84 -32.63 1.64 Allowed 'General case' 0 CA--C 1.545 0.761 0 N-CA-C 116.395 1.998 . . . . 0.0 116.395 -160.877 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 97' ' ' ASN . . . . . . . . . . . . . 0.2 OUTLIER -141.11 9.69 2.12 Favored 'General case' 0 N--CA 1.472 0.665 0 CA-C-N 120.74 1.609 . . . . 0.0 113.035 173.16 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 98' ' ' GLN . . . . . . . . . . . . . 12.9 tt0 -143.5 129.79 19.87 Favored 'General case' 0 CA--C 1.52 -0.182 0 O-C-N 120.484 -1.385 . . . . 0.0 109.216 -169.874 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 99' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -91.34 123.12 34.54 Favored 'General case' 0 N--CA 1.444 -0.765 0 C-N-CA 125.298 1.439 . . . . 0.0 109.045 179.642 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 100' ' ' THR . . . . . . . . . . . . . 79.7 m -98.87 115.87 29.82 Favored 'General case' 0 C--N 1.323 -0.584 0 C-N-CA 125.883 1.673 . . . . 0.0 106.495 165.83 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 101' ' ' LEU . . . . . . . . . . . . . 1.4 mm? -110.7 126.22 54.31 Favored 'General case' 0 CA--C 1.501 -0.924 0 N-CA-C 106.649 -1.612 . . . . 0.0 106.649 171.356 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 102' ' ' ALA . . . . . . . . . . . . . . . -138.02 153.21 49.4 Favored 'General case' 0 C--N 1.323 -0.545 0 O-C-N 124.396 1.06 . . . . 0.0 109.807 174.171 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 103' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -160.51 174.08 14.59 Favored 'General case' 0 N--CA 1.443 -0.78 0 C-N-CA 126.026 1.731 . . . . 0.0 108.04 177.526 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 104' ' ' ALA . . . . . . . . . . . . . . . -53.09 -34.6 57.35 Favored 'General case' 0 C--O 1.231 0.079 0 C-N-CA 123.662 0.785 . . . . 0.0 112.731 173.915 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 105' ' ' LYS . . . . . . . . . . . . . 1.6 mmpm? -62.84 -80.57 0.03 OUTLIER 'General case' 0 N--CA 1.455 -0.179 0 CA-C-N 118.545 0.611 . . . . 0.0 111.178 172.635 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 106' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -150.38 -172.73 4.25 Favored 'General case' 0 N--CA 1.453 -0.304 0 C-N-CA 125.812 1.645 . . . . 0.0 108.241 -164.523 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 107' ' ' THR . . . . . . . . . . . . . 15.3 t -144.36 145.78 32.16 Favored 'General case' 0 N--CA 1.451 -0.389 0 C-N-CA 124.826 1.25 . . . . 0.0 108.303 -174.895 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 108' ' ' LEU . . . . . . . . . . . . . 4.2 mp -134.4 162.16 32.99 Favored 'General case' 0 N--CA 1.449 -0.491 0 C-N-CA 128.018 2.527 . . . . 0.0 108.725 -165.788 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 109' ' ' THR . . . . . . . . . . . . . 57.8 m -133.66 110.3 9.77 Favored 'General case' 0 C--N 1.329 -0.315 0 N-CA-C 107.744 -1.206 . . . . 0.0 107.744 171.455 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 110' ' ' TYR . . . . . . . . . . . . . 95.2 m-85 -98.93 161.4 13.65 Favored 'General case' 0 N--CA 1.453 -0.301 0 N-CA-C 108.608 -0.886 . . . . 0.0 108.608 167.787 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 111' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -123.06 133.36 54.32 Favored 'General case' 0 CA--C 1.517 -0.316 0 CA-C-O 117.964 -1.017 . . . . 0.0 108.338 -175.614 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 112' ' ' LEU . . . . . . . . . . . . . 28.0 tp -58.8 103.47 0.17 Allowed 'General case' 0 C--O 1.232 0.175 0 N-CA-C 107.018 -1.475 . . . . 0.0 107.018 167.567 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 113' ' ' ALA . . . . . . . . . . . . . . . -147.17 77.03 1.44 Allowed 'General case' 0 C--N 1.33 -0.275 0 N-CA-C 107.267 -1.383 . . . . 0.0 107.267 -175.577 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 114' ' ' ASP . . . . . . . . . . . . 0.251 56.9 p30 . . . . . 0 C--N 1.331 -0.199 0 CA-C-O 124.205 1.955 . . . . 0.0 112.02 -173.927 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 11.6 ttp . . . . . 0 CA--C 1.534 0.346 0 N-CA-C 113.226 0.825 . . . . 0.0 113.226 . . . . . . . . . 0 0 . 1 . 009 nuclear orig core ' A' A ' 2' ' ' VAL . . . . . . . . . . . . . 7.1 p 42.96 66.85 0.12 Allowed 'Isoleucine or valine' 0 C--N 1.334 -0.109 0 C-N-CA 124.744 1.218 . . . . 0.0 111.233 145.581 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 3' ' ' THR . . . . . . . . . . . . . 71.5 p -79.86 161.72 65.12 Favored Pre-proline 0 C--N 1.328 -0.363 0 C-N-CA 118.034 -1.466 . . . . 0.0 108.976 -167.599 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 4' ' ' PRO . . . . . . . . . . . . . 15.7 Cg_endo -54.37 -42.3 68.94 Favored 'Trans proline' 0 CA--C 1.532 0.411 0 C-N-CA 122.236 1.957 . . . . 0.0 112.644 175.066 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 5' ' ' GLU . . . . . . . . . . . . . 1.2 tm-20 -51.13 -60.61 2.91 Favored 'General case' 0 C--N 1.329 -0.322 0 C-N-CA 126.068 1.747 . . . . 0.0 111.539 -175.951 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 6' ' ' GLN . . . . . . . . . . . . . 18.1 pt20 -66.03 15.42 0.03 OUTLIER 'General case' 0 CA--C 1.54 0.558 0 C-N-CA 127.333 2.253 . . . . 0.0 114.242 -177.711 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 7' ' ' LEU . . . . . . . . . . . . . 67.3 mt -133.93 -48.03 0.8 Allowed 'General case' 0 CA--C 1.522 -0.115 0 C-N-CA 125.345 1.458 . . . . 0.0 111.254 -172.57 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 8' ' ' GLN . . . . . . . . . . . . . 17.5 mt-30 -57.74 -4.1 0.26 Allowed 'General case' 0 CA--C 1.543 0.701 0 N-CA-C 115.681 1.734 . . . . 0.0 115.681 -179.54 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 9' ' ' HIS . . . . . . . . . . . . . 9.4 m-70 -133.26 15.4 4.15 Favored 'General case' 0 CA--C 1.538 0.511 0 C-N-CA 124.569 1.148 . . . . 0.0 112.624 174.333 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 10' ' ' HIS . . . . . . . . . . . . . 63.8 m-70 -130.55 109.99 11.09 Favored 'General case' 0 CA--C 1.539 0.554 0 C-N-CA 125.136 1.374 . . . . 0.0 109.885 -169.118 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 11' ' ' ARG . . . . . . . . . . . . . 32.3 ttt180 -68.64 150.69 47.66 Favored 'General case' 0 N--CA 1.474 0.732 0 C-N-CA 125.231 1.412 . . . . 0.0 110.765 175.127 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 12' ' ' PHE . . . . . . . . . . . . . 23.0 m-85 -136.48 157.55 46.52 Favored 'General case' 0 N--CA 1.451 -0.411 0 CA-C-O 121.693 0.758 . . . . 0.0 109.3 169.351 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 13' ' ' VAL . . . . . . . . . . . . . 11.4 p -132.97 150.59 33.04 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.336 0 O-C-N 120.992 -1.068 . . . . 0.0 109.958 175.754 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 14' ' ' LEU . . . . . . . . . . . . . 30.6 tp -80.1 97.57 6.91 Favored 'General case' 0 N--CA 1.454 -0.258 0 N-CA-C 108.001 -1.111 . . . . 0.0 108.001 177.53 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 3.1 mm-40 -68.24 -55.96 10.38 Favored 'General case' 0 C--N 1.323 -0.546 0 C-N-CA 125.184 1.393 . . . . 0.0 109.584 172.737 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 6.1 p -148.56 164.53 33.96 Favored 'General case' 0 N--CA 1.449 -0.478 0 CA-C-O 122.445 1.117 . . . . 0.0 110.219 -175.75 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 17' ' ' VAL . . . . . 0.466 HG11 ' H ' ' A' ' 18' ' ' ASN . 1.7 t -109.78 -164.64 0.21 Allowed 'Isoleucine or valine' 0 N--CA 1.445 -0.681 0 N-CA-C 104.892 -2.262 . . . . 0.0 104.892 -172.07 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 18' ' ' ASN . . . . . 0.466 ' H ' HG11 ' A' ' 17' ' ' VAL . 2.0 p-10 -44.47 -38.48 4.12 Favored 'General case' 0 CA--C 1.538 0.482 0 C-N-CA 126.902 2.081 . . . . 0.0 113.485 -171.465 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . -141.78 -44.89 0.06 OUTLIER Glycine 0 CA--C 1.523 0.543 0 C-N-CA 125.22 1.39 . . . . 0.0 110.539 169.616 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 0.5 OUTLIER -81.14 158.07 70.2 Favored Pre-proline 0 CA--C 1.534 0.336 0 C-N-CA 123.857 0.863 . . . . 0.0 111.472 -170.11 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 21' ' ' PRO . . . . . . . . . . . . . 80.2 Cg_endo -79.21 172.58 14.52 Favored 'Trans proline' 0 N--CA 1.457 -0.655 0 C-N-CA 123.223 2.615 . . . . 0.0 110.954 178.803 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 22' ' ' VAL . . . . . . . . . . . . . 88.7 t -94.81 157.17 3.08 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.422 0 N-CA-C 107.691 -1.226 . . . . 0.0 107.691 162.938 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 23' ' ' THR . . . . . . . . . . . . . 7.5 p -134.58 87.83 2.39 Favored 'General case' 0 N--CA 1.444 -0.75 0 N-CA-C 107.35 -1.352 . . . . 0.0 107.35 166.513 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 24' ' ' SER . . . . . . . . . . . . . 0.6 OUTLIER -159.89 135.19 8.16 Favored 'General case' 0 N--CA 1.447 -0.612 0 N-CA-C 105.669 -1.975 . . . . 0.0 105.669 172.234 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 25' ' ' ASP . . . . . . . . . . . . . 54.9 t0 -136.41 -42.18 0.63 Allowed 'General case' 0 C--N 1.324 -0.523 0 C-N-CA 126.678 1.991 . . . . 0.0 108.959 -174.086 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 26' ' ' LYS . . . . . . . . . . . . . 17.9 pttt -48.45 -45.98 37.25 Favored 'General case' 0 CA--C 1.516 -0.349 0 C-N-CA 125.496 1.518 . . . . 0.0 111.797 177.79 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 27' ' ' ASN . . . . . . . . . . . . . 0.2 OUTLIER -162.14 87.07 1.49 Allowed Pre-proline 0 C--N 1.325 -0.486 0 C-N-CA 130.022 3.329 . . . . 0.0 107.443 174.319 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 28' ' ' PRO . . . . . . . . . . . . . 17.0 Cg_endo -60.03 162.2 17.1 Favored 'Trans proline' 0 C--N 1.349 0.583 0 C-N-CA 122.972 2.448 . . . . 0.0 113.737 177.154 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 29' ' ' PRO . . . . . . . . . . . . . 17.9 Cg_endo -60.69 103.15 0.21 Allowed 'Trans proline' 0 N--CA 1.445 -1.359 0 C-N-CA 122.104 1.869 . . . . 0.0 108.401 152.388 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 30' ' ' GLU . . . . . . . . . . . . . 20.2 pt-20 -126.11 170.27 11.94 Favored 'General case' 0 C--N 1.323 -0.584 0 C-N-CA 125.578 1.551 . . . . 0.0 109.708 -179.905 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 31' ' ' ILE . . . . . . . . . . . . . 15.7 tt -141.15 157.02 22.24 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.412 0 N-CA-C 107.883 -1.154 . . . . 0.0 107.883 177.66 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 32' ' ' SER . . . . . . . . . . . . . 8.2 t -149.84 171.92 15.99 Favored 'General case' 0 C--N 1.323 -0.572 0 N-CA-C 106.64 -1.615 . . . . 0.0 106.64 166.2 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 33' ' ' PHE . . . . . . . . . . . . . 67.5 m-85 -141.07 168.21 20.34 Favored 'General case' 0 N--CA 1.447 -0.583 0 C-N-CA 124.004 0.921 . . . . 0.0 109.415 -173.895 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 34' ' ' GLY . . . . . . . . . . . . . . . -168.6 -165.0 25.26 Favored Glycine 0 C--N 1.332 0.345 0 C-N-CA 125.549 1.547 . . . . 0.0 109.332 168.092 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 35' ' ' GLU . . . . . . . . . . . . . 1.1 tm-20 -47.33 156.89 0.23 Allowed 'General case' 0 C--N 1.326 -0.445 0 C-N-CA 126.961 2.104 . . . . 0.0 112.96 -171.222 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 29.6 mtmm 52.59 26.52 4.39 Favored 'General case' 0 CA--C 1.531 0.221 0 C-N-CA 124.606 1.162 . . . . 0.0 112.015 -164.193 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 37' ' ' MET . . . . . . . . . . . . . 10.4 mmm 56.91 26.45 11.73 Favored 'General case' 0 CA--C 1.54 0.594 0 C-N-CA 124.3 1.04 . . . . 0.0 109.885 178.873 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 38' ' ' MET . . . . . . . . . . . . . 19.0 mtp -54.67 151.47 8.15 Favored 'General case' 0 N--CA 1.45 -0.437 0 C-N-CA 123.798 0.839 . . . . 0.0 110.113 176.473 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 39' ' ' ILE . . . . . . . . . . . . . 9.8 mt -134.13 116.22 22.5 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.465 0 N-CA-C 105.101 -2.185 . . . . 0.0 105.101 -176.664 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 40' ' ' SER . . . . . . . . . . . . . 66.8 m -141.7 119.63 11.96 Favored 'General case' 0 C--N 1.328 -0.33 0 N-CA-C 108.418 -0.956 . . . . 0.0 108.418 -172.479 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 41' ' ' GLY . . . . . . . . . . . . . . . -156.84 -165.36 14.73 Favored Glycine 0 CA--C 1.525 0.663 0 C-N-CA 124.42 1.009 . . . . 0.0 111.565 -171.111 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 42' ' ' SER . . . . . . . . . . . . . 28.7 t -157.43 123.37 4.74 Favored 'General case' 0 CA--C 1.511 -0.524 0 O-C-N 121.808 -0.819 . . . . 0.0 108.942 165.792 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 43' ' ' MET . . . . . . . . . . . . . 5.1 mmm -86.65 -43.15 12.86 Favored 'General case' 0 N--CA 1.45 -0.448 0 O-C-N 124.15 0.906 . . . . 0.0 111.18 160.142 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 44' ' ' CYS . . . . . 1.28 ' SG ' ' SG ' ' A' ' 70' ' ' CYS . 54.0 t -157.15 -71.23 0.1 Allowed 'General case' 0 CA--C 1.534 0.346 0 N-CA-C 107.413 -1.329 . . . . 0.0 107.413 177.907 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 45' ' ' ASN . . . . . . . . . . . . . 33.2 m-80 -77.66 26.81 0.17 Allowed 'General case' 0 N--CA 1.472 0.653 0 C-N-CA 127.488 2.315 . . . . 0.0 113.19 -179.054 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 46' ' ' ARG . . . . . . . . . . . . . 34.3 mtp85 53.08 -170.15 0.04 OUTLIER 'General case' 0 C--N 1.332 -0.194 0 C-N-CA 125.972 1.709 . . . . 0.0 108.973 -169.51 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 47' ' ' PHE . . . . . . . . . . . . . 29.6 p90 -178.99 153.11 0.6 Allowed 'General case' 0 C--O 1.238 0.493 0 C-N-CA 126.764 2.025 . . . . 0.0 108.516 160.753 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 48' ' ' SER . . . . . . . . . . . . . 6.3 p -163.93 143.13 7.85 Favored 'General case' 0 N--CA 1.449 -0.518 0 CA-C-O 117.695 -1.145 . . . . 0.0 110.669 179.184 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 49' ' ' GLY . . . . . . . . . . . . . . . -177.6 163.66 32.26 Favored Glycine 0 C--N 1.337 0.614 0 CA-C-N 119.647 1.112 . . . . 0.0 110.864 177.541 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 50' ' ' GLU . . . . . . . . . . . . . 38.1 mt-10 -75.84 100.45 4.78 Favored 'General case' 0 C--O 1.235 0.315 0 N-CA-C 109.241 -0.651 . . . . 0.0 109.241 173.902 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 51' ' ' GLY . . . . . . . . . . . . . . . -66.17 166.81 36.66 Favored Glycine 0 CA--C 1.529 0.921 0 CA-C-O 121.87 0.706 . . . . 0.0 112.343 170.199 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 52' ' ' LYS . . . . . . . . . . . . . 0.5 OUTLIER -132.71 143.16 49.43 Favored 'General case' 0 C--N 1.328 -0.356 0 C-N-CA 126.422 1.889 . . . . 0.0 107.301 165.982 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 53' ' ' LEU . . . . . . . . . . . . . 32.8 tp -156.66 151.77 26.3 Favored 'General case' 0 C--O 1.235 0.292 0 C-N-CA 126.286 1.834 . . . . 0.0 107.508 176.144 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 11.7 t -161.66 -24.26 0.05 Allowed 'General case' 0 CA--C 1.538 0.5 0 C-N-CA 124.818 1.247 . . . . 0.0 111.424 173.72 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 55' ' ' ASN . . . . . . . . . . . . . 17.8 p-10 -153.71 28.53 0.48 Allowed 'General case' 0 CA--C 1.54 0.562 0 C-N-CA 126.332 1.853 . . . . 0.0 112.304 -148.367 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 56' ' ' GLY . . . . . . . . . . . . . . . 71.89 27.12 71.2 Favored Glycine 0 CA--C 1.534 1.221 0 O-C-N 120.918 -1.114 . . . . 0.0 112.271 -177.721 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 57' ' ' GLU . . . . . . . . . . . . . 29.8 tt0 -135.02 142.83 46.5 Favored 'General case' 0 CA--C 1.533 0.303 0 N-CA-C 107.929 -1.138 . . . . 0.0 107.929 173.403 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 58' ' ' LEU . . . . . . . . . . . . . 31.7 tp -134.33 101.66 5.08 Favored 'General case' 0 C--O 1.234 0.287 0 C-N-CA 125.805 1.642 . . . . 0.0 109.403 -172.467 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 59' ' ' THR . . . . . . . . . . . . . 4.4 p -106.02 145.22 31.65 Favored 'General case' 0 C--N 1.328 -0.342 0 C-N-CA 124.345 1.058 . . . . 0.0 109.854 175.213 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 60' ' ' ALA . . . . . . . . . . . . . . . -95.41 130.06 42.34 Favored 'General case' 0 CA--C 1.531 0.225 0 C-N-CA 124.548 1.139 . . . . 0.0 110.202 169.781 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 61' ' ' LYS . . . . . . . . . . . . . 18.4 tttt -79.8 -15.23 57.85 Favored 'General case' 0 N--CA 1.473 0.684 0 N-CA-C 113.852 1.056 . . . . 0.0 113.852 177.853 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 62' ' ' GLY . . . . . . . . . . . . . . . 169.75 123.64 0.69 Allowed Glycine 0 C--N 1.332 0.33 0 N-CA-C 108.579 -1.808 . . . . 0.0 108.579 -178.86 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 63' ' ' LEU . . . . . . . . . . . . . 0.9 OUTLIER -128.26 94.24 3.85 Favored 'General case' 0 N--CA 1.45 -0.45 0 C-N-CA 124.769 1.228 . . . . 0.0 110.599 -151.971 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 64' ' ' ALA . . . . . . . . . . . . . . . -78.74 109.39 12.93 Favored 'General case' 0 C--O 1.236 0.361 0 C-N-CA 124.136 0.975 . . . . 0.0 111.601 -172.018 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 65' ' ' MET . . . . . . . . . . . . . 67.3 mtp -120.63 159.62 24.92 Favored 'General case' 0 CA--C 1.537 0.459 0 C-N-CA 124.24 1.016 . . . . 0.0 110.217 176.993 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 66' ' ' THR . . . . . . . . . . . . . 28.3 p -100.09 -164.89 1.16 Allowed 'General case' 0 CA--C 1.543 0.704 0 C-N-CA 125.444 1.498 . . . . 0.0 111.953 -169.379 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 67' ' ' ARG . . . . . . . . . . . . . 5.7 mmm180 -133.36 68.3 1.5 Allowed 'General case' 0 N--CA 1.471 0.597 0 C-N-CA 125.467 1.507 . . . . 0.0 109.968 -178.855 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 68' ' ' MET . . . . . . . . . . . . . 27.2 ptm -133.53 -172.22 2.91 Favored 'General case' 0 CA--C 1.538 0.506 0 C-N-CA 127.147 2.179 . . . . 0.0 110.369 -175.307 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 69' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -138.69 176.87 8.32 Favored 'General case' 0 C--O 1.236 0.35 0 C-N-CA 125.575 1.55 . . . . 0.0 110.061 -173.815 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 70' ' ' CYS . . . . . 1.28 ' SG ' ' SG ' ' A' ' 44' ' ' CYS . 60.2 m -138.05 4.88 2.53 Favored 'General case' 0 CA--C 1.54 0.582 0 N-CA-C 114.409 1.263 . . . . 0.0 114.409 -175.392 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 71' ' ' ALA . . . . . . . . . . . . . . . 58.61 3.98 0.33 Allowed 'General case' 0 N--CA 1.472 0.665 0 C-N-CA 125.743 1.617 . . . . 0.0 113.983 -177.057 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 72' ' ' ASN . . . . . . . . . . . . . 43.3 t-20 -143.19 142.05 20.75 Favored Pre-proline 0 C--O 1.238 0.498 0 N-CA-C 106.684 -1.599 . . . . 0.0 106.684 172.645 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 73' ' ' PRO . . . . . . . . . . . . . 37.3 Cg_endo -78.71 -27.65 4.77 Favored 'Trans proline' 0 C--O 1.221 -0.363 0 C-N-CA 121.564 1.509 . . . . 0.0 113.041 -169.189 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 74' ' ' GLN . . . . . . . . . . . . . 41.0 tt0 -51.43 -46.44 62.96 Favored 'General case' 0 N--CA 1.47 0.569 0 CA-C-N 119.501 1.046 . . . . 0.0 111.486 -177.435 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 75' ' ' LEU . . . . . . . . . . . . . 49.9 mt -70.02 -36.83 75.38 Favored 'General case' 0 C--N 1.329 -0.309 0 C-N-CA 124.914 1.286 . . . . 0.0 110.906 -178.286 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 76' ' ' ASN . . . . . . . . . . . . . 1.0 OUTLIER -78.9 2.11 21.28 Favored 'General case' 0 CA--C 1.541 0.599 0 C-N-CA 127.179 2.191 . . . . 0.0 112.325 178.046 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 77' ' ' GLU . . . . . . . . . . . . . 1.5 mm-40 -109.47 -39.82 5.06 Favored 'General case' 0 C--N 1.331 -0.212 0 C-N-CA 127.421 2.288 . . . . 0.0 108.338 173.819 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 78' ' ' LEU . . . . . . . . . . . . . 55.8 mt -56.29 -27.4 55.31 Favored 'General case' 0 C--N 1.343 0.319 0 C-N-CA 122.881 0.472 . . . . 0.0 110.653 168.285 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 79' ' ' ASP . . . . . . . . . . . . . 0.0 OUTLIER -63.76 -13.57 44.95 Favored 'General case' 0 CA--C 1.539 0.541 0 C-N-CA 126.3 1.84 . . . . 0.0 112.653 177.369 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 80' ' ' ASN . . . . . . . . . . . . . 67.8 m-20 -105.54 -44.84 4.59 Favored 'General case' 0 N--CA 1.465 0.277 0 C-N-CA 124.478 1.111 . . . . 0.0 109.962 169.452 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 81' ' ' THR . . . . . . . . . . . . . 85.9 m -44.59 -70.16 0.11 Allowed 'General case' 0 CA--C 1.535 0.38 0 C-N-CA 125.836 1.654 . . . . 0.0 111.273 -179.143 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 82' ' ' ILE . . . . . . . . . . . . . 8.2 tp -72.37 -29.72 32.5 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.347 0 O-C-N 121.428 -0.795 . . . . 0.0 111.088 -167.072 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 83' ' ' SER . . . . . . . . . . . . . 30.0 t -52.68 -60.09 3.67 Favored 'General case' 0 C--O 1.236 0.38 0 C-N-CA 124.735 1.214 . . . . 0.0 109.409 171.096 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 84' ' ' GLU . . . . . . . . . . . . . 30.8 tp10 -67.97 -39.03 83.42 Favored 'General case' 0 N--CA 1.449 -0.482 0 CA-C-O 118.209 -0.901 . . . . 0.0 110.875 -173.216 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 85' ' ' MET . . . . . . . . . . . . . 78.6 mtp -60.58 -42.78 97.4 Favored 'General case' 0 N--CA 1.464 0.275 0 CA-C-O 122.402 1.096 . . . . 0.0 109.309 -176.136 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 86' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -75.95 -23.71 55.4 Favored 'General case' 0 C--N 1.33 -0.257 0 C-N-CA 124.262 1.025 . . . . 0.0 111.722 -178.643 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 87' ' ' LYS . . . . . . . . . . . . . 3.0 tppt? -75.96 -52.29 10.58 Favored 'General case' 0 N--CA 1.441 -0.886 0 C-N-CA 124.589 1.156 . . . . 0.0 109.188 177.847 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 88' ' ' GLU . . . . . . . . . . . . . 17.3 pt-20 -64.95 -38.78 92.1 Favored 'General case' 0 CA--C 1.539 0.546 0 CA-C-O 118.927 -0.559 . . . . 0.0 110.536 178.124 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 89' ' ' GLY . . . . . . . . . . . . . . . 120.15 105.75 2.08 Favored Glycine 0 C--N 1.339 0.746 0 C-N-CA 126.743 2.116 . . . . 0.0 108.732 173.161 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 90' ' ' ALA . . . . . . . . . . . . . . . -77.18 133.29 38.97 Favored 'General case' 0 N--CA 1.448 -0.541 0 CA-C-O 118.457 -0.783 . . . . 0.0 109.566 -176.072 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 91' ' ' GLN . . . . . . . . . . . . . 59.1 mm-40 -65.21 139.2 58.63 Favored 'General case' 0 C--O 1.239 0.503 0 N-CA-C 105.099 -2.185 . . . . 0.0 105.099 152.533 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 92' ' ' VAL . . . . . . . . . . . . . 10.4 p -135.78 134.48 51.25 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.56 0 N-CA-C 106.154 -1.795 . . . . 0.0 106.154 -176.448 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 93' ' ' ASP . . . . . . . . . . . . . 0.7 OUTLIER -142.09 91.88 2.38 Favored 'General case' 0 N--CA 1.452 -0.373 0 N-CA-C 107.911 -1.144 . . . . 0.0 107.911 -170.442 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 94' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -96.91 109.49 22.2 Favored 'General case' 0 C--O 1.235 0.31 0 N-CA-C 106.922 -1.51 . . . . 0.0 106.922 174.395 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 95' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -70.13 -163.77 0.07 Allowed 'General case' 0 CA--C 1.542 0.664 0 N-CA-C 108.173 -1.047 . . . . 0.0 108.173 166.139 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 96' ' ' ALA . . . . . . . . . . . . . . . -56.97 -27.86 61.73 Favored 'General case' 0 CA--C 1.536 0.437 0 O-C-N 119.291 -2.131 . . . . 0.0 113.138 -178.616 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 97' ' ' ASN . . . . . . . . . . . . . 28.4 p30 -167.41 18.69 0.03 OUTLIER 'General case' 0 CA--C 1.539 0.538 0 C-N-CA 124.072 0.949 . . . . 0.0 112.705 -168.766 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 98' ' ' GLN . . . . . . . . . . . . . 2.3 tt0 -130.93 124.35 30.88 Favored 'General case' 0 N--CA 1.47 0.527 0 CA-C-N 120.297 1.408 . . . . 0.0 107.724 169.997 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 99' ' ' LEU . . . . . . . . . . . . . 15.3 tp -86.13 139.89 30.69 Favored 'General case' 0 C--O 1.233 0.185 0 C-N-CA 124.238 1.015 . . . . 0.0 109.519 170.109 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 100' ' ' THR . . . . . . . . . . . . . 15.8 m -123.38 126.17 46.34 Favored 'General case' 0 C--N 1.322 -0.592 0 C-N-CA 126.308 1.843 . . . . 0.0 107.127 171.346 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 101' ' ' LEU . . . . . . . . . . . . . 0.7 OUTLIER -114.23 135.45 54.04 Favored 'General case' 0 C--N 1.334 -0.071 0 C-N-CA 127.502 2.321 . . . . 0.0 106.04 167.9 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 102' ' ' ALA . . . . . . . . . . . . . . . -157.23 82.5 0.92 Allowed 'General case' 0 CA--C 1.536 0.417 0 CA-C-N 120.057 1.299 . . . . 0.0 111.325 178.852 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 103' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -98.87 171.01 8.34 Favored 'General case' 0 C--O 1.236 0.374 0 C-N-CA 125.947 1.699 . . . . 0.0 110.392 179.867 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 104' ' ' ALA . . . . . . . . . . . . . . . -56.16 -28.14 56.93 Favored 'General case' 0 C--O 1.233 0.213 0 CA-C-O 118.466 -0.778 . . . . 0.0 112.239 176.705 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 105' ' ' LYS . . . . . . . . . . . . . 32.8 mmtt -58.81 -80.5 0.02 OUTLIER 'General case' 0 CA--C 1.531 0.24 0 CA-C-N 119.244 0.929 . . . . 0.0 110.927 165.345 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 106' ' ' GLN . . . . . . . . . . . . . 7.1 mt-30 -157.0 -170.36 3.26 Favored 'General case' 0 CA--C 1.536 0.428 0 C-N-CA 125.098 1.359 . . . . 0.0 109.803 -173.136 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 107' ' ' THR . . . . . . . . . . . . . 3.4 t -130.32 140.4 50.64 Favored 'General case' 0 CA--C 1.537 0.444 0 C-N-CA 126.376 1.87 . . . . 0.0 108.29 -174.949 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 108' ' ' LEU . . . . . . . . . . . . . 4.8 mp -134.09 153.16 51.99 Favored 'General case' 0 C--O 1.235 0.325 0 C-N-CA 130.097 3.359 . . . . 0.0 108.461 -172.665 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 109' ' ' THR . . . . . . . . . . . . . 7.1 m -138.6 96.97 3.25 Favored 'General case' 0 CA--C 1.539 0.534 0 N-CA-C 109.419 -0.586 . . . . 0.0 109.419 -175.771 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 110' ' ' TYR . . . . . . . . . . . . . 66.9 m-85 -99.08 155.83 17.25 Favored 'General case' 0 N--CA 1.464 0.259 0 C-N-CA 124.056 0.943 . . . . 0.0 110.712 -175.244 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 111' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -114.5 145.21 42.19 Favored 'General case' 0 C--N 1.331 -0.199 0 C-N-CA 125.703 1.601 . . . . 0.0 108.758 -171.487 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 112' ' ' LEU . . . . . . . . . . . . . 54.4 tp -75.62 60.98 1.29 Allowed 'General case' 0 CA--C 1.534 0.36 0 C-N-CA 127.957 2.503 . . . . 0.0 108.396 175.558 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 113' ' ' ALA . . . . . . . . . . . . . . . -93.31 94.69 8.89 Favored 'General case' 0 N--CA 1.448 -0.544 0 N-CA-C 106.189 -1.782 . . . . 0.0 106.189 177.299 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 114' ' ' ASP . . . . . . . . . . . . . 37.9 t0 . . . . . 0 CA--C 1.515 -0.39 0 CA-C-O 121.62 0.724 . . . . 0.0 110.993 -178.927 . . . . . . . . 0 0 . 1 . 010 nuclear orig core ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 4.4 ptm . . . . . 0 CA--C 1.535 0.391 0 CA-C-O 121.471 0.653 . . . . 0.0 111.065 . . . . . . . . . 0 0 . 1 . 010 nuclear orig core ' A' A ' 2' ' ' VAL . . . . . . . . . . . . . 14.6 p -61.92 155.24 4.73 Favored 'Isoleucine or valine' 0 CA--C 1.54 0.561 0 C-N-CA 125.622 1.569 . . . . 0.0 111.127 175.575 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 3' ' ' THR . . . . . . . . . . . . . 31.5 p -124.45 163.8 34.26 Favored Pre-proline 0 CA--C 1.535 0.368 0 C-N-CA 124.292 1.037 . . . . 0.0 108.64 173.269 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 4' ' ' PRO . . . . . . . . . . . . . 57.9 Cg_endo -67.38 -34.8 25.7 Favored 'Trans proline' 0 N--CA 1.459 -0.5 0 C-N-CA 121.524 1.483 . . . . 0.0 111.046 170.066 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 5' ' ' GLU . . . . . 0.41 ' C ' ' H ' ' A' ' 7' ' ' LEU . 28.6 tt0 -56.14 -54.64 42.69 Favored 'General case' 0 C--N 1.328 -0.338 0 C-N-CA 125.005 1.322 . . . . 0.0 109.992 -174.918 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 6' ' ' GLN . . . . . 0.474 HE21 ' CD2' ' A' ' 94' ' ' LEU . 21.7 pt20 -63.87 6.4 0.17 Allowed 'General case' 0 CA--C 1.536 0.412 0 C-N-CA 125.318 1.447 . . . . 0.0 114.314 -179.48 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 7' ' ' LEU . . . . . 0.41 ' H ' ' C ' ' A' ' 5' ' ' GLU . 95.4 mt -123.77 -50.91 1.83 Allowed 'General case' 0 N--CA 1.451 -0.416 0 C-N-CA 125.895 1.678 . . . . 0.0 110.02 -177.763 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 8' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -61.37 -6.22 2.13 Favored 'General case' 0 N--CA 1.468 0.471 0 N-CA-C 113.967 1.099 . . . . 0.0 113.967 -169.794 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 9' ' ' HIS . . . . . . . . . . . . . 16.8 m170 -124.6 9.68 8.38 Favored 'General case' 0 CA--C 1.543 0.705 0 C-N-CA 127.078 2.151 . . . . 0.0 110.301 -171.002 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 10' ' ' HIS . . . . . . . . . . . . . 94.5 m-70 -132.99 154.97 49.99 Favored 'General case' 0 C--O 1.236 0.389 0 CA-C-N 119.438 1.017 . . . . 0.0 111.614 -175.771 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 11' ' ' ARG . . . . . . . . . . . . . 63.4 ttt180 -96.9 147.03 24.38 Favored 'General case' 0 CA--C 1.513 -0.445 0 C-N-CA 124.525 1.13 . . . . 0.0 108.694 173.821 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 12' ' ' PHE . . . . . . . . . . . . . 60.2 m-85 -126.24 161.4 27.84 Favored 'General case' 0 N--CA 1.45 -0.468 0 N-CA-C 108.953 -0.758 . . . . 0.0 108.953 165.487 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 13' ' ' VAL . . . . . . . . . . . . . 8.8 p -129.6 155.48 41.36 Favored 'Isoleucine or valine' 0 CA--C 1.545 0.782 0 C-N-CA 125.333 1.453 . . . . 0.0 109.797 166.889 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 14' ' ' LEU . . . . . . . . . . . . . 1.3 tp -85.75 100.61 12.14 Favored 'General case' 0 N--CA 1.47 0.527 0 C-N-CA 125.519 1.528 . . . . 0.0 108.909 -175.673 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 4.9 tm-20 -88.45 -36.21 16.62 Favored 'General case' 0 CA--C 1.534 0.329 0 C-N-CA 122.653 0.381 . . . . 0.0 110.056 -174.006 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -152.12 146.26 25.36 Favored 'General case' 0 C--O 1.234 0.247 0 CA-C-O 122.656 1.217 . . . . 0.0 109.97 -177.907 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 17' ' ' VAL . . . . . 0.494 HG11 ' H ' ' A' ' 18' ' ' ASN . 3.0 t -79.65 -164.64 0.07 OUTLIER 'Isoleucine or valine' 0 CA--C 1.546 0.807 0 C-N-CA 126.071 1.748 . . . . 0.0 107.597 172.095 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 18' ' ' ASN . . . . . 0.494 ' H ' HG11 ' A' ' 17' ' ' VAL . 40.3 t30 -51.83 -9.54 0.09 Allowed 'General case' 0 CA--C 1.547 0.853 0 C-N-CA 127.731 2.413 . . . . 0.0 115.648 170.207 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . 156.9 32.2 0.02 OUTLIER Glycine 0 CA--C 1.524 0.594 0 O-C-N 120.92 -1.113 . . . . 0.0 112.373 -179.122 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 26.0 mttp -150.73 156.02 35.95 Favored Pre-proline 0 C--O 1.236 0.387 0 C-N-CA 126.975 2.11 . . . . 0.0 108.05 176.18 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 21' ' ' PRO . . . . . . . . . . . . . 72.7 Cg_endo -86.06 172.5 7.39 Favored 'Trans proline' 0 N--CA 1.448 -1.195 0 C-N-CA 122.212 1.942 . . . . 0.0 111.426 -179.498 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 22' ' ' VAL . . . . . . . . . . . . . 54.4 t -115.18 127.39 72.76 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.342 0 C-N-CA 125.192 1.397 . . . . 0.0 109.449 -166.76 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 23' ' ' THR . . . . . . . . . . . . . 2.5 p -105.61 95.71 6.0 Favored 'General case' 0 CA--C 1.534 0.351 0 C-N-CA 125.219 1.407 . . . . 0.0 111.506 -167.637 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 24' ' ' SER . . . . . . . . . . . . . 34.7 t -163.4 135.34 5.06 Favored 'General case' 0 N--CA 1.449 -0.476 0 N-CA-C 108.069 -1.086 . . . . 0.0 108.069 172.714 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 25' ' ' ASP . . . . . . . . . . . . . 13.6 m-20 -107.26 -3.47 19.72 Favored 'General case' 0 N--CA 1.472 0.666 0 C-N-CA 124.567 1.147 . . . . 0.0 112.111 166.478 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 26' ' ' LYS . . . . . . . . . . . . . 92.2 mttt -142.97 129.5 20.15 Favored 'General case' 0 C--N 1.345 0.376 0 O-C-N 120.162 -1.586 . . . . 0.0 110.04 -176.667 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 27' ' ' ASN . . . . . . . . . . . . . 2.4 m-80 45.53 68.07 3.67 Favored Pre-proline 0 CA--C 1.535 0.382 0 C-N-CA 125.634 1.574 . . . . 0.0 109.443 -179.979 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 28' ' ' PRO . . . . . . . . . . . . . 18.0 Cg_endo -63.79 172.76 5.41 Favored 'Trans proline' 0 C--O 1.236 0.387 0 C-N-CA 123.314 2.676 . . . . 0.0 112.37 -173.361 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 29' ' ' PRO . . . . . . . . . . . . . 42.2 Cg_endo -74.05 62.71 5.03 Favored 'Trans proline' 0 N--CA 1.454 -0.826 0 C-N-CA 121.333 1.355 . . . . 0.0 110.435 166.497 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 30' ' ' GLU . . . . . . . . . . . . . 0.3 OUTLIER -81.37 169.85 16.72 Favored 'General case' 0 CA--C 1.536 0.42 0 O-C-N 120.581 -1.325 . . . . 0.0 108.897 174.812 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 31' ' ' ILE . . . . . . . . . . . . . 7.5 tt -146.17 105.86 0.66 Allowed 'Isoleucine or valine' 0 N--CA 1.452 -0.328 0 N-CA-C 105.665 -1.976 . . . . 0.0 105.665 169.6 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 32' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER -80.45 129.66 34.65 Favored 'General case' 0 N--CA 1.445 -0.706 0 N-CA-C 106.604 -1.628 . . . . 0.0 106.604 160.17 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 33' ' ' PHE . . . . . . . . . . . . . 59.7 m-85 -93.42 156.44 16.77 Favored 'General case' 0 C--O 1.239 0.512 0 N-CA-C 106.803 -1.554 . . . . 0.0 106.803 158.673 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 34' ' ' GLY . . . . . . . . . . . . . . . -167.53 122.34 1.03 Allowed Glycine 0 C--O 1.219 -0.803 0 CA-C-O 117.107 -1.941 . . . . 0.0 109.713 -177.221 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 35' ' ' GLU . . . . . . . . . . . . . 1.8 tm-20 70.24 114.46 0.05 OUTLIER 'General case' 0 CA--C 1.542 0.659 0 CA-C-N 120.341 2.071 . . . . 0.0 111.436 178.986 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 44.9 mtmt 63.91 -50.21 0.26 Allowed 'General case' 0 N--CA 1.477 0.913 0 C-N-CA 130.578 3.551 . . . . 0.0 116.478 176.751 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 37' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER 171.27 8.18 0.0 OUTLIER 'General case' 0 CA--C 1.543 0.676 1 C-N-CA 132.347 4.259 . . . . 0.0 111.342 177.173 . . . . . . . . 3 3 . 1 . 010 nuclear orig core ' A' A ' 38' ' ' MET . . . . . . . . . . . . . 65.5 mmm -57.02 157.32 5.92 Favored 'General case' 0 N--CA 1.473 0.683 0 CA-C-N 120.667 1.576 . . . . 0.0 111.596 -169.478 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 39' ' ' ILE . . . . . . . . . . . . . 52.9 mt -124.57 124.91 69.23 Favored 'Isoleucine or valine' 0 C--O 1.235 0.327 0 C-N-CA 126.641 1.976 . . . . 0.0 106.662 -166.687 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 40' ' ' SER . . . . . . . . . . . . . 59.8 p -138.21 123.39 19.23 Favored 'General case' 0 C--O 1.241 0.635 0 C-N-CA 125.309 1.444 . . . . 0.0 108.334 177.554 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 41' ' ' GLY . . . . . . . . . . . . . . . -171.93 178.44 44.16 Favored Glycine 0 CA--C 1.529 0.926 0 CA-C-N 119.974 1.261 . . . . 0.0 112.959 -173.677 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 42' ' ' SER . . . . . . . . . . . . . 20.6 t -154.47 109.98 3.15 Favored 'General case' 0 C--O 1.236 0.393 0 O-C-N 121.622 -0.929 . . . . 0.0 109.859 169.012 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 43' ' ' MET . . . . . . . . . . . . . 15.3 mmt -65.91 -64.58 0.83 Allowed 'General case' 0 N--CA 1.455 -0.185 0 N-CA-C 106.998 -1.482 . . . . 0.0 106.998 159.597 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 44' ' ' CYS . . . . . 1.296 ' SG ' ' SG ' ' A' ' 70' ' ' CYS . 19.7 t -146.37 -61.99 0.31 Allowed 'General case' 0 N--CA 1.454 -0.253 0 N-CA-C 108.807 -0.812 . . . . 0.0 108.807 -178.245 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 45' ' ' ASN . . . . . . . . . . . . . 2.9 m120 -77.24 15.95 0.66 Allowed 'General case' 0 CA--C 1.544 0.738 0 C-N-CA 125.731 1.612 . . . . 0.0 113.139 -175.371 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 46' ' ' ARG . . . . . . . . . . . . . 1.2 mtt180 56.94 164.93 0.03 OUTLIER 'General case' 0 N--CA 1.472 0.644 0 C-N-CA 126.765 2.026 . . . . 0.0 113.164 -156.421 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 47' ' ' PHE . . . . . . . . . . . . . 39.1 p90 -160.65 166.04 29.54 Favored 'General case' 0 C--O 1.234 0.249 0 C-N-CA 124.152 0.981 . . . . 0.0 110.416 153.873 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 48' ' ' SER . . . . . . . . . . . . . 0.2 OUTLIER -167.92 162.41 13.47 Favored 'General case' 0 C--O 1.236 0.366 0 C-N-CA 124.305 1.042 . . . . 0.0 109.457 174.545 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 49' ' ' GLY . . . . . . . . . . . . . . . -176.66 173.74 46.51 Favored Glycine 0 CA--C 1.53 1.021 0 CA-C-N 119.925 1.239 . . . . 0.0 113.23 175.573 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 50' ' ' GLU . . . . . . . . . . . . . 47.1 mt-10 -79.31 94.09 5.41 Favored 'General case' 0 C--O 1.238 0.452 0 C-N-CA 125.008 1.323 . . . . 0.0 107.771 167.263 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 51' ' ' GLY . . . . . . . . . . . . . . . -69.59 164.39 51.02 Favored Glycine 0 C--O 1.238 0.375 0 N-CA-C 110.995 -0.842 . . . . 0.0 110.995 168.455 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 52' ' ' LYS . . . . . . . . . . . . . 2.0 tttp -162.6 151.34 14.82 Favored 'General case' 0 N--CA 1.457 -0.084 0 C-N-CA 123.378 0.671 . . . . 0.0 110.06 169.915 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 53' ' ' LEU . . . . . . . . . . . . . 23.6 tp -148.68 135.13 19.54 Favored 'General case' 0 C--N 1.333 -0.12 0 N-CA-C 107.04 -1.467 . . . . 0.0 107.04 174.731 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 2.8 t -157.42 11.57 0.21 Allowed 'General case' 0 CA--C 1.543 0.687 0 CA-C-N 118.435 0.562 . . . . 0.0 111.929 170.123 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 55' ' ' ASN . . . . . . . . . . . . . 40.1 p30 -151.83 -2.02 0.3 Allowed 'General case' 0 N--CA 1.471 0.61 0 N-CA-C 114.232 1.197 . . . . 0.0 114.232 -172.572 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 56' ' ' GLY . . . . . . . . . . . . . . . 107.39 -2.24 34.75 Favored Glycine 0 CA--C 1.532 1.139 0 C-N-CA 125.437 1.494 . . . . 0.0 113.574 -175.049 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 57' ' ' GLU . . . . . . . . . . . . . 28.0 tt0 -119.25 142.79 47.73 Favored 'General case' 0 CA--C 1.539 0.524 0 CA-C-N 118.678 1.239 . . . . 0.0 109.542 -177.215 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 58' ' ' LEU . . . . . . . . . . . . . 57.2 tp -117.6 122.84 44.68 Favored 'General case' 0 C--O 1.232 0.175 0 C-N-CA 126.086 1.754 . . . . 0.0 109.713 175.919 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 59' ' ' THR . . . . . . . . . . . . . 63.5 p -109.24 166.24 11.0 Favored 'General case' 0 CA--C 1.534 0.331 0 C-N-CA 124.223 1.009 . . . . 0.0 110.782 165.103 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 60' ' ' ALA . . . . . . . . . . . . . . . -129.76 86.32 2.4 Favored 'General case' 0 C--O 1.235 0.301 0 CA-C-O 122.415 1.102 . . . . 0.0 108.67 150.266 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 61' ' ' LYS . . . . . . . . . . . . . 74.7 tttt -74.85 100.02 3.95 Favored 'General case' 0 C--O 1.236 0.38 0 N-CA-C 107.601 -1.259 . . . . 0.0 107.601 168.18 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 62' ' ' GLY . . . . . . . . . . . . . . . 111.87 48.18 0.69 Allowed Glycine 0 CA--C 1.525 0.716 0 C-N-CA 124.105 0.859 . . . . 0.0 111.744 -176.638 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 63' ' ' LEU . . . . . . . . . . . . . 4.0 tp -67.33 168.57 10.37 Favored 'General case' 0 CA--C 1.539 0.542 0 C-N-CA 125.071 1.348 . . . . 0.0 110.516 172.654 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 64' ' ' ALA . . . . . . . . . . . . . . . -143.4 160.92 39.68 Favored 'General case' 0 C--N 1.329 -0.316 0 O-C-N 119.885 -1.76 . . . . 0.0 107.395 159.731 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 65' ' ' MET . . . . . . . . . . . . . 68.3 mtp -152.82 -171.39 3.92 Favored 'General case' 0 CA--C 1.54 0.56 0 C-N-CA 126.848 2.059 . . . . 0.0 107.777 179.38 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 66' ' ' THR . . . . . . . . . . . . . 0.9 OUTLIER -131.86 -164.87 1.5 Allowed 'General case' 0 CA--C 1.545 0.755 0 C-N-CA 124.239 1.016 . . . . 0.0 109.36 164.993 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 67' ' ' ARG . . . . . . . . . . . . . 3.1 ppt_? -125.11 52.56 1.58 Allowed 'General case' 0 N--CA 1.466 0.347 0 C-N-CA 124.964 1.306 . . . . 0.0 110.931 176.916 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 68' ' ' MET . . . . . . . . . . . . . 22.5 ptp -102.56 163.08 12.43 Favored 'General case' 0 CA--C 1.52 -0.207 0 O-C-N 121.29 -0.881 . . . . 0.0 109.205 167.007 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 69' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -124.42 155.67 38.45 Favored 'General case' 0 C--N 1.323 -0.582 0 C-N-CA 126.772 2.029 . . . . 0.0 108.316 -170.639 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 70' ' ' CYS . . . . . 1.296 ' SG ' ' SG ' ' A' ' 44' ' ' CYS . 1.6 p -116.67 160.59 20.49 Favored 'General case' 0 C--N 1.324 -0.541 0 C-N-CA 125.528 1.531 . . . . 0.0 110.097 -174.984 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 71' ' ' ALA . . . . . . . . . . . . . . . -78.96 16.86 0.82 Allowed 'General case' 0 CA--C 1.54 0.591 0 C-N-CA 124.29 1.036 . . . . 0.0 112.097 176.548 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 72' ' ' ASN . . . . . . . . . . . . . 17.3 t-20 -136.17 143.62 44.63 Favored Pre-proline 0 CA--C 1.534 0.348 0 O-C-N 120.509 -1.369 . . . . 0.0 108.464 -173.589 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 73' ' ' PRO . . . . . . . . . . . . . 48.4 Cg_endo -71.72 -52.63 0.2 Allowed 'Trans proline' 0 C--N 1.349 0.587 0 C-N-CA 122.965 2.443 . . . . 0.0 111.455 179.721 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 74' ' ' GLN . . . . . . . . . . . . . 45.7 tt0 -57.83 -45.31 86.36 Favored 'General case' 0 C--O 1.22 -0.498 0 C-N-CA 124.277 1.031 . . . . 0.0 109.798 -175.691 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 75' ' ' LEU . . . . . . . . . . . . . 98.2 mt -61.29 -39.16 89.43 Favored 'General case' 0 CA--C 1.535 0.371 0 CA-C-N 118.966 0.803 . . . . 0.0 111.106 -177.331 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 76' ' ' ASN . . . . . . . . . . . . . 1.4 m-80 -64.46 -50.47 67.37 Favored 'General case' 0 N--CA 1.468 0.426 0 C-N-CA 124.554 1.142 . . . . 0.0 110.018 174.749 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 77' ' ' GLU . . . . . . . . . . . . . 18.5 tt0 -54.08 -34.75 60.97 Favored 'General case' 0 CA--C 1.539 0.542 0 C-N-CA 126.0 1.72 . . . . 0.0 111.145 175.082 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 78' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -73.88 -20.74 60.32 Favored 'General case' 0 N--CA 1.446 -0.655 0 CA-C-O 116.836 -1.554 . . . . 0.0 112.696 -175.116 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 79' ' ' ASP . . . . . . . . . . . . . 0.0 OUTLIER -54.49 -45.45 73.25 Favored 'General case' 0 N--CA 1.471 0.617 0 CA-C-N 120.474 1.488 . . . . 0.0 110.433 176.23 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 80' ' ' ASN . . . . . . . . . . . . . 3.1 p30 -99.15 -23.78 15.11 Favored 'General case' 0 N--CA 1.441 -0.887 0 C-N-CA 124.402 1.081 . . . . 0.0 109.811 -168.013 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 81' ' ' THR . . . . . . . . . . . . . 15.3 m -57.44 -57.24 13.55 Favored 'General case' 0 CA--C 1.541 0.618 0 N-CA-C 109.157 -0.683 . . . . 0.0 109.157 161.539 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 82' ' ' ILE . . . . . . . . . . . . . 10.8 tp -66.38 -37.94 80.72 Favored 'Isoleucine or valine' 0 C--N 1.345 0.372 0 CA-C-N 119.855 1.207 . . . . 0.0 111.089 -172.107 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 83' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -57.21 -46.63 82.73 Favored 'General case' 0 CA--C 1.533 0.319 0 CA-C-N 119.236 0.926 . . . . 0.0 110.529 -176.053 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 84' ' ' GLU . . . . . . . . . . . . . 4.0 mt-10 -81.56 -5.24 57.81 Favored 'General case' 0 N--CA 1.448 -0.547 0 CA-C-O 118.448 -0.787 . . . . 0.0 112.864 179.536 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 85' ' ' MET . . . . . . . . . . . . . 90.0 mtp -90.71 -4.21 56.89 Favored 'General case' 0 CA--C 1.537 0.445 0 CA-C-N 120.07 1.305 . . . . 0.0 111.985 164.8 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 86' ' ' LEU . . . . . . . . . . . . . 3.4 mm? -113.13 -32.36 6.35 Favored 'General case' 0 C--N 1.333 -0.112 0 O-C-N 121.231 -0.918 . . . . 0.0 112.071 178.043 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 87' ' ' LYS . . . . . . . . . . . . . 76.9 mttt -72.14 -49.4 36.22 Favored 'General case' 0 N--CA 1.448 -0.554 0 CA-C-N 118.817 0.735 . . . . 0.0 110.501 -177.408 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 88' ' ' GLU . . . . . . . . . . . . . 7.3 mm-40 -80.81 -3.31 50.65 Favored 'General case' 0 CA--C 1.54 0.591 0 C-N-CA 126.097 1.759 . . . . 0.0 112.642 -174.87 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 89' ' ' GLY . . . . . . . . . . . . . . . 84.5 106.04 0.6 Allowed Glycine 0 CA--C 1.524 0.656 0 CA-C-N 120.137 1.335 . . . . 0.0 110.916 -179.762 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 90' ' ' ALA . . . . . . . . . . . . . . . -79.87 152.25 29.76 Favored 'General case' 0 CA--C 1.516 -0.33 0 N-CA-C 109.014 -0.736 . . . . 0.0 109.014 170.632 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 91' ' ' GLN . . . . . . . . . . . . . 93.2 mm-40 -73.62 141.75 46.55 Favored 'General case' 0 N--CA 1.442 -0.858 0 N-CA-C 105.398 -2.075 . . . . 0.0 105.398 156.206 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 92' ' ' VAL . . . . . . . . . . . . . 7.4 p -128.9 108.8 17.74 Favored 'Isoleucine or valine' 0 N--CA 1.443 -0.821 0 N-CA-C 104.967 -2.234 . . . . 0.0 104.967 -179.502 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 93' ' ' ASP . . . . . . . . . . . . . 0.7 OUTLIER -124.81 75.48 1.43 Allowed 'General case' 0 C--N 1.327 -0.37 0 N-CA-C 106.444 -1.687 . . . . 0.0 106.444 -167.552 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 94' ' ' LEU . . . . . 0.474 ' CD2' HE21 ' A' ' 6' ' ' GLN . 42.0 tp -77.45 121.52 23.93 Favored 'General case' 0 C--O 1.234 0.254 0 N-CA-C 107.923 -1.14 . . . . 0.0 107.923 -178.188 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 95' ' ' THR . . . . . . . . . . . . . 1.4 m -86.65 -167.22 1.8 Allowed 'General case' 0 C--N 1.319 -0.743 0 C-N-CA 126.496 1.918 . . . . 0.0 108.057 168.238 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 96' ' ' ALA . . . . . . . . . . . . . . . -50.55 -37.87 41.87 Favored 'General case' 0 CA--C 1.543 0.676 0 O-C-N 119.563 -1.96 . . . . 0.0 113.729 -171.647 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 97' ' ' ASN . . . . . . . . . . . . . 1.3 p30 -157.3 18.48 0.29 Allowed 'General case' 0 CA--C 1.54 0.577 0 C-N-CA 125.783 1.633 . . . . 0.0 111.479 -173.363 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 98' ' ' GLN . . . . . . . . . . . . . 12.3 tt0 -136.03 116.87 14.11 Favored 'General case' 0 C--N 1.339 0.149 0 O-C-N 121.137 -0.977 . . . . 0.0 109.813 -177.673 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 99' ' ' LEU . . . . . . . . . . . . . 7.5 tp -77.2 117.94 19.22 Favored 'General case' 0 C--O 1.237 0.421 0 C-N-CA 127.509 2.324 . . . . 0.0 108.02 176.854 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 100' ' ' THR . . . . . . . . . . . . . 8.8 m -94.63 106.76 18.76 Favored 'General case' 0 CA--C 1.537 0.462 0 N-CA-C 106.758 -1.571 . . . . 0.0 106.758 165.192 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 101' ' ' LEU . . . . . . . . . . . . . 1.6 mm? -95.18 116.77 29.17 Favored 'General case' 0 CA--C 1.515 -0.373 0 N-CA-C 107.534 -1.284 . . . . 0.0 107.534 167.006 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 102' ' ' ALA . . . . . . . . . . . . . . . -126.71 139.47 53.12 Favored 'General case' 0 C--O 1.233 0.196 0 C-N-CA 123.499 0.719 . . . . 0.0 109.578 176.365 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 103' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -155.25 171.75 19.31 Favored 'General case' 0 N--CA 1.444 -0.755 0 C-N-CA 126.296 1.839 . . . . 0.0 107.959 178.346 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 104' ' ' ALA . . . . . . . . . . . . . . . -64.27 -22.14 66.84 Favored 'General case' 0 CA--C 1.539 0.536 0 N-CA-C 112.911 0.708 . . . . 0.0 112.911 178.025 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 105' ' ' LYS . . . . . . . . . . . . . 0.3 OUTLIER -67.61 -75.25 0.1 Allowed 'General case' 0 C--N 1.345 0.391 0 CA-C-N 119.19 0.905 . . . . 0.0 109.687 174.491 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 106' ' ' GLN . . . . . . . . . . . . . 7.8 mt-30 -147.29 178.5 8.36 Favored 'General case' 0 CA--C 1.536 0.431 0 C-N-CA 127.47 2.308 . . . . 0.0 107.825 -177.119 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 107' ' ' THR . . . . . . . . . . . . . 1.0 OUTLIER -128.7 158.22 39.19 Favored 'General case' 0 CA--C 1.542 0.636 0 C-N-CA 125.672 1.589 . . . . 0.0 107.467 171.333 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 108' ' ' LEU . . . . . . . . . . . . . 87.1 mt -145.76 162.56 37.34 Favored 'General case' 0 N--CA 1.468 0.455 0 C-N-CA 126.085 1.754 . . . . 0.0 110.491 -170.901 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 109' ' ' THR . . . . . . . . . . . . . 99.5 m -122.13 115.43 22.42 Favored 'General case' 0 C--O 1.238 0.456 0 C-N-CA 125.203 1.401 . . . . 0.0 108.196 172.293 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 110' ' ' TYR . . . . . . . . . . . . . 95.6 m-85 -109.68 143.32 39.61 Favored 'General case' 0 C--O 1.232 0.16 0 N-CA-C 109.617 -0.512 . . . . 0.0 109.617 171.461 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 111' ' ' LYS . . . . . . . . . . . . . 11.0 tppt? -99.08 142.97 29.89 Favored 'General case' 0 C--O 1.234 0.248 0 C-N-CA 123.954 0.902 . . . . 0.0 109.064 -178.134 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 112' ' ' LEU . . . . . . . . . . . . . 15.6 tp -73.95 60.01 0.73 Allowed 'General case' 0 CA--C 1.536 0.435 0 C-N-CA 125.275 1.43 . . . . 0.0 108.731 167.343 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 113' ' ' ALA . . . . . . . . . . . . . . . -81.8 75.43 8.74 Favored 'General case' 0 N--CA 1.449 -0.51 0 N-CA-C 106.863 -1.532 . . . . 0.0 106.863 167.67 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 114' ' ' ASP . . . . . . . . . . . . 0.269 19.5 p-10 . . . . . 0 CA--C 1.522 -0.102 0 CA-C-O 123.085 1.421 . . . . 0.0 112.307 -178.773 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 20.8 ttt . . . . . 0 CA--C 1.536 0.427 0 CA-C-O 121.396 0.617 . . . . 0.0 110.878 . . . . . . . . . 0 0 . 1 . 011 nuclear orig core ' A' A ' 2' ' ' VAL . . . . . . . . . . . . . 14.7 p -52.77 158.12 0.48 Allowed 'Isoleucine or valine' 0 CA--C 1.545 0.777 0 C-N-CA 128.088 2.555 . . . . 0.0 112.271 171.906 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 3' ' ' THR . . . . . . . . . . . . . 57.1 p -133.82 164.99 40.06 Favored Pre-proline 0 N--CA 1.467 0.425 0 O-C-N 121.24 -0.913 . . . . 0.0 111.071 178.367 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 4' ' ' PRO . . . . . . . . . . . . . 37.9 Cg_endo -62.84 -38.94 44.92 Favored 'Trans proline' 0 C--N 1.344 0.311 0 C-N-CA 123.565 2.843 . . . . 0.0 113.058 170.243 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 5' ' ' GLU . . . . . 0.411 ' C ' ' H ' ' A' ' 7' ' ' LEU . 8.7 tt0 -63.92 -44.73 92.02 Favored 'General case' 0 C--N 1.329 -0.284 0 C-N-CA 122.583 0.353 . . . . 0.0 111.019 -173.757 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 6' ' ' GLN . . . . . . . . . . . . . 13.5 pt20 -71.95 13.81 0.26 Allowed 'General case' 0 CA--C 1.541 0.611 0 C-N-CA 123.53 0.732 . . . . 0.0 112.744 179.542 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 7' ' ' LEU . . . . . 0.411 ' H ' ' C ' ' A' ' 5' ' ' GLU . 95.6 mt -126.52 -51.36 1.49 Allowed 'General case' 0 N--CA 1.452 -0.361 0 C-N-CA 125.928 1.691 . . . . 0.0 110.441 -176.58 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 8' ' ' GLN . . . . . . . . . . . . 0.267 0.0 OUTLIER -54.97 -12.07 0.76 Allowed 'General case' 0 N--CA 1.478 0.929 0 N-CA-C 115.098 1.518 . . . . 0.0 115.098 -173.303 . . . . . . . . 3 3 . 1 . 011 nuclear orig core ' A' A ' 9' ' ' HIS . . . . . . . . . . . . . 10.3 m170 -125.63 13.84 8.09 Favored 'General case' 0 N--CA 1.443 -0.815 0 C-N-CA 125.44 1.496 . . . . 0.0 110.469 -169.509 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 10' ' ' HIS . . . . . . . . . . . . . 81.2 m-70 -141.42 126.02 17.86 Favored 'General case' 0 CA--C 1.538 0.483 0 C-N-CA 124.844 1.258 . . . . 0.0 112.162 -175.196 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 11' ' ' ARG . . . . . . . . . . . . . 39.3 ttt180 -68.66 149.63 48.88 Favored 'General case' 0 N--CA 1.467 0.417 0 C-N-CA 123.7 0.8 . . . . 0.0 110.004 165.63 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 12' ' ' PHE . . . . . . . . . . . . . 30.9 m-85 -129.64 167.07 18.53 Favored 'General case' 0 CA--C 1.538 0.489 0 C-N-CA 124.314 1.046 . . . . 0.0 109.66 163.417 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 13' ' ' VAL . . . . . . . . . . . . . 12.7 p -135.44 147.15 28.99 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.619 0 O-C-N 121.053 -1.029 . . . . 0.0 110.313 176.346 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 14' ' ' LEU . . . . . . . . . . . . . 43.6 tp -73.17 97.58 2.43 Favored 'General case' 0 N--CA 1.456 -0.155 0 N-CA-C 107.763 -1.199 . . . . 0.0 107.763 172.011 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 4.9 mm-40 -79.36 -50.64 10.54 Favored 'General case' 0 C--N 1.324 -0.503 0 N-CA-C 108.983 -0.747 . . . . 0.0 108.983 173.527 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 77.5 p -147.72 165.38 30.67 Favored 'General case' 0 C--O 1.236 0.365 0 CA-C-O 122.236 1.017 . . . . 0.0 112.595 -176.643 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 17' ' ' VAL . . . . . . . . . . . . . 13.3 t -132.83 161.85 40.91 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.53 0 C-N-CA 127.04 2.136 . . . . 0.0 107.16 -164.73 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 18' ' ' ASN . . . . . . . . . . . . . 30.9 t30 -56.41 -36.45 68.96 Favored 'General case' 0 N--CA 1.468 0.436 0 C-N-CA 124.272 1.029 . . . . 0.0 113.424 -177.379 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . -94.09 -31.73 7.9 Favored Glycine 0 C--N 1.335 0.473 0 CA-C-O 118.593 -1.115 . . . . 0.0 113.919 -167.521 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 1.3 pttt 174.47 154.85 0.31 Allowed Pre-proline 0 N--CA 1.465 0.317 0 C-N-CA 127.922 2.489 . . . . 0.0 107.012 -177.636 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 21' ' ' PRO . . . . . . . . . . . . . 72.0 Cg_endo -71.29 177.29 6.79 Favored 'Trans proline' 0 N--CA 1.454 -0.816 0 C-N-CA 121.537 1.492 . . . . 0.0 111.289 -179.13 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 22' ' ' VAL . . . . . . . . . . . . . 7.0 p -129.8 164.67 31.84 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.408 0 C-N-CA 125.403 1.481 . . . . 0.0 108.497 -172.792 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 23' ' ' THR . . . . . . . . . . . . . 0.6 OUTLIER -146.64 129.56 16.32 Favored 'General case' 0 CA--C 1.534 0.342 0 N-CA-C 107.11 -1.441 . . . . 0.0 107.11 174.671 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 24' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER -152.29 84.85 1.26 Allowed 'General case' 0 C--N 1.328 -0.347 0 N-CA-C 104.448 -2.427 . . . . 0.0 104.448 171.134 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 25' ' ' ASP . . . . . . . . . . . . . 0.8 OUTLIER -51.51 -40.7 60.11 Favored 'General case' 0 C--N 1.33 -0.25 0 C-N-CA 123.976 0.91 . . . . 0.0 109.492 175.441 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 26' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -91.4 107.18 19.03 Favored 'General case' 0 N--CA 1.449 -0.492 0 C-N-CA 125.829 1.652 . . . . 0.0 108.893 177.99 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 27' ' ' ASN . . . . . . . . . . . . . 73.9 m-80 47.75 73.37 1.01 Allowed Pre-proline 0 CA--C 1.537 0.456 0 C-N-CA 127.356 2.262 . . . . 0.0 112.116 173.228 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 28' ' ' PRO . . . . . . . . . . . . . 52.2 Cg_endo -66.59 170.76 11.83 Favored 'Trans proline' 0 C--O 1.242 0.678 0 C-N-CA 122.839 2.359 . . . . 0.0 112.615 -176.545 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 29' ' ' PRO . . . . . . . . . . . . . 43.6 Cg_endo -71.22 63.64 2.69 Favored 'Trans proline' 0 CA--C 1.538 0.705 0 C-N-CA 123.747 2.964 . . . . 0.0 111.615 173.411 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 30' ' ' GLU . . . . . . . . . . . . . 16.4 pt-20 -81.64 166.49 20.13 Favored 'General case' 0 C--O 1.24 0.557 0 O-C-N 120.461 -1.399 . . . . 0.0 109.927 174.275 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 31' ' ' ILE . . . . . . . . . . . . . 12.7 tt -139.57 138.23 39.6 Favored 'Isoleucine or valine' 0 N--CA 1.455 -0.224 0 N-CA-C 107.632 -1.247 . . . . 0.0 107.632 -179.969 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 32' ' ' SER . . . . . . . . . . . . . 36.8 p -124.01 120.97 33.99 Favored 'General case' 0 N--CA 1.445 -0.689 0 N-CA-C 106.627 -1.62 . . . . 0.0 106.627 176.882 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 33' ' ' PHE . . . . . . . . . . . . . 75.3 m-85 -86.88 137.55 32.29 Favored 'General case' 0 N--CA 1.448 -0.536 0 N-CA-C 105.035 -2.209 . . . . 0.0 105.035 171.97 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 34' ' ' GLY . . . . . . . . . . . . . . . -156.97 163.95 32.53 Favored Glycine 0 C--N 1.335 0.504 0 O-C-N 121.063 -1.023 . . . . 0.0 110.663 178.46 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 35' ' ' GLU . . . . . . . . . . . . . 3.9 tt0 63.73 -161.98 0.28 Allowed 'General case' 0 N--CA 1.452 -0.363 0 CA-C-N 118.675 1.238 . . . . 0.0 110.525 175.432 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 2.8 mtpt -59.32 71.71 0.01 OUTLIER 'General case' 0 CA--C 1.539 0.557 0 C-N-CA 127.046 2.139 . . . . 0.0 111.503 -177.005 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 37' ' ' MET . . . . . . . . . . . . 0.297 0.0 OUTLIER 50.71 19.36 0.59 Allowed 'General case' 0 N--CA 1.445 -0.688 0 C-N-CA 128.19 2.596 . . . . 0.0 115.449 -169.52 . . . . . . . . 3 3 . 1 . 011 nuclear orig core ' A' A ' 38' ' ' MET . . . . . . . . . . . . . 0.7 OUTLIER -67.34 165.4 16.47 Favored 'General case' 0 N--CA 1.443 -0.777 0 O-C-N 120.877 -1.139 . . . . 0.0 110.757 -174.772 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 39' ' ' ILE . . . . . . . . . . . . . 5.2 mt -135.11 126.46 46.32 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.368 0 N-CA-C 105.75 -1.944 . . . . 0.0 105.75 -169.754 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 40' ' ' SER . . . . . . . . . . . . . 7.4 m -129.92 151.59 50.31 Favored 'General case' 0 CA--C 1.531 0.235 0 N-CA-C 107.819 -1.178 . . . . 0.0 107.819 169.039 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 41' ' ' GLY . . . . . . . . . . . . . . . 178.46 173.91 44.25 Favored Glycine 0 C--O 1.237 0.316 0 N-CA-C 109.599 -1.4 . . . . 0.0 109.599 -178.34 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 42' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -147.38 83.61 1.55 Allowed 'General case' 0 N--CA 1.451 -0.405 0 O-C-N 122.226 -0.573 . . . . 0.0 111.134 179.982 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 43' ' ' MET . . . . . . . . . . . . . 6.1 mmt -47.82 -55.71 9.12 Favored 'General case' 0 C--N 1.342 0.266 0 C-N-CA 123.68 0.792 . . . . 0.0 109.006 169.14 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 44' ' ' CYS . . . . . 1.293 ' SG ' ' SG ' ' A' ' 70' ' ' CYS . 18.0 p -163.26 -27.38 0.04 OUTLIER 'General case' 0 N--CA 1.443 -0.819 0 C-N-CA 125.115 1.366 . . . . 0.0 110.989 176.093 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 45' ' ' ASN . . . . . . . . . . . . . 0.5 OUTLIER -121.38 20.23 11.26 Favored 'General case' 0 N--CA 1.47 0.559 0 C-N-CA 126.265 1.826 . . . . 0.0 112.217 -167.107 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 46' ' ' ARG . . . . . . . . . . . . . 34.3 mtm180 48.35 166.88 0.0 OUTLIER 'General case' 0 C--N 1.329 -0.312 0 C-N-CA 127.011 2.124 . . . . 0.0 111.661 -155.124 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 47' ' ' PHE . . . . . . . . . . . . . 6.0 p90 -164.41 147.93 9.29 Favored 'General case' 0 C--N 1.317 -0.819 0 N-CA-C 106.127 -1.805 . . . . 0.0 106.127 166.029 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 48' ' ' SER . . . . . . . . . . . . . 1.5 p -160.75 151.79 18.82 Favored 'General case' 0 C--N 1.314 -0.954 0 N-CA-C 107.304 -1.369 . . . . 0.0 107.304 179.529 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 49' ' ' GLY . . . . . . . . . . . . . . . -172.51 163.05 35.01 Favored Glycine 0 CA--C 1.524 0.635 0 N-CA-C 106.574 -2.61 . . . . 0.0 106.574 165.852 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 50' ' ' GLU . . . . . . . . . . . . . 25.8 mt-10 -64.27 115.68 5.28 Favored 'General case' 0 C--O 1.238 0.498 0 N-CA-C 107.781 -1.192 . . . . 0.0 107.781 172.109 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 51' ' ' GLY . . . . . . . . . . . . . . . -61.42 161.36 26.48 Favored Glycine 0 CA--C 1.531 1.064 0 O-C-N 123.628 0.58 . . . . 0.0 113.388 174.545 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 52' ' ' LYS . . . . . . . . . . . . . 25.9 ttpt -133.4 135.53 44.71 Favored 'General case' 0 N--CA 1.464 0.227 0 O-C-N 121.692 -0.887 . . . . 0.0 109.219 165.894 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 53' ' ' LEU . . . . . . . . . . . . . 9.6 tp -160.47 93.76 1.04 Allowed 'General case' 0 N--CA 1.453 -0.31 0 C-N-CA 123.511 0.724 . . . . 0.0 109.881 -176.356 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 2.5 t -136.74 -12.45 1.75 Allowed 'General case' 0 C--N 1.326 -0.445 0 C-N-CA 123.721 0.808 . . . . 0.0 111.047 168.765 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 55' ' ' ASN . . . . . . . . . . . . . 4.3 t30 -136.6 24.67 3.14 Favored 'General case' 0 CA--C 1.541 0.602 0 C-N-CA 127.114 2.165 . . . . 0.0 109.944 -171.851 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 56' ' ' GLY . . . . . . . . . . . . . . . 73.66 -3.55 33.8 Favored Glycine 0 CA--C 1.532 1.096 0 O-C-N 120.584 -1.322 . . . . 0.0 114.716 -175.968 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 57' ' ' GLU . . . . . . . . . . . . . 30.9 tt0 -110.45 105.28 14.2 Favored 'General case' 0 N--CA 1.452 -0.363 0 CA-C-N 118.747 1.274 . . . . 0.0 110.159 -161.539 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 58' ' ' LEU . . . . . . . . . . . . . 21.2 tp -75.99 93.83 3.32 Favored 'General case' 0 CA--C 1.536 0.408 0 C-N-CA 125.222 1.409 . . . . 0.0 112.251 176.84 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 59' ' ' THR . . . . . . . . . . . . . 14.9 p -108.02 127.74 54.04 Favored 'General case' 0 N--CA 1.474 0.742 0 C-N-CA 124.815 1.246 . . . . 0.0 109.955 172.916 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 60' ' ' ALA . . . . . . . . . . . . . . . -132.0 87.34 2.43 Favored 'General case' 0 N--CA 1.454 -0.226 0 C-N-CA 124.443 1.097 . . . . 0.0 109.504 173.571 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 61' ' ' LYS . . . . . . . . . . . . . 47.6 tttm -44.89 -62.4 1.24 Allowed 'General case' 0 C--N 1.331 -0.209 0 C-N-CA 125.817 1.647 . . . . 0.0 110.082 167.745 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 62' ' ' GLY . . . . . . . . . . . . . . . -79.38 45.57 2.87 Favored Glycine 0 CA--C 1.521 0.441 0 C-N-CA 125.251 1.405 . . . . 0.0 112.725 -176.52 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 63' ' ' LEU . . . . . . . . . . . . . 5.7 tp -63.56 142.6 58.34 Favored 'General case' 0 N--CA 1.441 -0.879 0 CA-C-N 118.474 1.137 . . . . 0.0 108.248 166.641 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 64' ' ' ALA . . . . . . . . . . . . . . . -128.88 93.11 3.53 Favored 'General case' 0 N--CA 1.455 -0.223 0 C-N-CA 124.727 1.211 . . . . 0.0 109.741 -173.351 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 65' ' ' MET . . . . . . . . . . . . . 74.9 mtp -115.64 156.36 26.01 Favored 'General case' 0 N--CA 1.467 0.406 0 C-N-CA 124.717 1.207 . . . . 0.0 110.346 -177.377 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 66' ' ' THR . . . . . . . . . . . . . 34.7 p -88.73 -172.06 3.57 Favored 'General case' 0 CA--C 1.544 0.717 0 C-N-CA 123.933 0.893 . . . . 0.0 109.736 173.245 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 67' ' ' ARG . . . . . . . . . . . . . 34.0 mtm180 -130.45 14.34 5.52 Favored 'General case' 0 N--CA 1.47 0.564 0 C-N-CA 124.005 0.922 . . . . 0.0 112.97 170.614 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 68' ' ' MET . . . . . . . . . . . . . 4.0 mpp? -61.5 166.53 4.0 Favored 'General case' 0 CA--C 1.532 0.254 0 O-C-N 120.033 -1.667 . . . . 0.0 111.688 178.367 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 69' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -58.02 111.08 1.06 Allowed 'General case' 0 N--CA 1.445 -0.677 0 C-N-CA 125.96 1.704 . . . . 0.0 108.291 171.305 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 70' ' ' CYS . . . . . 1.293 ' SG ' ' SG ' ' A' ' 44' ' ' CYS . 69.7 m -62.12 -14.09 33.34 Favored 'General case' 0 C--O 1.231 0.111 0 CA-C-O 118.485 -0.769 . . . . 0.0 112.86 170.585 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 71' ' ' ALA . . . . . . . . . . . . . . . 61.03 3.98 0.76 Allowed 'General case' 0 CA--C 1.533 0.295 0 C-N-CA 126.69 1.996 . . . . 0.0 115.38 163.941 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 72' ' ' ASN . . . . . . . . . . . . . 7.4 t30 -142.73 143.4 25.72 Favored Pre-proline 0 N--CA 1.466 0.373 0 N-CA-C 107.775 -1.194 . . . . 0.0 107.775 158.315 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 73' ' ' PRO . . . . . . . . . . . . . 19.0 Cg_endo -63.83 -47.02 7.54 Favored 'Trans proline' 0 C--N 1.346 0.411 0 C-N-CA 123.148 2.565 . . . . 0.0 111.815 -165.963 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 74' ' ' GLN . . . . . . . . . . . . . 48.2 tt0 -59.79 -38.65 82.5 Favored 'General case' 0 CA--C 1.532 0.272 0 CA-C-O 119.238 -0.41 . . . . 0.0 110.616 -179.052 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 75' ' ' LEU . . . . . . . . . . . . . 36.7 mt -72.24 -41.99 66.17 Favored 'General case' 0 CA--C 1.533 0.301 0 N-CA-C 109.269 -0.641 . . . . 0.0 109.269 -178.115 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 76' ' ' ASN . . . . . . . . . . . . . 4.1 t-20 -63.14 -37.85 88.86 Favored 'General case' 0 N--CA 1.469 0.494 0 C-N-CA 123.104 0.562 . . . . 0.0 111.188 -179.721 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 77' ' ' GLU . . . . . . . . . . . . . 0.7 OUTLIER -60.53 -24.33 65.28 Favored 'General case' 0 CA--C 1.542 0.647 0 N-CA-C 113.331 0.863 . . . . 0.0 113.331 175.257 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 78' ' ' LEU . . . . . . . . . . . . . 94.3 mt -89.37 -15.42 33.36 Favored 'General case' 0 CA--C 1.522 -0.128 0 CA-C-O 118.352 -0.832 . . . . 0.0 111.585 -176.375 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 79' ' ' ASP . . . . . . . . . . . . . 35.5 t70 -55.9 -42.26 75.74 Favored 'General case' 0 CA--C 1.518 -0.26 0 C-N-CA 124.952 1.301 . . . . 0.0 111.895 175.58 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 80' ' ' ASN . . . . . . . . . . . . . 71.6 m-20 -77.16 -55.49 5.39 Favored 'General case' 0 N--CA 1.451 -0.398 0 N-CA-C 107.47 -1.307 . . . . 0.0 107.47 -179.104 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 81' ' ' THR . . . . . . . . . . . . . 22.5 m -45.23 -54.95 6.34 Favored 'General case' 0 CA--C 1.536 0.405 0 C-N-CA 126.241 1.816 . . . . 0.0 110.938 -176.931 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 82' ' ' ILE . . . . . . . . . . . . . 9.5 tp -64.93 -40.74 90.08 Favored 'Isoleucine or valine' 0 C--O 1.236 0.362 0 CA-C-N 119.089 0.859 . . . . 0.0 111.373 -175.529 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 83' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -64.86 -38.63 91.61 Favored 'General case' 0 N--CA 1.449 -0.513 0 N-CA-C 109.083 -0.71 . . . . 0.0 109.083 -175.893 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 84' ' ' GLU . . . . . . . . . . . . . 94.7 mt-10 -74.75 -34.1 62.46 Favored 'General case' 0 N--CA 1.446 -0.631 0 C-N-CA 126.705 2.002 . . . . 0.0 111.374 -177.402 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 85' ' ' MET . . . . . . . . . . . . . 84.3 mtp -67.31 -55.09 15.29 Favored 'General case' 0 C--N 1.34 0.192 0 CA-C-O 122.131 0.967 . . . . 0.0 108.556 -179.678 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 86' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -66.6 -20.79 66.09 Favored 'General case' 0 C--N 1.333 -0.122 0 C-N-CA 123.657 0.783 . . . . 0.0 111.98 -173.93 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 87' ' ' LYS . . . . . . . . . . . . . 2.5 tptt -71.19 -40.49 71.16 Favored 'General case' 0 N--CA 1.453 -0.321 0 CA-C-O 117.668 -1.158 . . . . 0.0 111.303 179.153 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 88' ' ' GLU . . . . . . . . . . . . . 0.6 OUTLIER -84.54 -37.94 20.62 Favored 'General case' 0 C--N 1.341 0.225 0 O-C-N 124.282 0.989 . . . . 0.0 112.169 -175.615 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 89' ' ' GLY . . . . . . . . . . . . . . . 122.09 84.94 0.75 Allowed Glycine 0 CA--C 1.503 -0.7 0 N-CA-C 109.937 -1.265 . . . . 0.0 109.937 -174.031 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 90' ' ' ALA . . . . . . . . . . . . . . . -67.33 139.43 57.23 Favored 'General case' 0 N--CA 1.447 -0.616 0 N-CA-C 108.441 -0.948 . . . . 0.0 108.441 175.336 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 91' ' ' GLN . . . . . . . . . . . . . 6.9 mp0 -67.33 141.94 56.97 Favored 'General case' 0 N--CA 1.439 -1.01 0 N-CA-C 105.305 -2.109 . . . . 0.0 105.305 164.897 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 92' ' ' VAL . . . . . . . . . . . . . 79.5 t -130.01 117.76 41.91 Favored 'Isoleucine or valine' 0 N--CA 1.447 -0.607 0 N-CA-C 105.561 -2.015 . . . . 0.0 105.561 178.597 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 93' ' ' ASP . . . . . . . . . . . . . 31.4 m-20 -128.0 84.79 2.28 Favored 'General case' 0 C--N 1.327 -0.375 0 C-N-CA 127.065 2.146 . . . . 0.0 105.309 -171.764 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 94' ' ' LEU . . . . . . . . . . . . . 57.8 tp -85.2 109.17 18.12 Favored 'General case' 0 CA--C 1.516 -0.359 0 CA-C-O 122.336 1.065 . . . . 0.0 108.568 173.131 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 95' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -77.75 179.27 6.74 Favored 'General case' 0 C--N 1.315 -0.933 0 C-N-CA 127.022 2.129 . . . . 0.0 109.115 169.086 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 96' ' ' ALA . . . . . . . . . . . . . . . -44.52 -41.94 6.81 Favored 'General case' 0 CA--C 1.535 0.373 0 C-N-CA 125.021 1.328 . . . . 0.0 114.026 -163.918 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 97' ' ' ASN . . . . . . . . . . . . . 17.0 p30 -150.96 31.55 0.62 Allowed 'General case' 0 CA--C 1.535 0.376 0 C-N-CA 125.352 1.461 . . . . 0.0 111.993 170.92 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 98' ' ' GLN . . . . . . . . . . . . . 13.7 tt0 -147.8 125.57 11.89 Favored 'General case' 0 N--CA 1.457 -0.122 0 O-C-N 121.484 -0.76 . . . . 0.0 109.83 -178.62 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 99' ' ' LEU . . . . . . . . . . . . . 22.5 tp -90.22 129.64 36.45 Favored 'General case' 0 C--N 1.327 -0.399 0 C-N-CA 126.615 1.966 . . . . 0.0 110.448 -177.007 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 100' ' ' THR . . . . . . . . . . . . . 74.5 m -104.58 128.64 52.63 Favored 'General case' 0 N--CA 1.454 -0.271 0 C-N-CA 123.815 0.846 . . . . 0.0 109.593 158.931 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 101' ' ' LEU . . . . . . . . . . . . . 1.0 OUTLIER -98.13 141.93 30.45 Favored 'General case' 0 CA--C 1.519 -0.222 0 C-N-CA 126.175 1.79 . . . . 0.0 107.126 159.881 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 102' ' ' ALA . . . . . . . . . . . . . . . -143.76 148.13 35.18 Favored 'General case' 0 C--N 1.328 -0.362 0 C-N-CA 124.814 1.246 . . . . 0.0 107.831 172.015 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 103' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -162.54 173.42 14.01 Favored 'General case' 0 N--CA 1.442 -0.838 0 C-N-CA 126.89 2.076 . . . . 0.0 107.651 173.591 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 104' ' ' ALA . . . . . . . . . . . . . . . -51.17 -36.64 42.11 Favored 'General case' 0 CA--C 1.531 0.214 0 C-N-CA 123.803 0.841 . . . . 0.0 112.146 173.868 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 105' ' ' LYS . . . . . . . . . . . . . 12.5 mmtp -63.33 -74.61 0.09 Allowed 'General case' 0 C--N 1.339 0.113 0 CA-C-O 118.683 -0.675 . . . . 0.0 111.162 174.706 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 106' ' ' GLN . . . . . . . . . . . . . 2.6 pt20 -152.73 -172.04 4.12 Favored 'General case' 0 CA--C 1.534 0.355 0 CA-C-N 118.625 0.648 . . . . 0.0 111.667 -176.261 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 107' ' ' THR . . . . . . . . . . . . . 1.8 t -128.58 135.81 49.87 Favored 'General case' 0 CA--C 1.534 0.345 0 C-N-CA 126.321 1.848 . . . . 0.0 107.875 177.498 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 108' ' ' LEU . . . . . . . . . . . . . 5.9 mp -123.78 149.83 45.17 Favored 'General case' 0 C--O 1.233 0.229 0 C-N-CA 128.346 2.658 . . . . 0.0 107.604 -173.838 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 109' ' ' THR . . . . . . . . . . . . . 1.3 m -132.08 102.19 5.71 Favored 'General case' 0 C--O 1.238 0.45 0 CA-C-O 121.746 0.784 . . . . 0.0 109.469 -176.367 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 110' ' ' TYR . . . . . . . . . . . . . 51.5 m-85 -103.26 144.61 31.11 Favored 'General case' 0 N--CA 1.453 -0.318 0 C-N-CA 124.925 1.29 . . . . 0.0 110.375 -173.893 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 111' ' ' LYS . . . . . . . . . . . . . 0.8 OUTLIER -98.81 142.65 30.07 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-O 117.739 -1.124 . . . . 0.0 109.398 -176.769 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 112' ' ' LEU . . . . . . . . . . . . . 39.1 tp -74.14 56.91 0.63 Allowed 'General case' 0 CA--C 1.542 0.644 0 C-N-CA 124.017 0.927 . . . . 0.0 109.214 162.586 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 113' ' ' ALA . . . . . . . . . . . . . . . -92.22 63.68 4.34 Favored 'General case' 0 C--O 1.236 0.368 0 CA-C-O 122.487 1.137 . . . . 0.0 108.456 -177.625 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 114' ' ' ASP . . . . . . . . . . . . . 5.1 p-10 . . . . . 0 C--N 1.326 -0.43 0 CA-C-N 114.633 -1.167 . . . . 0.0 113.203 -157.202 . . . . . . . . 0 0 . 1 . 012 nuclear orig core ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 53.0 ttp . . . . . 0 N--CA 1.452 -0.371 0 N-CA-C 108.853 -0.795 . . . . 0.0 108.853 . . . . . . . . . 0 0 . 1 . 012 nuclear orig core ' A' A ' 2' ' ' VAL . . . . . . . . . . . . . 13.4 p -67.44 160.46 4.31 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.366 0 C-N-CA 123.986 0.914 . . . . 0.0 111.177 175.117 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 3' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -124.66 156.52 67.99 Favored Pre-proline 0 CA--C 1.541 0.616 0 C-N-CA 125.601 1.56 . . . . 0.0 111.093 163.885 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 4' ' ' PRO . . . . . . . . . . . . . 93.9 Cg_endo -72.72 -33.15 8.53 Favored 'Trans proline' 0 C--N 1.347 0.493 0 C-N-CA 124.001 3.134 . . . . 0.0 111.704 -174.943 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 5' ' ' GLU . . . . . . . . . . . . . 49.6 tt0 -44.51 -44.91 8.97 Favored 'General case' 0 CA--C 1.537 0.443 0 C-N-CA 124.304 1.041 . . . . 0.0 109.277 169.847 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 6' ' ' GLN . . . . . . . . . . . . . 10.6 mt-30 -70.35 4.88 2.0 Favored 'General case' 0 CA--C 1.538 0.503 0 N-CA-C 114.364 1.246 . . . . 0.0 114.364 -179.351 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 7' ' ' LEU . . . . . . . . . . . . . 19.7 mt -125.75 -48.98 1.63 Allowed 'General case' 0 C--N 1.333 -0.123 0 C-N-CA 125.712 1.605 . . . . 0.0 110.299 -174.922 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 8' ' ' GLN . . . . . . . . . . . . . 14.4 mt-30 -58.21 -2.73 0.2 Allowed 'General case' 0 CA--C 1.54 0.573 0 C-N-CA 127.395 2.278 . . . . 0.0 115.682 -171.708 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 9' ' ' HIS . . . . . . . . . . . . . 56.3 m-70 -141.15 8.07 2.03 Favored 'General case' 0 CA--C 1.537 0.461 0 C-N-CA 125.204 1.402 . . . . 0.0 112.809 173.296 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 10' ' ' HIS . . . . . . . . . . . . . 95.8 m-70 -122.6 120.17 32.97 Favored 'General case' 0 CA--C 1.529 0.152 0 CA-C-N 119.339 0.972 . . . . 0.0 109.937 -169.798 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 11' ' ' ARG . . . . . 0.463 HH21 ' CD ' ' A' ' 30' ' ' GLU . 1.2 ttt85 -81.76 150.79 27.76 Favored 'General case' 0 CA--C 1.517 -0.317 0 C-N-CA 124.049 0.94 . . . . 0.0 111.226 -179.577 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 12' ' ' PHE . . . . . . . . . . . . . 95.7 m-85 -139.11 159.08 43.0 Favored 'General case' 0 N--CA 1.438 -1.026 0 C-N-CA 125.829 1.652 . . . . 0.0 108.634 174.539 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 13' ' ' VAL . . . . . 0.419 ' HA ' ' HA ' ' A' ' 30' ' ' GLU . 0.0 OUTLIER -136.02 140.06 44.69 Favored 'Isoleucine or valine' 0 C--N 1.312 -1.025 0 C-N-CA 128.346 2.658 . . . . 0.0 106.391 -170.236 . . . . . . . . 3 3 . 1 . 012 nuclear orig core ' A' A ' 14' ' ' LEU . . . . . . . . . . . . . 15.2 tp -77.48 77.82 4.0 Favored 'General case' 0 N--CA 1.465 0.287 0 CA-C-O 122.407 1.099 . . . . 0.0 110.376 -177.958 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 7.3 tp10 -63.79 -41.01 98.02 Favored 'General case' 0 C--N 1.324 -0.536 0 C-N-CA 127.03 2.132 . . . . 0.0 110.655 -174.241 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 2.6 p -154.78 147.55 24.39 Favored 'General case' 0 CA--C 1.535 0.365 0 N-CA-C 113.949 1.092 . . . . 0.0 113.949 167.811 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 17' ' ' VAL . . . . . . . . . . . . . 13.7 t -95.9 166.96 1.75 Allowed 'Isoleucine or valine' 0 N--CA 1.462 0.157 0 C-N-CA 125.467 1.507 . . . . 0.0 108.177 176.842 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 18' ' ' ASN . . . . . . . . . . . . . 15.0 t30 -44.8 -23.54 0.14 Allowed 'General case' 0 CA--C 1.536 0.409 0 C-N-CA 128.476 2.71 . . . . 0.0 114.857 168.846 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . -112.01 -54.88 0.48 Allowed Glycine 0 C--N 1.335 0.498 0 C-N-CA 124.256 0.932 . . . . 0.0 112.789 179.761 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -153.99 161.92 28.07 Favored Pre-proline 0 CA--C 1.533 0.3 0 C-N-CA 124.696 1.198 . . . . 0.0 108.821 -166.856 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 21' ' ' PRO . . . . . . . . . . . . . 59.4 Cg_endo -71.95 173.54 12.66 Favored 'Trans proline' 0 N--CA 1.456 -0.688 0 C-N-CA 121.772 1.648 . . . . 0.0 110.995 175.165 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 22' ' ' VAL . . . . . . . . . . . . . 3.9 t -119.9 145.38 26.25 Favored 'Isoleucine or valine' 0 C--O 1.233 0.223 0 N-CA-C 106.917 -1.512 . . . . 0.0 106.917 175.465 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 23' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -145.37 117.55 8.38 Favored 'General case' 0 C--N 1.324 -0.527 0 N-CA-C 108.112 -1.07 . . . . 0.0 108.112 172.959 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 24' ' ' SER . . . . . . . . . . . . . 70.4 p -117.2 4.24 12.65 Favored 'General case' 0 N--CA 1.462 0.169 0 O-C-N 120.971 -1.081 . . . . 0.0 112.746 175.932 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 25' ' ' ASP . . . . . . . . . . . . . 1.7 t70 62.21 -37.61 0.13 Allowed 'General case' 0 N--CA 1.475 0.791 0 C-N-CA 131.183 3.793 . . . . 0.0 114.464 -179.209 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 26' ' ' LYS . . . . . . . . . . . . . 7.0 tptp -134.98 155.45 50.73 Favored 'General case' 0 N--CA 1.438 -1.072 0 C-N-CA 128.223 2.609 . . . . 0.0 105.468 171.435 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 27' ' ' ASN . . . . . . . . . . . . . 76.6 m-20 49.13 68.07 3.88 Favored Pre-proline 0 C--N 1.325 -0.469 0 C-N-CA 126.232 1.813 . . . . 0.0 110.28 177.382 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 28' ' ' PRO . . . . . . . . . . . . . 54.7 Cg_endo -64.51 155.1 68.28 Favored 'Trans proline' 0 N--CA 1.455 -0.738 0 C-N-CA 122.559 2.172 . . . . 0.0 110.633 177.108 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 29' ' ' PRO . . . . . . . . . . . . . 30.1 Cg_endo -69.13 78.95 0.77 Allowed 'Trans proline' 0 N--CA 1.455 -0.776 0 C-N-CA 123.045 2.496 . . . . 0.0 108.841 166.155 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 30' ' ' GLU . . . . . 0.463 ' CD ' HH21 ' A' ' 11' ' ' ARG . 8.4 pt-20 -106.49 150.03 26.5 Favored 'General case' 0 C--N 1.319 -0.735 0 C-N-CA 127.66 2.384 . . . . 0.0 106.38 -178.829 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 31' ' ' ILE . . . . . . . . . . . . . 16.6 tt -132.14 144.8 36.03 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.467 0 N-CA-C 107.001 -1.481 . . . . 0.0 107.001 -173.752 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 32' ' ' SER . . . . . . . . . . . . . 65.6 p -138.5 164.69 28.76 Favored 'General case' 0 N--CA 1.447 -0.602 0 N-CA-C 107.199 -1.408 . . . . 0.0 107.199 172.71 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 33' ' ' PHE . . . . . . . . . . . . . 59.2 m-85 -125.78 163.68 22.33 Favored 'General case' 0 N--CA 1.447 -0.623 0 N-CA-C 109.018 -0.734 . . . . 0.0 109.018 176.505 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 34' ' ' GLY . . . . . . . . . . . . . . . -151.4 -171.85 19.74 Favored Glycine 0 N--CA 1.451 -0.301 0 N-CA-C 109.033 -1.627 . . . . 0.0 109.033 172.748 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 35' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -44.34 150.69 0.29 Allowed 'General case' 0 CA--C 1.531 0.24 0 C-N-CA 126.374 1.87 . . . . 0.0 111.106 -175.577 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 36' ' ' LYS . . . . . 0.419 ' HA ' ' HE3' ' A' ' 36' ' ' LYS . 0.0 OUTLIER 57.1 26.83 12.52 Favored 'General case' 0 CA--C 1.533 0.316 0 C-N-CA 124.496 1.118 . . . . 0.0 111.0 -169.486 . . . . . . . . 3 3 . 1 . 012 nuclear orig core ' A' A ' 37' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER 51.6 28.66 4.85 Favored 'General case' 0 CA--C 1.542 0.658 0 C-N-CA 125.587 1.555 . . . . 0.0 111.573 -178.126 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 38' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -57.6 141.64 47.43 Favored 'General case' 0 N--CA 1.444 -0.761 0 C-N-CA 125.536 1.534 . . . . 0.0 109.633 -179.606 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 39' ' ' ILE . . . . . . . . . . . . . 18.8 mt -112.37 126.09 69.73 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.703 0 C-N-CA 126.429 1.892 . . . . 0.0 106.504 -170.099 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 40' ' ' SER . . . . . . . . . . . . . 69.4 m -135.71 135.7 40.26 Favored 'General case' 0 C--O 1.236 0.357 0 C-N-CA 124.213 1.005 . . . . 0.0 110.749 -178.964 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 41' ' ' GLY . . . . . . . . . . . . . . . 167.88 176.87 38.8 Favored Glycine 0 CA--C 1.534 1.245 0 C-N-CA 124.139 0.876 . . . . 0.0 112.225 -174.868 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 42' ' ' SER . . . . . . . . . . . . . 39.9 t -147.52 109.19 4.38 Favored 'General case' 0 N--CA 1.445 -0.725 0 C-N-CA 126.761 2.024 . . . . 0.0 107.901 169.873 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 43' ' ' MET . . . . . . . . . . . . . 11.8 mmt -62.17 -45.03 95.22 Favored 'General case' 0 C--O 1.222 -0.361 0 C-N-CA 120.603 -0.439 . . . . 0.0 110.804 164.339 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 44' ' ' CYS . . . . . 1.304 ' SG ' ' SG ' ' A' ' 70' ' ' CYS . 2.7 t -157.27 -60.87 0.09 Allowed 'General case' 0 CA--C 1.513 -0.444 0 N-CA-C 105.022 -2.214 . . . . 0.0 105.022 -172.32 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 45' ' ' ASN . . . . . . . . . . . . . 1.9 m-20 -101.34 12.85 36.69 Favored 'General case' 0 C--N 1.328 -0.328 0 C-N-CA 125.53 1.532 . . . . 0.0 114.746 -164.541 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 46' ' ' ARG . . . . . . . . . . . . . 18.1 mmm-85 61.38 152.26 0.03 OUTLIER 'General case' 0 C--O 1.218 -0.56 0 C-N-CA 128.191 2.596 . . . . 0.0 112.979 -164.512 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 47' ' ' PHE . . . . . . . . . . . . . 2.9 p90 -158.38 170.86 21.28 Favored 'General case' 0 CA--C 1.515 -0.401 0 C-N-CA 124.62 1.168 . . . . 0.0 107.919 169.639 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 48' ' ' SER . . . . . . . . . . . . . 19.4 m -160.62 163.34 32.67 Favored 'General case' 0 C--N 1.317 -0.824 0 N-CA-C 106.128 -1.804 . . . . 0.0 106.128 179.616 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 49' ' ' GLY . . . . . . . . . . . . . . . -175.91 170.07 42.9 Favored Glycine 0 N--CA 1.445 -0.755 0 CA-C-N 120.532 1.515 . . . . 0.0 110.739 155.487 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 50' ' ' GLU . . . . . . . . . . . . . 27.0 tt0 -74.17 111.68 9.57 Favored 'General case' 0 N--CA 1.441 -0.88 0 N-CA-C 107.266 -1.383 . . . . 0.0 107.266 162.79 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 51' ' ' GLY . . . . . . . . . . . . . . . -82.24 179.93 53.04 Favored Glycine 0 CA--C 1.536 1.377 0 C-N-CA 123.765 0.698 . . . . 0.0 112.927 158.317 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 52' ' ' LYS . . . . . . . . . . . . . 37.9 tttt -162.74 156.83 20.85 Favored 'General case' 0 N--CA 1.473 0.714 0 C-N-CA 126.554 1.941 . . . . 0.0 107.689 168.304 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 53' ' ' LEU . . . . . . . . . . . . . 1.2 tm? -123.89 115.47 21.35 Favored 'General case' 0 C--O 1.234 0.283 0 C-N-CA 124.143 0.977 . . . . 0.0 109.044 176.411 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 28.5 t -134.92 -54.25 0.81 Allowed 'General case' 0 CA--C 1.534 0.365 0 CA-C-O 118.429 -0.796 . . . . 0.0 111.19 175.541 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 55' ' ' ASN . . . . . . . . . . . . . 4.7 p30 -110.6 13.07 22.64 Favored 'General case' 0 N--CA 1.475 0.781 0 N-CA-C 113.55 0.944 . . . . 0.0 113.55 -178.237 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 56' ' ' GLY . . . . . . . . . . . . . . . 91.18 4.86 68.25 Favored Glycine 0 CA--C 1.528 0.887 0 C-N-CA 124.283 0.944 . . . . 0.0 111.911 -172.653 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 57' ' ' GLU . . . . . . . . . . . . . 39.5 tt0 -113.97 109.36 18.36 Favored 'General case' 0 N--CA 1.451 -0.394 0 C-N-CA 124.513 1.125 . . . . 0.0 108.672 -166.13 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 58' ' ' LEU . . . . . . . . . . . . . 35.7 tp -80.42 95.97 6.58 Favored 'General case' 0 N--CA 1.454 -0.257 0 C-N-CA 124.571 1.148 . . . . 0.0 109.074 173.609 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 59' ' ' THR . . . . . . . . . . . . . 1.2 p -95.11 146.86 24.0 Favored 'General case' 0 C--O 1.238 0.461 0 C-N-CA 123.749 0.82 . . . . 0.0 109.805 168.281 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 60' ' ' ALA . . . . . . . . . . . . . . . -68.84 170.28 9.9 Favored 'General case' 0 CA--C 1.537 0.477 0 CA-C-O 121.912 0.863 . . . . 0.0 110.955 163.931 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 61' ' ' LYS . . . . . . . . . . . . . 23.6 tttt -155.02 -9.76 0.12 Allowed 'General case' 0 CA--C 1.535 0.402 0 C-N-CA 128.191 2.596 . . . . 0.0 112.231 179.685 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 62' ' ' GLY . . . . . . . . . . . . . . . 171.03 77.34 0.04 OUTLIER Glycine 0 C--N 1.334 0.464 0 N-CA-C 106.279 -2.728 . . . . 0.0 106.279 -172.827 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 63' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -115.32 146.98 41.0 Favored 'General case' 0 N--CA 1.449 -0.512 0 C-N-CA 124.963 1.305 . . . . 0.0 109.326 -171.915 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 64' ' ' ALA . . . . . . . . . . . . . . . -120.87 167.13 12.87 Favored 'General case' 0 N--CA 1.45 -0.472 0 C-N-CA 125.025 1.33 . . . . 0.0 109.226 -175.01 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 65' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -150.85 -178.66 6.71 Favored 'General case' 0 C--O 1.238 0.456 0 C-N-CA 126.327 1.851 . . . . 0.0 107.223 171.354 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 66' ' ' THR . . . . . . . . . . . . . 4.0 p -129.83 179.53 5.79 Favored 'General case' 0 CA--C 1.538 0.515 0 CA-C-N 119.181 0.9 . . . . 0.0 110.206 164.268 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 67' ' ' ARG . . . . . . . . . . . . . 10.0 mmt85 -127.55 81.29 2.01 Favored 'General case' 0 CA--C 1.529 0.152 0 C-N-CA 125.953 1.701 . . . . 0.0 108.088 179.599 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 68' ' ' MET . . . . . . . . . . . . . 61.5 mtm -118.06 -174.4 2.64 Favored 'General case' 0 CA--C 1.538 0.501 0 C-N-CA 129.242 3.017 . . . . 0.0 109.389 170.933 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 69' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -104.69 173.1 6.45 Favored 'General case' 0 N--CA 1.465 0.284 0 C-N-CA 127.821 2.448 . . . . 0.0 108.709 168.244 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 70' ' ' CYS . . . . . 1.304 ' SG ' ' SG ' ' A' ' 44' ' ' CYS . 68.1 m -142.53 150.01 39.86 Favored 'General case' 0 C--O 1.233 0.214 0 C-N-CA 123.87 0.868 . . . . 0.0 110.265 174.854 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 71' ' ' ALA . . . . . . . . . . . . . . . -84.3 36.7 0.59 Allowed 'General case' 0 CA--C 1.538 0.489 0 C-N-CA 124.149 0.98 . . . . 0.0 111.398 179.074 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 72' ' ' ASN . . . . . . . . . . . . . 4.0 t30 -166.6 150.15 6.52 Favored Pre-proline 0 N--CA 1.465 0.324 0 C-N-CA 124.298 1.039 . . . . 0.0 108.821 159.302 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 73' ' ' PRO . . . . . . . . . . . . . 96.2 Cg_endo -84.2 -33.64 0.3 Allowed 'Trans proline' 0 N--CA 1.461 -0.424 0 C-N-CA 122.352 2.035 . . . . 0.0 113.288 -171.128 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 74' ' ' GLN . . . . . . . . . . . . . 43.2 tt0 -60.88 -37.4 82.06 Favored 'General case' 0 N--CA 1.465 0.317 0 O-C-N 121.671 -0.643 . . . . 0.0 111.541 -175.644 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 75' ' ' LEU . . . . . . . . . . . . . 50.2 mt -53.58 -43.61 68.67 Favored 'General case' 0 CA--C 1.535 0.382 0 C-N-CA 124.968 1.307 . . . . 0.0 108.678 173.186 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 76' ' ' ASN . . . . . . . . . . . . . 0.7 OUTLIER -77.85 5.07 10.33 Favored 'General case' 0 N--CA 1.47 0.528 0 C-N-CA 128.137 2.575 . . . . 0.0 112.4 -174.518 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 77' ' ' GLU . . . . . . . . . . . . . 0.2 OUTLIER -101.72 -46.02 5.06 Favored 'General case' 0 CA--C 1.535 0.394 0 C-N-CA 126.754 2.021 . . . . 0.0 107.79 168.901 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 78' ' ' LEU . . . . . . . . . . . . . 15.3 mt -65.41 -29.03 69.68 Favored 'General case' 0 CA--C 1.53 0.202 0 C-N-CA 124.977 1.311 . . . . 0.0 111.284 176.937 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 79' ' ' ASP . . . . . . . . . . . . . 0.0 OUTLIER -61.56 -6.48 2.47 Favored 'General case' 0 N--CA 1.469 0.498 0 C-N-CA 126.463 1.905 . . . . 0.0 114.467 168.835 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 80' ' ' ASN . . . . . . . . . . . . . 85.6 m-20 -106.95 -40.31 5.5 Favored 'General case' 0 CA--C 1.531 0.242 0 C-N-CA 124.614 1.166 . . . . 0.0 111.223 164.345 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 81' ' ' THR . . . . . . . . . . . . . 6.9 m -55.43 -65.02 0.66 Allowed 'General case' 0 C--N 1.347 0.493 0 CA-C-N 119.997 1.271 . . . . 0.0 111.524 -176.689 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 82' ' ' ILE . . . . . . . . . . . . . 9.4 tp -60.43 -37.08 73.36 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.297 0 CA-C-N 119.324 0.965 . . . . 0.0 110.345 -168.455 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 83' ' ' SER . . . . . . . . . . . . . 4.4 m -58.17 -46.82 85.05 Favored 'General case' 0 N--CA 1.446 -0.64 0 C-N-CA 124.891 1.276 . . . . 0.0 110.156 -178.857 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 84' ' ' GLU . . . . . . . . . . . . . 29.3 tt0 -76.8 -41.27 45.14 Favored 'General case' 0 N--CA 1.445 -0.704 0 C-N-CA 126.023 1.729 . . . . 0.0 110.368 -176.781 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 85' ' ' MET . . . . . . . . . . . . . 6.3 ptm -66.74 -40.28 88.27 Favored 'General case' 0 CA--C 1.516 -0.357 0 C-N-CA 123.923 0.889 . . . . 0.0 108.614 -176.59 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 86' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -71.32 -31.54 67.52 Favored 'General case' 0 N--CA 1.447 -0.577 0 C-N-CA 118.292 -1.363 . . . . 0.0 111.696 -171.138 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 87' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -55.92 -49.89 72.23 Favored 'General case' 0 N--CA 1.45 -0.468 0 N-CA-C 107.859 -1.163 . . . . 0.0 107.859 177.953 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 88' ' ' GLU . . . . . . . . . . . . . 28.0 mt-10 -69.12 -26.58 64.97 Favored 'General case' 0 N--CA 1.445 -0.699 0 CA-C-O 117.235 -1.364 . . . . 0.0 112.544 174.978 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 89' ' ' GLY . . . . . . . . . . . . . . . 94.25 104.23 1.81 Allowed Glycine 0 CA--C 1.499 -0.935 0 CA-C-N 120.474 1.488 . . . . 0.0 109.395 -171.865 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 90' ' ' ALA . . . . . . . . . . . . . . . -80.22 136.04 36.38 Favored 'General case' 0 N--CA 1.445 -0.724 0 N-CA-C 108.668 -0.864 . . . . 0.0 108.668 173.346 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 91' ' ' GLN . . . . . . . . . . . . . 86.3 mm-40 -65.89 138.54 57.93 Favored 'General case' 0 N--CA 1.448 -0.57 0 N-CA-C 106.205 -1.776 . . . . 0.0 106.205 163.558 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 92' ' ' VAL . . . . . . . . . . . . . 76.1 t -131.62 119.8 43.42 Favored 'Isoleucine or valine' 0 N--CA 1.445 -0.692 0 N-CA-C 105.746 -1.946 . . . . 0.0 105.746 -178.975 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 93' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -136.62 94.67 3.02 Favored 'General case' 0 N--CA 1.446 -0.629 0 CA-C-O 122.62 1.2 . . . . 0.0 108.796 170.589 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 94' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -65.93 108.73 2.27 Favored 'General case' 0 N--CA 1.446 -0.656 0 N-CA-C 106.661 -1.607 . . . . 0.0 106.661 165.85 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 95' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -71.21 -178.32 2.0 Allowed 'General case' 0 C--N 1.317 -0.811 0 C-N-CA 126.286 1.834 . . . . 0.0 106.862 168.987 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 96' ' ' ALA . . . . . . . . . . . . . . . -44.93 -34.22 2.31 Favored 'General case' 0 CA--C 1.542 0.668 0 N-CA-C 114.328 1.233 . . . . 0.0 114.328 -179.432 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 97' ' ' ASN . . . . . . . . . . . . . 14.2 p30 -152.02 22.43 0.67 Allowed 'General case' 0 N--CA 1.47 0.547 0 N-CA-C 114.459 1.281 . . . . 0.0 114.459 170.788 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 98' ' ' GLN . . . . . . . . . . . . . 1.5 tt0 -141.3 119.27 11.92 Favored 'General case' 0 N--CA 1.465 0.323 0 O-C-N 120.716 -1.24 . . . . 0.0 111.192 -175.56 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 99' ' ' LEU . . . . . . . . . . . . . 8.5 tp -70.85 107.29 3.95 Favored 'General case' 0 C--O 1.237 0.408 0 C-N-CA 126.957 2.103 . . . . 0.0 108.489 177.675 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 100' ' ' THR . . . . . . . . . . . . . 3.2 m -88.37 117.29 27.19 Favored 'General case' 0 C--N 1.327 -0.371 0 N-CA-C 106.0 -1.852 . . . . 0.0 106.0 172.778 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 101' ' ' LEU . . . . . . . . . . . . . 1.1 mm? -110.09 147.67 33.19 Favored 'General case' 0 CA--C 1.515 -0.367 0 N-CA-C 108.822 -0.807 . . . . 0.0 108.822 171.424 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 102' ' ' ALA . . . . . . . . . . . . . . . -149.09 161.27 42.29 Favored 'General case' 0 CA--C 1.53 0.209 0 C-N-CA 124.023 0.929 . . . . 0.0 109.654 166.289 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 103' ' ' THR . . . . . . . . . . . . . 1.6 p -147.7 177.19 9.49 Favored 'General case' 0 C--N 1.327 -0.385 0 C-N-CA 127.76 2.424 . . . . 0.0 107.358 159.682 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 104' ' ' ALA . . . . . . . . . . . . . . . -56.11 -25.04 44.18 Favored 'General case' 0 CA--C 1.534 0.334 0 CA-C-O 118.796 -0.621 . . . . 0.0 112.532 162.258 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 105' ' ' LYS . . . . . . . . . . . . . 24.5 mmtt -71.3 -82.41 0.04 OUTLIER 'General case' 0 N--CA 1.456 -0.141 0 C-N-CA 123.476 0.71 . . . . 0.0 109.392 170.835 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 106' ' ' GLN . . . . . . . . . . . . . 14.7 pt20 -156.29 176.6 12.47 Favored 'General case' 0 C--O 1.236 0.358 0 CA-C-O 121.401 0.619 . . . . 0.0 112.635 -171.057 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 107' ' ' THR . . . . . . . . . . . . . 0.8 OUTLIER -120.78 134.99 55.27 Favored 'General case' 0 C--O 1.232 0.172 0 C-N-CA 127.775 2.43 . . . . 0.0 108.848 -168.288 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 108' ' ' LEU . . . . . . . . . . . . . 2.4 mm? -117.29 151.22 37.41 Favored 'General case' 0 C--O 1.236 0.383 0 N-CA-C 107.843 -1.169 . . . . 0.0 107.843 176.904 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 109' ' ' THR . . . . . . . . . . . . . 0.1 OUTLIER -119.29 107.48 13.45 Favored 'General case' 0 C--N 1.324 -0.503 0 N-CA-C 103.564 -2.754 . . . . 0.0 103.564 179.614 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 110' ' ' TYR . . . . . . . . . . . . . 67.1 m-85 -110.77 134.05 52.82 Favored 'General case' 0 N--CA 1.447 -0.611 0 N-CA-C 108.645 -0.872 . . . . 0.0 108.645 173.555 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 111' ' ' LYS . . . . . . . . . . . . . 2.5 tmtt? -94.21 142.63 27.18 Favored 'General case' 0 C--N 1.322 -0.628 0 N-CA-C 108.246 -1.02 . . . . 0.0 108.246 -178.387 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 112' ' ' LEU . . . . . . . . . . . . . 56.8 tp -66.27 105.74 1.5 Allowed 'General case' 0 C--N 1.329 -0.31 0 N-CA-C 107.547 -1.279 . . . . 0.0 107.547 169.064 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 113' ' ' ALA . . . . . . . . . . . . . . . -137.72 98.38 3.66 Favored 'General case' 0 CA--C 1.516 -0.353 0 N-CA-C 107.038 -1.467 . . . . 0.0 107.038 177.846 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 114' ' ' ASP . . . . . . . . . . . . . 30.9 t0 . . . . . 0 C--N 1.325 -0.494 0 CA-C-O 123.67 1.7 . . . . 0.0 111.244 -169.115 . . . . . . . . 0 0 . 1 . 013 nuclear orig core ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 18.9 ttt . . . . . 0 C--O 1.236 0.385 0 N-CA-C 109.311 -0.626 . . . . 0.0 109.311 . . . . . . . . . 0 0 . 1 . 013 nuclear orig core ' A' A ' 2' ' ' VAL . . . . . . . . . . . . . 7.5 p -55.12 129.51 16.48 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.439 0 N-CA-C 109.397 -0.594 . . . . 0.0 109.397 175.78 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 3' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -122.64 159.93 50.93 Favored Pre-proline 0 N--CA 1.449 -0.487 0 N-CA-C 109.867 -0.42 . . . . 0.0 109.867 -179.164 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 4' ' ' PRO . . . . . . . . . . . . . 36.6 Cg_endo -70.67 -37.03 7.47 Favored 'Trans proline' 0 N--CA 1.464 -0.262 0 C-N-CA 122.472 2.115 . . . . 0.0 112.799 -173.757 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 5' ' ' GLU . . . . . 0.418 ' C ' ' H ' ' A' ' 7' ' ' LEU . 0.0 OUTLIER -57.84 -54.17 49.97 Favored 'General case' 0 C--N 1.328 -0.365 0 C-N-CA 125.788 1.635 . . . . 0.0 109.67 -179.289 . . . . . . . . 3 3 . 1 . 013 nuclear orig core ' A' A ' 6' ' ' GLN . . . . . . . . . . . . . 12.6 pt20 -67.02 25.34 0.02 OUTLIER 'General case' 0 CA--C 1.545 0.772 0 C-N-CA 126.24 1.816 . . . . 0.0 114.779 177.917 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 7' ' ' LEU . . . . . 0.418 ' H ' ' C ' ' A' ' 5' ' ' GLU . 97.4 mt -141.74 -49.41 0.39 Allowed 'General case' 0 N--CA 1.451 -0.398 0 C-N-CA 127.249 2.219 . . . . 0.0 108.869 -177.761 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 8' ' ' GLN . . . . . . . . . . . . . 0.1 OUTLIER -46.94 -6.3 0.01 OUTLIER 'General case' 0 N--CA 1.471 0.623 0 C-N-CA 130.119 3.367 . . . . 0.0 118.215 -177.914 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 9' ' ' HIS . . . . . . . . . . . . . 32.0 p80 -145.77 10.84 1.22 Allowed 'General case' 0 C--N 1.325 -0.463 0 CA-C-N 119.641 1.109 . . . . 0.0 112.972 174.798 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 10' ' ' HIS . . . . . . . . . . . . . 32.0 m-70 -100.69 163.96 12.09 Favored 'General case' 0 C--O 1.238 0.489 0 C-N-CA 123.711 0.804 . . . . 0.0 109.733 -176.631 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 11' ' ' ARG . . . . . 0.428 HH21 ' CD ' ' A' ' 30' ' ' GLU . 4.4 ttt85 -126.96 145.69 50.6 Favored 'General case' 0 CA--C 1.514 -0.407 0 C-N-CA 125.456 1.502 . . . . 0.0 107.811 173.184 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 12' ' ' PHE . . . . . . . . . . . . . 42.4 m-85 -136.21 148.13 47.96 Favored 'General case' 0 N--CA 1.445 -0.724 0 N-CA-C 105.717 -1.957 . . . . 0.0 105.717 179.478 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 13' ' ' VAL . . . . . . . . . . . . . 2.5 t -122.2 148.99 25.55 Favored 'Isoleucine or valine' 0 C--O 1.24 0.583 0 C-N-CA 125.413 1.485 . . . . 0.0 108.492 178.981 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 14' ' ' LEU . . . . . . . . . . . . . 7.5 tp -77.37 80.74 3.86 Favored 'General case' 0 N--CA 1.447 -0.596 0 O-C-N 124.418 1.074 . . . . 0.0 109.835 -178.471 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -61.08 -34.97 75.77 Favored 'General case' 0 CA--C 1.534 0.341 0 C-N-CA 123.969 0.908 . . . . 0.0 110.047 -179.961 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 3.2 m -165.83 143.69 5.71 Favored 'General case' 0 CA--C 1.535 0.373 0 O-C-N 121.35 -0.844 . . . . 0.0 111.717 176.368 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 17' ' ' VAL . . . . . . . . . . . . . 2.8 t -97.31 161.13 2.86 Favored 'Isoleucine or valine' 0 CA--C 1.542 0.644 0 C-N-CA 126.396 1.878 . . . . 0.0 108.25 -177.371 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 18' ' ' ASN . . . . . . . . . . . . . 19.9 t30 -51.85 -32.12 30.67 Favored 'General case' 0 N--CA 1.473 0.692 0 C-N-CA 123.438 0.695 . . . . 0.0 112.416 167.4 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . -78.66 -54.48 4.23 Favored Glycine 0 N--CA 1.445 -0.736 0 CA-C-O 119.039 -0.867 . . . . 0.0 111.842 -178.36 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 8.5 mtmt -168.87 166.35 6.49 Favored Pre-proline 0 N--CA 1.466 0.331 0 C-N-CA 126.709 2.003 . . . . 0.0 110.444 -168.703 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 21' ' ' PRO . . . . . . . . . . . . . 36.3 Cg_endo -58.29 161.93 12.98 Favored 'Trans proline' 0 N--CA 1.457 -0.648 0 C-N-CA 121.57 1.514 . . . . 0.0 111.151 163.572 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 22' ' ' VAL . . . . . . . . . . . . . 11.6 p -141.7 127.9 19.25 Favored 'Isoleucine or valine' 0 CA--C 1.529 0.162 0 C-N-CA 124.014 0.926 . . . . 0.0 108.677 175.267 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 23' ' ' THR . . . . . . . . . . . . . 0.6 OUTLIER -136.41 130.94 33.47 Favored 'General case' 0 N--CA 1.451 -0.377 0 N-CA-C 106.678 -1.601 . . . . 0.0 106.678 171.842 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 24' ' ' SER . . . . . . . . . . . . . 0.5 OUTLIER -126.74 67.59 1.25 Allowed 'General case' 0 N--CA 1.453 -0.315 0 N-CA-C 106.886 -1.524 . . . . 0.0 106.886 178.673 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 25' ' ' ASP . . . . . . . . . . . . . 2.0 t70 65.38 -70.69 0.09 Allowed 'General case' 0 C--O 1.233 0.2 0 C-N-CA 128.772 2.829 . . . . 0.0 113.878 173.003 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 26' ' ' LYS . . . . . . . . . . . . . 16.1 ttmt -145.88 -7.86 0.56 Allowed 'General case' 0 CA--C 1.531 0.217 0 C-N-CA 126.414 1.886 . . . . 0.0 111.928 175.07 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 27' ' ' ASN . . . . . . . . . . . . . 80.0 m-20 -124.18 73.33 57.64 Favored Pre-proline 0 C--O 1.232 0.135 0 C-N-CA 124.607 1.163 . . . . 0.0 108.424 -174.303 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 28' ' ' PRO . . . . . . . . . . . . . 55.5 Cg_endo -69.72 173.21 11.27 Favored 'Trans proline' 0 N--CA 1.457 -0.645 0 C-N-CA 123.259 2.639 . . . . 0.0 112.728 179.115 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 29' ' ' PRO . . . . . . . . . . . . . 34.8 Cg_endo -65.7 64.83 0.4 Allowed 'Trans proline' 0 CA--C 1.537 0.637 0 C-N-CA 125.145 3.897 . . . . 0.0 112.301 166.517 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 30' ' ' GLU . . . . . 0.428 ' CD ' HH21 ' A' ' 11' ' ' ARG . 4.5 pt-20 -79.99 169.68 17.52 Favored 'General case' 0 CA--C 1.538 0.489 0 O-C-N 120.592 -1.318 . . . . 0.0 110.218 175.203 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 31' ' ' ILE . . . . . . . . . . . . . 9.1 tt -145.48 143.5 21.84 Favored 'Isoleucine or valine' 0 C--O 1.238 0.45 0 N-CA-C 106.676 -1.602 . . . . 0.0 106.676 -179.058 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 32' ' ' SER . . . . . . . . . . . . . 80.4 p -140.08 150.5 44.41 Favored 'General case' 0 C--O 1.236 0.368 0 N-CA-C 108.762 -0.829 . . . . 0.0 108.762 174.139 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 33' ' ' PHE . . . . . . . . . . . . . 9.0 m-30 -127.66 133.11 49.63 Favored 'General case' 0 CA--C 1.535 0.385 0 C-N-CA 127.063 2.145 . . . . 0.0 105.237 -169.669 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 34' ' ' GLY . . . . . . . . . . . . . . . -112.43 -166.74 17.34 Favored Glycine 0 N--CA 1.471 0.999 0 C-N-CA 124.761 1.172 . . . . 0.0 111.642 -179.371 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 35' ' ' GLU . . . . . . . . . . . . . 16.8 tt0 -69.93 32.67 0.04 OUTLIER 'General case' 0 CA--C 1.546 0.823 0 C-N-CA 127.931 2.492 . . . . 0.0 116.143 -164.802 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 1.1 mmtm -157.16 10.98 0.21 Allowed 'General case' 0 N--CA 1.44 -0.959 0 C-N-CA 127.919 2.488 . . . . 0.0 116.609 -166.209 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 37' ' ' MET . . . . . . . . . . . . . 41.1 mmm 53.66 21.02 2.4 Favored 'General case' 0 CA--C 1.555 1.153 0 CA-C-N 120.129 1.332 . . . . 0.0 112.106 -161.576 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 38' ' ' MET . . . . . . . . . . . . . 11.0 mmm -69.76 165.6 21.05 Favored 'General case' 0 C--O 1.227 -0.127 0 O-C-N 120.178 -1.576 . . . . 0.0 110.979 177.765 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 39' ' ' ILE . . . . . . . . . . . . . 58.5 mt -137.27 138.03 45.66 Favored 'Isoleucine or valine' 0 C--O 1.237 0.411 0 O-C-N 121.85 -0.531 . . . . 0.0 109.749 -176.401 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 40' ' ' SER . . . . . . . . . . . . . 9.3 p -143.85 118.52 9.81 Favored 'General case' 0 CA--C 1.539 0.55 0 C-N-CA 125.194 1.398 . . . . 0.0 109.465 171.728 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 41' ' ' GLY . . . . . . . . . . . . . . . -157.48 -173.93 26.53 Favored Glycine 0 CA--C 1.533 1.187 0 C-N-CA 125.169 1.366 . . . . 0.0 111.138 178.114 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 42' ' ' SER . . . . . . . . . . . . . 74.0 p -157.39 94.2 1.36 Allowed 'General case' 0 C--O 1.223 -0.297 0 C-N-CA 124.208 1.003 . . . . 0.0 110.311 178.754 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 43' ' ' MET . . . . . . . . . . . . . 2.2 mmt -67.01 -40.98 87.4 Favored 'General case' 0 CA--C 1.534 0.331 0 CA-C-O 120.978 0.418 . . . . 0.0 110.868 176.622 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 44' ' ' CYS . . . . . 1.285 ' SG ' ' SG ' ' A' ' 70' ' ' CYS . 33.1 t -151.12 -63.24 0.19 Allowed 'General case' 0 N--CA 1.448 -0.554 0 N-CA-C 104.808 -2.293 . . . . 0.0 104.808 158.457 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 45' ' ' ASN . . . . . . . . . . . . . 71.4 m-20 -83.67 30.0 0.51 Allowed 'General case' 0 CA--C 1.528 0.134 0 C-N-CA 126.47 1.908 . . . . 0.0 114.328 -168.798 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 46' ' ' ARG . . . . . . . . . . . . . 61.7 mtt180 59.25 167.56 0.06 Allowed 'General case' 0 N--CA 1.472 0.649 0 C-N-CA 126.117 1.767 . . . . 0.0 110.965 -171.668 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 47' ' ' PHE . . . . . . . . . . . . . 34.8 p90 -159.31 167.2 29.49 Favored 'General case' 0 C--O 1.239 0.55 0 N-CA-C 108.506 -0.924 . . . . 0.0 108.506 154.122 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 48' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -162.1 137.03 7.07 Favored 'General case' 0 C--O 1.238 0.48 0 N-CA-C 108.352 -0.981 . . . . 0.0 108.352 177.529 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 49' ' ' GLY . . . . . . . . . . . . . . . -170.9 162.48 35.43 Favored Glycine 0 C--N 1.339 0.703 0 N-CA-C 110.209 -1.157 . . . . 0.0 110.209 172.152 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 50' ' ' GLU . . . . . . . . . . . . . 40.3 mt-10 -74.13 101.33 3.9 Favored 'General case' 0 C--O 1.237 0.407 0 C-N-CA 124.323 1.049 . . . . 0.0 108.442 170.258 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 51' ' ' GLY . . . . . . . . . . . . . . . -68.63 -179.46 19.4 Favored Glycine 0 CA--C 1.535 1.341 0 C-N-CA 123.542 0.592 . . . . 0.0 112.561 164.269 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 52' ' ' LYS . . . . . . . . . . . . . 13.9 ttmt -156.0 161.26 40.5 Favored 'General case' 0 CA--C 1.535 0.373 0 C-N-CA 126.373 1.869 . . . . 0.0 108.835 176.257 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 53' ' ' LEU . . . . . . . . . . . . . 1.2 tm? -146.67 129.59 16.32 Favored 'General case' 0 CA--C 1.519 -0.214 0 N-CA-C 105.597 -2.001 . . . . 0.0 105.597 174.162 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 2.2 t -152.25 -33.84 0.13 Allowed 'General case' 0 CA--C 1.536 0.426 0 CA-C-N 117.642 0.201 . . . . 0.0 111.258 162.9 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 55' ' ' ASN . . . . . . . . . . . . . 20.0 p-10 -131.33 31.15 4.4 Favored 'General case' 0 CA--C 1.534 0.36 0 C-N-CA 128.052 2.541 . . . . 0.0 111.2 -164.761 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 56' ' ' GLY . . . . . . . . . . . . . . . 60.56 31.65 75.51 Favored Glycine 0 CA--C 1.532 1.1 0 O-C-N 121.591 -0.693 . . . . 0.0 111.645 -176.72 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 57' ' ' GLU . . . . . . . . . . . . . 33.5 tt0 -134.15 139.6 45.98 Favored 'General case' 0 C--O 1.237 0.426 0 N-CA-C 107.631 -1.248 . . . . 0.0 107.631 177.528 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 58' ' ' LEU . . . . . . . . . . . . . 56.6 tp -120.59 95.92 4.92 Favored 'General case' 0 CA--C 1.534 0.349 0 C-N-CA 127.806 2.442 . . . . 0.0 108.843 -176.198 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 59' ' ' THR . . . . . . . . . . . . . 15.6 p -98.48 137.61 36.91 Favored 'General case' 0 C--O 1.237 0.434 0 C-N-CA 124.982 1.313 . . . . 0.0 110.671 174.719 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 60' ' ' ALA . . . . . . . . . . . . . . . -123.32 85.46 2.42 Favored 'General case' 0 CA--C 1.536 0.411 0 C-N-CA 125.145 1.378 . . . . 0.0 111.476 171.888 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 61' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -53.19 -15.45 0.91 Allowed 'General case' 0 N--CA 1.455 -0.189 0 C-N-CA 128.82 2.848 . . . . 0.0 117.151 -178.903 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 62' ' ' GLY . . . . . . . . . . . . . . . -148.8 45.66 0.7 Allowed Glycine 0 CA--C 1.52 0.392 0 C-N-CA 124.734 1.159 . . . . 0.0 110.985 -174.379 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 63' ' ' LEU . . . . . . . . . . . . . 9.3 tp -55.91 139.82 44.85 Favored 'General case' 0 N--CA 1.446 -0.649 0 N-CA-C 108.831 -0.803 . . . . 0.0 108.831 168.171 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 64' ' ' ALA . . . . . . . . . . . . . . . -127.13 162.02 27.1 Favored 'General case' 0 C--N 1.327 -0.373 0 N-CA-C 108.17 -1.048 . . . . 0.0 108.17 166.35 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 65' ' ' MET . . . . . . . . . . . . . 0.1 OUTLIER -150.5 177.09 10.34 Favored 'General case' 0 CA--C 1.538 0.507 0 C-N-CA 126.468 1.907 . . . . 0.0 108.591 -175.571 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 66' ' ' THR . . . . . . . . . . . . . 25.4 p -118.0 -178.21 3.45 Favored 'General case' 0 N--CA 1.469 0.524 0 C-N-CA 125.141 1.376 . . . . 0.0 111.12 -178.401 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 67' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -126.2 87.27 2.65 Favored 'General case' 0 C--O 1.236 0.353 0 C-N-CA 123.858 0.863 . . . . 0.0 110.477 172.955 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 68' ' ' MET . . . . . . . . . . . . . 37.0 mtm -132.16 -166.13 1.69 Allowed 'General case' 0 CA--C 1.537 0.471 0 C-N-CA 128.161 2.584 . . . . 0.0 108.534 174.424 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 69' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -145.57 173.95 11.6 Favored 'General case' 0 CA--C 1.539 0.531 0 C-N-CA 125.183 1.393 . . . . 0.0 109.645 174.692 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 70' ' ' CYS . . . . . 1.285 ' SG ' ' SG ' ' A' ' 44' ' ' CYS . 73.0 m -130.48 14.08 5.5 Favored 'General case' 0 C--O 1.234 0.284 0 N-CA-C 114.174 1.176 . . . . 0.0 114.174 -172.707 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 71' ' ' ALA . . . . . . . . . . . . . . . 60.8 10.4 2.68 Favored 'General case' 0 CA--C 1.534 0.338 0 C-N-CA 124.943 1.297 . . . . 0.0 113.271 178.419 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 72' ' ' ASN . . . . . . . . . . . . . 0.2 OUTLIER -133.46 164.96 40.25 Favored Pre-proline 0 CA--C 1.547 0.828 0 C-N-CA 125.213 1.405 . . . . 0.0 107.26 168.667 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 73' ' ' PRO . . . . . . . . . . . . . 60.7 Cg_endo -82.25 -45.91 0.07 OUTLIER 'Trans proline' 0 N--CA 1.46 -0.454 0 C-N-CA 123.71 2.94 . . . . 0.0 111.917 175.157 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 74' ' ' GLN . . . . . . . . . . . . . 58.7 tt0 -47.95 -53.93 14.43 Favored 'General case' 0 C--O 1.223 -0.29 0 C-N-CA 126.394 1.878 . . . . 0.0 110.615 -171.55 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 75' ' ' LEU . . . . . . . . . . . . . 55.0 mt -60.28 -37.18 79.67 Favored 'General case' 0 CA--C 1.535 0.403 0 C-N-CA 125.764 1.626 . . . . 0.0 110.875 -178.567 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 76' ' ' ASN . . . . . . . . . . . . . 1.7 t-20 -73.03 -4.68 33.95 Favored 'General case' 0 N--CA 1.469 0.483 0 C-N-CA 126.198 1.799 . . . . 0.0 111.938 177.926 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 77' ' ' GLU . . . . . . . . . . . . . 1.0 OUTLIER -113.65 -24.4 9.22 Favored 'General case' 0 CA--C 1.535 0.394 0 C-N-CA 125.265 1.426 . . . . 0.0 110.439 170.609 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 78' ' ' LEU . . . . . . . . . . . . . 6.2 mp -63.99 -36.66 84.7 Favored 'General case' 0 N--CA 1.464 0.253 0 O-C-N 120.842 -1.161 . . . . 0.0 109.861 170.453 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 79' ' ' ASP . . . . . . . . . . . . . 0.0 OUTLIER -56.95 -32.69 66.27 Favored 'General case' 0 CA--C 1.53 0.182 0 C-N-CA 123.816 0.846 . . . . 0.0 111.38 173.958 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 80' ' ' ASN . . . . . . . . . . . . . 12.2 m-20 -91.22 -28.57 17.73 Favored 'General case' 0 N--CA 1.452 -0.356 0 C-N-CA 123.017 0.527 . . . . 0.0 110.529 178.558 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 81' ' ' THR . . . . . . . . . . . . . 29.7 m -54.02 -65.14 0.62 Allowed 'General case' 0 CA--C 1.534 0.348 0 C-N-CA 124.926 1.29 . . . . 0.0 108.7 171.27 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 82' ' ' ILE . . . . . . . . . . . . . 10.4 tp -64.18 -35.1 72.8 Favored 'Isoleucine or valine' 0 C--O 1.234 0.284 0 O-C-N 121.84 -0.537 . . . . 0.0 111.011 -171.539 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 83' ' ' SER . . . . . . . . . . . . . 8.6 m -64.3 -40.92 96.92 Favored 'General case' 0 N--CA 1.443 -0.804 0 CA-C-O 118.305 -0.855 . . . . 0.0 111.983 -170.605 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 84' ' ' GLU . . . . . 0.472 ' OE1' ' HE2' ' A' ' 105' ' ' LYS . 4.6 mt-10 -77.86 -39.5 43.15 Favored 'General case' 0 N--CA 1.45 -0.432 0 CA-C-O 118.497 -0.763 . . . . 0.0 110.963 175.421 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 85' ' ' MET . . . . . . . . . . . . . 96.0 mtp -57.88 -49.15 77.68 Favored 'General case' 0 N--CA 1.463 0.201 0 CA-C-O 121.919 0.866 . . . . 0.0 108.725 -173.147 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 86' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -71.7 -25.49 62.11 Favored 'General case' 0 N--CA 1.453 -0.32 0 C-N-CA 123.714 0.806 . . . . 0.0 112.861 -177.197 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 87' ' ' LYS . . . . . . . . . . . . . 6.5 tptm -73.81 -49.74 23.84 Favored 'General case' 0 CA--C 1.516 -0.328 0 N-CA-C 108.338 -0.986 . . . . 0.0 108.338 -178.292 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 88' ' ' GLU . . . . . . . . . . . . . 5.6 mm-40 -69.83 -38.86 76.66 Favored 'General case' 0 N--CA 1.447 -0.616 0 O-C-N 124.449 1.093 . . . . 0.0 110.254 -177.177 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 89' ' ' GLY . . . . . . . . . . . . . . . 126.09 92.27 0.85 Allowed Glycine 0 C--N 1.339 0.695 0 N-CA-C 109.125 -1.59 . . . . 0.0 109.125 -179.594 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 90' ' ' ALA . . . . . . . . . . . . . . . -69.66 136.38 51.05 Favored 'General case' 0 N--CA 1.452 -0.341 0 N-CA-C 106.983 -1.488 . . . . 0.0 106.983 178.388 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 91' ' ' GLN . . . . . . . . . . . . . 4.9 mp0 -68.78 136.43 52.76 Favored 'General case' 0 N--CA 1.442 -0.845 0 N-CA-C 104.385 -2.45 . . . . 0.0 104.385 167.617 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 92' ' ' VAL . . . . . . . . . . . . . 4.0 p -127.47 122.58 59.74 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.392 0 N-CA-C 105.88 -1.896 . . . . 0.0 105.88 -177.27 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 93' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -139.23 92.4 2.59 Favored 'General case' 0 C--N 1.33 -0.277 0 N-CA-C 108.475 -0.935 . . . . 0.0 108.475 178.914 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 94' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -89.54 107.37 19.04 Favored 'General case' 0 C--N 1.333 -0.14 0 N-CA-C 106.809 -1.552 . . . . 0.0 106.809 174.125 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 95' ' ' THR . . . . . . . . . . . . . 13.4 t -67.8 -163.22 0.03 OUTLIER 'General case' 0 CA--C 1.536 0.424 0 C-N-CA 125.822 1.649 . . . . 0.0 108.767 169.588 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 96' ' ' ALA . . . . . . . . . . . . . . . -44.62 -40.95 6.21 Favored 'General case' 0 CA--C 1.544 0.714 0 O-C-N 120.288 -1.507 . . . . 0.0 112.421 178.929 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 97' ' ' ASN . . . . . . . . . . . . . 9.9 p30 -157.12 4.02 0.14 Allowed 'General case' 0 CA--C 1.541 0.619 0 N-CA-C 114.839 1.422 . . . . 0.0 114.839 -170.135 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 98' ' ' GLN . . . . . . . . . . . . . 8.5 tt0 -126.96 129.89 49.02 Favored 'General case' 0 N--CA 1.464 0.257 0 CA-C-N 120.361 1.437 . . . . 0.0 109.649 -176.809 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 99' ' ' LEU . . . . . . . . . . . . . 9.9 tp -81.32 133.56 35.45 Favored 'General case' 0 N--CA 1.449 -0.482 0 C-N-CA 123.864 0.866 . . . . 0.0 109.275 175.584 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 100' ' ' THR . . . . . . . . . . . . . 1.1 m -115.13 128.15 56.02 Favored 'General case' 0 C--N 1.323 -0.575 0 N-CA-C 105.223 -2.14 . . . . 0.0 105.223 171.247 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 101' ' ' LEU . . . . . . . . . . . . . 8.5 mp -112.74 163.96 13.95 Favored 'General case' 0 CA--C 1.512 -0.49 0 N-CA-C 110.073 -0.343 . . . . 0.0 110.073 163.311 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 102' ' ' ALA . . . . . . . . . . . . . . . -151.81 160.68 43.48 Favored 'General case' 0 C--N 1.325 -0.488 0 C-N-CA 126.764 2.026 . . . . 0.0 106.187 158.418 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 103' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -165.84 178.63 6.4 Favored 'General case' 0 N--CA 1.444 -0.73 0 C-N-CA 129.17 2.988 . . . . 0.0 106.208 164.134 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 104' ' ' ALA . . . . . . . . . . . . . . . -46.86 -45.06 20.06 Favored 'General case' 0 CA--C 1.533 0.292 0 O-C-N 121.417 -0.802 . . . . 0.0 111.089 169.511 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 105' ' ' LYS . . . . . 0.472 ' HE2' ' OE1' ' A' ' 84' ' ' GLU . 22.0 mttm -58.04 -74.32 0.06 Allowed 'General case' 0 C--N 1.343 0.284 0 N-CA-C 112.202 0.445 . . . . 0.0 112.202 179.955 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 106' ' ' GLN . . . . . . . . . . . . . 8.8 pt20 -163.0 -174.46 3.89 Favored 'General case' 0 C--N 1.33 -0.274 0 C-N-CA 123.247 0.619 . . . . 0.0 109.743 -173.368 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 107' ' ' THR . . . . . . . . . . . . . 2.1 t -105.51 166.2 10.6 Favored 'General case' 0 CA--C 1.539 0.55 0 C-N-CA 125.6 1.56 . . . . 0.0 107.924 168.746 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 108' ' ' LEU . . . . . . . . . . . . . 76.6 mt -139.92 150.43 44.55 Favored 'General case' 0 C--O 1.237 0.436 0 C-N-CA 126.556 1.942 . . . . 0.0 106.517 169.425 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 109' ' ' THR . . . . . . . . . . . . . 4.9 m -123.48 108.47 12.7 Favored 'General case' 0 C--O 1.238 0.497 0 N-CA-C 107.92 -1.141 . . . . 0.0 107.92 176.152 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 110' ' ' TYR . . . . . . . . . . . . . 75.2 m-85 -110.17 156.06 21.13 Favored 'General case' 0 N--CA 1.453 -0.282 0 N-CA-C 109.684 -0.487 . . . . 0.0 109.684 179.302 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 111' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -127.93 134.59 49.33 Favored 'General case' 0 C--O 1.236 0.377 0 CA-C-O 118.0 -1.0 . . . . 0.0 108.582 -172.394 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 112' ' ' LEU . . . . . . . . . . . . . 64.1 tp -60.63 82.28 0.01 OUTLIER 'General case' 0 CA--C 1.534 0.344 0 C-N-CA 127.911 2.484 . . . . 0.0 110.653 177.568 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 113' ' ' ALA . . . . . . . . . . . . . . . -115.39 83.0 1.85 Allowed 'General case' 0 C--N 1.33 -0.262 0 N-CA-C 106.015 -1.846 . . . . 0.0 106.015 172.673 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 114' ' ' ASP . . . . . . . . . . . . . 3.0 p-10 . . . . . 0 C--N 1.332 -0.155 0 C-N-CA 123.809 0.844 . . . . 0.0 110.848 -176.382 . . . . . . . . 0 0 . 1 . 014 nuclear orig core ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 CA--C 1.534 0.36 0 CA-C-O 121.827 0.823 . . . . 0.0 110.837 . . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 2' ' ' VAL . . . . . . . . . . . . . 8.7 p -57.11 152.09 2.83 Favored 'Isoleucine or valine' 0 CA--C 1.544 0.737 0 C-N-CA 126.672 1.989 . . . . 0.0 110.521 164.115 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 3' ' ' THR . . . . . . . . . . . . . 29.6 p -128.03 162.32 50.62 Favored Pre-proline 0 CA--C 1.537 0.467 0 O-C-N 120.993 -1.067 . . . . 0.0 110.594 176.573 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 4' ' ' PRO . . . . . . . . . . . . . 18.1 Cg_endo -65.99 -41.48 13.45 Favored 'Trans proline' 0 C--N 1.345 0.394 0 C-N-CA 122.436 2.091 . . . . 0.0 112.54 175.117 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 5' ' ' GLU . . . . . . . . . . . . . 2.9 mt-10 -57.33 -50.03 74.23 Favored 'General case' 0 C--N 1.329 -0.286 0 C-N-CA 124.163 0.985 . . . . 0.0 111.016 -176.425 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 6' ' ' GLN . . . . . . . . . . . . . 5.5 pt20 -71.7 14.56 0.19 Allowed 'General case' 0 CA--C 1.541 0.604 0 N-CA-C 114.649 1.351 . . . . 0.0 114.649 -170.951 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 7' ' ' LEU . . . . . . . . . . . . . 94.1 mt -126.22 -52.51 1.51 Allowed 'General case' 0 CA--C 1.516 -0.344 0 C-N-CA 126.358 1.863 . . . . 0.0 109.27 -170.555 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 8' ' ' GLN . . . . . . . . . . . . . 2.0 mt-30 -44.9 -20.67 0.04 OUTLIER 'General case' 0 CA--C 1.539 0.538 0 C-N-CA 127.829 2.452 . . . . 0.0 116.701 -176.187 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 9' ' ' HIS . . . . . . . . . . . . . 33.2 p80 -138.66 19.33 2.69 Favored 'General case' 0 CA--C 1.537 0.446 0 C-N-CA 123.825 0.85 . . . . 0.0 113.245 177.769 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 10' ' ' HIS . . . . . . . . . . . . . 78.1 m-70 -118.6 118.46 31.74 Favored 'General case' 0 CA--C 1.531 0.246 0 C-N-CA 124.104 0.961 . . . . 0.0 108.438 179.22 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 11' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -74.5 140.85 44.83 Favored 'General case' 0 N--CA 1.465 0.284 0 N-CA-C 108.692 -0.855 . . . . 0.0 108.692 175.916 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 12' ' ' PHE . . . . . . . . . . . . . 3.3 m-85 -121.19 162.25 20.47 Favored 'General case' 0 N--CA 1.446 -0.633 0 CA-C-O 124.749 2.214 . . . . 0.0 108.762 163.98 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 13' ' ' VAL . . . . . . . . . . . . . 0.0 OUTLIER -136.79 145.98 29.25 Favored 'Isoleucine or valine' 0 C--N 1.31 -1.112 0 C-N-CA 130.143 3.377 . . . . 0.0 106.873 -179.218 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 14' ' ' LEU . . . . . . . . . . . . . 0.8 OUTLIER -69.75 140.92 53.5 Favored 'General case' 0 CA--C 1.504 -0.805 0 N-CA-C 106.532 -1.655 . . . . 0.0 106.532 166.555 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -117.29 -55.7 2.3 Favored 'General case' 0 N--CA 1.44 -0.952 0 O-C-N 124.222 0.951 . . . . 0.0 108.859 177.017 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 55.3 p -133.43 113.22 12.28 Favored 'General case' 0 N--CA 1.447 -0.616 0 CA-C-O 122.364 1.078 . . . . 0.0 109.841 -173.548 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 17' ' ' VAL . . . . . . . . . . . . . 3.2 t -74.25 160.0 5.4 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.45 0 C-N-CA 125.485 1.514 . . . . 0.0 107.648 179.639 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 18' ' ' ASN . . . . . . . . . . . . . 0.2 OUTLIER -44.75 -35.99 2.97 Favored 'General case' 0 N--CA 1.466 0.371 0 C-N-CA 125.536 1.534 . . . . 0.0 113.773 174.795 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . -107.4 -8.84 30.28 Favored Glycine 0 CA--C 1.528 0.855 0 CA-C-O 116.88 -2.067 . . . . 0.0 115.392 -173.519 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 16.0 ptpt 174.62 165.21 0.35 Allowed Pre-proline 0 N--CA 1.476 0.833 0 CA-C-N 120.497 2.149 . . . . 0.0 112.146 178.742 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 21' ' ' PRO . . . . . . . . . . . . . 45.5 Cg_endo -62.12 173.69 3.04 Favored 'Trans proline' 0 CA--C 1.534 0.499 0 C-N-CA 123.284 2.656 . . . . 0.0 111.856 164.064 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 22' ' ' VAL . . . . . . . . . . . . . 9.0 p -145.6 150.99 15.16 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.508 0 CA-C-O 121.66 0.743 . . . . 0.0 111.013 168.428 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 23' ' ' THR . . . . . . . . . . . . . 14.6 p -115.47 103.96 11.28 Favored 'General case' 0 N--CA 1.452 -0.326 0 C-N-CA 126.458 1.903 . . . . 0.0 107.338 172.743 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 24' ' ' SER . . . . . . . . . . . . . 14.9 m -127.72 75.73 1.62 Allowed 'General case' 0 C--N 1.332 -0.154 0 N-CA-C 106.88 -1.526 . . . . 0.0 106.88 -179.07 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 25' ' ' ASP . . . . . . . . . . . . . 97.2 m-20 -81.79 14.3 2.75 Favored 'General case' 0 N--CA 1.468 0.431 0 C-N-CA 123.917 0.887 . . . . 0.0 111.873 -169.927 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 26' ' ' LYS . . . . . . . . . . . . . 32.8 ttpt -148.88 114.8 5.72 Favored 'General case' 0 N--CA 1.45 -0.447 0 N-CA-C 105.881 -1.896 . . . . 0.0 105.881 179.947 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 27' ' ' ASN . . . . . . . . . . . . . 0.0 OUTLIER 43.6 73.76 0.89 Allowed Pre-proline 0 CA--C 1.546 0.804 0 C-N-CA 127.73 2.412 . . . . 0.0 109.788 -172.724 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 28' ' ' PRO . . . . . . . . . . . . . 9.3 Cg_endo -60.0 164.53 11.98 Favored 'Trans proline' 0 CA--C 1.538 0.677 0 CA-C-N 120.952 1.376 . . . . 0.0 111.988 -176.091 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 29' ' ' PRO . . . . . . . . . . . . . 61.5 Cg_endo -63.9 92.89 0.18 Allowed 'Trans proline' 0 N--CA 1.452 -0.934 0 N-CA-C 106.972 -1.972 . . . . 0.0 106.972 161.045 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 30' ' ' GLU . . . . . . . . . . . . . 7.9 pt-20 -123.24 157.81 32.28 Favored 'General case' 0 C--N 1.32 -0.715 0 C-N-CA 124.652 1.181 . . . . 0.0 108.112 -168.199 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 31' ' ' ILE . . . . . . . . . . . . . 16.3 tt -143.48 109.83 1.51 Allowed 'Isoleucine or valine' 0 N--CA 1.453 -0.293 0 N-CA-C 108.223 -1.029 . . . . 0.0 108.223 178.596 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 32' ' ' SER . . . . . . . . . . . . . 22.9 t -88.31 171.77 9.92 Favored 'General case' 0 N--CA 1.445 -0.684 0 N-CA-C 107.341 -1.355 . . . . 0.0 107.341 159.684 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 33' ' ' PHE . . . . . . . . . . . . . 92.0 m-85 -133.73 -170.09 2.43 Favored 'General case' 0 N--CA 1.441 -0.893 0 C-N-CA 125.467 1.507 . . . . 0.0 107.327 178.08 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 34' ' ' GLY . . . . . . . . . . . . . . . 170.87 -163.43 36.5 Favored Glycine 0 N--CA 1.444 -0.771 0 N-CA-C 109.57 -1.412 . . . . 0.0 109.57 172.142 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 35' ' ' GLU . . . . . . . . . . . . . 2.2 tt0 -55.76 157.09 4.44 Favored 'General case' 0 CA--C 1.534 0.334 0 C-N-CA 124.229 1.012 . . . . 0.0 112.096 -162.378 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 30.2 mtmt 52.74 20.83 1.69 Allowed 'General case' 0 CA--C 1.537 0.448 0 C-N-CA 124.235 1.014 . . . . 0.0 113.109 -168.94 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 37' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER 61.93 29.07 17.71 Favored 'General case' 0 CA--C 1.542 0.666 0 C-N-CA 125.475 1.51 . . . . 0.0 110.638 -175.967 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 38' ' ' MET . . . . . . . . . . . . . 0.7 OUTLIER -60.32 162.05 6.53 Favored 'General case' 0 C--O 1.233 0.232 0 O-C-N 120.794 -1.191 . . . . 0.0 111.633 172.957 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 39' ' ' ILE . . . . . . . . . . . . . 19.7 mt -122.96 135.21 63.78 Favored 'Isoleucine or valine' 0 C--O 1.237 0.401 0 C-N-CA 126.123 1.769 . . . . 0.0 107.217 -174.262 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 40' ' ' SER . . . . . . . . . . . . . 56.8 m -137.49 114.53 10.74 Favored 'General case' 0 C--O 1.226 -0.156 0 N-CA-C 108.019 -1.104 . . . . 0.0 108.019 170.983 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 41' ' ' GLY . . . . . . . . . . . . . . . -146.96 174.65 26.7 Favored Glycine 0 C--N 1.335 0.495 0 CA-C-N 119.335 0.97 . . . . 0.0 112.53 177.288 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 42' ' ' SER . . . . . 0.418 ' HA ' ' HA ' ' A' ' 46' ' ' ARG . 8.4 t -150.75 70.7 1.01 Allowed 'General case' 0 C--O 1.226 -0.137 0 C-N-CA 123.567 0.747 . . . . 0.0 110.55 -172.009 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 43' ' ' MET . . . . . . . . . . . . . 82.8 mmm -54.71 -62.82 1.41 Allowed 'General case' 0 C--N 1.344 0.336 0 N-CA-C 108.324 -0.991 . . . . 0.0 108.324 173.475 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 44' ' ' CYS . . . . . 1.283 ' SG ' ' SG ' ' A' ' 70' ' ' CYS . 8.8 t -139.33 -50.43 0.51 Allowed 'General case' 0 N--CA 1.451 -0.387 0 C-N-CA 123.625 0.77 . . . . 0.0 110.548 165.664 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 45' ' ' ASN . . . . . . . . . . . . . 48.6 m-80 -103.69 19.35 20.03 Favored 'General case' 0 N--CA 1.472 0.649 0 CA-C-N 119.973 1.26 . . . . 0.0 113.342 -171.309 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 46' ' ' ARG . . . . . 0.418 ' HA ' ' HA ' ' A' ' 42' ' ' SER . 0.0 OUTLIER 66.04 152.47 0.06 Allowed 'General case' 0 N--CA 1.464 0.253 0 C-N-CA 125.431 1.493 . . . . 0.0 111.043 -177.848 . . . . . . . . 3 3 . 1 . 014 nuclear orig core ' A' A ' 47' ' ' PHE . . . . . . . . . . . . . 25.0 p90 -154.54 168.36 26.98 Favored 'General case' 0 N--CA 1.447 -0.611 0 CA-C-O 122.768 1.27 . . . . 0.0 108.621 171.26 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 48' ' ' SER . . . . . . . . . . . . . 3.9 p -152.15 171.94 17.13 Favored 'General case' 0 N--CA 1.44 -0.973 0 CA-C-N 113.889 -1.505 . . . . 0.0 108.027 177.597 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 49' ' ' GLY . . . . . . . . . . . . . . . 179.25 163.78 30.76 Favored Glycine 0 N--CA 1.445 -0.73 0 N-CA-C 109.337 -1.505 . . . . 0.0 109.337 164.628 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 50' ' ' GLU . . . . . . . . . . . . . 13.5 pt-20 -82.99 95.37 7.99 Favored 'General case' 0 N--CA 1.44 -0.939 0 N-CA-C 105.572 -2.011 . . . . 0.0 105.572 165.032 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 51' ' ' GLY . . . . . . . . . . . . . . . -70.13 169.93 45.38 Favored Glycine 0 N--CA 1.447 -0.62 0 N-CA-C 109.781 -1.328 . . . . 0.0 109.781 167.85 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 52' ' ' LYS . . . . . . . . . . . . . 2.1 tppm? -153.27 146.42 24.66 Favored 'General case' 0 N--CA 1.452 -0.344 0 N-CA-C 107.72 -1.215 . . . . 0.0 107.72 169.585 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 53' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -121.33 82.39 1.93 Allowed 'General case' 0 CA--C 1.515 -0.385 0 N-CA-C 106.236 -1.765 . . . . 0.0 106.236 -178.992 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 1.5 t -103.91 -53.53 2.74 Favored 'General case' 0 N--CA 1.448 -0.567 0 N-CA-C 108.222 -1.029 . . . . 0.0 108.222 178.502 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 55' ' ' ASN . . . . . . . . . . . . . 17.6 p-10 -132.39 28.88 4.32 Favored 'General case' 0 CA--C 1.537 0.474 0 C-N-CA 125.889 1.676 . . . . 0.0 112.749 -163.954 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 56' ' ' GLY . . . . . . . . . . . . . . . 69.26 30.25 71.69 Favored Glycine 0 CA--C 1.53 1.007 0 O-C-N 121.146 -0.971 . . . . 0.0 111.806 -179.077 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 57' ' ' GLU . . . . . . . . . . . . . 42.8 tt0 -131.84 126.27 33.85 Favored 'General case' 0 N--CA 1.449 -0.5 0 N-CA-C 107.28 -1.378 . . . . 0.0 107.28 -178.176 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 58' ' ' LEU . . . . . . . . . . . . . 49.5 tp -102.6 103.62 13.94 Favored 'General case' 0 C--O 1.234 0.274 0 C-N-CA 124.073 0.949 . . . . 0.0 109.163 173.109 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 59' ' ' THR . . . . . . . . . . . . . 2.8 p -93.04 153.44 18.7 Favored 'General case' 0 CA--C 1.532 0.273 0 C-N-CA 122.883 0.473 . . . . 0.0 110.478 168.439 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 60' ' ' ALA . . . . . . . . . . . . . . . -155.34 106.3 2.55 Favored 'General case' 0 C--O 1.234 0.256 0 C-N-CA 125.58 1.552 . . . . 0.0 108.399 153.852 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 61' ' ' LYS . . . . . . . . . . . . . 29.1 ttpt -79.48 -25.3 41.91 Favored 'General case' 0 CA--C 1.535 0.365 0 C-N-CA 123.226 0.611 . . . . 0.0 110.638 168.157 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 62' ' ' GLY . . . . . . . . . . . . . . . -83.83 37.45 2.82 Favored Glycine 0 C--N 1.334 0.434 0 C-N-CA 126.443 1.973 . . . . 0.0 112.852 -176.399 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 63' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -82.03 81.33 8.02 Favored 'General case' 0 N--CA 1.444 -0.729 0 CA-C-O 121.857 0.837 . . . . 0.0 111.7 -164.096 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 64' ' ' ALA . . . . . . . . . . . . . . . -72.46 131.43 42.55 Favored 'General case' 0 C--N 1.327 -0.402 0 CA-C-N 115.278 -0.874 . . . . 0.0 108.98 176.09 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 65' ' ' MET . . . . . . . . . . . . . 54.9 mtp -130.97 -178.22 4.72 Favored 'General case' 0 CA--C 1.543 0.691 0 C-N-CA 128.239 2.616 . . . . 0.0 109.832 179.666 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 66' ' ' THR . . . . . . . . . . . . . 18.2 p -116.68 -168.93 1.54 Allowed 'General case' 0 N--CA 1.472 0.643 0 C-N-CA 125.339 1.456 . . . . 0.0 111.834 -179.171 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 67' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -138.35 79.97 1.77 Allowed 'General case' 0 N--CA 1.452 -0.36 0 C-N-CA 126.556 1.943 . . . . 0.0 107.014 -177.024 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 68' ' ' MET . . . . . . . . . . . . . 76.1 mtm -131.72 -160.31 1.04 Allowed 'General case' 0 C--N 1.325 -0.475 0 C-N-CA 126.804 2.042 . . . . 0.0 107.575 178.962 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 69' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -143.53 155.96 44.47 Favored 'General case' 0 N--CA 1.445 -0.685 0 C-N-CA 124.993 1.317 . . . . 0.0 110.205 160.382 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 70' ' ' CYS . . . . . 1.283 ' SG ' ' SG ' ' A' ' 44' ' ' CYS . 1.6 p -92.0 -9.01 44.47 Favored 'General case' 0 C--N 1.321 -0.663 0 C-N-CA 126.946 2.099 . . . . 0.0 112.001 171.006 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 71' ' ' ALA . . . . . . . . . . . . . . . 59.64 5.99 0.77 Allowed 'General case' 0 CA--C 1.538 0.503 0 C-N-CA 126.675 1.99 . . . . 0.0 114.183 -167.636 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 72' ' ' ASN . . . . . . . . . . . . . 21.2 t-20 -111.24 144.66 30.91 Favored Pre-proline 0 CA--C 1.533 0.301 0 C-N-CA 124.828 1.251 . . . . 0.0 108.567 174.362 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 73' ' ' PRO . . . . . . . . . . . . . 87.5 Cg_endo -77.48 -47.05 0.13 Allowed 'Trans proline' 0 CA--C 1.534 0.513 0 C-N-CA 122.652 2.235 . . . . 0.0 111.912 -178.471 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 74' ' ' GLN . . . . . . . . . . . . . 15.4 tt0 -59.12 -45.75 90.11 Favored 'General case' 0 N--CA 1.452 -0.361 0 C-N-CA 127.381 2.272 . . . . 0.0 110.175 -171.749 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 75' ' ' LEU . . . . . . . . . . . . . 98.6 mt -65.06 -42.99 93.71 Favored 'General case' 0 N--CA 1.452 -0.344 0 C-N-CA 125.138 1.375 . . . . 0.0 110.498 177.687 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 76' ' ' ASN . . . . . . . . . . . . . 0.6 OUTLIER -60.55 -44.99 95.53 Favored 'General case' 0 N--CA 1.468 0.473 0 C-N-CA 123.854 0.861 . . . . 0.0 111.679 177.977 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 77' ' ' GLU . . . . . . . . . . . . . 21.3 tp10 -63.99 -34.5 78.15 Favored 'General case' 0 CA--C 1.536 0.435 0 C-N-CA 123.699 0.8 . . . . 0.0 111.23 175.077 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 78' ' ' LEU . . . . . . . . . . . . . 21.7 mt -64.2 -20.49 66.06 Favored 'General case' 0 CA--C 1.533 0.3 0 CA-C-O 118.166 -0.921 . . . . 0.0 112.259 178.682 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 79' ' ' ASP . . . . . . . . . . . . . 67.6 m-20 -65.1 -27.67 68.92 Favored 'General case' 0 N--CA 1.467 0.406 0 CA-C-N 119.641 1.109 . . . . 0.0 111.39 172.153 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 80' ' ' ASN . . . . . . . . . . . . . 0.9 OUTLIER -76.12 -52.93 9.09 Favored 'General case' 0 N--CA 1.455 -0.214 0 N-CA-C 107.749 -1.204 . . . . 0.0 107.749 175.85 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 81' ' ' THR . . . . . 0.425 HG21 HE21 ' A' ' 106' ' ' GLN . 28.9 m -47.98 -57.27 5.97 Favored 'General case' 0 CA--C 1.535 0.391 0 C-N-CA 124.066 0.946 . . . . 0.0 110.468 178.482 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 82' ' ' ILE . . . . . . . . . . . . . 10.7 tp -58.13 -39.98 75.26 Favored 'Isoleucine or valine' 0 C--O 1.233 0.193 0 CA-C-N 119.538 1.063 . . . . 0.0 111.401 -172.851 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 83' ' ' SER . . . . . . . . . . . . . 28.6 t -60.65 -53.9 51.88 Favored 'General case' 0 N--CA 1.446 -0.645 0 C-N-CA 123.572 0.749 . . . . 0.0 109.008 -177.459 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 84' ' ' GLU . . . . . . . . . . . . . 9.7 tt0 -76.34 -16.21 59.8 Favored 'General case' 0 CA--C 1.539 0.53 0 N-CA-C 112.765 0.654 . . . . 0.0 112.765 -175.765 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 85' ' ' MET . . . . . . . . . . . . . 77.6 mtp -67.41 -61.18 2.03 Favored 'General case' 0 C--N 1.34 0.175 0 CA-C-N 120.175 1.352 . . . . 0.0 107.499 166.657 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 86' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -63.45 -29.09 70.43 Favored 'General case' 0 C--N 1.33 -0.249 0 C-N-CA 124.63 1.172 . . . . 0.0 112.025 -172.614 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 87' ' ' LYS . . . . . . . . . . . . . 10.9 mttt -64.4 -34.88 79.2 Favored 'General case' 0 C--N 1.333 -0.116 0 CA-C-N 118.752 0.706 . . . . 0.0 110.735 179.703 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 88' ' ' GLU . . . . . . . . . . . . . 9.4 mm-40 -105.07 0.56 27.66 Favored 'General case' 0 CA--C 1.53 0.2 0 C-N-CA 124.669 1.188 . . . . 0.0 111.845 -167.876 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 89' ' ' GLY . . . . . . . . . . . . . . . 86.77 96.68 0.84 Allowed Glycine 0 C--N 1.336 0.545 0 N-CA-C 108.797 -1.721 . . . . 0.0 108.797 -177.432 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 90' ' ' ALA . . . . . . . . . . . . . . . -78.29 135.23 37.49 Favored 'General case' 0 N--CA 1.449 -0.481 0 N-CA-C 109.074 -0.713 . . . . 0.0 109.074 175.759 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 91' ' ' GLN . . . . . . . . . . . . . 2.4 mp0 -72.76 112.14 8.53 Favored 'General case' 0 N--CA 1.449 -0.481 0 N-CA-C 105.548 -2.019 . . . . 0.0 105.548 176.125 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 92' ' ' VAL . . . . . . . . . . . . . 55.4 t -104.15 105.94 19.4 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.35 0 N-CA-C 106.551 -1.648 . . . . 0.0 106.551 -178.731 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 93' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER -121.58 91.49 3.53 Favored 'General case' 0 CA--C 1.516 -0.36 0 N-CA-C 108.478 -0.934 . . . . 0.0 108.478 176.72 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 94' ' ' LEU . . . . . . . . . . . . . 44.0 tp -76.73 134.34 39.22 Favored 'General case' 0 N--CA 1.451 -0.408 0 N-CA-C 107.527 -1.286 . . . . 0.0 107.527 167.519 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 95' ' ' THR . . . . . . . . . . . . . 1.2 t -117.7 178.36 4.43 Favored 'General case' 0 C--N 1.319 -0.746 0 N-CA-C 104.969 -2.234 . . . . 0.0 104.969 169.581 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 96' ' ' ALA . . . . . . . . . . . . . . . -44.78 -21.15 0.05 OUTLIER 'General case' 0 CA--C 1.545 0.758 0 N-CA-C 118.542 2.793 . . . . 0.0 118.542 -157.617 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 97' ' ' ASN . . . . . . . . . . . . . 0.4 OUTLIER -160.35 14.72 0.12 Allowed 'General case' 0 CA--C 1.542 0.643 0 C-N-CA 125.257 1.423 . . . . 0.0 111.68 162.693 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 98' ' ' GLN . . . . . . . . . . . . . 16.4 tt0 -130.57 124.95 32.97 Favored 'General case' 0 N--CA 1.466 0.326 0 O-C-N 120.466 -1.396 . . . . 0.0 109.197 -176.388 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 99' ' ' LEU . . . . . . . . . . . . . 12.6 tp -79.06 148.22 32.53 Favored 'General case' 0 C--N 1.326 -0.441 0 C-N-CA 125.875 1.67 . . . . 0.0 109.052 172.676 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 100' ' ' THR . . . . . . . . . . . . . 22.8 m -122.07 129.27 52.25 Favored 'General case' 0 N--CA 1.454 -0.228 0 N-CA-C 106.973 -1.491 . . . . 0.0 106.973 152.077 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 101' ' ' LEU . . . . . . . . . . . . . 1.5 mm? -102.2 100.39 10.59 Favored 'General case' 0 CA--C 1.517 -0.313 0 N-CA-C 105.716 -1.957 . . . . 0.0 105.716 160.703 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 102' ' ' ALA . . . . . . . . . . . . . . . -94.42 151.03 19.7 Favored 'General case' 0 CA--C 1.532 0.286 0 N-CA-C 107.863 -1.162 . . . . 0.0 107.863 167.793 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 103' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -161.82 177.76 9.58 Favored 'General case' 0 N--CA 1.443 -0.809 0 C-N-CA 126.209 1.803 . . . . 0.0 108.177 166.524 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 104' ' ' ALA . . . . . . . . . . . . . . . -50.86 -37.87 45.93 Favored 'General case' 0 N--CA 1.447 -0.589 0 C-N-CA 123.418 0.687 . . . . 0.0 112.715 174.05 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 105' ' ' LYS . . . . . . . . . . . . . 0.3 OUTLIER -60.85 -71.99 0.13 Allowed 'General case' 0 C--N 1.342 0.255 0 N-CA-C 112.604 0.594 . . . . 0.0 112.604 178.928 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 106' ' ' GLN . . . . . 0.425 HE21 HG21 ' A' ' 81' ' ' THR . 26.7 mt-30 -150.75 176.86 10.64 Favored 'General case' 0 C--N 1.329 -0.307 0 C-N-CA 127.573 2.349 . . . . 0.0 106.76 -171.956 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 107' ' ' THR . . . . . . . . . . . . . 5.8 t -114.13 149.6 35.39 Favored 'General case' 0 N--CA 1.448 -0.555 0 N-CA-C 106.523 -1.658 . . . . 0.0 106.523 161.697 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 108' ' ' LEU . . . . . . . . . . . . . 78.9 mt -140.59 123.22 16.19 Favored 'General case' 0 C--O 1.237 0.403 0 N-CA-C 106.773 -1.566 . . . . 0.0 106.773 -175.6 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 109' ' ' THR . . . . . . . . . . . . . 24.4 m -89.65 122.27 32.62 Favored 'General case' 0 C--O 1.24 0.566 0 N-CA-C 107.286 -1.376 . . . . 0.0 107.286 176.974 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 110' ' ' TYR . . . . . . . . . . . . . 95.4 m-85 -114.32 157.52 22.68 Favored 'General case' 0 N--CA 1.453 -0.324 0 N-CA-C 108.717 -0.846 . . . . 0.0 108.717 174.045 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 111' ' ' LYS . . . . . . . . . . . . . 0.8 OUTLIER -122.38 141.02 52.02 Favored 'General case' 0 C--N 1.332 -0.163 0 C-N-CA 124.029 0.932 . . . . 0.0 109.016 -173.271 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 112' ' ' LEU . . . . . . . . . . . . . 25.3 tp -73.86 54.19 0.49 Allowed 'General case' 0 CA--C 1.534 0.343 0 C-N-CA 128.347 2.659 . . . . 0.0 108.875 171.857 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 113' ' ' ALA . . . . . . . . . . . . . . . -93.64 79.75 4.28 Favored 'General case' 0 N--CA 1.448 -0.526 0 N-CA-C 105.26 -2.126 . . . . 0.0 105.26 174.808 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 114' ' ' ASP . . . . . . . . . . . . . 20.4 t0 . . . . . 0 C--N 1.327 -0.384 0 CA-C-O 123.745 1.736 . . . . 0.0 109.99 -170.153 . . . . . . . . 0 0 . 1 . 015 nuclear orig core ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 4.6 ttp . . . . . 0 C--O 1.234 0.269 0 N-CA-C 108.195 -1.039 . . . . 0.0 108.195 . . . . . . . . . 0 0 . 1 . 015 nuclear orig core ' A' A ' 2' ' ' VAL . . . . . . . . . . . . . 54.2 t -61.89 156.32 4.07 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.446 0 C-N-CA 124.573 1.149 . . . . 0.0 109.861 179.781 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 3' ' ' THR . . . . . . . . . . . . . 62.2 p -134.16 165.66 35.05 Favored Pre-proline 0 CA--C 1.53 0.209 0 O-C-N 121.844 -0.535 . . . . 0.0 111.919 170.277 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 4' ' ' PRO . . . . . . . . . . . . . 29.9 Cg_endo -63.38 -35.96 58.51 Favored 'Trans proline' 0 N--CA 1.459 -0.53 0 C-N-CA 123.116 2.544 . . . . 0.0 113.791 170.951 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 5' ' ' GLU . . . . . . . . . . . . . 57.2 tt0 -57.37 -49.63 75.55 Favored 'General case' 0 C--N 1.325 -0.48 0 C-N-CA 123.217 0.607 . . . . 0.0 111.116 -171.935 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 6' ' ' GLN . . . . . . . . . . . . . 18.4 pt20 -68.56 14.22 0.08 Allowed 'General case' 0 CA--C 1.537 0.447 0 C-N-CA 127.374 2.27 . . . . 0.0 114.491 -178.259 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 7' ' ' LEU . . . . . . . . . . . . . 72.1 mt -134.7 -49.54 0.77 Allowed 'General case' 0 N--CA 1.456 -0.129 0 C-N-CA 124.449 1.1 . . . . 0.0 112.372 -170.726 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 8' ' ' GLN . . . . . . . . . . . . . 0.2 OUTLIER -52.65 -1.35 0.02 OUTLIER 'General case' 0 N--CA 1.466 0.362 0 C-N-CA 128.518 2.727 . . . . 0.0 117.902 -172.771 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 9' ' ' HIS . . . . . . . . . . . . . 91.8 m-70 -143.55 10.94 1.66 Allowed 'General case' 0 CA--C 1.535 0.393 0 CA-C-N 120.269 1.395 . . . . 0.0 111.695 172.538 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 10' ' ' HIS . . . . . . . . . . . . . 81.7 m-70 -108.42 115.26 29.77 Favored 'General case' 0 N--CA 1.452 -0.346 0 C-N-CA 124.909 1.284 . . . . 0.0 108.563 -167.892 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 11' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -70.38 142.08 52.13 Favored 'General case' 0 N--CA 1.464 0.27 0 N-CA-C 107.777 -1.194 . . . . 0.0 107.777 169.726 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 12' ' ' PHE . . . . . . . . . . . . . 41.9 m-85 -125.47 164.61 20.09 Favored 'General case' 0 N--CA 1.444 -0.76 0 C-N-CA 125.623 1.569 . . . . 0.0 107.874 162.459 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 13' ' ' VAL . . . . . . . . . . . . . 4.3 t -134.29 146.91 30.44 Favored 'Isoleucine or valine' 0 C--O 1.236 0.345 0 N-CA-C 107.784 -1.191 . . . . 0.0 107.784 -178.794 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 14' ' ' LEU . . . . . . . . . . . . . 27.2 tp -75.18 91.28 2.6 Favored 'General case' 0 N--CA 1.454 -0.252 0 O-C-N 123.787 0.679 . . . . 0.0 109.402 -175.301 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 0.7 OUTLIER -66.44 -42.38 87.74 Favored 'General case' 0 C--O 1.237 0.397 0 C-N-CA 124.656 1.182 . . . . 0.0 109.514 -177.134 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -161.9 152.95 18.02 Favored 'General case' 0 N--CA 1.449 -0.51 0 CA-C-O 121.737 0.78 . . . . 0.0 111.174 -174.146 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 17' ' ' VAL . . . . . . . . . . . . . 2.0 t -116.72 161.29 15.58 Favored 'Isoleucine or valine' 0 C--O 1.235 0.324 0 N-CA-C 107.011 -1.477 . . . . 0.0 107.011 -179.53 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 18' ' ' ASN . . . . . . . . . . . . . 17.9 t30 -51.17 -42.2 60.68 Favored 'General case' 0 N--CA 1.46 0.07 0 C-N-CA 123.147 0.579 . . . . 0.0 111.902 176.846 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . -62.54 -72.89 0.58 Allowed Glycine 0 CA--C 1.525 0.697 0 N-CA-C 110.159 -1.176 . . . . 0.0 110.159 174.265 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 17.0 mttt -165.74 166.88 9.58 Favored Pre-proline 0 C--N 1.332 -0.176 0 C-N-CA 128.239 2.616 . . . . 0.0 108.405 -171.445 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 21' ' ' PRO . . . . . . . . . . . . . 56.8 Cg_endo -58.96 169.43 3.51 Favored 'Trans proline' 0 N--CA 1.455 -0.751 0 CA-C-N 120.389 1.175 . . . . 0.0 110.679 172.389 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 22' ' ' VAL . . . . . . . . . . . . . 2.7 t -105.97 162.4 5.06 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.396 0 N-CA-C 107.067 -1.457 . . . . 0.0 107.067 174.922 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 23' ' ' THR . . . . . . . . . . . . . 0.6 OUTLIER -136.96 81.0 1.85 Allowed 'General case' 0 C--N 1.329 -0.289 0 C-N-CA 124.3 1.04 . . . . 0.0 108.533 -172.868 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 24' ' ' SER . . . . . . . . . . . . . 27.7 m -128.88 100.51 5.71 Favored 'General case' 0 C--N 1.325 -0.458 0 C-N-CA 125.701 1.6 . . . . 0.0 107.179 -175.637 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 25' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER -75.1 -16.06 60.58 Favored 'General case' 0 N--CA 1.467 0.405 0 C-N-CA 125.765 1.626 . . . . 0.0 112.151 -174.164 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 26' ' ' LYS . . . . . . . . . . . . . 20.4 tttp -143.4 136.72 28.09 Favored 'General case' 0 N--CA 1.448 -0.554 0 N-CA-C 105.748 -1.945 . . . . 0.0 105.748 -174.679 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 27' ' ' ASN . . . . . . . . . . . . . 42.8 m-20 44.93 66.62 4.96 Favored Pre-proline 0 CA--C 1.547 0.839 0 C-N-CA 125.844 1.657 . . . . 0.0 110.862 178.895 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 28' ' ' PRO . . . . . . . . . . . . . 56.2 Cg_endo -65.87 173.82 6.48 Favored 'Trans proline' 0 C--N 1.346 0.413 0 C-N-CA 123.988 3.125 . . . . 0.0 112.751 -176.275 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 29' ' ' PRO . . . . . . . . . . . . . 70.3 Cg_endo -72.82 93.79 0.79 Allowed 'Trans proline' 0 N--CA 1.446 -1.272 0 N-CA-C 108.397 -1.424 . . . . 0.0 108.397 157.359 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 30' ' ' GLU . . . . . . . . . . . . . 0.2 OUTLIER -98.38 177.64 5.29 Favored 'General case' 0 C--N 1.327 -0.403 0 O-C-N 120.546 -1.346 . . . . 0.0 109.686 167.754 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 31' ' ' ILE . . . . . . . . . . . . . 9.0 tt -147.54 114.33 0.98 Allowed 'Isoleucine or valine' 0 N--CA 1.451 -0.378 0 N-CA-C 106.952 -1.499 . . . . 0.0 106.952 171.348 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 32' ' ' SER . . . . . . . . . . . . . 15.1 m -116.11 159.61 21.5 Favored 'General case' 0 C--O 1.238 0.477 0 N-CA-C 108.902 -0.777 . . . . 0.0 108.902 174.441 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 33' ' ' PHE . . . . . . . . . . . . . 29.0 m-85 -130.55 152.55 49.8 Favored 'General case' 0 N--CA 1.448 -0.555 0 N-CA-C 108.364 -0.976 . . . . 0.0 108.364 175.862 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 34' ' ' GLY . . . . . . . . . . . . . . . -117.98 -178.44 17.26 Favored Glycine 0 C--N 1.332 0.317 0 N-CA-C 109.568 -1.413 . . . . 0.0 109.568 171.13 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 35' ' ' GLU . . . . . . . . . . . . . 3.8 pt-20 -63.22 -26.17 68.67 Favored 'General case' 0 C--N 1.324 -0.513 0 C-N-CA 128.671 2.788 . . . . 0.0 112.527 -158.359 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 0.3 OUTLIER -85.2 13.44 6.35 Favored 'General case' 0 N--CA 1.437 -1.121 0 C-N-CA 129.296 3.038 . . . . 0.0 114.308 173.352 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 37' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER 60.8 14.78 5.38 Favored 'General case' 0 CA--C 1.55 0.946 0 C-N-CA 127.394 2.278 . . . . 0.0 112.522 -168.305 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 38' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -54.58 160.51 1.77 Allowed 'General case' 0 N--CA 1.467 0.416 0 O-C-N 119.912 -1.742 . . . . 0.0 110.623 177.658 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 39' ' ' ILE . . . . . . . . . . . . . 17.9 mt -132.12 120.7 44.53 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.514 0 N-CA-C 105.555 -2.017 . . . . 0.0 105.555 -177.546 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 40' ' ' SER . . . . . . . . . . . . . 17.3 m -129.18 89.1 2.8 Favored 'General case' 0 CA--C 1.535 0.378 0 C-N-CA 126.131 1.772 . . . . 0.0 108.607 -174.674 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 41' ' ' GLY . . . . . . . . . . . . . . . -135.61 -167.91 11.42 Favored Glycine 0 CA--C 1.538 1.487 0 C-N-CA 124.304 0.954 . . . . 0.0 110.95 -173.735 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 42' ' ' SER . . . . . . . . . . . . . 23.6 t -171.91 93.02 0.14 Allowed 'General case' 0 CA--C 1.535 0.379 0 C-N-CA 128.247 2.619 . . . . 0.0 108.525 177.497 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 43' ' ' MET . . . . . . . . . . . . . 2.6 mmt -63.74 -51.1 66.46 Favored 'General case' 0 C--O 1.231 0.107 0 N-CA-C 108.651 -0.87 . . . . 0.0 108.651 170.761 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 44' ' ' CYS . . . . . 1.302 ' SG ' ' SG ' ' A' ' 70' ' ' CYS . 48.9 t -148.79 -66.06 0.23 Allowed 'General case' 0 CA--C 1.514 -0.427 0 N-CA-C 108.182 -1.044 . . . . 0.0 108.182 169.023 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 45' ' ' ASN . . . . . . . . . . . . . 1.1 m-80 -75.93 17.36 0.33 Allowed 'General case' 0 CA--C 1.534 0.347 0 C-N-CA 127.835 2.454 . . . . 0.0 112.549 -172.612 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 46' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER 61.68 161.32 0.07 Allowed 'General case' 0 N--CA 1.463 0.207 0 C-N-CA 125.855 1.662 . . . . 0.0 111.545 -163.952 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 47' ' ' PHE . . . . . . . . . . . . . 35.0 p90 -158.81 159.78 35.5 Favored 'General case' 0 C--N 1.329 -0.308 0 N-CA-C 107.541 -1.281 . . . . 0.0 107.541 153.348 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 48' ' ' SER . . . . . . . . . . . . . 1.4 m -151.91 158.47 43.22 Favored 'General case' 0 C--O 1.237 0.427 0 N-CA-C 108.561 -0.903 . . . . 0.0 108.561 161.075 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 49' ' ' GLY . . . . . . . . . . . . . . . -177.76 166.68 37.12 Favored Glycine 0 CA--C 1.52 0.389 0 N-CA-C 110.136 -1.186 . . . . 0.0 110.136 179.578 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 50' ' ' GLU . . . . . . . . . . . . . 43.4 mt-10 -88.51 98.26 11.54 Favored 'General case' 0 N--CA 1.449 -0.488 0 N-CA-C 107.575 -1.268 . . . . 0.0 107.575 -176.832 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 51' ' ' GLY . . . . . . . . . . . . . . . -59.61 169.87 6.54 Favored Glycine 0 CA--C 1.531 1.083 0 CA-C-N 115.737 -0.665 . . . . 0.0 112.424 172.106 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 52' ' ' LYS . . . . . . . . . . . . . 35.6 ttpt -155.02 147.03 23.6 Favored 'General case' 0 C--O 1.235 0.327 0 O-C-N 121.549 -0.971 . . . . 0.0 111.142 169.606 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 53' ' ' LEU . . . . . . . . . . . . . 24.2 tp -134.77 139.73 45.37 Favored 'General case' 0 N--CA 1.453 -0.324 0 C-N-CA 127.575 2.35 . . . . 0.0 107.484 170.148 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 1.3 t -162.21 -14.77 0.04 OUTLIER 'General case' 0 CA--C 1.541 0.606 0 C-N-CA 125.574 1.55 . . . . 0.0 110.39 163.917 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 55' ' ' ASN . . . . . . . . . . . . . 43.9 m-20 -123.44 14.12 9.54 Favored 'General case' 0 CA--C 1.541 0.601 0 C-N-CA 124.761 1.224 . . . . 0.0 113.099 -170.407 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 56' ' ' GLY . . . . . . . . . . . . . . . 72.09 19.7 78.61 Favored Glycine 0 CA--C 1.533 1.183 0 CA-C-N 120.429 1.468 . . . . 0.0 112.672 -172.24 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 57' ' ' GLU . . . . . . . . . . . . . 19.7 tt0 -130.01 149.84 51.55 Favored 'General case' 0 CA--C 1.541 0.607 0 C-N-CA 125.187 1.395 . . . . 0.0 107.958 -176.726 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 58' ' ' LEU . . . . . . . . . . . . . 66.2 tp -114.72 124.74 52.57 Favored 'General case' 0 N--CA 1.465 0.291 0 CA-C-N 119.603 1.092 . . . . 0.0 109.066 177.516 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 59' ' ' THR . . . . . . . . . . . . . 11.8 p -123.01 159.47 28.32 Favored 'General case' 0 C--N 1.326 -0.42 0 C-N-CA 126.171 1.788 . . . . 0.0 110.15 169.531 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 60' ' ' ALA . . . . . . . . . . . . . . . -80.54 169.62 17.44 Favored 'General case' 0 N--CA 1.451 -0.423 0 C-N-CA 126.191 1.796 . . . . 0.0 113.468 162.532 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 61' ' ' LYS . . . . . . . . . . . . . 77.6 tttt -135.79 121.51 19.66 Favored 'General case' 0 N--CA 1.441 -0.876 0 N-CA-C 105.211 -2.144 . . . . 0.0 105.211 147.212 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 62' ' ' GLY . . . . . . . . . . . . . . . 104.41 -61.25 0.41 Allowed Glycine 0 CA--C 1.526 0.73 0 CA-C-O 118.575 -1.125 . . . . 0.0 113.775 160.569 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 63' ' ' LEU . . . . . . . . . . . . . 2.5 tp 44.85 87.79 0.02 OUTLIER 'General case' 0 CA--C 1.54 0.578 0 C-N-CA 128.305 2.642 . . . . 0.0 113.591 -175.499 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 64' ' ' ALA . . . . . . . . . . . . . . . -71.57 147.44 47.63 Favored 'General case' 0 C--N 1.33 -0.25 0 N-CA-C 107.094 -1.446 . . . . 0.0 107.094 162.05 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 65' ' ' MET . . . . . . . . . . . . . 63.9 mtp -147.06 -171.11 3.7 Favored 'General case' 0 CA--C 1.542 0.666 0 C-N-CA 126.806 2.042 . . . . 0.0 107.625 174.679 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 66' ' ' THR . . . . . . . . . . . . . 3.9 p -139.15 -168.82 2.52 Favored 'General case' 0 CA--C 1.546 0.812 0 C-N-CA 124.494 1.118 . . . . 0.0 109.847 176.785 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 67' ' ' ARG . . . . . . . . . . . . . 16.6 mmt85 -119.18 28.44 8.24 Favored 'General case' 0 N--CA 1.473 0.716 0 C-N-CA 127.322 2.249 . . . . 0.0 111.935 177.934 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 68' ' ' MET . . . . . . . . . . . . . 77.4 mtm -74.98 -169.7 0.96 Allowed 'General case' 0 CA--C 1.541 0.621 0 O-C-N 120.632 -1.293 . . . . 0.0 109.698 178.651 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 69' ' ' MET . . . . . . . . . . . . . 1.0 OUTLIER -149.63 176.68 10.44 Favored 'General case' 0 CA--C 1.522 -0.134 0 C-N-CA 125.531 1.532 . . . . 0.0 109.626 174.321 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 70' ' ' CYS . . . . . 1.302 ' SG ' ' SG ' ' A' ' 44' ' ' CYS . 75.9 m -133.8 15.38 3.96 Favored 'General case' 0 CA--C 1.537 0.461 0 C-N-CA 124.225 1.01 . . . . 0.0 111.658 179.986 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 71' ' ' ALA . . . . . . . . . . . . . . . 60.6 -25.75 0.04 OUTLIER 'General case' 0 CA--C 1.537 0.455 0 C-N-CA 130.184 3.394 . . . . 0.0 115.308 -171.212 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 72' ' ' ASN . . . . . . . . . . . . . 19.8 t30 -96.42 144.56 28.04 Favored Pre-proline 0 C--O 1.236 0.347 0 C-N-CA 124.116 0.967 . . . . 0.0 110.366 -176.552 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 73' ' ' PRO . . . . . . . . . . . . . 53.5 Cg_endo -73.72 -38.19 2.55 Favored 'Trans proline' 0 N--CA 1.46 -0.447 0 C-N-CA 122.044 1.829 . . . . 0.0 112.284 -174.6 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 74' ' ' GLN . . . . . . . . . . . . . 63.1 tt0 -52.48 -46.25 66.5 Favored 'General case' 0 C--O 1.224 -0.277 0 CA-C-N 118.973 0.806 . . . . 0.0 110.661 -178.378 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 75' ' ' LEU . . . . . . . . . . . . . 90.0 mt -66.12 -37.65 86.26 Favored 'General case' 0 CA--C 1.534 0.347 0 O-C-N 121.873 -0.517 . . . . 0.0 111.623 -179.557 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 76' ' ' ASN . . . . . . . . . . . . . 0.8 OUTLIER -76.05 -28.92 57.84 Favored 'General case' 0 N--CA 1.467 0.38 0 CA-C-N 118.936 0.789 . . . . 0.0 111.691 -178.483 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 77' ' ' GLU . . . . . . . . . . . . . 3.3 tp10 -65.75 -36.64 84.14 Favored 'General case' 0 CA--C 1.533 0.321 0 C-N-CA 125.047 1.339 . . . . 0.0 109.008 166.729 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 78' ' ' LEU . . . . . 0.408 ' HA ' ' HB ' ' A' ' 81' ' ' THR . 5.2 mp -70.63 -13.17 61.98 Favored 'General case' 0 N--CA 1.453 -0.298 0 O-C-N 121.121 -0.987 . . . . 0.0 113.55 -177.429 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 79' ' ' ASP . . . . . . . . . . . . . 13.4 t70 -52.99 -58.28 7.51 Favored 'General case' 0 C--O 1.231 0.12 0 C-N-CA 124.725 1.21 . . . . 0.0 110.696 163.273 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 80' ' ' ASN . . . . . . . . . . . . . 13.4 p30 -75.33 -35.7 61.15 Favored 'General case' 0 N--CA 1.444 -0.731 0 N-CA-C 109.605 -0.517 . . . . 0.0 109.605 -173.525 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 81' ' ' THR . . . . . 0.408 ' HB ' ' HA ' ' A' ' 78' ' ' LEU . 32.6 m -48.43 -53.15 18.86 Favored 'General case' 0 N--CA 1.447 -0.606 0 C-N-CA 125.29 1.436 . . . . 0.0 110.349 174.29 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 82' ' ' ILE . . . . . . . . . . . . . 8.9 tp -77.2 -38.31 27.15 Favored 'Isoleucine or valine' 0 C--N 1.341 0.231 0 CA-C-N 120.069 1.304 . . . . 0.0 111.586 -178.686 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 83' ' ' SER . . . . . . . . . . . . . 4.2 t -50.46 -50.96 51.0 Favored 'General case' 0 C--O 1.238 0.467 0 C-N-CA 123.679 0.791 . . . . 0.0 109.851 -179.904 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 84' ' ' GLU . . . . . . . . . . . . . 0.5 OUTLIER -67.41 -44.64 78.31 Favored 'General case' 0 N--CA 1.45 -0.444 0 C-N-CA 124.46 1.104 . . . . 0.0 112.006 -178.451 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 85' ' ' MET . . . . . . . . . . . . . 90.2 mtp -66.8 -23.41 66.05 Favored 'General case' 0 C--O 1.232 0.16 0 CA-C-O 121.864 0.84 . . . . 0.0 110.7 -166.667 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 86' ' ' LEU . . . . . . . . . . . . . 2.8 mm? -98.02 -31.42 12.16 Favored 'General case' 0 N--CA 1.446 -0.664 0 C-N-CA 125.301 1.44 . . . . 0.0 110.413 -177.814 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 87' ' ' LYS . . . . . . . . . . . . . 54.0 mttt -66.6 -49.91 64.77 Favored 'General case' 0 N--CA 1.439 -0.986 0 N-CA-C 107.438 -1.319 . . . . 0.0 107.438 179.16 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 88' ' ' GLU . . . . . . . . . . . . . 31.2 mt-10 -89.15 -8.44 53.68 Favored 'General case' 0 CA--C 1.532 0.265 0 N-CA-C 113.169 0.804 . . . . 0.0 113.169 -168.115 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 89' ' ' GLY . . . . . . . . . . . . . . . 83.54 138.91 3.63 Favored Glycine 0 C--N 1.337 0.588 0 C-N-CA 124.358 0.98 . . . . 0.0 112.423 175.45 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 90' ' ' ALA . . . . . . . . . . . . . . . -131.48 154.03 49.16 Favored 'General case' 0 CA--C 1.514 -0.426 0 N-CA-C 114.127 1.158 . . . . 0.0 114.127 -165.275 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 91' ' ' GLN . . . . . . . . . . . . . 9.0 mp0 -70.36 129.22 38.71 Favored 'General case' 0 N--CA 1.445 -0.709 0 N-CA-C 104.242 -2.503 . . . . 0.0 104.242 163.1 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 92' ' ' VAL . . . . . . . . . . . . . 3.3 p -128.6 77.32 0.55 Allowed 'Isoleucine or valine' 0 C--N 1.325 -0.489 0 N-CA-C 106.512 -1.662 . . . . 0.0 106.512 -177.135 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 93' ' ' ASP . . . . . . . . . . . . . 2.4 m-20 -72.32 147.65 46.12 Favored 'General case' 0 N--CA 1.448 -0.546 0 N-CA-C 107.206 -1.405 . . . . 0.0 107.206 172.537 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 94' ' ' LEU . . . . . . . . . . . . . 61.1 tp -142.07 102.73 4.18 Favored 'General case' 0 N--CA 1.448 -0.534 0 N-CA-C 107.909 -1.145 . . . . 0.0 107.909 171.283 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 95' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -70.67 179.48 2.58 Favored 'General case' 0 N--CA 1.442 -0.855 0 CA-C-N 114.771 -1.104 . . . . 0.0 108.825 168.486 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 96' ' ' ALA . . . . . . . . . . . . . . . -47.07 -33.01 4.53 Favored 'General case' 0 CA--C 1.535 0.401 0 C-N-CA 126.273 1.829 . . . . 0.0 115.173 -169.955 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 97' ' ' ASN . . . . . . . . . . . . . 0.0 OUTLIER -148.35 6.8 0.76 Allowed 'General case' 0 CA--C 1.537 0.445 0 C-N-CA 126.325 1.85 . . . . 0.0 110.69 -173.897 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 98' ' ' GLN . . . . . . . . . . . . . 24.7 tt0 -143.46 111.41 6.09 Favored 'General case' 0 CA--C 1.529 0.156 0 CA-C-N 119.566 1.076 . . . . 0.0 109.899 -164.9 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 99' ' ' LEU . . . . . . . . . . . . . 10.9 tp -66.79 147.37 53.35 Favored 'General case' 0 C--O 1.235 0.321 0 C-N-CA 125.63 1.572 . . . . 0.0 107.745 170.744 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 100' ' ' THR . . . . . . . . . . . . . 85.3 m -143.46 100.69 3.65 Favored 'General case' 0 C--N 1.326 -0.439 0 N-CA-C 106.638 -1.615 . . . . 0.0 106.638 169.506 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 101' ' ' LEU . . . . . . . . . . . . . 3.2 mm? -81.37 146.33 30.38 Favored 'General case' 0 CA--C 1.517 -0.303 0 N-CA-C 107.651 -1.241 . . . . 0.0 107.651 175.571 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 102' ' ' ALA . . . . . . . . . . . . . . . -143.46 152.03 41.04 Favored 'General case' 0 C--O 1.235 0.336 0 C-N-CA 123.679 0.792 . . . . 0.0 109.7 164.126 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 103' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -151.61 173.92 14.07 Favored 'General case' 0 C--N 1.326 -0.448 0 C-N-CA 126.93 2.092 . . . . 0.0 108.735 179.631 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 104' ' ' ALA . . . . . . . . . . . . . . . -49.85 -19.19 0.62 Allowed 'General case' 0 CA--C 1.536 0.419 0 N-CA-C 115.44 1.644 . . . . 0.0 115.44 164.392 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 105' ' ' LYS . . . . . . . . . . . . . 23.8 mmtt -87.95 -74.15 0.46 Allowed 'General case' 0 N--CA 1.455 -0.19 0 CA-C-N 119.775 1.171 . . . . 0.0 109.245 172.67 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 106' ' ' GLN . . . . . . . . . . . . . 13.4 mt-30 -150.34 179.76 7.86 Favored 'General case' 0 N--CA 1.462 0.151 0 C-N-CA 124.644 1.178 . . . . 0.0 109.835 -160.862 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 107' ' ' THR . . . . . . . . . . . . . 3.5 t -135.22 125.51 26.36 Favored 'General case' 0 CA--C 1.538 0.506 0 C-N-CA 124.587 1.155 . . . . 0.0 109.699 177.777 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 108' ' ' LEU . . . . . . . . . . . . . 8.5 mp -119.44 149.02 42.56 Favored 'General case' 0 C--O 1.234 0.245 0 C-N-CA 126.746 2.018 . . . . 0.0 109.337 -172.257 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 109' ' ' THR . . . . . . . . . . . . . 32.2 m -121.27 124.69 45.24 Favored 'General case' 0 N--CA 1.451 -0.419 0 N-CA-C 108.338 -0.986 . . . . 0.0 108.338 -173.022 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 110' ' ' TYR . . . . . . . . . . . . . 32.3 m-85 -124.39 163.86 20.88 Favored 'General case' 0 CA--C 1.518 -0.272 0 N-CA-C 109.482 -0.562 . . . . 0.0 109.482 -179.98 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 111' ' ' LYS . . . . . . . . . . . . . 0.5 OUTLIER -128.0 140.08 52.18 Favored 'General case' 0 CA--C 1.514 -0.405 0 CA-C-O 117.54 -1.219 . . . . 0.0 108.883 -171.734 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 112' ' ' LEU . . . . . . . . . . . . . 28.9 tp -71.85 47.01 0.13 Allowed 'General case' 0 CA--C 1.54 0.592 0 C-N-CA 127.386 2.275 . . . . 0.0 110.079 175.078 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 113' ' ' ALA . . . . . . . . . . . . . . . -78.96 82.32 5.15 Favored 'General case' 0 N--CA 1.446 -0.644 0 N-CA-C 106.489 -1.671 . . . . 0.0 106.489 166.225 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 114' ' ' ASP . . . . . . . . . . . . . 45.1 t0 . . . . . 0 CA--C 1.506 -0.73 0 N-CA-C 107.421 -1.325 . . . . 0.0 107.421 173.908 . . . . . . . . 0 0 . 1 . 016 nuclear orig core ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 C--O 1.237 0.424 0 N-CA-C 110.069 -0.345 . . . . 0.0 110.069 . . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 2' ' ' VAL . . . . . . . . . . . . . 7.3 p -55.63 142.89 9.54 Favored 'Isoleucine or valine' 0 N--CA 1.447 -0.59 0 C-N-CA 124.133 0.973 . . . . 0.0 109.331 175.377 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 3' ' ' THR . . . . . . . . . . . . . 0.8 OUTLIER -130.74 162.88 52.44 Favored Pre-proline 0 C--N 1.327 -0.403 0 C-N-CA 124.953 1.301 . . . . 0.0 109.196 -176.939 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 4' ' ' PRO . . . . . . . . . . . . . 30.7 Cg_endo -65.53 -34.52 42.25 Favored 'Trans proline' 0 N--CA 1.457 -0.636 0 C-N-CA 122.275 1.984 . . . . 0.0 111.731 -178.579 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 5' ' ' GLU . . . . . 0.421 ' C ' ' H ' ' A' ' 7' ' ' LEU . 55.1 tt0 -58.63 -55.13 39.02 Favored 'General case' 0 C--N 1.322 -0.61 0 C-N-CA 124.731 1.212 . . . . 0.0 110.656 -177.156 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 6' ' ' GLN . . . . . . . . . . . . . 21.3 pt20 -66.35 12.65 0.06 Allowed 'General case' 0 CA--C 1.541 0.635 0 C-N-CA 125.348 1.459 . . . . 0.0 113.793 177.829 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 7' ' ' LEU . . . . . 0.421 ' H ' ' C ' ' A' ' 5' ' ' GLU . 82.4 mt -124.46 -47.19 1.86 Allowed 'General case' 0 N--CA 1.454 -0.238 0 C-N-CA 126.378 1.871 . . . . 0.0 110.456 177.815 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 8' ' ' GLN . . . . . . . . . . . . 0.259 3.3 pt20 -56.34 -14.53 2.98 Favored 'General case' 0 N--CA 1.472 0.66 0 N-CA-C 114.874 1.435 . . . . 0.0 114.874 -176.361 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 9' ' ' HIS . . . . . . . . . . . . . 10.6 m-70 -124.92 16.64 8.58 Favored 'General case' 0 C--N 1.32 -0.685 0 C-N-CA 124.489 1.116 . . . . 0.0 111.274 -174.811 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 10' ' ' HIS . . . . . . . . . . . . . 97.8 m-70 -142.53 121.3 12.67 Favored 'General case' 0 CA--C 1.541 0.63 0 C-N-CA 125.711 1.604 . . . . 0.0 110.805 -179.879 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 11' ' ' ARG . . . . . . . . . . . . . 4.4 ptm85 -78.67 160.18 27.64 Favored 'General case' 0 N--CA 1.467 0.397 0 C-N-CA 124.853 1.261 . . . . 0.0 109.578 174.164 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 12' ' ' PHE . . . . . . . . . . . . . 34.2 m-85 -140.03 134.74 31.84 Favored 'General case' 0 C--N 1.329 -0.286 0 C-N-CA 123.926 0.891 . . . . 0.0 110.664 -179.171 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 13' ' ' VAL . . . . . . . . . . . . . 11.0 p -120.88 144.21 30.55 Favored 'Isoleucine or valine' 0 C--O 1.233 0.226 0 O-C-N 121.192 -0.942 . . . . 0.0 110.149 -179.213 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 14' ' ' LEU . . . . . . . . . . . . . 35.0 tp -79.42 86.56 5.11 Favored 'General case' 0 C--N 1.332 -0.193 0 C-N-CA 124.959 1.304 . . . . 0.0 110.598 -169.383 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 4.0 mm-40 -55.44 -42.3 74.02 Favored 'General case' 0 C--O 1.235 0.322 0 C-N-CA 124.527 1.131 . . . . 0.0 111.022 176.169 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 22.3 t -155.11 142.98 19.98 Favored 'General case' 0 N--CA 1.452 -0.369 0 CA-C-O 121.918 0.866 . . . . 0.0 110.962 174.571 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 17' ' ' VAL . . . . . . . . . . . . . 44.3 t -67.2 171.15 0.85 Allowed 'Isoleucine or valine' 0 C--O 1.24 0.594 0 N-CA-C 107.235 -1.394 . . . . 0.0 107.235 159.42 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 18' ' ' ASN . . . . . . . . . . . . . 0.2 OUTLIER -46.65 -44.47 18.44 Favored 'General case' 0 CA--C 1.528 0.129 0 C-N-CA 124.245 1.018 . . . . 0.0 111.503 170.888 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . -86.73 -58.57 1.9 Allowed Glycine 0 N--CA 1.446 -0.649 0 O-C-N 124.223 0.952 . . . . 0.0 110.988 -166.421 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 24.3 mttt -149.42 166.15 15.95 Favored Pre-proline 0 C--O 1.238 0.493 0 C-N-CA 126.286 1.834 . . . . 0.0 110.449 -173.178 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 21' ' ' PRO . . . . . . . . . . . . . 42.4 Cg_endo -56.11 171.27 0.86 Allowed 'Trans proline' 0 N--CA 1.455 -0.793 0 C-N-CA 122.082 1.854 . . . . 0.0 111.897 164.329 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 22' ' ' VAL . . . . . . . . . . . . . 4.1 p -128.37 147.15 32.94 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.341 0 C-N-CA 124.775 1.23 . . . . 0.0 108.415 -178.757 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 23' ' ' THR . . . . . . . . . . . . . 1.4 p -110.61 145.57 37.64 Favored 'General case' 0 N--CA 1.452 -0.358 0 C-N-CA 124.734 1.214 . . . . 0.0 109.38 179.172 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 24' ' ' SER . . . . . . . . . . . . . 23.3 t -150.27 137.91 19.88 Favored 'General case' 0 N--CA 1.437 -1.096 0 C-N-CA 127.5 2.32 . . . . 0.0 105.247 176.483 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 25' ' ' ASP . . . . . . . . . . . . . 37.4 t70 -49.74 -59.27 3.97 Favored 'General case' 0 C--N 1.32 -0.706 0 C-N-CA 124.098 0.959 . . . . 0.0 111.905 171.875 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 26' ' ' LYS . . . . . . . . . . . . . 11.2 tttt -153.47 -3.58 0.2 Allowed 'General case' 0 N--CA 1.47 0.542 0 N-CA-C 113.946 1.091 . . . . 0.0 113.946 -175.97 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 27' ' ' ASN . . . . . . . . . . . . . 43.4 m-80 -127.02 83.36 66.2 Favored Pre-proline 0 C--O 1.234 0.263 0 N-CA-C 107.543 -1.28 . . . . 0.0 107.543 -176.249 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 28' ' ' PRO . . . . . . . . . . . . . 49.2 Cg_endo -65.77 162.86 32.86 Favored 'Trans proline' 0 N--CA 1.453 -0.909 0 C-N-CA 121.817 1.678 . . . . 0.0 110.633 -176.559 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 29' ' ' PRO . . . . . . . . . . . . . 30.0 Cg_endo -65.29 84.8 0.2 Allowed 'Trans proline' 0 N--CA 1.449 -1.131 0 C-N-CA 122.437 2.091 . . . . 0.0 108.512 162.913 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 30' ' ' GLU . . . . . . . . . . . . . 11.6 pt-20 -105.49 162.21 13.67 Favored 'General case' 0 C--O 1.241 0.622 0 C-N-CA 124.337 1.055 . . . . 0.0 108.31 169.709 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 31' ' ' ILE . . . . . . . . . . . . . 20.2 tt -138.53 137.19 43.63 Favored 'Isoleucine or valine' 0 N--CA 1.447 -0.622 0 C-N-CA 127.606 2.363 . . . . 0.0 105.501 177.894 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 32' ' ' SER . . . . . . . . . . . . . 1.5 m -131.39 163.72 27.26 Favored 'General case' 0 N--CA 1.447 -0.622 0 N-CA-C 107.974 -1.121 . . . . 0.0 107.974 174.159 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 33' ' ' PHE . . . . . . . . . . . . . 35.3 m-85 -131.65 166.6 21.1 Favored 'General case' 0 N--CA 1.445 -0.679 0 N-CA-C 107.097 -1.446 . . . . 0.0 107.097 -179.698 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 34' ' ' GLY . . . . . . . . . . . . . . . 166.93 141.15 3.07 Favored Glycine 0 CA--C 1.503 -0.659 0 N-CA-C 108.208 -1.957 . . . . 0.0 108.208 -174.966 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 35' ' ' GLU . . . . . . . . . . . . . 90.8 mt-10 59.64 108.83 0.02 OUTLIER 'General case' 0 C--O 1.222 -0.348 0 C-N-CA 127.698 2.399 . . . . 0.0 110.675 -176.612 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 35.5 mtpt 61.48 12.31 4.33 Favored 'General case' 0 N--CA 1.473 0.701 0 N-CA-C 115.312 1.597 . . . . 0.0 115.312 169.486 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 37' ' ' MET . . . . . . . . . . . . . 13.5 mmm 58.06 49.84 10.97 Favored 'General case' 0 CA--C 1.537 0.479 0 C-N-CA 124.35 1.06 . . . . 0.0 112.488 -161.097 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 38' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -63.27 167.13 5.48 Favored 'General case' 0 N--CA 1.452 -0.346 0 O-C-N 120.624 -1.298 . . . . 0.0 109.279 150.017 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 39' ' ' ILE . . . . . . . . . . . . . 10.3 mt -132.61 133.46 59.53 Favored 'Isoleucine or valine' 0 C--O 1.238 0.477 0 C-N-CA 125.503 1.521 . . . . 0.0 107.214 -179.223 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 40' ' ' SER . . . . . . . . . . . . . 16.4 m -131.47 151.84 51.22 Favored 'General case' 0 C--N 1.33 -0.268 0 N-CA-C 106.887 -1.523 . . . . 0.0 106.887 156.361 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 41' ' ' GLY . . . . . . . . . . . . . . . -178.06 178.42 48.51 Favored Glycine 0 N--CA 1.446 -0.699 0 N-CA-C 109.767 -1.333 . . . . 0.0 109.767 174.158 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 42' ' ' SER . . . . . . . . . . . . . 6.1 p -151.95 84.53 1.28 Allowed 'General case' 0 N--CA 1.445 -0.687 0 N-CA-C 108.978 -0.749 . . . . 0.0 108.978 -169.673 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 43' ' ' MET . . . . . . . . . . . . . 17.5 mmm -60.81 -46.38 90.73 Favored 'General case' 0 C--N 1.341 0.228 0 N-CA-C 108.43 -0.952 . . . . 0.0 108.43 169.726 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 44' ' ' CYS . . . . . 1.282 ' SG ' ' SG ' ' A' ' 70' ' ' CYS . 2.2 t -159.84 -66.93 0.07 Allowed 'General case' 0 N--CA 1.433 -1.319 0 N-CA-C 105.14 -2.17 . . . . 0.0 105.14 165.559 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 45' ' ' ASN . . . . . . . . . . . . . 5.0 m-80 -74.63 10.96 1.14 Allowed 'General case' 0 N--CA 1.471 0.595 0 C-N-CA 125.633 1.573 . . . . 0.0 114.682 -166.89 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 46' ' ' ARG . . . . . . . . . . . . . 6.7 mmm-85 56.46 164.79 0.02 OUTLIER 'General case' 0 C--N 1.332 -0.195 0 C-N-CA 126.671 1.988 . . . . 0.0 112.695 -169.329 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 47' ' ' PHE . . . . . . . . . . . . . 53.0 p90 -167.05 165.21 15.84 Favored 'General case' 0 C--N 1.325 -0.496 0 C-N-CA 125.561 1.544 . . . . 0.0 107.727 178.403 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 48' ' ' SER . . . . . . . . . . . . . 0.5 OUTLIER -168.54 141.37 2.93 Favored 'General case' 0 C--N 1.329 -0.303 0 C-N-CA 125.611 1.564 . . . . 0.0 107.742 171.688 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 49' ' ' GLY . . . . . . . . . . . . . . . -152.94 163.33 30.44 Favored Glycine 0 CA--C 1.53 1.028 0 N-CA-C 111.019 -0.832 . . . . 0.0 111.019 175.21 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 50' ' ' GLU . . . . . . . . . . . . . 9.9 pt-20 -63.76 83.18 0.03 OUTLIER 'General case' 0 CA--C 1.538 0.504 0 C-N-CA 128.258 2.623 . . . . 0.0 110.038 172.432 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 51' ' ' GLY . . . . . . . . . . . . . . . -63.8 -76.79 0.26 Allowed Glycine 0 N--CA 1.466 0.635 0 O-C-N 121.386 -0.821 . . . . 0.0 113.355 -166.754 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 52' ' ' LYS . . . . . . . . . . . . . 3.4 ttpm? 57.33 126.94 0.0 OUTLIER 'General case' 0 C--N 1.331 -0.208 0 C-N-CA 130.631 3.573 . . . . 0.0 112.797 176.518 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 53' ' ' LEU . . . . . . . . . . . . . 32.4 tp -125.07 119.45 28.67 Favored 'General case' 0 N--CA 1.467 0.405 0 O-C-N 121.643 -0.661 . . . . 0.0 110.339 -174.341 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 10.0 t -145.1 -17.09 0.5 Allowed 'General case' 0 CA--C 1.539 0.551 0 C-N-CA 125.185 1.394 . . . . 0.0 110.692 178.703 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 55' ' ' ASN . . . . . . . . . . . . . 6.6 m-20 -129.3 6.65 5.33 Favored 'General case' 0 CA--C 1.536 0.416 0 CA-C-N 119.331 0.969 . . . . 0.0 112.275 -159.734 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 56' ' ' GLY . . . . . . . . . . . . . . . 75.06 4.66 73.25 Favored Glycine 0 CA--C 1.532 1.124 0 O-C-N 121.451 -0.781 . . . . 0.0 112.237 -165.792 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 57' ' ' GLU . . . . . . . . . . . . . 33.2 tt0 -121.03 131.24 54.16 Favored 'General case' 0 C--O 1.234 0.28 0 CA-C-N 118.443 1.121 . . . . 0.0 108.698 -169.052 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 58' ' ' LEU . . . . . . . . . . . . . 47.0 tp -116.65 98.64 6.64 Favored 'General case' 0 C--O 1.236 0.352 0 C-N-CA 124.814 1.246 . . . . 0.0 108.864 173.713 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 59' ' ' THR . . . . . . . . . . . . . 2.1 p -85.34 169.73 13.44 Favored 'General case' 0 C--N 1.327 -0.379 0 C-N-CA 123.961 0.904 . . . . 0.0 111.945 172.492 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 60' ' ' ALA . . . . . . . . . . . . . . . -142.94 103.76 4.22 Favored 'General case' 0 N--CA 1.455 -0.18 0 C-N-CA 125.995 1.718 . . . . 0.0 109.437 148.567 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 61' ' ' LYS . . . . . . . . . . . . . 45.5 tttt -69.23 -18.45 63.88 Favored 'General case' 0 CA--C 1.542 0.672 0 CA-C-O 118.892 -0.575 . . . . 0.0 111.988 173.598 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 62' ' ' GLY . . . . . . . . . . . . . . . -102.84 -83.85 1.75 Allowed Glycine 0 CA--C 1.526 0.73 0 C-N-CA 124.521 1.058 . . . . 0.0 110.764 176.382 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 63' ' ' LEU . . . . . . . . . . . . . 2.4 tp 65.03 79.06 0.26 Allowed 'General case' 0 N--CA 1.448 -0.546 0 C-N-CA 129.442 3.097 . . . . 0.0 114.379 -178.003 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 64' ' ' ALA . . . . . . . . . . . . . . . -70.09 92.65 0.76 Allowed 'General case' 0 CA--C 1.539 0.525 0 C-N-CA 125.121 1.368 . . . . 0.0 112.367 178.591 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 65' ' ' MET . . . . . . . . . . . . . 52.8 mtp -99.22 173.81 6.61 Favored 'General case' 0 N--CA 1.472 0.628 0 C-N-CA 124.649 1.18 . . . . 0.0 111.45 176.205 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 66' ' ' THR . . . . . . . . . . . . . 5.5 p -115.76 -164.84 0.98 Allowed 'General case' 0 CA--C 1.547 0.836 0 C-N-CA 124.725 1.21 . . . . 0.0 112.104 -178.429 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 67' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -141.26 31.53 1.73 Allowed 'General case' 0 N--CA 1.474 0.772 0 C-N-CA 126.449 1.9 . . . . 0.0 112.332 -173.265 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 68' ' ' MET . . . . . . . . . . . . . 76.6 mtm -76.71 179.97 5.72 Favored 'General case' 0 CA--C 1.545 0.785 0 C-N-CA 125.302 1.441 . . . . 0.0 109.969 173.079 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 69' ' ' MET . . . . . . . . . . . . . 1.5 mpp? -110.91 168.63 9.34 Favored 'General case' 0 C--O 1.237 0.417 0 C-N-CA 128.415 2.686 . . . . 0.0 109.702 172.915 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 70' ' ' CYS . . . . . 1.282 ' SG ' ' SG ' ' A' ' 44' ' ' CYS . 1.7 m -140.12 150.26 44.05 Favored 'General case' 0 N--CA 1.469 0.487 0 C-N-CA 125.161 1.384 . . . . 0.0 112.427 176.522 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 71' ' ' ALA . . . . . . . . . . . . . . . -70.29 -10.96 60.47 Favored 'General case' 0 CA--C 1.534 0.354 0 C-N-CA 126.039 1.736 . . . . 0.0 114.91 -174.443 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 72' ' ' ASN . . . . . . . . . . . . . 61.3 t30 -135.67 142.53 41.22 Favored Pre-proline 0 C--O 1.235 0.303 0 N-CA-C 105.756 -1.942 . . . . 0.0 105.756 177.716 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 73' ' ' PRO . . . . . . . . . . . . . 87.2 Cg_endo -84.56 -23.95 2.55 Favored 'Trans proline' 0 N--CA 1.458 -0.575 0 CA-C-N 120.536 1.227 . . . . 0.0 111.384 -163.862 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 74' ' ' GLN . . . . . . . . . . . . . 57.4 tt0 -60.06 -43.63 95.29 Favored 'General case' 0 N--CA 1.452 -0.332 0 C-N-CA 123.574 0.75 . . . . 0.0 109.004 175.311 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 75' ' ' LEU . . . . . . . . . . . . . 65.3 mt -59.25 -45.91 89.91 Favored 'General case' 0 C--N 1.341 0.199 0 CA-C-N 118.213 0.461 . . . . 0.0 110.309 178.726 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 76' ' ' ASN . . . . . . . . . . . . . 27.2 t-20 -64.83 -49.63 69.85 Favored 'General case' 0 C--O 1.222 -0.368 0 N-CA-C 108.892 -0.781 . . . . 0.0 108.892 -176.768 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 77' ' ' GLU . . . . . . . . . . . . . 8.4 tt0 -56.61 -34.5 67.29 Favored 'General case' 0 CA--C 1.537 0.471 0 C-N-CA 125.392 1.477 . . . . 0.0 112.754 -178.961 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 78' ' ' LEU . . . . . . . . . . . . . 3.5 mp -67.51 -14.01 62.56 Favored 'General case' 0 C--O 1.236 0.348 0 C-N-CA 125.056 1.343 . . . . 0.0 112.758 -179.574 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 79' ' ' ASP . . . . . . . . . . . . . 5.0 p-10 -60.23 -38.0 82.05 Favored 'General case' 0 CA--C 1.52 -0.196 0 CA-C-N 119.217 0.917 . . . . 0.0 111.531 176.355 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 80' ' ' ASN . . . . . . . . . . . . . 63.3 m-20 -77.26 -38.81 50.17 Favored 'General case' 0 N--CA 1.445 -0.675 0 CA-C-O 118.11 -0.948 . . . . 0.0 109.999 178.02 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 81' ' ' THR . . . . . . . . . . . . . 41.7 m -54.62 -52.76 61.22 Favored 'General case' 0 C--N 1.341 0.199 0 CA-C-N 118.983 0.81 . . . . 0.0 109.73 179.336 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 82' ' ' ILE . . . . . . . . . . . . . 9.6 tp -65.63 -36.89 78.69 Favored 'Isoleucine or valine' 0 CA--C 1.531 0.216 0 CA-C-N 118.842 0.746 . . . . 0.0 110.273 -175.182 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 83' ' ' SER . . . . . . . . . . . . . 10.8 t -58.11 -49.33 77.32 Favored 'General case' 0 C--O 1.234 0.269 0 CA-C-N 117.994 0.361 . . . . 0.0 110.897 174.819 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 84' ' ' GLU . . . . . . . . . . . . . 78.1 tt0 -78.18 -7.64 57.32 Favored 'General case' 0 C--N 1.327 -0.411 0 C-N-CA 126.593 1.957 . . . . 0.0 111.62 -175.557 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 85' ' ' MET . . . . . . . . . . . . . 81.5 mtp -90.28 -52.19 5.06 Favored 'General case' 0 CA--C 1.515 -0.371 0 CA-C-N 120.999 1.727 . . . . 0.0 110.373 167.243 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 86' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -66.47 -29.67 69.85 Favored 'General case' 0 N--CA 1.453 -0.293 0 CA-C-O 118.816 -0.612 . . . . 0.0 110.882 -169.387 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 87' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -58.84 -56.82 17.29 Favored 'General case' 0 N--CA 1.452 -0.357 0 CA-C-N 119.345 0.975 . . . . 0.0 112.405 -171.933 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 88' ' ' GLU . . . . . . . . . . . . . 81.1 mt-10 -73.39 -34.98 65.81 Favored 'General case' 0 C--N 1.331 -0.204 0 C-N-CA 123.137 0.575 . . . . 0.0 110.855 -175.327 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 89' ' ' GLY . . . . . . . . . . . . . . . 123.13 104.35 1.71 Allowed Glycine 0 C--N 1.333 0.365 0 N-CA-C 107.373 -2.291 . . . . 0.0 107.373 -176.108 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 90' ' ' ALA . . . . . . . . . . . . . . . -74.96 137.15 41.42 Favored 'General case' 0 N--CA 1.451 -0.424 0 N-CA-C 107.873 -1.158 . . . . 0.0 107.873 170.768 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 91' ' ' GLN . . . . . . . . . . . . . 17.9 mp0 -65.83 121.98 16.28 Favored 'General case' 0 N--CA 1.442 -0.844 0 N-CA-C 104.738 -2.319 . . . . 0.0 104.738 159.369 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 92' ' ' VAL . . . . . . . . . . . . . 25.2 t -107.33 119.91 57.76 Favored 'Isoleucine or valine' 0 N--CA 1.44 -0.968 0 N-CA-C 104.83 -2.285 . . . . 0.0 104.83 174.229 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 93' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -134.33 104.04 5.98 Favored 'General case' 0 N--CA 1.452 -0.338 0 N-CA-C 107.049 -1.463 . . . . 0.0 107.049 176.773 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 94' ' ' LEU . . . . . . . . . . . . . 27.1 tp -98.2 118.49 34.95 Favored 'General case' 0 CA--C 1.515 -0.39 0 N-CA-C 106.823 -1.547 . . . . 0.0 106.823 173.854 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 95' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -80.71 -165.4 0.88 Allowed 'General case' 0 C--N 1.323 -0.569 0 C-N-CA 124.429 1.091 . . . . 0.0 109.494 165.846 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 96' ' ' ALA . . . . . . . . . . . . . . . -47.74 -52.13 19.67 Favored 'General case' 0 CA--C 1.541 0.633 0 O-C-N 120.524 -1.36 . . . . 0.0 113.143 -179.887 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 97' ' ' ASN . . . . . . . . . . . . . 0.0 OUTLIER -135.26 8.52 3.43 Favored 'General case' 0 N--CA 1.478 0.961 0 N-CA-C 114.05 1.129 . . . . 0.0 114.05 -177.942 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 98' ' ' GLN . . . . . . . . . . . . . 18.4 tt0 -136.79 124.78 22.79 Favored 'General case' 0 N--CA 1.453 -0.294 0 O-C-N 121.233 -0.917 . . . . 0.0 109.371 -170.111 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 99' ' ' LEU . . . . . . . . . . . . . 1.0 OUTLIER -88.45 142.24 27.88 Favored 'General case' 0 N--CA 1.449 -0.515 0 C-N-CA 125.453 1.501 . . . . 0.0 109.229 175.521 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 100' ' ' THR . . . . . . . . . . . . . 79.3 m -122.99 115.55 22.07 Favored 'General case' 0 C--N 1.322 -0.622 0 N-CA-C 105.436 -2.061 . . . . 0.0 105.436 171.685 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 101' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -112.93 101.35 9.41 Favored 'General case' 0 CA--C 1.51 -0.585 0 C-N-CA 126.109 1.764 . . . . 0.0 107.153 -179.05 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 102' ' ' ALA . . . . . . . . . . . . . . . -117.69 152.49 35.12 Favored 'General case' 0 C--N 1.326 -0.444 0 C-N-CA 123.284 0.634 . . . . 0.0 109.59 -177.622 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 103' ' ' THR . . . . . . . . . . . . . 0.4 OUTLIER -159.09 176.12 12.66 Favored 'General case' 0 N--CA 1.44 -0.97 0 C-N-CA 126.481 1.912 . . . . 0.0 106.659 176.147 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 104' ' ' ALA . . . . . . . . . . . . . . . -62.58 -14.01 37.82 Favored 'General case' 0 CA--C 1.536 0.424 0 N-CA-C 113.338 0.866 . . . . 0.0 113.338 173.669 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 105' ' ' LYS . . . . . . . . . . . . . 12.6 tppt? -73.79 -75.76 0.14 Allowed 'General case' 0 N--CA 1.437 -1.084 0 C-N-CA 125.302 1.441 . . . . 0.0 107.461 176.154 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 106' ' ' GLN . . . . . . . . . . . . . 14.5 mt-30 -165.27 178.78 6.66 Favored 'General case' 0 CA--C 1.542 0.646 0 C-N-CA 128.605 2.762 . . . . 0.0 104.834 -169.213 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 107' ' ' THR . . . . . . . . . . . . . 4.6 t -131.42 141.85 49.92 Favored 'General case' 0 CA--C 1.539 0.547 0 C-N-CA 124.796 1.238 . . . . 0.0 110.237 -173.533 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 108' ' ' LEU . . . . . . . . . . . . . 8.9 mp -126.21 154.34 43.41 Favored 'General case' 0 C--O 1.234 0.265 0 C-N-CA 128.419 2.687 . . . . 0.0 108.596 -171.146 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 109' ' ' THR . . . . . . . . . . . . . 27.2 m -123.01 117.74 26.17 Favored 'General case' 0 N--CA 1.466 0.363 0 C-N-CA 123.409 0.684 . . . . 0.0 109.238 173.911 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 110' ' ' TYR . . . . . . . . . . . . . 73.9 m-85 -108.86 160.72 15.76 Favored 'General case' 0 CA--C 1.539 0.523 0 C-N-CA 123.461 0.704 . . . . 0.0 109.508 174.772 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 111' ' ' LYS . . . . . . . . . . . . . 2.1 tppt? -114.83 147.69 39.5 Favored 'General case' 0 N--CA 1.467 0.413 0 C-N-CA 124.603 1.161 . . . . 0.0 110.068 -178.944 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 112' ' ' LEU . . . . . . . . . . . . . 23.9 tp -73.43 38.33 0.09 Allowed 'General case' 0 CA--C 1.542 0.654 0 C-N-CA 127.379 2.272 . . . . 0.0 111.871 171.76 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 113' ' ' ALA . . . . . . . . . . . . . . . -77.05 88.06 3.56 Favored 'General case' 0 C--N 1.324 -0.535 0 O-C-N 119.234 -2.166 . . . . 0.0 109.453 -176.878 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 114' ' ' ASP . . . . . . . . . . . . 0.31 29.8 p-10 . . . . . 0 N--CA 1.464 0.264 0 CA-C-O 123.712 1.72 . . . . 0.0 113.324 -173.134 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 24.6 tpp . . . . . 0 C--O 1.24 0.597 0 N-CA-C 108.895 -0.78 . . . . 0.0 108.895 . . . . . . . . . 0 0 . 1 . 017 nuclear orig core ' A' A ' 2' ' ' VAL . . . . . . . . . . . . . 10.0 p -53.9 118.71 1.25 Allowed 'Isoleucine or valine' 0 N--CA 1.449 -0.485 0 C-N-CA 123.884 0.873 . . . . 0.0 109.128 -178.016 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 3' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -128.56 157.53 74.71 Favored Pre-proline 0 N--CA 1.449 -0.501 0 N-CA-C 109.287 -0.634 . . . . 0.0 109.287 -167.776 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 4' ' ' PRO . . . . . . . . . . . . . 21.7 Cg_endo -63.62 -48.45 5.66 Favored 'Trans proline' 0 N--CA 1.456 -0.691 0 C-N-CA 122.74 2.293 . . . . 0.0 111.787 -176.469 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 5' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER -68.17 -12.66 61.32 Favored 'General case' 0 C--N 1.325 -0.491 0 N-CA-C 113.722 1.008 . . . . 0.0 113.722 -173.007 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 6' ' ' GLN . . . . . . . . . . . . . 11.1 pt20 -93.85 15.21 17.18 Favored 'General case' 0 CA--C 1.54 0.566 0 N-CA-C 113.908 1.077 . . . . 0.0 113.908 167.442 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 7' ' ' LEU . . . . . 0.406 ' C ' ' H ' ' A' ' 9' ' ' HIS . 90.6 mt -129.88 -44.76 1.18 Allowed 'General case' 0 N--CA 1.469 0.508 0 C-N-CA 124.569 1.148 . . . . 0.0 111.949 -175.639 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 8' ' ' GLN . . . . . . . . . . . . . 1.5 mp0 -56.64 2.32 0.02 OUTLIER 'General case' 0 N--CA 1.472 0.671 0 N-CA-C 118.353 2.723 . . . . 0.0 118.353 -176.059 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 9' ' ' HIS . . . . . 0.406 ' H ' ' C ' ' A' ' 7' ' ' LEU . 5.7 m-70 -139.66 10.58 2.46 Favored 'General case' 0 C--N 1.319 -0.739 0 C-N-CA 127.946 2.498 . . . . 0.0 112.516 179.95 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 10' ' ' HIS . . . . . . . . . . . . . 27.8 m-70 -133.25 110.54 10.17 Favored 'General case' 0 N--CA 1.455 -0.214 0 C-N-CA 124.153 0.981 . . . . 0.0 108.687 -161.462 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 11' ' ' ARG . . . . . . . . . . . . . 20.7 ttt-85 -68.74 147.11 52.28 Favored 'General case' 0 N--CA 1.465 0.315 0 N-CA-C 108.444 -0.947 . . . . 0.0 108.444 172.915 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 12' ' ' PHE . . . . . . . . . . . . . 46.5 m-85 -127.83 161.07 29.87 Favored 'General case' 0 N--CA 1.45 -0.448 0 N-CA-C 107.648 -1.242 . . . . 0.0 107.648 165.502 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 13' ' ' VAL . . . . . . . . . . . . . 7.5 p -131.44 143.17 41.33 Favored 'Isoleucine or valine' 0 CA--C 1.512 -0.484 0 N-CA-C 108.188 -1.041 . . . . 0.0 108.188 172.045 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 14' ' ' LEU . . . . . . . . . . . . . 5.6 tt -70.04 110.19 4.96 Favored 'General case' 0 N--CA 1.441 -0.903 0 N-CA-C 107.874 -1.158 . . . . 0.0 107.874 179.977 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 15' ' ' GLU . . . . . 0.403 ' H ' ' HA ' ' A' ' 110' ' ' TYR . 3.1 tt0 -86.0 -42.05 14.33 Favored 'General case' 0 N--CA 1.438 -1.043 0 O-C-N 124.013 0.821 . . . . 0.0 110.217 -169.371 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 12.6 p -154.33 142.81 20.66 Favored 'General case' 0 N--CA 1.448 -0.555 0 CA-C-O 121.735 0.779 . . . . 0.0 109.834 168.369 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 17' ' ' VAL . . . . . . . . . . . . . 23.2 t -75.62 175.08 0.76 Allowed 'Isoleucine or valine' 0 CA--C 1.536 0.409 0 N-CA-C 107.028 -1.471 . . . . 0.0 107.028 168.401 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 18' ' ' ASN . . . . . . . . . . . . . 10.6 t30 -43.9 -51.6 7.44 Favored 'General case' 0 C--N 1.34 0.194 0 C-N-CA 124.533 1.133 . . . . 0.0 112.628 -171.554 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . -78.29 -66.21 1.77 Allowed Glycine 0 N--CA 1.444 -0.812 0 O-C-N 123.725 0.641 . . . . 0.0 111.609 176.28 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 0.8 OUTLIER -139.68 165.75 29.06 Favored Pre-proline 0 CA--C 1.532 0.259 0 CA-C-N 117.752 0.776 . . . . 0.0 112.917 -159.126 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 21' ' ' PRO . . . . . . . . . . . . . 56.5 Cg_endo -61.46 -176.9 0.19 Allowed 'Trans proline' 0 N--CA 1.457 -0.654 0 C-N-CA 124.094 3.196 . . . . 0.0 113.185 176.627 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 22' ' ' VAL . . . . . . . . . . . . . 81.6 t -120.86 155.36 24.36 Favored 'Isoleucine or valine' 0 N--CA 1.448 -0.544 0 C-N-CA 126.576 1.95 . . . . 0.0 109.208 -179.227 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 23' ' ' THR . . . . . . . . . . . . . 11.3 t -141.17 114.36 8.63 Favored 'General case' 0 C--O 1.235 0.292 0 CA-C-O 123.259 1.504 . . . . 0.0 111.844 168.169 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 24' ' ' SER . . . . . . . . . . . . . 39.1 t -158.18 94.91 1.33 Allowed 'General case' 0 C--N 1.319 -0.74 0 N-CA-C 105.017 -2.216 . . . . 0.0 105.017 172.433 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 25' ' ' ASP . . . . . . . . . . . . . 0.7 OUTLIER -80.06 38.97 0.42 Allowed 'General case' 0 N--CA 1.468 0.451 0 C-N-CA 125.467 1.507 . . . . 0.0 110.552 -176.297 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 26' ' ' LYS . . . . . . . . . . . . . 33.0 ttpt -151.28 -46.73 0.11 Allowed 'General case' 0 CA--C 1.508 -0.654 0 O-C-N 120.268 -1.52 . . . . 0.0 112.083 178.181 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 27' ' ' ASN . . . . . . . . . . . . . 0.0 OUTLIER -150.79 83.27 5.8 Favored Pre-proline 0 C--N 1.319 -0.739 0 N-CA-C 106.708 -1.59 . . . . 0.0 106.708 176.644 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 28' ' ' PRO . . . . . . . . . . . . . 75.2 Cg_endo -71.19 170.74 17.48 Favored 'Trans proline' 0 N--CA 1.454 -0.83 0 C-N-CA 122.171 1.914 . . . . 0.0 109.257 167.561 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 29' ' ' PRO . . . . . . . . . . . . . 37.6 Cg_endo -70.85 63.91 2.43 Favored 'Trans proline' 0 N--CA 1.457 -0.656 0 C-N-CA 124.065 3.177 . . . . 0.0 111.063 173.469 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 30' ' ' GLU . . . . . . . . . . . . . 2.4 pt-20 -78.66 168.82 19.2 Favored 'General case' 0 C--O 1.239 0.505 0 O-C-N 120.09 -1.631 . . . . 0.0 109.2 172.608 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 31' ' ' ILE . . . . . . . . . . . . . 14.4 tt -144.16 152.68 15.62 Favored 'Isoleucine or valine' 0 C--O 1.237 0.434 0 N-CA-C 107.641 -1.244 . . . . 0.0 107.641 -177.202 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 32' ' ' SER . . . . . . . . . . . . . 41.1 p -147.09 165.89 28.55 Favored 'General case' 0 N--CA 1.444 -0.747 0 CA-C-O 121.666 0.746 . . . . 0.0 109.372 178.154 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 33' ' ' PHE . . . . . . . . . . . . . 78.5 m-85 -146.13 125.67 13.27 Favored 'General case' 0 N--CA 1.445 -0.713 0 N-CA-C 105.623 -1.992 . . . . 0.0 105.623 -168.373 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 34' ' ' GLY . . . . . . . . . . . . . . . -156.19 167.13 33.31 Favored Glycine 0 CA--C 1.53 1.02 0 N-CA-C 109.631 -1.387 . . . . 0.0 109.631 160.729 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 35' ' ' GLU . . . . . . . . . . . . . 4.6 mt-10 56.54 89.63 0.04 OUTLIER 'General case' 0 N--CA 1.468 0.438 0 C-N-CA 126.945 2.098 . . . . 0.0 113.869 168.641 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 44.3 mtmt 74.14 32.35 1.03 Allowed 'General case' 0 N--CA 1.474 0.769 0 C-N-CA 127.472 2.309 . . . . 0.0 113.204 176.097 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 37' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER 59.03 33.86 23.21 Favored 'General case' 0 CA--C 1.54 0.585 0 C-N-CA 123.791 0.836 . . . . 0.0 110.21 -176.931 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 38' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -67.5 171.38 6.22 Favored 'General case' 0 N--CA 1.453 -0.278 0 O-C-N 120.902 -1.124 . . . . 0.0 111.115 170.535 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 39' ' ' ILE . . . . . . . . . . . . . 27.6 mt -137.33 109.34 6.72 Favored 'Isoleucine or valine' 0 C--O 1.235 0.325 0 N-CA-C 108.061 -1.089 . . . . 0.0 108.061 -176.452 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 40' ' ' SER . . . . . . . . . . . . . 34.7 m -90.1 137.93 31.94 Favored 'General case' 0 C--N 1.33 -0.246 0 C-N-CA 123.601 0.76 . . . . 0.0 109.027 158.642 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 41' ' ' GLY . . . . . . . . . . . . . . . -160.6 -179.33 35.29 Favored Glycine 0 CA--C 1.525 0.668 0 N-CA-C 110.254 -1.139 . . . . 0.0 110.254 165.257 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 42' ' ' SER . . . . . . . . . . . . . 1.8 p -160.34 92.78 1.0 Allowed 'General case' 0 N--CA 1.454 -0.24 0 CA-C-N 118.841 1.32 . . . . 0.0 111.254 174.439 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 43' ' ' MET . . . . . . . . . . . . . 9.2 mmt -64.73 -66.94 0.48 Allowed 'General case' 0 C--O 1.232 0.149 0 N-CA-C 109.498 -0.556 . . . . 0.0 109.498 175.316 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 44' ' ' CYS . . . . . 1.283 ' SG ' ' SG ' ' A' ' 70' ' ' CYS . 44.8 t -132.72 -59.83 0.89 Allowed 'General case' 0 N--CA 1.452 -0.358 0 N-CA-C 106.426 -1.694 . . . . 0.0 106.426 168.449 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 45' ' ' ASN . . . . . . . . . . . . . 4.8 m120 -80.34 27.56 0.34 Allowed 'General case' 0 C--N 1.328 -0.329 0 C-N-CA 128.665 2.786 . . . . 0.0 112.064 -165.453 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 46' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER 52.55 -166.19 0.06 Allowed 'General case' 0 C--N 1.327 -0.41 0 C-N-CA 124.769 1.228 . . . . 0.0 108.021 -157.275 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 47' ' ' PHE . . . . . . . . . . . . . 6.3 p90 -178.42 170.43 1.69 Allowed 'General case' 0 C--O 1.237 0.446 0 C-N-CA 129.19 2.996 . . . . 0.0 107.984 147.616 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 48' ' ' SER . . . . . . . . . . . . . 1.5 p -166.1 160.63 16.53 Favored 'General case' 0 C--N 1.322 -0.6 0 C-N-CA 126.192 1.797 . . . . 0.0 108.751 178.153 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 49' ' ' GLY . . . . . . . . . . . . . . . 177.83 163.1 28.98 Favored Glycine 0 C--N 1.332 0.337 0 N-CA-C 110.721 -0.951 . . . . 0.0 110.721 163.16 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 50' ' ' GLU . . . . . . . . . . . . . 11.1 pt-20 -68.52 100.31 1.09 Allowed 'General case' 0 N--CA 1.449 -0.493 0 CA-C-O 122.048 0.928 . . . . 0.0 108.721 173.525 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 51' ' ' GLY . . . . . . . . . . . . . . . -77.04 171.88 55.14 Favored Glycine 0 CA--C 1.529 0.945 0 C-N-CA 124.224 0.916 . . . . 0.0 111.912 171.421 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 52' ' ' LYS . . . . . . . . . . . . . 6.2 ttpm? -156.9 148.62 22.57 Favored 'General case' 0 N--CA 1.464 0.247 0 C-N-CA 124.916 1.287 . . . . 0.0 108.066 166.444 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 53' ' ' LEU . . . . . . . . . . . . . 50.7 tp -148.37 142.65 26.18 Favored 'General case' 0 C--N 1.338 0.069 0 C-N-CA 124.512 1.125 . . . . 0.0 109.141 174.655 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 23.1 t -156.21 -61.88 0.1 Allowed 'General case' 0 CA--C 1.535 0.393 0 C-N-CA 125.389 1.475 . . . . 0.0 107.792 173.599 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 55' ' ' ASN . . . . . . . . . . . . . 20.7 p-10 -65.46 -58.67 5.25 Favored 'General case' 0 N--CA 1.464 0.265 0 C-N-CA 125.711 1.604 . . . . 0.0 113.016 177.818 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 56' ' ' GLY . . . . . . . . . . . . . . . 150.96 14.16 0.08 OUTLIER Glycine 0 CA--C 1.529 0.944 0 C-N-CA 123.489 0.566 . . . . 0.0 111.911 -163.573 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 57' ' ' GLU . . . . . . . . . . . . . 26.8 tt0 -131.96 115.84 16.37 Favored 'General case' 0 CA--C 1.533 0.29 0 CA-C-N 118.185 0.992 . . . . 0.0 109.146 -175.654 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 58' ' ' LEU . . . . . . . . . . . . . 37.8 tp -93.13 102.4 14.71 Favored 'General case' 0 C--O 1.236 0.366 0 C-N-CA 127.291 2.237 . . . . 0.0 110.159 -177.503 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 59' ' ' THR . . . . . . . . . . . . . 18.2 p -94.68 163.59 13.31 Favored 'General case' 0 CA--C 1.533 0.313 0 C-N-CA 122.945 0.498 . . . . 0.0 110.036 168.122 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 60' ' ' ALA . . . . . . . . . . . . . . . -147.24 103.48 3.58 Favored 'General case' 0 C--N 1.342 0.273 0 C-N-CA 123.673 0.789 . . . . 0.0 111.218 155.465 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 61' ' ' LYS . . . . . . . . . . . . . 73.6 tttt -86.47 77.62 9.4 Favored 'General case' 0 N--CA 1.463 0.18 0 C-N-CA 124.496 1.118 . . . . 0.0 109.48 178.201 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 62' ' ' GLY . . . . . . . . . . . . . . . 148.01 80.44 0.03 OUTLIER Glycine 0 N--CA 1.464 0.526 0 N-CA-C 110.161 -1.176 . . . . 0.0 110.161 175.14 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 63' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -117.47 83.22 1.95 Allowed 'General case' 0 N--CA 1.439 -0.98 0 C-N-CA 124.294 1.038 . . . . 0.0 110.065 -159.609 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 64' ' ' ALA . . . . . . . . . . . . . . . -77.68 96.17 4.79 Favored 'General case' 0 C--O 1.244 0.777 0 C-N-CA 126.034 1.733 . . . . 0.0 112.134 179.756 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 65' ' ' MET . . . . . . . . . . . . 0.259 6.5 ptm -124.61 172.3 9.35 Favored 'General case' 0 CA--C 1.531 0.235 0 C-N-CA 123.706 0.803 . . . . 0.0 109.787 170.611 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 66' ' ' THR . . . . . . . . . . . . . 15.8 p -104.85 -165.09 1.1 Allowed 'General case' 0 C--N 1.326 -0.455 0 C-N-CA 124.371 1.068 . . . . 0.0 109.503 -162.25 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 67' ' ' ARG . . . . . . . . . . . . . 0.5 OUTLIER -133.5 26.03 4.09 Favored 'General case' 0 C--O 1.237 0.404 0 C-N-CA 125.416 1.486 . . . . 0.0 112.075 -178.181 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 68' ' ' MET . . . . . . . . . . . . . 18.2 ptm -73.26 -169.68 0.67 Allowed 'General case' 0 CA--C 1.536 0.436 0 C-N-CA 125.321 1.448 . . . . 0.0 110.467 172.693 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 69' ' ' MET . . . . . . . . . . . . . 0.8 OUTLIER -142.6 -179.16 6.14 Favored 'General case' 0 C--O 1.238 0.49 0 C-N-CA 127.157 2.183 . . . . 0.0 109.03 -179.715 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 70' ' ' CYS . . . . . 1.283 ' SG ' ' SG ' ' A' ' 44' ' ' CYS . 70.0 m -149.21 163.71 36.86 Favored 'General case' 0 N--CA 1.455 -0.194 0 C-N-CA 124.417 1.087 . . . . 0.0 111.157 -176.581 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 71' ' ' ALA . . . . . . . . . . . . . . . -69.65 11.9 0.23 Allowed 'General case' 0 CA--C 1.54 0.592 0 C-N-CA 126.377 1.871 . . . . 0.0 113.874 178.214 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 72' ' ' ASN . . . . . . . . . . . . . 13.7 t30 -147.3 143.72 18.53 Favored Pre-proline 0 C--O 1.235 0.305 0 O-C-N 120.667 -1.27 . . . . 0.0 108.598 179.991 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 73' ' ' PRO . . . . . . . . . . . . . 68.1 Cg_endo -75.63 -25.42 10.92 Favored 'Trans proline' 0 N--CA 1.459 -0.556 0 C-N-CA 122.055 1.837 . . . . 0.0 111.601 179.919 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 74' ' ' GLN . . . . . . . . . . . . . 54.1 tt0 -70.13 -48.53 57.1 Favored 'General case' 0 N--CA 1.451 -0.385 0 C-N-CA 124.129 0.971 . . . . 0.0 109.606 -179.341 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 75' ' ' LEU . . . . . . . . . . . . . 41.5 mt -54.71 -45.15 73.97 Favored 'General case' 0 N--CA 1.471 0.612 0 CA-C-N 118.873 0.761 . . . . 0.0 109.149 174.528 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 76' ' ' ASN . . . . . . . . . . . . . 15.0 t-20 -61.07 -39.62 90.58 Favored 'General case' 0 CA--C 1.535 0.366 0 C-N-CA 124.236 1.015 . . . . 0.0 111.166 -175.787 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 77' ' ' GLU . . . . . . . . . . . . . 5.8 tm-20 -81.45 -30.8 33.33 Favored 'General case' 0 N--CA 1.455 -0.221 0 C-N-CA 125.721 1.608 . . . . 0.0 113.349 -177.889 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 78' ' ' LEU . . . . . . . . . . . . . 9.2 mt -61.12 -25.92 67.32 Favored 'General case' 0 N--CA 1.466 0.341 0 C-N-CA 123.231 0.612 . . . . 0.0 112.393 -179.796 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 79' ' ' ASP . . . . . . . . . . . . . 4.2 t70 -47.64 -49.56 26.94 Favored 'General case' 0 CA--C 1.517 -0.295 0 C-N-CA 125.912 1.685 . . . . 0.0 111.416 165.632 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 80' ' ' ASN . . . . . . . . . . . . . 2.7 m120 -74.34 -36.55 63.65 Favored 'General case' 0 N--CA 1.448 -0.568 0 CA-C-O 118.364 -0.827 . . . . 0.0 109.714 -175.234 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 81' ' ' THR . . . . . . . . . . . . . 89.9 m -54.11 -63.06 1.27 Allowed 'General case' 0 C--N 1.344 0.357 0 N-CA-C 108.054 -1.091 . . . . 0.0 108.054 172.152 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 82' ' ' ILE . . . . . . . . . . . . . 10.9 tp -65.76 -39.05 83.7 Favored 'Isoleucine or valine' 0 N--CA 1.449 -0.506 0 CA-C-O 118.97 -0.538 . . . . 0.0 110.433 -165.643 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 83' ' ' SER . . . . . . . . . . . . . 8.6 t -61.55 -49.37 76.95 Favored 'General case' 0 N--CA 1.447 -0.592 0 N-CA-C 109.312 -0.625 . . . . 0.0 109.312 -177.842 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 84' ' ' GLU . . . . . . . . . . . . . 3.6 tp10 -67.55 -22.38 65.41 Favored 'General case' 0 CA--C 1.537 0.455 0 C-N-CA 123.738 0.815 . . . . 0.0 111.856 179.813 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 85' ' ' MET . . . . . . . . . . . . . 7.1 ptm -87.6 -41.3 13.53 Favored 'General case' 0 CA--C 1.515 -0.388 0 N-CA-C 106.236 -1.765 . . . . 0.0 106.236 -171.691 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 86' ' ' LEU . . . . . . . . . . . . . 2.3 mm? -67.56 -25.57 65.86 Favored 'General case' 0 N--CA 1.439 -1.011 0 C-N-CA 119.272 -0.971 . . . . 0.0 111.926 -173.043 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 87' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -64.87 -53.95 38.62 Favored 'General case' 0 N--CA 1.448 -0.56 0 CA-C-O 118.799 -0.62 . . . . 0.0 110.785 -175.09 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 88' ' ' GLU . . . . . . . . . . . . . 12.4 pt-20 -71.49 -41.76 68.91 Favored 'General case' 0 C--O 1.234 0.255 0 CA-C-O 118.876 -0.583 . . . . 0.0 112.41 -176.092 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 89' ' ' GLY . . . . . . . . . . . . . . . 126.53 93.96 0.89 Allowed Glycine 0 C--N 1.334 0.457 0 N-CA-C 108.879 -1.689 . . . . 0.0 108.879 -173.405 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 90' ' ' ALA . . . . . . . . . . . . . . . -69.4 136.79 52.14 Favored 'General case' 0 N--CA 1.447 -0.612 0 N-CA-C 108.818 -0.808 . . . . 0.0 108.818 176.805 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 91' ' ' GLN . . . . . . . . . . . . . 29.0 mm-40 -74.89 92.71 2.57 Favored 'General case' 0 N--CA 1.446 -0.64 0 N-CA-C 105.011 -2.218 . . . . 0.0 105.011 177.974 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 92' ' ' VAL . . . . . . . . . . . . . 7.5 p -86.67 132.13 33.08 Favored 'Isoleucine or valine' 0 N--CA 1.443 -0.78 0 N-CA-C 106.007 -1.849 . . . . 0.0 106.007 179.955 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 93' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -137.61 152.43 49.35 Favored 'General case' 0 C--N 1.323 -0.559 0 N-CA-C 106.489 -1.671 . . . . 0.0 106.489 167.334 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 94' ' ' LEU . . . . . . . . . . . . . 54.1 tp -132.69 100.51 4.96 Favored 'General case' 0 CA--C 1.514 -0.429 0 CA-C-O 121.7 0.762 . . . . 0.0 108.968 -179.463 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 95' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -64.18 169.47 4.47 Favored 'General case' 0 C--N 1.323 -0.547 0 CA-C-N 113.718 -1.583 . . . . 0.0 109.831 164.099 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 96' ' ' ALA . . . . . . . . . . . . . . . -44.67 -24.54 0.2 Allowed 'General case' 0 N--CA 1.469 0.499 0 C-N-CA 127.952 2.501 . . . . 0.0 116.95 -170.93 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 97' ' ' ASN . . . . . . . . . . . . . 0.0 OUTLIER -155.39 6.71 0.24 Allowed 'General case' 0 CA--C 1.542 0.653 0 C-N-CA 126.551 1.94 . . . . 0.0 111.09 170.299 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 98' ' ' GLN . . . . . . . . . . . . . 25.7 tt0 -127.69 110.44 12.66 Favored 'General case' 0 N--CA 1.469 0.498 0 C-N-CA 125.383 1.473 . . . . 0.0 110.643 -170.382 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 99' ' ' LEU . . . . . . . . . . . . . 11.1 tp -75.01 143.72 43.44 Favored 'General case' 0 C--N 1.321 -0.667 0 C-N-CA 127.573 2.349 . . . . 0.0 108.037 173.606 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 100' ' ' THR . . . . . . . . . . . . . 4.6 m -132.81 118.91 19.58 Favored 'General case' 0 C--N 1.327 -0.378 0 N-CA-C 106.669 -1.604 . . . . 0.0 106.669 175.342 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 101' ' ' LEU . . . . . . . . . . . . . 2.7 mm? -115.59 111.08 20.14 Favored 'General case' 0 CA--C 1.513 -0.459 0 N-CA-C 106.099 -1.815 . . . . 0.0 106.099 174.521 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 102' ' ' ALA . . . . . . . . . . . . . . . -106.15 158.08 17.09 Favored 'General case' 0 C--N 1.326 -0.421 0 N-CA-C 108.331 -0.989 . . . . 0.0 108.331 162.775 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 103' ' ' THR . . . . . . . . . . . . . 1.8 m -157.09 -179.28 8.05 Favored 'General case' 0 N--CA 1.436 -1.163 0 N-CA-C 105.596 -2.002 . . . . 0.0 105.596 171.853 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 104' ' ' ALA . . . . . . . . . . . . . . . -50.6 -39.01 48.8 Favored 'General case' 0 N--CA 1.451 -0.394 0 C-N-CA 122.683 0.393 . . . . 0.0 111.379 172.14 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 105' ' ' LYS . . . . . . . . . . . . . 4.5 tmtt? -61.69 -67.19 0.43 Allowed 'General case' 0 CA--C 1.532 0.279 0 N-CA-C 114.56 1.318 . . . . 0.0 114.56 -177.67 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 106' ' ' GLN . . . . . . . . . . . . . 8.9 pt20 -167.01 -173.45 2.35 Favored 'General case' 0 C--O 1.238 0.474 0 C-N-CA 126.477 1.911 . . . . 0.0 107.997 -178.993 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 107' ' ' THR . . . . . . . . . . . . . 14.8 t -118.47 140.26 50.15 Favored 'General case' 0 CA--C 1.534 0.345 0 C-N-CA 123.314 0.645 . . . . 0.0 109.869 174.008 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 108' ' ' LEU . . . . . . . . . . . . . 53.5 mt -125.11 138.15 54.17 Favored 'General case' 0 C--O 1.236 0.348 0 C-N-CA 127.726 2.41 . . . . 0.0 106.521 -178.513 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 109' ' ' THR . . . . . . . . . . . . . 31.5 m -112.38 144.96 40.94 Favored 'General case' 0 C--O 1.235 0.3 0 N-CA-C 107.793 -1.188 . . . . 0.0 107.793 179.992 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 110' ' ' TYR . . . . . 0.403 ' HA ' ' H ' ' A' ' 15' ' ' GLU . 34.4 m-85 -130.5 172.77 11.54 Favored 'General case' 0 C--O 1.233 0.209 0 C-N-CA 123.987 0.915 . . . . 0.0 111.158 -178.918 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 111' ' ' LYS . . . . . . . . . . . . . 8.8 tppt? -125.79 143.87 50.88 Favored 'General case' 0 CA--C 1.514 -0.414 0 C-N-CA 124.885 1.274 . . . . 0.0 109.679 173.202 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 112' ' ' LEU . . . . . . . . . . . . . 43.7 tp -74.07 51.91 0.43 Allowed 'General case' 0 CA--C 1.539 0.535 0 C-N-CA 125.999 1.72 . . . . 0.0 108.93 165.159 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 113' ' ' ALA . . . . . . . . . . . . . . . -85.32 91.27 8.13 Favored 'General case' 0 N--CA 1.451 -0.406 0 O-C-N 119.84 -1.788 . . . . 0.0 106.421 170.238 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 114' ' ' ASP . . . . . . . . . . . . . 43.5 t0 . . . . . 0 CA--C 1.513 -0.457 0 CA-C-O 123.664 1.697 . . . . 0.0 109.243 -178.59 . . . . . . . . 0 0 . 1 . 018 nuclear orig core ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 29.5 ttm . . . . . 0 N--CA 1.452 -0.355 0 CA-C-O 121.157 0.503 . . . . 0.0 109.877 . . . . . . . . . 0 0 . 1 . 018 nuclear orig core ' A' A ' 2' ' ' VAL . . . . . . . . . . . . . 7.7 p -50.18 151.73 0.6 Allowed 'Isoleucine or valine' 0 CA--C 1.536 0.419 0 C-N-CA 127.377 2.271 . . . . 0.0 111.838 173.238 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 3' ' ' THR . . . . . . . . . . . . . 20.6 p -134.95 165.05 39.62 Favored Pre-proline 0 CA--C 1.533 0.316 0 C-N-CA 123.382 0.673 . . . . 0.0 110.581 177.468 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 4' ' ' PRO . . . . . . . . . . . . . 9.7 Cg_endo -58.28 -36.33 97.81 Favored 'Trans proline' 0 C--O 1.235 0.343 0 C-N-CA 122.999 2.466 . . . . 0.0 113.452 175.828 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 5' ' ' GLU . . . . . . . . . . . . . 0.2 OUTLIER -61.18 -44.29 97.53 Favored 'General case' 0 CA--C 1.538 0.505 0 C-N-CA 124.198 0.999 . . . . 0.0 111.765 -174.947 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 6' ' ' GLN . . . . . . . . . . . . . 15.7 pt20 -75.14 18.94 0.17 Allowed 'General case' 0 CA--C 1.542 0.642 0 C-N-CA 125.306 1.442 . . . . 0.0 112.573 177.279 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 7' ' ' LEU . . . . . . . . . . . . . 81.4 mt -136.71 -51.35 0.68 Allowed 'General case' 0 N--CA 1.469 0.485 0 CA-C-N 119.843 1.202 . . . . 0.0 113.073 -174.12 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 8' ' ' GLN . . . . . . . . . . . . . 0.2 OUTLIER -44.04 -28.75 0.51 Allowed 'General case' 0 N--CA 1.473 0.679 0 N-CA-C 115.712 1.745 . . . . 0.0 115.712 -176.16 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 9' ' ' HIS . . . . . . . . . . . . . 79.5 m-70 -131.43 32.27 4.22 Favored 'General case' 0 C--O 1.238 0.489 0 C-N-CA 123.392 0.677 . . . . 0.0 111.82 -173.562 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 10' ' ' HIS . . . . . . . . . . . . . 98.4 m-70 -129.34 113.67 15.25 Favored 'General case' 0 N--CA 1.452 -0.339 0 C-N-CA 124.995 1.318 . . . . 0.0 109.634 176.537 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 11' ' ' ARG . . . . . . . . . . . . . 17.0 ttt180 -69.64 150.09 47.4 Favored 'General case' 0 C--O 1.233 0.214 0 N-CA-C 108.678 -0.86 . . . . 0.0 108.678 166.511 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 12' ' ' PHE . . . . . . . . . . . . . 99.0 m-85 -138.89 157.98 45.05 Favored 'General case' 0 CA--C 1.503 -0.84 0 CA-C-O 123.994 1.854 . . . . 0.0 108.655 171.018 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 13' ' ' VAL . . . . . . . . . . . . . 0.0 OUTLIER -126.7 131.36 71.24 Favored 'Isoleucine or valine' 0 C--N 1.311 -1.103 0 CA-C-N 113.008 -1.906 . . . . 0.0 106.09 -176.358 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 14' ' ' LEU . . . . . . . . . . . . . 26.5 tp -65.64 102.61 0.75 Allowed 'General case' 0 CA--C 1.515 -0.375 0 N-CA-C 107.629 -1.248 . . . . 0.0 107.629 175.963 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -86.2 -52.87 5.38 Favored 'General case' 0 N--CA 1.443 -0.822 0 N-CA-C 107.652 -1.24 . . . . 0.0 107.652 -172.188 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -138.15 123.95 19.95 Favored 'General case' 0 C--O 1.235 0.33 0 CA-C-O 121.573 0.701 . . . . 0.0 110.248 -173.9 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 17' ' ' VAL . . . . . . . . . . . . . 11.3 t -75.86 170.52 1.47 Allowed 'Isoleucine or valine' 0 C--O 1.237 0.437 0 N-CA-C 107.621 -1.252 . . . . 0.0 107.621 172.847 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 18' ' ' ASN . . . . . . . . . . . . . 0.3 OUTLIER -58.17 -20.57 42.0 Favored 'General case' 0 CA--C 1.536 0.424 0 CA-C-O 117.873 -1.06 . . . . 0.0 112.896 168.475 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . -106.85 -64.53 0.61 Allowed Glycine 0 C--N 1.341 0.856 0 C-N-CA 125.491 1.52 . . . . 0.0 111.887 -174.896 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 25.1 mmtm -136.04 164.45 43.04 Favored Pre-proline 0 N--CA 1.469 0.495 0 CA-C-N 118.814 1.307 . . . . 0.0 110.55 -176.86 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 21' ' ' PRO . . . . . . . . . . . . . 57.2 Cg_endo -66.4 153.38 78.25 Favored 'Trans proline' 0 CA--C 1.537 0.659 0 N-CA-C 108.605 -1.344 . . . . 0.0 108.605 159.632 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 22' ' ' VAL . . . . . . . . . . . . . 11.7 t -89.51 158.4 2.96 Favored 'Isoleucine or valine' 0 C--O 1.24 0.601 0 N-CA-C 108.961 -0.755 . . . . 0.0 108.961 176.563 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 23' ' ' THR . . . . . . . . . . . . . 3.1 m -130.7 124.38 31.4 Favored 'General case' 0 CA--C 1.532 0.259 0 C-N-CA 125.143 1.377 . . . . 0.0 107.954 178.453 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 24' ' ' SER . . . . . . . . . . . . . 5.4 m -153.6 136.08 15.07 Favored 'General case' 0 N--CA 1.452 -0.331 0 C-N-CA 127.46 2.304 . . . . 0.0 106.921 -167.595 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 25' ' ' ASP . . . . . . . . . . . . . 2.9 t70 -47.95 -84.06 0.01 OUTLIER 'General case' 0 N--CA 1.472 0.634 0 C-N-CA 127.281 2.232 . . . . 0.0 110.266 -179.752 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 26' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -135.62 -1.36 2.53 Favored 'General case' 0 CA--C 1.531 0.214 0 C-N-CA 125.484 1.514 . . . . 0.0 112.753 173.923 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 27' ' ' ASN . . . . . . . . . . . . . 60.6 m-80 -115.62 81.25 8.92 Favored Pre-proline 0 CA--C 1.532 0.286 0 C-N-CA 126.092 1.757 . . . . 0.0 107.426 -179.038 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 28' ' ' PRO . . . . . . . . . . . . . 19.0 Cg_endo -68.76 169.09 18.36 Favored 'Trans proline' 0 CA--C 1.534 0.506 0 C-N-CA 123.067 2.511 . . . . 0.0 113.659 177.093 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 29' ' ' PRO . . . . . . . . . . . . . 13.6 Cg_endo -62.43 109.91 0.96 Allowed 'Trans proline' 0 N--CA 1.449 -1.131 0 N-CA-C 107.226 -1.875 . . . . 0.0 107.226 145.763 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 30' ' ' GLU . . . . . . . . . . . . . 10.4 pt-20 -130.21 165.04 23.2 Favored 'General case' 0 C--N 1.318 -0.767 0 C-N-CA 127.996 2.519 . . . . 0.0 106.046 175.847 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 31' ' ' ILE . . . . . . . . . . . . . 20.3 tt -145.47 146.13 19.88 Favored 'Isoleucine or valine' 0 N--CA 1.447 -0.609 0 C-N-CA 125.556 1.542 . . . . 0.0 107.189 -177.401 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 32' ' ' SER . . . . . . . . . . . . . 27.5 p -133.07 172.85 12.09 Favored 'General case' 0 N--CA 1.441 -0.905 0 C-N-CA 126.022 1.729 . . . . 0.0 107.373 168.223 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 33' ' ' PHE . . . . . . . . . . . . . 98.8 m-85 -137.13 -173.22 3.4 Favored 'General case' 0 N--CA 1.448 -0.535 0 N-CA-C 107.919 -1.141 . . . . 0.0 107.919 -174.663 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 34' ' ' GLY . . . . . . . . . . . . . . . 176.42 -160.43 28.05 Favored Glycine 0 N--CA 1.451 -0.333 0 N-CA-C 109.385 -1.486 . . . . 0.0 109.385 170.545 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 35' ' ' GLU . . . . . . . . . . . . . 1.9 tt0 -52.95 154.25 2.98 Favored 'General case' 0 N--CA 1.448 -0.56 0 C-N-CA 125.016 1.326 . . . . 0.0 111.84 -167.894 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 11.7 mtpt 52.78 26.99 4.92 Favored 'General case' 0 CA--C 1.536 0.423 0 CA-C-O 117.956 -1.021 . . . . 0.0 112.195 -169.193 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 37' ' ' MET . . . . . . . . . . . . . 31.4 mmm 54.95 26.48 7.99 Favored 'General case' 0 CA--C 1.542 0.659 0 C-N-CA 124.823 1.249 . . . . 0.0 111.14 -174.95 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 38' ' ' MET . . . . . . . . . . . . . 25.3 mmm -56.0 155.69 6.09 Favored 'General case' 0 CA--C 1.519 -0.213 0 O-C-N 121.055 -1.028 . . . . 0.0 110.444 175.521 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 39' ' ' ILE . . . . . . . . . . . . . 10.4 mt -123.91 135.61 62.96 Favored 'Isoleucine or valine' 0 N--CA 1.449 -0.511 0 C-N-CA 124.793 1.237 . . . . 0.0 107.815 -175.073 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 40' ' ' SER . . . . . . . . . . . . . 66.6 m -131.04 121.09 24.42 Favored 'General case' 0 N--CA 1.45 -0.437 0 N-CA-C 106.495 -1.669 . . . . 0.0 106.495 169.233 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 41' ' ' GLY . . . . . . . . . . . . . . . -164.82 165.2 37.43 Favored Glycine 0 C--O 1.237 0.291 0 N-CA-C 108.994 -1.642 . . . . 0.0 108.994 179.331 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 42' ' ' SER . . . . . 0.461 ' HA ' ' HA ' ' A' ' 46' ' ' ARG . 92.0 p -157.56 108.41 2.26 Favored 'General case' 0 N--CA 1.444 -0.752 0 CA-C-N 117.596 0.698 . . . . 0.0 111.681 -176.667 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 43' ' ' MET . . . . . . . . . . . . . 7.2 mmt -87.4 -58.43 2.58 Favored 'General case' 0 N--CA 1.451 -0.401 0 C-N-CA 124.121 0.968 . . . . 0.0 109.322 -177.533 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 44' ' ' CYS . . . . . 1.301 ' SG ' ' SG ' ' A' ' 70' ' ' CYS . 43.6 t -155.29 -19.11 0.11 Allowed 'General case' 0 CA--C 1.535 0.379 0 N-CA-C 112.442 0.534 . . . . 0.0 112.442 -179.406 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 45' ' ' ASN . . . . . . . . . . . . . 2.8 m-80 -125.95 16.36 7.96 Favored 'General case' 0 N--CA 1.473 0.687 0 C-N-CA 125.997 1.719 . . . . 0.0 109.413 179.68 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 46' ' ' ARG . . . . . 0.461 ' HA ' ' HA ' ' A' ' 42' ' ' SER 0.376 6.0 ptt180 44.05 -172.48 0.01 OUTLIER 'General case' 0 CA--C 1.536 0.413 0 C-N-CA 127.469 2.308 . . . . 0.0 113.623 -161.956 . . . . . . . . 3 3 . 1 . 018 nuclear orig core ' A' A ' 47' ' ' PHE . . . . . . . . . . . . . 21.5 p90 -173.5 162.96 4.33 Favored 'General case' 0 N--CA 1.472 0.646 0 C-N-CA 125.672 1.589 . . . . 0.0 109.151 164.33 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 48' ' ' SER . . . . . . . . . . . . . 7.6 p -155.02 135.1 13.04 Favored 'General case' 0 N--CA 1.449 -0.512 0 C-N-CA 123.998 0.919 . . . . 0.0 108.649 178.134 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 49' ' ' GLY . . . . . . . . . . . . . . . -169.0 165.39 38.89 Favored Glycine 0 C--N 1.337 0.616 0 N-CA-C 110.014 -1.234 . . . . 0.0 110.014 171.519 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 50' ' ' GLU . . . . . . . . . . . . . 2.4 pt-20 -83.48 103.17 12.62 Favored 'General case' 0 N--CA 1.442 -0.867 0 CA-C-O 122.619 1.199 . . . . 0.0 108.796 178.588 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 51' ' ' GLY . . . . . . . . . . . . . . . -58.23 174.97 2.47 Favored Glycine 0 CA--C 1.539 1.559 0 CA-C-N 114.647 -1.16 . . . . 0.0 111.112 163.223 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 52' ' ' LYS . . . . . . . . . . . . . 29.8 ttpt -142.71 159.01 43.06 Favored 'General case' 0 C--N 1.329 -0.315 0 N-CA-C 106.006 -1.85 . . . . 0.0 106.006 156.651 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 53' ' ' LEU . . . . . . . . . . . . . 49.5 tp -148.08 95.29 2.45 Favored 'General case' 0 N--CA 1.447 -0.62 0 N-CA-C 107.195 -1.409 . . . . 0.0 107.195 170.23 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 2.4 t -137.58 6.37 2.73 Favored 'General case' 0 CA--C 1.533 0.3 0 CA-C-N 115.498 -0.773 . . . . 0.0 111.196 174.627 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 55' ' ' ASN . . . . . . . . . . . . . 7.9 p-10 -142.74 -21.15 0.66 Allowed 'General case' 0 C--O 1.222 -0.394 0 CA-C-O 117.672 -1.156 . . . . 0.0 114.035 175.725 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 56' ' ' GLY . . . . . . . . . . . . . . . 119.28 7.92 9.72 Favored Glycine 0 CA--C 1.529 0.943 0 CA-C-N 119.29 0.95 . . . . 0.0 112.945 -172.099 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 57' ' ' GLU . . . . . . . . . . . . . 41.3 tt0 -127.16 128.37 46.04 Favored 'General case' 0 C--O 1.235 0.303 0 CA-C-N 118.841 1.32 . . . . 0.0 108.299 -173.836 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 58' ' ' LEU . . . . . . . . . . . . . 52.5 tp -100.42 94.25 6.06 Favored 'General case' 0 CA--C 1.531 0.216 0 C-N-CA 125.628 1.571 . . . . 0.0 108.924 177.505 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 59' ' ' THR . . . . . . . . . . . . . 40.8 p -91.42 146.51 23.75 Favored 'General case' 0 C--O 1.235 0.327 0 N-CA-C 108.129 -1.063 . . . . 0.0 108.129 162.745 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 60' ' ' ALA . . . . . . . . . . . . . . . -140.93 102.37 4.25 Favored 'General case' 0 C--N 1.334 -0.1 0 C-N-CA 124.491 1.116 . . . . 0.0 108.392 166.998 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 61' ' ' LYS . . . . . . . . . . . . . 49.6 mttp -65.4 -60.88 2.49 Favored 'General case' 0 N--CA 1.442 -0.837 0 C-N-CA 124.545 1.138 . . . . 0.0 111.856 -171.148 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 62' ' ' GLY . . . . . . . . . . . . . . . -55.35 -59.93 9.66 Favored Glycine 0 C--O 1.227 -0.282 0 C-N-CA 125.047 1.308 . . . . 0.0 111.262 -165.388 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 63' ' ' LEU . . . . . . . . . . . . . 3.8 tp 49.17 60.86 3.46 Favored 'General case' 0 N--CA 1.445 -0.696 0 C-N-CA 127.646 2.379 . . . . 0.0 113.817 168.962 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 64' ' ' ALA . . . . . . . . . . . . . . . -78.88 135.06 36.9 Favored 'General case' 0 C--N 1.324 -0.525 0 CA-C-N 115.845 -0.616 . . . . 0.0 111.192 -178.004 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 65' ' ' MET . . . . . . . . . . . . . 66.4 mtp -133.57 -175.17 3.73 Favored 'General case' 0 CA--C 1.547 0.84 0 C-N-CA 124.985 1.314 . . . . 0.0 111.288 -172.874 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 66' ' ' THR . . . . . . . . . . . . . 30.0 p -107.78 -164.81 1.0 Allowed 'General case' 0 N--CA 1.47 0.565 0 C-N-CA 127.604 2.361 . . . . 0.0 110.887 177.807 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 67' ' ' ARG . . . . . . . . . . . . . 2.1 mpp_? -132.81 87.44 2.41 Favored 'General case' 0 C--O 1.232 0.15 0 C-N-CA 126.821 2.048 . . . . 0.0 107.215 173.187 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 68' ' ' MET . . . . . . . . . . . . . 10.0 mtm -139.43 162.44 35.03 Favored 'General case' 0 N--CA 1.467 0.418 0 C-N-CA 123.878 0.871 . . . . 0.0 113.061 -173.017 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 69' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -119.01 164.17 15.87 Favored 'General case' 0 C--O 1.235 0.302 0 C-N-CA 127.492 2.317 . . . . 0.0 106.991 171.953 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 70' ' ' CYS . . . . . 1.301 ' SG ' ' SG ' ' A' ' 44' ' ' CYS . 57.5 m -140.36 23.89 2.32 Favored 'General case' 0 N--CA 1.474 0.733 0 C-N-CA 124.033 0.933 . . . . 0.0 112.73 -175.149 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 71' ' ' ALA . . . . . . . . . . . . . . . 54.6 -1.29 0.02 OUTLIER 'General case' 0 CA--C 1.511 -0.534 0 N-CA-C 117.586 2.439 . . . . 0.0 117.586 -176.602 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 72' ' ' ASN . . . . . . . . . . . . . 0.0 OUTLIER -138.58 144.05 40.64 Favored Pre-proline 0 N--CA 1.441 -0.913 0 CA-C-N 118.833 0.742 . . . . 0.0 109.512 167.928 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 73' ' ' PRO . . . . . . . . . . . . . 74.5 Cg_endo -74.97 -20.64 16.73 Favored 'Trans proline' 0 N--CA 1.45 -1.086 0 C-N-CA 121.944 1.763 . . . . 0.0 111.853 -178.056 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 74' ' ' GLN . . . . . . . . . . . . . 39.4 tt0 -58.54 -45.82 88.1 Favored 'General case' 0 CA--C 1.531 0.248 0 CA-C-N 120.606 1.548 . . . . 0.0 110.607 -177.184 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 75' ' ' LEU . . . . . . . . . . . . . 83.4 mt -66.75 -41.51 87.68 Favored 'General case' 0 CA--C 1.522 -0.117 0 C-N-CA 123.843 0.857 . . . . 0.0 110.122 175.911 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 76' ' ' ASN . . . . . . . . . . . . . 3.0 t-20 -59.79 -45.33 92.65 Favored 'General case' 0 C--O 1.219 -0.505 0 C-N-CA 124.052 0.941 . . . . 0.0 110.294 -177.403 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 77' ' ' GLU . . . . . . . . . . . . . 29.7 mt-10 -56.46 -43.01 79.13 Favored 'General case' 0 N--CA 1.448 -0.542 0 C-N-CA 125.508 1.523 . . . . 0.0 111.02 175.43 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 78' ' ' LEU . . . . . . . . . . . . . 0.7 OUTLIER -61.08 -32.05 71.71 Favored 'General case' 0 C--N 1.339 0.121 0 CA-C-O 118.253 -0.879 . . . . 0.0 112.355 -177.808 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 79' ' ' ASP . . . . . . . . . . . . . 0.0 OUTLIER -54.26 -39.82 67.2 Favored 'General case' 0 CA--C 1.535 0.398 0 C-N-CA 124.127 0.971 . . . . 0.0 112.902 174.311 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 80' ' ' ASN . . . . . . . . . . . . . 6.9 p30 -87.29 -37.8 16.86 Favored 'General case' 0 CA--C 1.518 -0.272 0 CA-C-N 119.001 0.819 . . . . 0.0 109.849 175.834 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 81' ' ' THR . . . . . . . . . . . . . 32.7 m -53.24 -54.44 36.14 Favored 'General case' 0 N--CA 1.455 -0.186 0 O-C-N 123.856 0.723 . . . . 0.0 109.18 -174.513 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 82' ' ' ILE . . . . . . . . . . . . . 10.7 tp -64.54 -32.94 59.87 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.475 0 C-N-CA 122.824 0.45 . . . . 0.0 111.356 -176.968 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 83' ' ' SER . . . . . . . . . . . . . 36.4 p -64.08 -53.41 50.24 Favored 'General case' 0 N--CA 1.443 -0.775 0 N-CA-C 109.647 -0.501 . . . . 0.0 109.647 -171.35 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 84' ' ' GLU . . . . . . . . . . . . . 2.4 tp10 -62.72 -42.08 99.47 Favored 'General case' 0 N--CA 1.449 -0.502 0 C-N-CA 124.734 1.213 . . . . 0.0 109.261 -176.421 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 85' ' ' MET . . . . . . . . . . . . . 78.9 mtp -60.28 -41.41 93.29 Favored 'General case' 0 C--N 1.343 0.323 0 C-N-CA 123.778 0.831 . . . . 0.0 110.18 179.141 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 86' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -80.44 -19.35 46.32 Favored 'General case' 0 C--N 1.332 -0.19 0 O-C-N 121.436 -0.79 . . . . 0.0 112.096 -176.657 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 87' ' ' LYS . . . . . . . . . . . . . 2.4 mptm? -76.46 -55.4 5.57 Favored 'General case' 0 N--CA 1.447 -0.584 0 CA-C-O 118.198 -0.906 . . . . 0.0 109.537 169.622 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 88' ' ' GLU . . . . . . . . . . . . . 21.1 pt-20 -69.06 -24.66 64.19 Favored 'General case' 0 CA--C 1.535 0.368 0 CA-C-N 118.768 0.713 . . . . 0.0 111.376 -177.004 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 89' ' ' GLY . . . . . . . . . . . . . . . 106.57 99.14 2.6 Favored Glycine 0 C--N 1.337 0.591 0 N-CA-C 110.106 -1.198 . . . . 0.0 110.106 174.848 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 90' ' ' ALA . . . . . . . . . . . . . . . -74.1 133.67 42.86 Favored 'General case' 0 N--CA 1.446 -0.665 0 C-N-CA 123.075 0.55 . . . . 0.0 110.158 -175.68 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 91' ' ' GLN . . . . . . . . . . . . . 1.8 mp0 -73.04 125.2 27.08 Favored 'General case' 0 N--CA 1.452 -0.356 0 N-CA-C 105.447 -2.057 . . . . 0.0 105.447 170.403 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 92' ' ' VAL . . . . . . . . . . . . . 25.5 t -122.21 126.72 74.7 Favored 'Isoleucine or valine' 0 N--CA 1.446 -0.628 0 N-CA-C 107.743 -1.206 . . . . 0.0 107.743 -174.579 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 93' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -135.38 80.7 1.85 Allowed 'General case' 0 N--CA 1.451 -0.376 0 N-CA-C 106.767 -1.568 . . . . 0.0 106.767 177.679 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 94' ' ' LEU . . . . . . . . . . . . . 1.6 tm? -84.75 102.79 13.29 Favored 'General case' 0 CA--C 1.514 -0.432 0 N-CA-C 107.433 -1.321 . . . . 0.0 107.433 173.726 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 95' ' ' THR . . . . . . . . . . . . . 1.1 m -82.58 177.71 8.57 Favored 'General case' 0 C--N 1.322 -0.611 0 CA-C-N 114.064 -1.425 . . . . 0.0 108.244 178.45 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 96' ' ' ALA . . . . . . . . . . . . . . . -52.62 -20.17 2.86 Favored 'General case' 0 CA--C 1.539 0.554 0 N-CA-C 114.574 1.324 . . . . 0.0 114.574 -173.607 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 97' ' ' ASN . . . . . . . . . . . . . 17.4 p30 -146.62 -10.15 0.47 Allowed 'General case' 0 N--CA 1.467 0.419 0 N-CA-C 116.553 2.057 . . . . 0.0 116.553 160.388 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 98' ' ' GLN . . . . . . . . . . . . . 6.2 tt0 -112.9 128.96 56.61 Favored 'General case' 0 N--CA 1.47 0.549 0 CA-C-N 122.092 2.223 . . . . 0.0 111.356 -178.526 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 99' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -84.24 122.97 29.62 Favored 'General case' 0 C--O 1.235 0.299 0 C-N-CA 125.012 1.325 . . . . 0.0 107.768 170.293 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 100' ' ' THR . . . . . . . . . . . . . 5.1 m -110.18 127.82 55.14 Favored 'General case' 0 C--N 1.326 -0.444 0 N-CA-C 107.239 -1.393 . . . . 0.0 107.239 171.52 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 101' ' ' LEU . . . . . . . . . . . . . 2.7 mm? -114.49 143.12 45.46 Favored 'General case' 0 CA--C 1.514 -0.431 0 C-N-CA 125.464 1.506 . . . . 0.0 108.959 172.353 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 102' ' ' ALA . . . . . . . . . . . . . . . -144.8 159.62 42.59 Favored 'General case' 0 C--O 1.235 0.303 0 C-N-CA 124.936 1.295 . . . . 0.0 108.432 161.693 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 103' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -160.61 174.83 13.42 Favored 'General case' 0 N--CA 1.443 -0.781 0 C-N-CA 126.308 1.843 . . . . 0.0 108.014 170.416 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 104' ' ' ALA . . . . . . . . . . . . . . . -62.25 -28.72 69.91 Favored 'General case' 0 C--O 1.235 0.296 0 O-C-N 121.743 -0.598 . . . . 0.0 111.588 176.395 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 105' ' ' LYS . . . . . . . . . . . . . 8.9 mmtm -69.58 -84.77 0.03 OUTLIER 'General case' 0 N--CA 1.45 -0.434 0 C-N-CA 123.505 0.722 . . . . 0.0 109.769 167.014 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 106' ' ' GLN . . . . . . . . . . . . . 23.3 mt-30 -141.37 -169.83 2.95 Favored 'General case' 0 C--N 1.328 -0.362 0 C-N-CA 123.656 0.782 . . . . 0.0 109.364 -158.711 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 107' ' ' THR . . . . . . . . . . . . . 1.1 t -149.69 147.31 27.92 Favored 'General case' 0 N--CA 1.45 -0.455 0 N-CA-C 106.287 -1.746 . . . . 0.0 106.287 -168.773 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 108' ' ' LEU . . . . . . . . . . . . . 36.8 mt -144.87 160.74 40.81 Favored 'General case' 0 N--CA 1.465 0.324 0 N-CA-C 107.634 -1.247 . . . . 0.0 107.634 -177.503 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 109' ' ' THR . . . . . . . . . . . . . 63.6 m -133.0 133.91 43.76 Favored 'General case' 0 C--O 1.236 0.353 0 N-CA-C 107.609 -1.256 . . . . 0.0 107.609 169.649 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 110' ' ' TYR . . . . . . . . . . . . . 19.1 m-85 -118.32 178.86 4.29 Favored 'General case' 0 C--O 1.236 0.345 0 C-N-CA 124.231 1.013 . . . . 0.0 108.981 178.77 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 111' ' ' LYS . . . . . . . . . . . . . 1.0 OUTLIER -139.13 138.83 37.35 Favored 'General case' 0 N--CA 1.455 -0.215 0 CA-C-O 118.02 -0.99 . . . . 0.0 110.879 178.045 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 112' ' ' LEU . . . . . . . . . . . . . 22.5 tp -60.53 19.68 0.01 OUTLIER 'General case' 0 CA--C 1.544 0.718 0 C-N-CA 131.309 3.843 . . . . 0.0 114.839 175.643 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 113' ' ' ALA . . . . . . . . . . . . . . . -67.82 84.59 0.21 Allowed 'General case' 0 CA--C 1.541 0.609 0 O-C-N 120.233 -1.542 . . . . 0.0 111.082 179.91 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 114' ' ' ASP . . . . . . . . . . . . . 23.4 t0 . . . . . 0 N--CA 1.47 0.541 0 CA-C-O 122.974 1.368 . . . . 0.0 110.791 -176.447 . . . . . . . . 0 0 . 1 . 019 nuclear orig core ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 C--O 1.237 0.429 0 N-CA-C 111.097 0.036 . . . . 0.0 111.097 . . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 2' ' ' VAL . . . . . 0.403 HG23 HE21 ' A' ' 6' ' ' GLN . 7.2 p -57.92 139.25 17.81 Favored 'Isoleucine or valine' 0 C--O 1.238 0.455 0 O-C-N 123.595 0.56 . . . . 0.0 110.063 175.834 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 3' ' ' THR . . . . . . . . . . . . . 0.8 OUTLIER -121.9 165.05 21.68 Favored Pre-proline 0 N--CA 1.448 -0.53 0 C-N-CA 124.01 0.924 . . . . 0.0 110.173 179.3 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 4' ' ' PRO . . . . . . . . . . . . . 18.3 Cg_endo -61.78 -50.63 4.99 Favored 'Trans proline' 0 N--CA 1.454 -0.832 0 C-N-CA 122.281 1.987 . . . . 0.0 111.133 174.338 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 5' ' ' GLU . . . . . . . . . . . . . 13.9 tt0 -55.01 -40.31 70.02 Favored 'General case' 0 CA--C 1.536 0.407 0 C-N-CA 124.244 1.018 . . . . 0.0 112.613 -168.513 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 6' ' ' GLN . . . . . 0.403 HE21 HG23 ' A' ' 2' ' ' VAL . 12.1 pt20 -73.14 14.65 0.28 Allowed 'General case' 0 CA--C 1.538 0.518 0 C-N-CA 125.433 1.493 . . . . 0.0 113.938 179.96 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 7' ' ' LEU . . . . . . . . . . . . . 88.6 mt -129.74 -46.29 1.16 Allowed 'General case' 0 C--N 1.34 0.168 0 C-N-CA 125.081 1.352 . . . . 0.0 110.478 -176.017 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 8' ' ' GLN . . . . . . . . . . . . . 2.3 mp0 -49.01 -15.34 0.1 Allowed 'General case' 0 N--CA 1.473 0.715 0 C-N-CA 127.078 2.151 . . . . 0.0 116.697 -178.944 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 9' ' ' HIS . . . . . . . . . . . . . 94.6 m-70 -130.23 13.5 5.62 Favored 'General case' 0 C--N 1.325 -0.473 0 C-N-CA 124.828 1.251 . . . . 0.0 112.492 -175.819 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 10' ' ' HIS . . . . . . . . . . . . . 46.9 m-70 -125.66 138.9 53.92 Favored 'General case' 0 C--O 1.238 0.462 0 C-N-CA 124.815 1.246 . . . . 0.0 107.987 -173.325 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 11' ' ' ARG . . . . . . . . . . . . . 21.6 ttt180 -95.0 146.7 24.07 Favored 'General case' 0 N--CA 1.465 0.279 0 C-N-CA 125.531 1.533 . . . . 0.0 109.754 174.277 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 12' ' ' PHE . . . . . . . . . . . . . 35.5 m-85 -134.26 156.14 48.93 Favored 'General case' 0 N--CA 1.441 -0.914 0 CA-C-O 123.675 1.702 . . . . 0.0 109.253 175.198 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 13' ' ' VAL . . . . . . . . . . . . . 0.0 OUTLIER -138.96 130.82 36.36 Favored 'Isoleucine or valine' 0 C--N 1.313 -1.002 0 CA-C-N 113.03 -1.895 . . . . 0.0 107.242 -172.713 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 14' ' ' LEU . . . . . . . . . . . . . 11.6 tp -64.86 102.72 0.62 Allowed 'General case' 0 N--CA 1.45 -0.475 0 N-CA-C 106.392 -1.707 . . . . 0.0 106.392 176.148 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 15' ' ' GLU . . . . . 0.488 ' HG3' ' HE2' ' A' ' 111' ' ' LYS . 1.3 tm-20 -85.33 -41.38 15.55 Favored 'General case' 0 N--CA 1.449 -0.495 0 N-CA-C 108.91 -0.774 . . . . 0.0 108.91 -173.826 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 5.8 p -151.92 142.71 22.91 Favored 'General case' 0 N--CA 1.442 -0.833 0 CA-C-O 122.442 1.115 . . . . 0.0 109.342 169.229 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 17' ' ' VAL . . . . . . . . . . . . . 2.2 t -70.22 175.86 0.57 Allowed 'Isoleucine or valine' 0 CA--C 1.54 0.582 0 N-CA-C 107.111 -1.44 . . . . 0.0 107.111 168.253 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 18' ' ' ASN . . . . . . . . . . . . . 0.6 OUTLIER -44.88 -24.01 0.18 Allowed 'General case' 0 CA--C 1.539 0.53 0 C-N-CA 127.473 2.309 . . . . 0.0 116.391 -172.467 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . -163.89 17.54 0.12 Allowed Glycine 0 CA--C 1.532 1.141 0 CA-C-O 118.356 -1.247 . . . . 0.0 113.413 170.512 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 40.9 mtmt -145.97 155.54 51.47 Favored Pre-proline 0 N--CA 1.469 0.523 0 CA-C-N 120.412 2.106 . . . . 0.0 109.519 -178.032 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 21' ' ' PRO . . . . . . . . . . . . . 80.9 Cg_endo -72.34 171.59 16.66 Favored 'Trans proline' 0 N--CA 1.45 -1.053 0 C-N-CA 122.118 1.879 . . . . 0.0 110.812 176.544 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 22' ' ' VAL . . . . . . . . . . . . . 3.8 p -120.1 165.37 15.58 Favored 'Isoleucine or valine' 0 CA--C 1.54 0.581 0 C-N-CA 124.349 1.059 . . . . 0.0 111.973 178.184 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 23' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -77.15 -175.8 3.78 Favored 'General case' 0 CA--C 1.545 0.778 0 C-N-CA 127.26 2.224 . . . . 0.0 112.503 -175.525 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 24' ' ' SER . . . . . . . . . . . . . 19.6 m 69.17 67.11 0.27 Allowed 'General case' 0 N--CA 1.452 -0.344 0 C-N-CA 128.995 2.918 . . . . 0.0 114.663 160.574 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 25' ' ' ASP . . . . . . . . . . . . . 6.5 m-20 -46.54 -38.9 10.03 Favored 'General case' 0 CA--C 1.538 0.483 0 C-N-CA 125.699 1.6 . . . . 0.0 113.308 176.324 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 26' ' ' LYS . . . . . . . . . . . . . 77.9 tttt -95.42 -17.9 21.15 Favored 'General case' 0 N--CA 1.466 0.335 0 O-C-N 120.874 -1.141 . . . . 0.0 112.501 -175.853 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 27' ' ' ASN . . . . . . . . . . . . . 4.1 p30 -150.44 69.62 8.83 Favored Pre-proline 0 CA--C 1.534 0.335 0 C-N-CA 124.136 0.974 . . . . 0.0 110.437 -177.015 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 28' ' ' PRO . . . . . . . . . . . . . 40.8 Cg_endo -65.38 162.49 33.38 Favored 'Trans proline' 0 N--CA 1.46 -0.5 0 C-N-CA 122.126 1.884 . . . . 0.0 111.279 -176.802 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 29' ' ' PRO . . . . . . . . . . . . . 18.6 Cg_endo -62.52 87.02 0.11 Allowed 'Trans proline' 0 N--CA 1.453 -0.873 0 C-N-CA 123.562 2.842 . . . . 0.0 109.416 160.211 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 30' ' ' GLU . . . . . . . . . . . . . 1.1 pt-20 -97.23 158.74 15.3 Favored 'General case' 0 N--CA 1.447 -0.576 0 C-N-CA 124.765 1.226 . . . . 0.0 108.292 173.504 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 31' ' ' ILE . . . . . . . . . . . . . 16.4 tt -139.06 137.09 42.36 Favored 'Isoleucine or valine' 0 N--CA 1.443 -0.777 0 N-CA-C 105.456 -2.053 . . . . 0.0 105.456 179.558 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 32' ' ' SER . . . . . . . . . . . . . 68.7 p -136.46 160.12 39.72 Favored 'General case' 0 C--N 1.321 -0.663 0 N-CA-C 106.804 -1.554 . . . . 0.0 106.804 170.151 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 33' ' ' PHE . . . . . . . . . . . . . 58.1 m-85 -118.38 164.67 14.89 Favored 'General case' 0 C--N 1.326 -0.445 0 N-CA-C 108.088 -1.078 . . . . 0.0 108.088 179.462 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 34' ' ' GLY . . . . . . . . . . . . . . . 167.91 142.4 3.47 Favored Glycine 0 N--CA 1.448 -0.542 0 N-CA-C 109.017 -1.633 . . . . 0.0 109.017 177.305 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 35' ' ' GLU . . . . . . . . . . . . . 0.3 OUTLIER 57.28 116.01 0.01 OUTLIER 'General case' 0 CA--C 1.537 0.461 0 C-N-CA 129.264 3.026 . . . . 0.0 114.481 168.947 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 8.6 mtmm 59.08 18.31 6.27 Favored 'General case' 0 N--CA 1.473 0.694 0 O-C-N 120.453 -1.404 . . . . 0.0 113.057 -173.091 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 37' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER 58.85 35.73 24.35 Favored 'General case' 0 CA--C 1.535 0.398 0 C-N-CA 124.843 1.257 . . . . 0.0 110.242 -174.163 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 38' ' ' MET . . . . . . . . . . . . . 9.2 mtp -69.05 164.49 22.32 Favored 'General case' 0 N--CA 1.45 -0.428 0 O-C-N 121.469 -0.77 . . . . 0.0 110.307 167.947 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 39' ' ' ILE . . . . . . . . . . . . . 9.3 mt -122.59 139.93 47.94 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.439 0 C-N-CA 126.485 1.914 . . . . 0.0 106.92 179.115 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 40' ' ' SER . . . . . . . . . . . . . 73.1 m -124.14 149.16 46.58 Favored 'General case' 0 N--CA 1.454 -0.239 0 C-N-CA 125.604 1.562 . . . . 0.0 108.364 163.223 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 41' ' ' GLY . . . . . . . . . . . . . . . 172.84 -178.8 44.69 Favored Glycine 0 CA--C 1.523 0.592 0 N-CA-C 109.221 -1.552 . . . . 0.0 109.221 172.199 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 42' ' ' SER . . . . . . . . . . . . . 40.4 t -142.0 154.61 45.14 Favored 'General case' 0 N--CA 1.449 -0.496 0 N-CA-C 107.303 -1.369 . . . . 0.0 107.303 162.569 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 43' ' ' MET . . . . . . . . . . . . . 14.9 mmt -107.03 -53.01 2.67 Favored 'General case' 0 N--CA 1.454 -0.247 0 N-CA-C 107.43 -1.322 . . . . 0.0 107.43 159.211 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 44' ' ' CYS . . . . . 1.298 ' SG ' ' SG ' ' A' ' 70' ' ' CYS . 12.7 t -151.06 -50.57 0.12 Allowed 'General case' 0 CA--C 1.534 0.338 0 N-CA-C 107.114 -1.439 . . . . 0.0 107.114 176.738 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 45' ' ' ASN . . . . . . . . . . . . . 14.1 m-80 -88.39 16.06 6.94 Favored 'General case' 0 CA--C 1.518 -0.25 0 C-N-CA 125.276 1.43 . . . . 0.0 113.967 -175.837 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 46' ' ' ARG . . . . . . . . . . . . . 3.9 mmt180 58.23 172.26 0.06 Allowed 'General case' 0 N--CA 1.465 0.277 0 C-N-CA 123.86 0.864 . . . . 0.0 110.459 -168.775 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 47' ' ' PHE . . . . . . . . . . . . . 48.7 p90 -163.59 172.35 14.47 Favored 'General case' 0 C--O 1.241 0.618 0 C-N-CA 123.841 0.856 . . . . 0.0 109.712 161.232 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 48' ' ' SER . . . . . . . . . . . . . 1.7 p -173.93 143.99 0.99 Allowed 'General case' 0 N--CA 1.449 -0.518 0 C-N-CA 124.898 1.279 . . . . 0.0 108.863 177.205 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 49' ' ' GLY . . . . . . . . . . . . . . . -176.91 169.83 42.35 Favored Glycine 0 CA--C 1.524 0.628 0 O-C-N 121.25 -0.906 . . . . 0.0 112.455 172.776 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 50' ' ' GLU . . . . . . . . . . . . . 17.3 mt-10 -72.31 94.83 1.64 Allowed 'General case' 0 N--CA 1.461 0.092 0 C-N-CA 124.922 1.289 . . . . 0.0 108.257 171.851 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 51' ' ' GLY . . . . . . . . . . . . . . . -58.98 -65.91 3.16 Favored Glycine 0 C--O 1.226 -0.385 0 C-N-CA 125.818 1.675 . . . . 0.0 113.193 -177.555 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 52' ' ' LYS . . . . . . . . . . . . . 2.5 ttmp? 70.57 138.48 0.04 OUTLIER 'General case' 0 C--N 1.326 -0.443 0 C-N-CA 128.041 2.537 . . . . 0.0 112.655 178.018 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 53' ' ' LEU . . . . . . . . . . . . . 24.8 tp -147.09 102.55 3.52 Favored 'General case' 0 C--O 1.236 0.347 0 C-N-CA 123.637 0.775 . . . . 0.0 109.801 179.734 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 2.0 t -153.09 19.48 0.57 Allowed 'General case' 0 CA--C 1.54 0.574 0 C-N-CA 123.775 0.83 . . . . 0.0 111.658 176.525 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 55' ' ' ASN . . . . . . . . . . . . . 11.9 p30 -146.03 3.69 0.94 Allowed 'General case' 0 N--CA 1.47 0.55 0 N-CA-C 113.847 1.055 . . . . 0.0 113.847 164.985 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 56' ' ' GLY . . . . . . . . . . . . . . . 95.68 16.14 40.51 Favored Glycine 0 CA--C 1.527 0.814 0 CA-C-N 119.495 1.043 . . . . 0.0 112.511 -175.695 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 57' ' ' GLU . . . . . . . . . . . . . 23.6 tt0 -136.04 156.67 48.38 Favored 'General case' 0 CA--C 1.537 0.472 0 C-N-CA 124.426 1.09 . . . . 0.0 108.331 -174.618 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 58' ' ' LEU . . . . . . . . . . . . . 38.9 tp -129.62 97.22 4.46 Favored 'General case' 0 CA--C 1.541 0.597 0 C-N-CA 125.182 1.393 . . . . 0.0 110.502 -173.109 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 59' ' ' THR . . . . . . . . . . . . . 2.7 p -113.07 104.99 12.93 Favored 'General case' 0 N--CA 1.474 0.746 0 C-N-CA 127.575 2.35 . . . . 0.0 112.203 -175.448 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 60' ' ' ALA . . . . . . . . . . . . . . . -72.73 126.05 28.97 Favored 'General case' 0 C--O 1.233 0.201 0 O-C-N 122.119 -0.363 . . . . 0.0 110.917 176.583 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 61' ' ' LYS . . . . . . . . . . . . . 16.2 ttpt -77.96 46.25 0.57 Allowed 'General case' 0 CA--C 1.543 0.692 0 C-N-CA 124.909 1.284 . . . . 0.0 113.68 -177.866 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 62' ' ' GLY . . . . . . . . . . . . . . . 134.33 -21.95 3.8 Favored Glycine 0 N--CA 1.474 1.207 0 O-C-N 120.708 -1.245 . . . . 0.0 114.84 170.732 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 63' ' ' LEU . . . . . . . . . . . . . 1.6 tp 44.89 80.06 0.04 OUTLIER 'General case' 0 CA--C 1.546 0.816 0 C-N-CA 128.008 2.523 . . . . 0.0 114.424 169.143 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 64' ' ' ALA . . . . . . . . . . . . . . . -65.18 100.03 0.42 Allowed 'General case' 0 CA--C 1.545 0.765 0 C-N-CA 127.166 2.187 . . . . 0.0 114.056 -175.132 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 65' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -108.55 175.3 5.51 Favored 'General case' 0 N--CA 1.484 1.263 0 C-N-CA 125.11 1.364 . . . . 0.0 111.433 -173.02 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 66' ' ' THR . . . . . . . . . . . . . 17.0 p -118.12 -165.65 1.13 Allowed 'General case' 0 N--CA 1.478 0.926 0 C-N-CA 126.146 1.778 . . . . 0.0 111.462 -177.618 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 67' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -142.79 75.99 1.51 Allowed 'General case' 0 N--CA 1.474 0.733 0 C-N-CA 125.463 1.505 . . . . 0.0 109.559 177.897 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 68' ' ' MET . . . . . . . . . . . . . 51.5 mtm -126.12 164.72 20.29 Favored 'General case' 0 C--N 1.326 -0.434 0 C-N-CA 129.592 3.157 . . . . 0.0 108.604 -179.423 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 69' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -113.63 163.32 15.12 Favored 'General case' 0 N--CA 1.449 -0.523 0 C-N-CA 126.246 1.819 . . . . 0.0 107.016 173.302 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 70' ' ' CYS . . . . . 1.298 ' SG ' ' SG ' ' A' ' 44' ' ' CYS . 0.5 OUTLIER -121.89 -6.94 9.01 Favored 'General case' 0 C--N 1.323 -0.548 0 C-N-CA 126.284 1.833 . . . . 0.0 114.276 -170.081 . . . . . . . . 3 3 . 1 . 019 nuclear orig core ' A' A ' 71' ' ' ALA . . . . . . . . . . . . . . . 61.17 4.2 0.84 Allowed 'General case' 0 CA--C 1.538 0.503 0 C-N-CA 125.361 1.464 . . . . 0.0 114.597 -172.403 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 72' ' ' ASN . . . . . . . . . . . . . 25.0 t30 -132.61 142.5 45.08 Favored Pre-proline 0 N--CA 1.472 0.641 0 CA-C-N 120.67 1.577 . . . . 0.0 108.575 160.457 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 73' ' ' PRO . . . . . . . . . . . . . 70.0 Cg_endo -79.25 -29.36 3.17 Favored 'Trans proline' 0 C--N 1.346 0.401 0 C-N-CA 122.124 1.883 . . . . 0.0 112.179 -169.986 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 74' ' ' GLN . . . . . . . . . . . . . 31.8 tt0 -60.52 -39.63 88.53 Favored 'General case' 0 C--O 1.221 -0.42 0 CA-C-N 116.691 -0.231 . . . . 0.0 110.419 -179.751 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 75' ' ' LEU . . . . . . . . . . . . . 69.5 mt -66.84 -37.73 85.03 Favored 'General case' 0 N--CA 1.467 0.399 0 O-C-N 121.834 -0.541 . . . . 0.0 109.895 174.328 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 76' ' ' ASN . . . . . . . . . . . . . 2.2 t-20 -64.52 -46.37 83.19 Favored 'General case' 0 C--O 1.22 -0.491 0 C-N-CA 125.182 1.393 . . . . 0.0 111.45 -177.663 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 77' ' ' GLU . . . . . . . . . . . . . 8.2 pt-20 -71.3 -30.2 65.95 Favored 'General case' 0 N--CA 1.468 0.455 0 CA-C-N 119.564 1.074 . . . . 0.0 111.935 177.237 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 78' ' ' LEU . . . . . . . . . . . . . 1.0 OUTLIER -61.09 -35.94 78.35 Favored 'General case' 0 C--N 1.329 -0.308 0 C-N-CA 124.13 0.972 . . . . 0.0 109.346 177.388 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 79' ' ' ASP . . . . . . . . . . . . . 0.0 OUTLIER -59.12 -29.03 67.09 Favored 'General case' 0 N--CA 1.463 0.188 0 C-N-CA 124.074 0.95 . . . . 0.0 112.489 173.603 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 80' ' ' ASN . . . . . . . . . . . . . 10.9 t30 -97.68 -20.04 17.87 Favored 'General case' 0 N--CA 1.452 -0.37 0 C-N-CA 124.082 0.953 . . . . 0.0 111.366 -178.842 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 81' ' ' THR . . . . . . . . . . . . . 20.4 m -69.8 -57.95 4.48 Favored 'General case' 0 N--CA 1.448 -0.545 0 N-CA-C 107.051 -1.462 . . . . 0.0 107.051 172.208 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 82' ' ' ILE . . . . . . . . . . . . . 8.9 tp -66.74 -39.91 84.81 Favored 'Isoleucine or valine' 0 N--CA 1.454 -0.269 0 C-N-CA 124.058 0.943 . . . . 0.0 111.333 -170.264 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 83' ' ' SER . . . . . . . . . . . . . 43.3 p -50.15 -49.23 52.78 Favored 'General case' 0 C--O 1.236 0.389 0 C-N-CA 124.542 1.137 . . . . 0.0 110.621 -176.141 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 84' ' ' GLU . . . . . . . . . . . . . 0.9 OUTLIER -70.94 -40.29 72.13 Favored 'General case' 0 N--CA 1.447 -0.582 0 CA-C-O 117.386 -1.293 . . . . 0.0 112.108 178.919 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 85' ' ' MET . . . . . . . . . . . . . 91.8 mtp -58.81 -41.37 86.61 Favored 'General case' 0 C--N 1.347 0.472 0 CA-C-N 120.94 1.7 . . . . 0.0 109.117 -176.279 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 86' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -77.56 -27.77 51.58 Favored 'General case' 0 C--O 1.232 0.179 0 C-N-CA 123.899 0.88 . . . . 0.0 112.043 -175.859 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 87' ' ' LYS . . . . . . . . . . . . . 64.5 mttt -76.34 -52.0 10.82 Favored 'General case' 0 N--CA 1.446 -0.672 0 N-CA-C 108.601 -0.888 . . . . 0.0 108.601 176.765 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 88' ' ' GLU . . . . . . . . . . . . . 18.0 mm-40 -51.19 -51.34 54.69 Favored 'General case' 0 CA--C 1.527 0.072 0 C-N-CA 125.242 1.417 . . . . 0.0 109.511 176.641 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 89' ' ' GLY . . . . . . . . . . . . . . . 106.67 133.16 7.28 Favored Glycine 0 C--N 1.335 0.523 0 N-CA-C 107.677 -2.169 . . . . 0.0 107.677 -166.653 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 90' ' ' ALA . . . . . . . . . . . . . . . -138.19 142.72 40.02 Favored 'General case' 0 CA--C 1.516 -0.35 0 C-N-CA 123.708 0.803 . . . . 0.0 109.695 -168.333 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 91' ' ' GLN . . . . . . . . . . . . . 6.0 mp0 -72.31 129.15 37.74 Favored 'General case' 0 N--CA 1.444 -0.775 0 N-CA-C 105.206 -2.146 . . . . 0.0 105.206 -177.098 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 92' ' ' VAL . . . . . . . . . . . . . 7.5 p -122.14 127.35 75.23 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.325 0 N-CA-C 106.947 -1.501 . . . . 0.0 106.947 -175.9 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 93' ' ' ASP . . . . . . . . . . . . . 0.8 OUTLIER -142.76 94.54 2.65 Favored 'General case' 0 C--O 1.234 0.253 0 N-CA-C 107.822 -1.177 . . . . 0.0 107.822 -173.452 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 94' ' ' LEU . . . . . . . . . . . . . 0.9 OUTLIER -99.45 102.65 14.28 Favored 'General case' 0 CA--C 1.515 -0.371 0 N-CA-C 107.069 -1.456 . . . . 0.0 107.069 176.043 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 95' ' ' THR . . . . . . . . . . . . . 5.8 t -78.02 -168.81 1.36 Allowed 'General case' 0 CA--C 1.536 0.407 0 O-C-N 125.043 1.465 . . . . 0.0 107.9 178.975 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 96' ' ' ALA . . . . . . . . . . . . . . . -53.15 -23.29 7.87 Favored 'General case' 0 CA--C 1.541 0.599 0 N-CA-C 114.041 1.126 . . . . 0.0 114.041 -175.075 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 97' ' ' ASN . . . . . . . . . . . . . 30.2 p30 -158.19 6.35 0.13 Allowed 'General case' 0 N--CA 1.473 0.697 0 N-CA-C 116.247 1.943 . . . . 0.0 116.247 164.757 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 98' ' ' GLN . . . . . . . . . . . . . 3.2 tt0 -121.6 130.53 53.56 Favored 'General case' 0 N--CA 1.471 0.6 0 CA-C-N 121.216 1.826 . . . . 0.0 110.743 -176.766 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 99' ' ' LEU . . . . . . . . . . . . . 14.5 tp -83.77 138.84 33.06 Favored 'General case' 0 C--O 1.232 0.168 0 O-C-N 121.523 -0.736 . . . . 0.0 110.145 171.768 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 100' ' ' THR . . . . . . . . . . . . . 28.8 m -120.74 120.14 34.78 Favored 'General case' 0 N--CA 1.448 -0.556 0 N-CA-C 105.773 -1.936 . . . . 0.0 105.773 159.433 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 101' ' ' LEU . . . . . . . . . . . . . 3.2 mm? -96.77 138.59 34.1 Favored 'General case' 0 CA--C 1.505 -0.753 0 N-CA-C 106.661 -1.607 . . . . 0.0 106.661 149.376 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 102' ' ' ALA . . . . . . . . . . . . . . . -131.98 154.04 49.72 Favored 'General case' 0 C--N 1.327 -0.411 0 N-CA-C 107.319 -1.363 . . . . 0.0 107.319 165.529 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 103' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -162.94 172.2 15.44 Favored 'General case' 0 N--CA 1.442 -0.845 0 C-N-CA 127.815 2.446 . . . . 0.0 107.891 176.274 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 104' ' ' ALA . . . . . . . . . . . . . . . -53.47 -29.97 38.52 Favored 'General case' 0 CA--C 1.537 0.471 0 C-N-CA 124.16 0.984 . . . . 0.0 113.103 174.94 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 105' ' ' LYS . . . . . . . . . . . . . 53.2 mmtt -70.7 -72.39 0.21 Allowed 'General case' 0 C--O 1.232 0.138 0 C-N-CA 123.61 0.764 . . . . 0.0 111.815 175.143 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 106' ' ' GLN . . . . . . . . . . . . . 2.6 pt20 -154.57 -168.48 2.93 Favored 'General case' 0 C--O 1.232 0.168 0 C-N-CA 123.49 0.716 . . . . 0.0 110.169 -178.983 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 107' ' ' THR . . . . . . . . . . . . . 7.2 t -130.64 152.91 49.49 Favored 'General case' 0 N--CA 1.446 -0.637 0 C-N-CA 126.284 1.834 . . . . 0.0 107.583 176.264 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 108' ' ' LEU . . . . . . . . . . . . . 3.5 mm? -121.63 166.29 14.47 Favored 'General case' 0 C--O 1.237 0.442 0 C-N-CA 125.193 1.397 . . . . 0.0 109.995 174.179 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 109' ' ' THR . . . . . . . . . . . . . 9.4 m -130.96 106.6 8.52 Favored 'General case' 0 N--CA 1.448 -0.565 0 N-CA-C 107.94 -1.133 . . . . 0.0 107.94 166.225 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 110' ' ' TYR . . . . . . . . . . . . . 49.6 m-85 -98.96 165.26 11.84 Favored 'General case' 0 C--O 1.235 0.308 0 N-CA-C 108.946 -0.761 . . . . 0.0 108.946 172.668 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 111' ' ' LYS . . . . . 0.488 ' HE2' ' HG3' ' A' ' 15' ' ' GLU . 5.0 tppt? -122.39 146.18 47.58 Favored 'General case' 0 C--O 1.226 -0.134 0 C-N-CA 124.249 1.02 . . . . 0.0 110.144 178.932 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 112' ' ' LEU . . . . . . . . . . . . . 26.1 tp -69.65 17.82 0.05 OUTLIER 'General case' 0 CA--C 1.546 0.795 0 C-N-CA 128.813 2.845 . . . . 0.0 113.519 -177.736 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 113' ' ' ALA . . . . . . . . . . . . . . . -60.54 90.19 0.02 OUTLIER 'General case' 0 CA--C 1.534 0.361 0 C-N-CA 126.023 1.729 . . . . 0.0 111.794 -168.397 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 114' ' ' ASP . . . . . . . . . . . . . 27.2 t0 . . . . . 0 CA--C 1.51 -0.592 0 CA-C-O 122.901 1.334 . . . . 0.0 111.494 -168.864 . . . . . . . . 0 0 . 1 . 001 nuclear orig full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 9.6 ttt . . . . . 0 C--O 1.234 0.252 0 N-CA-C 109.506 -0.553 . . . . 0.0 109.506 . . . . . . . . . 0 0 . 1 . 001 nuclear orig full ' A' A ' 2' ' ' VAL . . . . . . . . . . . . . 74.9 t -59.69 137.3 22.3 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.448 0 N-CA-C 108.382 -0.97 . . . . 0.0 108.382 173.403 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 3' ' ' THR . . . . . . . . . . . . . 0.1 OUTLIER -124.75 162.38 43.32 Favored Pre-proline 0 CA--C 1.537 0.444 0 C-N-CA 122.494 0.318 . . . . 0.0 110.98 177.107 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 4' ' ' PRO . . . . . . . . . . . . . 9.2 Cg_endo -71.22 -41.74 2.38 Favored 'Trans proline' 0 CA--C 1.532 0.41 0 C-N-CA 122.833 2.356 . . . . 0.0 112.58 -179.312 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 5' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -61.01 -44.59 97.19 Favored 'General case' 0 C--N 1.325 -0.48 0 C-N-CA 124.231 1.012 . . . . 0.0 110.576 -173.516 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 6' ' ' GLN . . . . . . . . . . . . . 12.7 pt20 -65.5 12.63 0.05 OUTLIER 'General case' 0 CA--C 1.541 0.612 0 C-N-CA 125.803 1.641 . . . . 0.0 114.678 175.135 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 7' ' ' LEU . . . . . . . . . . . . . 77.0 mt -130.97 -45.57 1.03 Allowed 'General case' 0 C--O 1.225 -0.187 0 C-N-CA 125.488 1.515 . . . . 0.0 110.354 -177.34 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 8' ' ' GLN . . . . . . . . . . . . . 19.3 mt-30 -62.12 -3.08 1.12 Allowed 'General case' 0 N--CA 1.469 0.487 0 N-CA-C 115.534 1.679 . . . . 0.0 115.534 -171.956 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 9' ' ' HIS . . . . . . . . . . . . . 97.7 m-70 -135.41 13.68 3.49 Favored 'General case' 0 C--N 1.326 -0.414 0 C-N-CA 125.181 1.393 . . . . 0.0 111.488 177.128 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 10' ' ' HIS . . . . . . . . . . . . . 94.7 m-70 -131.13 108.21 9.58 Favored 'General case' 0 N--CA 1.451 -0.404 0 C-N-CA 124.753 1.221 . . . . 0.0 109.353 -172.119 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 11' ' ' ARG . . . . . . . . . . . . . 9.5 ptt180 -74.83 163.34 27.77 Favored 'General case' 0 C--O 1.235 0.311 0 N-CA-C 108.976 -0.75 . . . . 0.0 108.976 174.617 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 12' ' ' PHE . . . . . . . . . . . . . 46.7 m-85 -139.19 146.8 40.98 Favored 'General case' 0 N--CA 1.448 -0.568 0 N-CA-C 108.416 -0.957 . . . . 0.0 108.416 173.137 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 13' ' ' VAL . . . . . 0.44 ' HA ' ' HA ' ' A' ' 30' ' ' GLU . 7.2 p -112.3 137.17 46.11 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.478 0 O-C-N 121.267 -0.895 . . . . 0.0 109.686 178.622 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 14' ' ' LEU . . . . . . . . . . . . . 26.7 tp -64.22 121.97 15.51 Favored 'General case' 0 N--CA 1.466 0.375 0 N-CA-C 107.254 -1.387 . . . . 0.0 107.254 178.669 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 1.6 tm-20 -105.63 -50.22 3.25 Favored 'General case' 0 C--N 1.326 -0.454 0 N-CA-C 108.134 -1.061 . . . . 0.0 108.134 -174.429 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 5.3 p -146.11 124.23 12.16 Favored 'General case' 0 N--CA 1.446 -0.663 0 CA-C-O 121.995 0.902 . . . . 0.0 110.713 179.833 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 17' ' ' VAL . . . . . . . . . . . . . 2.4 t -64.93 160.04 3.57 Favored 'Isoleucine or valine' 0 C--O 1.239 0.531 0 N-CA-C 107.137 -1.431 . . . . 0.0 107.137 161.776 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 18' ' ' ASN . . . . . . . . . . . . . 1.5 t30 -44.97 -43.31 8.97 Favored 'General case' 0 CA--C 1.53 0.203 0 C-N-CA 123.77 0.828 . . . . 0.0 111.864 165.115 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . -90.43 -33.67 8.49 Favored Glycine 0 CA--C 1.526 0.756 0 CA-C-O 117.686 -1.619 . . . . 0.0 114.389 -170.235 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 10.5 mttt -161.67 165.7 15.93 Favored Pre-proline 0 N--CA 1.469 0.496 0 CA-C-N 119.806 1.803 . . . . 0.0 110.321 -174.357 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 21' ' ' PRO . . . . . . . . . . . . . 97.0 Cg_endo -64.01 -179.96 0.94 Allowed 'Trans proline' 0 CA--C 1.537 0.639 0 C-N-CA 122.614 2.209 . . . . 0.0 110.953 163.121 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 22' ' ' VAL . . . . . . . . . . . . . 3.8 t -130.1 145.37 35.74 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.426 0 N-CA-C 107.909 -1.145 . . . . 0.0 107.909 169.837 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 23' ' ' THR . . . . . . . . . . . . . 0.1 OUTLIER -143.65 111.79 6.24 Favored 'General case' 0 C--O 1.233 0.213 0 C-N-CA 124.877 1.271 . . . . 0.0 108.273 178.107 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 24' ' ' SER . . . . . . . . . . . . . 2.9 m -134.16 45.12 2.64 Favored 'General case' 0 CA--C 1.535 0.378 0 CA-C-N 118.668 0.667 . . . . 0.0 112.244 -163.989 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 25' ' ' ASP . . . . . . . . . . . . . 1.0 OUTLIER 65.14 -81.17 0.03 OUTLIER 'General case' 0 N--CA 1.463 0.178 0 C-N-CA 128.695 2.798 . . . . 0.0 110.171 172.27 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 26' ' ' LYS . . . . . . . . . . . . . 21.3 ttpp -143.63 5.23 1.38 Allowed 'General case' 0 CA--C 1.535 0.373 0 C-N-CA 124.653 1.181 . . . . 0.0 112.008 171.085 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 27' ' ' ASN . . . . . . . . . . . . . 70.0 m-80 -122.41 70.05 33.32 Favored Pre-proline 0 C--O 1.233 0.202 0 C-N-CA 125.514 1.525 . . . . 0.0 108.158 -174.238 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 28' ' ' PRO . . . . . . . . . . . . . 93.0 Cg_endo -72.91 160.68 45.46 Favored 'Trans proline' 0 N--CA 1.454 -0.811 0 C-N-CA 121.986 1.791 . . . . 0.0 111.214 -178.623 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 29' ' ' PRO . . . . . . . . . . . . . 39.6 Cg_endo -68.17 64.84 1.04 Allowed 'Trans proline' 0 N--CA 1.458 -0.568 0 C-N-CA 123.864 3.043 . . . . 0.0 111.392 164.022 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 30' ' ' GLU . . . . . 0.44 ' HA ' ' HA ' ' A' ' 13' ' ' VAL . 14.7 pt-20 -72.71 170.07 15.33 Favored 'General case' 0 N--CA 1.446 -0.635 0 O-C-N 120.316 -1.49 . . . . 0.0 109.408 166.705 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 31' ' ' ILE . . . . . . . . . . . . . 20.0 tt -141.77 149.26 20.05 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.483 0 N-CA-C 106.983 -1.488 . . . . 0.0 106.983 178.475 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 32' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER -134.75 164.35 27.74 Favored 'General case' 0 N--CA 1.442 -0.829 0 CA-C-O 122.856 1.312 . . . . 0.0 109.083 172.929 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 33' ' ' PHE . . . . . . . . . . . . . 95.2 m-85 -133.02 167.13 20.85 Favored 'General case' 0 C--N 1.323 -0.58 0 CA-C-N 113.74 -1.573 . . . . 0.0 107.609 -177.233 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 34' ' ' GLY . . . . . . . . . . . . . . . -166.47 -170.69 31.7 Favored Glycine 0 N--CA 1.447 -0.615 0 N-CA-C 110.007 -1.237 . . . . 0.0 110.007 172.354 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 35' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -44.31 149.15 0.39 Allowed 'General case' 0 C--O 1.234 0.282 0 C-N-CA 126.707 2.003 . . . . 0.0 111.383 -173.261 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 32.7 mmtm 65.01 15.66 10.12 Favored 'General case' 0 CA--C 1.536 0.43 0 C-N-CA 125.574 1.549 . . . . 0.0 111.727 -170.919 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 37' ' ' MET . . . . . . . . . . . . . 11.5 mmm 59.7 20.97 9.68 Favored 'General case' 0 CA--C 1.54 0.576 0 C-N-CA 126.12 1.768 . . . . 0.0 113.272 -171.839 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 38' ' ' MET . . . . . . . . . . . . . 0.8 OUTLIER -61.19 160.01 11.1 Favored 'General case' 0 N--CA 1.452 -0.328 0 O-C-N 121.171 -0.956 . . . . 0.0 112.011 178.911 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 39' ' ' ILE . . . . . . . . . . . . . 10.4 mt -131.7 138.45 52.85 Favored 'Isoleucine or valine' 0 C--O 1.236 0.375 0 C-N-CA 124.851 1.26 . . . . 0.0 108.625 -168.473 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 40' ' ' SER . . . . . . . . . . . . . 13.7 m -135.89 132.83 37.03 Favored 'General case' 0 CA--C 1.531 0.232 0 N-CA-C 106.389 -1.708 . . . . 0.0 106.389 166.47 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 41' ' ' GLY . . . . . . . . . . . . . . . -157.91 172.35 35.08 Favored Glycine 0 C--N 1.334 0.439 0 CA-C-N 119.109 0.868 . . . . 0.0 111.49 -177.965 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 42' ' ' SER . . . . . . . . . . . . . 15.1 p -149.57 72.17 1.13 Allowed 'General case' 0 N--CA 1.452 -0.336 0 O-C-N 121.861 -0.788 . . . . 0.0 112.068 -165.283 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 43' ' ' MET . . . . . . . . . . . . . 6.3 mmt -66.48 -58.42 5.28 Favored 'General case' 0 CA--C 1.537 0.445 0 N-CA-C 109.315 -0.624 . . . . 0.0 109.315 178.207 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 44' ' ' CYS . . . . . 1.293 ' SG ' ' SG ' ' A' ' 70' ' ' CYS . 3.8 t -145.4 -57.32 0.32 Allowed 'General case' 0 N--CA 1.462 0.17 0 N-CA-C 107.128 -1.434 . . . . 0.0 107.128 161.247 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 45' ' ' ASN . . . . . . . . . . . . . 16.1 m-80 -74.42 7.17 3.06 Favored 'General case' 0 C--N 1.331 -0.211 0 C-N-CA 127.363 2.265 . . . . 0.0 113.267 -171.327 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 46' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER 57.9 150.1 0.01 OUTLIER 'General case' 0 C--O 1.225 -0.2 0 C-N-CA 126.831 2.052 . . . . 0.0 112.23 -166.115 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 47' ' ' PHE . . . . . . . . . . . . . 38.4 p90 -146.02 170.14 17.24 Favored 'General case' 0 N--CA 1.445 -0.706 0 CA-C-O 122.63 1.205 . . . . 0.0 109.392 167.963 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 48' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -161.66 161.9 29.71 Favored 'General case' 0 C--N 1.324 -0.531 0 C-N-CA 126.032 1.733 . . . . 0.0 106.83 174.996 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 49' ' ' GLY . . . . . . . . . . . . . . . 174.15 168.04 34.49 Favored Glycine 0 CA--C 1.523 0.591 0 CA-C-N 119.364 0.984 . . . . 0.0 111.976 166.178 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 50' ' ' GLU . . . . . . . . . . . . . 31.1 mt-10 -80.2 94.93 6.14 Favored 'General case' 0 C--O 1.236 0.368 0 C-N-CA 123.514 0.726 . . . . 0.0 109.874 -178.964 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 51' ' ' GLY . . . . . . . . . . . . . . . -69.71 173.37 37.79 Favored Glycine 0 CA--C 1.528 0.857 0 CA-C-O 122.797 1.221 . . . . 0.0 113.135 174.147 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 52' ' ' LYS . . . . . . . . . . . . . 1.4 ttmp? -151.63 154.28 36.09 Favored 'General case' 0 N--CA 1.454 -0.268 0 C-N-CA 126.205 1.802 . . . . 0.0 107.635 -179.66 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 53' ' ' LEU . . . . . . . . . . . . . 1.5 tm? -149.44 117.73 6.44 Favored 'General case' 0 N--CA 1.453 -0.29 0 N-CA-C 106.247 -1.76 . . . . 0.0 106.247 169.231 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 1.3 t -144.06 -26.15 0.54 Allowed 'General case' 0 CA--C 1.535 0.392 0 C-N-CA 124.431 1.092 . . . . 0.0 112.126 -179.341 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 55' ' ' ASN . . . . . . . . . . . . . 0.5 OUTLIER -140.19 -10.75 1.11 Allowed 'General case' 0 N--CA 1.473 0.678 0 CA-C-N 119.924 1.238 . . . . 0.0 113.489 177.246 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 56' ' ' GLY . . . . . . . . . . . . . . . 126.3 6.23 5.82 Favored Glycine 0 CA--C 1.532 1.095 0 O-C-N 121.242 -0.911 . . . . 0.0 112.069 -173.063 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 57' ' ' GLU . . . . . . . . . . . . . 28.1 tt0 -114.26 113.71 24.98 Favored 'General case' 0 C--O 1.237 0.426 0 C-N-CA 125.419 1.488 . . . . 0.0 108.387 -169.535 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 58' ' ' LEU . . . . . . . . . . . . . 47.6 tp -94.36 97.4 10.18 Favored 'General case' 0 CA--C 1.533 0.305 0 C-N-CA 122.878 0.471 . . . . 0.0 110.439 175.354 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 59' ' ' THR . . . . . . . . . . . . . 6.4 p -99.29 139.01 35.57 Favored 'General case' 0 C--O 1.237 0.422 0 C-N-CA 124.171 0.988 . . . . 0.0 110.057 168.66 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 60' ' ' ALA . . . . . . . . . . . . . . . -94.34 108.73 20.62 Favored 'General case' 0 C--O 1.234 0.253 0 C-N-CA 124.799 1.239 . . . . 0.0 109.594 171.523 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 61' ' ' LYS . . . . . . . . . . . . . 11.0 tttt -75.36 72.0 2.37 Favored 'General case' 0 C--O 1.235 0.338 0 C-N-CA 124.916 1.286 . . . . 0.0 108.786 170.06 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 62' ' ' GLY . . . . . . . . . . . . . . . 102.86 104.47 2.86 Favored Glycine 0 N--CA 1.451 -0.349 0 N-CA-C 107.721 -2.152 . . . . 0.0 107.721 -174.433 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 63' ' ' LEU . . . . . . . . . . . . . 1.8 tp -90.42 161.79 15.4 Favored 'General case' 0 N--CA 1.447 -0.619 0 N-CA-C 108.506 -0.924 . . . . 0.0 108.506 160.352 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 64' ' ' ALA . . . . . . . . . . . . . . . -153.8 144.14 22.26 Favored 'General case' 0 C--O 1.235 0.299 0 C-N-CA 124.363 1.065 . . . . 0.0 109.858 165.848 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 65' ' ' MET . . . . . . . . . . . . . 8.5 mtt -145.48 169.31 18.6 Favored 'General case' 0 N--CA 1.472 0.628 0 C-N-CA 127.014 2.126 . . . . 0.0 111.752 -172.313 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 66' ' ' THR . . . . . . . . . . . . . 6.7 p -105.33 -172.37 2.08 Favored 'General case' 0 CA--C 1.544 0.748 0 C-N-CA 124.781 1.232 . . . . 0.0 110.78 177.003 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 67' ' ' ARG . . . . . . . . . . . . . 64.9 mtm-85 -121.48 76.14 1.23 Allowed 'General case' 0 N--CA 1.47 0.571 0 C-N-CA 124.728 1.211 . . . . 0.0 109.604 169.943 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 68' ' ' MET . . . . . . . . . . . . . 78.6 mtm -102.79 178.33 4.6 Favored 'General case' 0 CA--C 1.533 0.322 0 C-N-CA 124.924 1.29 . . . . 0.0 110.81 171.95 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 69' ' ' MET . . . . . . . . . . . . . 0.4 OUTLIER -137.24 171.7 14.09 Favored 'General case' 0 C--O 1.237 0.434 0 C-N-CA 127.058 2.143 . . . . 0.0 105.233 166.54 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 70' ' ' CYS . . . . . 1.293 ' SG ' ' SG ' ' A' ' 44' ' ' CYS . 97.0 m -141.51 9.03 2.01 Favored 'General case' 0 C--N 1.328 -0.327 0 N-CA-C 115.251 1.574 . . . . 0.0 115.251 -168.438 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 71' ' ' ALA . . . . . . . . . . . . . . . 62.19 2.23 0.8 Allowed 'General case' 0 CA--C 1.536 0.43 0 C-N-CA 126.72 2.008 . . . . 0.0 115.037 179.088 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 72' ' ' ASN . . . . . . . . . . . . . 0.1 OUTLIER -121.83 157.12 58.2 Favored Pre-proline 0 N--CA 1.476 0.867 0 N-CA-C 106.53 -1.655 . . . . 0.0 106.53 156.368 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 73' ' ' PRO . . . . . . . . . . . . . 64.7 Cg_endo -77.38 -41.85 0.32 Allowed 'Trans proline' 0 N--CA 1.459 -0.519 0 C-N-CA 122.236 1.957 . . . . 0.0 111.817 -178.487 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 74' ' ' GLN . . . . . . . . . . . . . 40.1 tt0 -47.52 -60.57 2.44 Favored 'General case' 0 CA--C 1.532 0.271 0 C-N-CA 126.972 2.109 . . . . 0.0 110.609 -173.959 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 75' ' ' LEU . . . . . . . . . . . . . 82.4 mt -55.44 -40.65 71.81 Favored 'General case' 0 CA--C 1.536 0.42 0 C-N-CA 125.126 1.37 . . . . 0.0 110.537 -177.786 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 76' ' ' ASN . . . . . . . . . . . . . 23.7 t-20 -75.14 -19.93 59.64 Favored 'General case' 0 N--CA 1.467 0.384 0 C-N-CA 125.309 1.444 . . . . 0.0 112.379 -176.05 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 77' ' ' GLU . . . . . . . . . . . . . 0.3 OUTLIER -92.48 -31.35 15.28 Favored 'General case' 0 CA--C 1.535 0.376 0 C-N-CA 124.501 1.12 . . . . 0.0 111.821 174.338 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 78' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -61.21 -25.48 67.08 Favored 'General case' 0 CA--C 1.534 0.347 0 C-N-CA 126.503 1.921 . . . . 0.0 111.787 -176.982 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 79' ' ' ASP . . . . . . . . . . . . . 20.2 m-20 -56.58 -43.44 80.03 Favored 'General case' 0 C--O 1.237 0.395 0 C-N-CA 125.549 1.54 . . . . 0.0 111.254 170.959 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 80' ' ' ASN . . . . . . . . . . . . . 49.1 m-20 -72.85 -32.07 65.21 Favored 'General case' 0 N--CA 1.453 -0.294 0 C-N-CA 119.288 -0.965 . . . . 0.0 110.261 -177.193 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 81' ' ' THR . . . . . . . . . . . . . 0.9 OUTLIER -58.04 -54.1 50.79 Favored 'General case' 0 N--CA 1.452 -0.367 0 CA-C-N 118.835 0.743 . . . . 0.0 110.264 172.567 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 82' ' ' ILE . . . . . . . . . . . . . 7.3 tp -65.06 -36.46 77.86 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.277 0 C-N-CA 119.77 -0.772 . . . . 0.0 110.143 -175.321 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 83' ' ' SER . . . . . . . . . . . . . 6.4 m -56.61 -51.62 67.96 Favored 'General case' 0 N--CA 1.449 -0.525 0 C-N-CA 122.974 0.51 . . . . 0.0 111.474 176.681 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 84' ' ' GLU . . . . . . . . . . . . . 3.3 mm-40 -56.75 -54.92 40.71 Favored 'General case' 0 N--CA 1.452 -0.355 0 C-N-CA 126.059 1.744 . . . . 0.0 110.083 176.414 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 85' ' ' MET . . . . . . . . . . . . . 87.8 mtp -60.95 -41.66 96.72 Favored 'General case' 0 C--N 1.341 0.233 0 CA-C-O 121.863 0.839 . . . . 0.0 108.762 -169.721 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 86' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -77.35 -20.57 54.64 Favored 'General case' 0 C--N 1.331 -0.223 0 O-C-N 121.361 -0.837 . . . . 0.0 112.407 -177.289 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 87' ' ' LYS . . . . . . . . . . . . . 5.4 tttm -72.66 -54.77 8.12 Favored 'General case' 0 N--CA 1.452 -0.364 0 N-CA-C 108.195 -1.039 . . . . 0.0 108.195 170.304 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 88' ' ' GLU . . . . . . . . . . . . . 15.4 pt-20 -73.95 -33.87 64.07 Favored 'General case' 0 CA--C 1.534 0.362 0 CA-C-O 118.667 -0.682 . . . . 0.0 111.918 -168.433 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 89' ' ' GLY . . . . . . . . . . . . . . . 120.33 87.4 1.01 Allowed Glycine 0 C--N 1.335 0.519 0 N-CA-C 108.616 -1.794 . . . . 0.0 108.616 178.509 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 90' ' ' ALA . . . . . . . . . . . . . . . -69.07 119.3 13.15 Favored 'General case' 0 N--CA 1.443 -0.823 0 N-CA-C 107.535 -1.283 . . . . 0.0 107.535 -173.26 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 91' ' ' GLN . . . . . . . . . . . . . 58.9 mm-40 -79.76 116.02 19.69 Favored 'General case' 0 N--CA 1.447 -0.579 0 N-CA-C 105.48 -2.044 . . . . 0.0 105.48 -177.083 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 92' ' ' VAL . . . . . . . . . . . . . 24.2 t -103.55 108.69 25.06 Favored 'Isoleucine or valine' 0 N--CA 1.448 -0.536 0 C-N-CA 127.422 2.289 . . . . 0.0 109.201 -168.787 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 93' ' ' ASP . . . . . . . . . . . . . 5.1 t0 -107.54 68.59 0.72 Allowed 'General case' 0 C--O 1.238 0.489 0 C-N-CA 126.508 1.923 . . . . 0.0 109.051 174.674 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 94' ' ' LEU . . . . . . . . . . . . . 1.7 tm? -75.55 109.93 9.52 Favored 'General case' 0 N--CA 1.452 -0.327 0 N-CA-C 106.882 -1.525 . . . . 0.0 106.882 168.944 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 95' ' ' THR . . . . . . . . . . . . . 7.7 t -89.52 -163.74 1.05 Allowed 'General case' 0 C--N 1.326 -0.42 0 C-N-CA 125.539 1.536 . . . . 0.0 108.387 175.766 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 96' ' ' ALA . . . . . . . . . . . . . . . -44.76 -40.87 6.41 Favored 'General case' 0 CA--C 1.54 0.584 0 C-N-CA 124.609 1.164 . . . . 0.0 113.791 -174.357 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 97' ' ' ASN . . . . . . . . . . . . . 6.2 p30 -162.91 14.52 0.07 Allowed 'General case' 0 N--CA 1.47 0.536 0 C-N-CA 124.681 1.193 . . . . 0.0 113.207 -173.752 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 98' ' ' GLN . . . . . . . . . . . . . 6.0 tt0 -128.83 130.42 46.91 Favored 'General case' 0 C--N 1.333 -0.143 0 N-CA-C 106.555 -1.646 . . . . 0.0 106.555 174.913 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 99' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -81.3 136.13 35.75 Favored 'General case' 0 C--N 1.327 -0.409 0 N-CA-C 107.17 -1.418 . . . . 0.0 107.17 169.465 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 100' ' ' THR . . . . . . . . . . . . . 0.3 OUTLIER -128.84 137.91 51.75 Favored 'General case' 0 N--CA 1.45 -0.456 0 N-CA-C 106.12 -1.807 . . . . 0.0 106.12 165.228 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 101' ' ' LEU . . . . . . . . . . . . . 4.5 mm? -106.63 157.33 17.77 Favored 'General case' 0 N--CA 1.449 -0.502 0 N-CA-C 107.861 -1.163 . . . . 0.0 107.861 164.753 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 102' ' ' ALA . . . . . . . . . . . . . . . -155.31 109.47 2.89 Favored 'General case' 0 C--N 1.329 -0.283 0 N-CA-C 108.321 -0.992 . . . . 0.0 108.321 159.06 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 103' ' ' THR . . . . . . . . . . . . . 0.5 OUTLIER -121.37 -172.66 2.46 Favored 'General case' 0 C--O 1.238 0.476 0 N-CA-C 108.608 -0.886 . . . . 0.0 108.608 -175.687 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 104' ' ' ALA . . . . . . . . . . . . . . . -53.09 -44.17 67.35 Favored 'General case' 0 N--CA 1.454 -0.26 0 O-C-N 121.102 -0.998 . . . . 0.0 110.202 168.728 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 105' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -59.57 -66.7 0.47 Allowed 'General case' 0 C--O 1.234 0.265 0 N-CA-C 113.277 0.843 . . . . 0.0 113.277 -173.758 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 106' ' ' GLN . . . . . . . . . . . . . 7.8 pt20 -166.22 -172.77 2.36 Favored 'General case' 0 CA--C 1.535 0.393 0 C-N-CA 127.114 2.165 . . . . 0.0 108.139 178.76 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 107' ' ' THR . . . . . . . . . . . . . 4.5 t -100.2 157.45 16.57 Favored 'General case' 0 C--O 1.24 0.57 0 C-N-CA 125.441 1.497 . . . . 0.0 108.186 163.267 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 108' ' ' LEU . . . . . . . . . . . . . 76.6 mt -146.95 141.56 26.62 Favored 'General case' 0 C--N 1.332 -0.173 0 C-N-CA 127.071 2.148 . . . . 0.0 105.968 176.757 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 109' ' ' THR . . . . . . . . . . . . . 27.9 m -130.14 126.5 37.67 Favored 'General case' 0 C--O 1.237 0.411 0 N-CA-C 107.959 -1.126 . . . . 0.0 107.959 -174.147 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 110' ' ' TYR . . . . . . . . . . . . . 12.4 m-85 -124.43 158.58 32.43 Favored 'General case' 0 CA--C 1.531 0.237 0 C-N-CA 124.215 1.006 . . . . 0.0 109.375 -176.04 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 111' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -108.75 145.32 35.31 Favored 'General case' 0 CA--C 1.516 -0.362 0 C-N-CA 124.14 0.976 . . . . 0.0 109.905 -178.931 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 112' ' ' LEU . . . . . . . . . . . . . 25.7 tp -75.61 58.56 1.07 Allowed 'General case' 0 CA--C 1.54 0.582 0 C-N-CA 124.816 1.246 . . . . 0.0 108.515 166.917 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 113' ' ' ALA . . . . . . . . . . . . . . . -78.94 64.5 3.89 Favored 'General case' 0 CA--C 1.529 0.163 0 O-C-N 120.534 -1.354 . . . . 0.0 108.102 170.66 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 114' ' ' ASP . . . . . . . . . . . . . 25.2 t0 -84.44 14.55 4.37 Favored 'General case' 0 N--CA 1.465 0.316 0 CA-C-O 122.04 0.924 . . . . 0.0 113.322 -161.526 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 115' ' ' LEU . . . . . . . . . . . . . 15.3 mt 61.07 15.31 6.09 Favored 'General case' 0 CA--C 1.532 0.282 0 C-N-CA 127.407 2.283 . . . . 0.0 112.186 -172.828 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 116' ' ' MET . . . . . . . . . . . . . 9.8 tpt -120.84 96.16 5.0 Favored 'General case' 0 N--CA 1.448 -0.538 0 N-CA-C 105.807 -1.923 . . . . 0.0 105.807 176.313 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 117' ' ' ASN . . . . . . . . . . . . . 86.1 m-20 . . . . . 0 C--O 1.236 0.379 0 N-CA-C 108.132 -1.062 . . . . 0.0 108.132 178.106 . . . . . . . . 0 0 . 1 . 002 nuclear orig full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 48.5 ttp . . . . . 0 N--CA 1.454 -0.239 0 N-CA-C 109.253 -0.647 . . . . 0.0 109.253 . . . . . . . . . 0 0 . 1 . 002 nuclear orig full ' A' A ' 2' ' ' VAL . . . . . . . . . . . . . 12.2 p -58.07 142.8 13.3 Favored 'Isoleucine or valine' 0 C--O 1.241 0.649 0 C-N-CA 124.197 0.999 . . . . 0.0 111.336 177.126 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 3' ' ' THR . . . . . . . . . . . . . 51.8 p -126.65 165.67 26.92 Favored Pre-proline 0 CA--C 1.535 0.371 0 C-N-CA 124.54 1.136 . . . . 0.0 110.223 179.467 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 4' ' ' PRO . . . . . . . . . . . . . 45.2 Cg_endo -69.91 -34.45 14.05 Favored 'Trans proline' 0 CA--C 1.533 0.445 0 C-N-CA 122.672 2.248 . . . . 0.0 113.662 175.893 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 5' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -49.18 -59.97 3.2 Favored 'General case' 0 N--CA 1.477 0.88 0 C-N-CA 125.747 1.619 . . . . 0.0 110.121 -179.964 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 6' ' ' GLN . . . . . . . . . . . . . 19.9 pt20 -64.32 14.83 0.02 OUTLIER 'General case' 0 CA--C 1.542 0.64 0 C-N-CA 127.957 2.503 . . . . 0.0 114.789 176.946 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 7' ' ' LEU . . . . . . . . . . . . . 95.5 mt -132.77 -48.74 0.88 Allowed 'General case' 0 CA--C 1.518 -0.259 0 C-N-CA 124.758 1.223 . . . . 0.0 110.633 -175.734 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 8' ' ' GLN . . . . . . . . . . . . . 5.9 mt-30 -56.83 -5.76 0.27 Allowed 'General case' 0 CA--C 1.536 0.429 0 C-N-CA 126.024 1.73 . . . . 0.0 114.699 -175.725 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 9' ' ' HIS . . . . . . . . . . . . . 95.9 m-70 -125.11 0.63 7.87 Favored 'General case' 0 CA--C 1.532 0.27 0 CA-C-O 118.022 -0.99 . . . . 0.0 113.486 178.534 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 10' ' ' HIS . . . . . . . . . . . . . 98.2 m-70 -120.91 126.59 50.4 Favored 'General case' 0 C--O 1.234 0.253 0 CA-C-N 119.595 1.088 . . . . 0.0 111.919 -170.29 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 11' ' ' ARG . . . . . . . . . . . . . 32.8 ttt180 -70.4 154.38 41.96 Favored 'General case' 0 C--N 1.331 -0.212 0 C-N-CA 124.884 1.274 . . . . 0.0 109.06 162.929 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 12' ' ' PHE . . . . . . . . . . . . . 41.4 m-85 -130.83 165.83 22.15 Favored 'General case' 0 N--CA 1.444 -0.76 0 C-N-CA 125.727 1.611 . . . . 0.0 107.982 164.581 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 13' ' ' VAL . . . . . 0.431 ' HA ' ' HA ' ' A' ' 30' ' ' GLU . 7.3 p -128.86 145.83 35.11 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.436 0 O-C-N 120.924 -1.11 . . . . 0.0 108.562 174.495 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 14' ' ' LEU . . . . . . . . . . . . . 4.9 tp -77.86 86.93 4.08 Favored 'General case' 0 C--O 1.233 0.23 0 N-CA-C 107.452 -1.314 . . . . 0.0 107.452 176.838 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 15' ' ' GLU . . . . . 0.41 ' HG2' ' HE2' ' A' ' 111' ' ' LYS . 17.7 tp10 -70.49 -49.86 43.97 Favored 'General case' 0 C--N 1.323 -0.546 0 CA-C-N 115.718 -0.674 . . . . 0.0 109.455 -176.465 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 63.2 p -147.51 136.2 21.92 Favored 'General case' 0 N--CA 1.446 -0.642 0 CA-C-O 122.363 1.078 . . . . 0.0 111.386 176.408 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 17' ' ' VAL . . . . . . . . . . . . . 3.2 t -77.68 169.04 1.81 Allowed 'Isoleucine or valine' 0 C--O 1.238 0.486 0 C-N-CA 125.71 1.604 . . . . 0.0 107.355 174.324 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 18' ' ' ASN . . . . . . . . . . . . . 0.5 OUTLIER -51.23 -34.68 33.25 Favored 'General case' 0 CA--C 1.534 0.329 0 C-N-CA 123.469 0.707 . . . . 0.0 112.205 165.063 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . -93.01 -45.35 3.61 Favored Glycine 0 CA--C 1.527 0.788 0 CA-C-O 118.395 -1.225 . . . . 0.0 113.875 -170.892 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 13.9 mttt -160.28 166.09 16.39 Favored Pre-proline 0 N--CA 1.469 0.488 0 C-N-CA 126.145 1.778 . . . . 0.0 109.819 -173.261 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 21' ' ' PRO . . . . . . . . . . . . . 91.1 Cg_endo -63.5 -178.78 0.54 Allowed 'Trans proline' 0 CA--C 1.542 0.893 0 C-N-CA 122.718 2.279 . . . . 0.0 111.358 163.477 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 22' ' ' VAL . . . . . . . . . . . . . 4.0 t -131.59 154.74 40.93 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.377 0 C-N-CA 124.107 0.963 . . . . 0.0 108.445 172.881 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 23' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -148.63 112.91 5.25 Favored 'General case' 0 C--O 1.234 0.27 0 N-CA-C 105.791 -1.929 . . . . 0.0 105.791 170.832 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 24' ' ' SER . . . . . . . . . . . . . 15.3 m -121.33 48.94 1.58 Allowed 'General case' 0 N--CA 1.469 0.497 0 CA-C-N 119.505 1.048 . . . . 0.0 108.348 174.769 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 25' ' ' ASP . . . . . . . . . . . . . 38.4 t0 51.35 -83.77 0.01 OUTLIER 'General case' 0 N--CA 1.453 -0.308 0 C-N-CA 128.671 2.788 . . . . 0.0 110.852 -169.787 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 26' ' ' LYS . . . . . . . . . . . . . 32.6 tttm -130.5 -4.71 4.23 Favored 'General case' 0 CA--C 1.537 0.465 0 C-N-CA 125.698 1.599 . . . . 0.0 111.214 -172.121 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 27' ' ' ASN . . . . . . . . . . . . . 6.2 p30 -118.8 58.38 3.68 Favored Pre-proline 0 CA--C 1.545 0.753 0 C-N-CA 126.26 1.824 . . . . 0.0 112.885 177.735 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 28' ' ' PRO . . . . . . . . . . . . . 54.1 Cg_endo -71.09 168.07 24.3 Favored 'Trans proline' 0 CA--C 1.548 1.215 0 C-N-CA 123.72 2.947 . . . . 0.0 112.627 -176.6 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 29' ' ' PRO . . . . . . . . . . . . . 20.6 Cg_endo -73.2 63.71 4.3 Favored 'Trans proline' 0 C--N 1.355 0.873 0 C-N-CA 123.59 2.86 . . . . 0.0 113.525 179.067 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 30' ' ' GLU . . . . . 0.431 ' HA ' ' HA ' ' A' ' 13' ' ' VAL . 8.7 pt-20 -72.15 169.44 16.09 Favored 'General case' 0 CA--C 1.537 0.469 0 O-C-N 120.228 -1.545 . . . . 0.0 111.638 175.148 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 31' ' ' ILE . . . . . . . . . . . . . 16.6 tt -143.46 146.46 21.27 Favored 'Isoleucine or valine' 0 CA--C 1.529 0.166 0 N-CA-C 107.909 -1.145 . . . . 0.0 107.909 -179.39 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 32' ' ' SER . . . . . . . . . . . . . 14.7 p -137.48 157.26 46.94 Favored 'General case' 0 C--O 1.237 0.441 0 O-C-N 120.962 -1.086 . . . . 0.0 109.669 170.986 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 33' ' ' PHE . . . . . . . . . . . . . 86.5 m-85 -121.99 155.92 34.56 Favored 'General case' 0 N--CA 1.442 -0.857 0 N-CA-C 107.207 -1.405 . . . . 0.0 107.207 177.681 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 34' ' ' GLY . . . . . . . . . . . . . . . -149.87 -165.12 12.24 Favored Glycine 0 CA--C 1.516 0.12 0 N-CA-C 109.271 -1.532 . . . . 0.0 109.271 177.189 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 35' ' ' GLU . . . . . . . . . . . . . 0.2 OUTLIER -44.1 154.57 0.11 Allowed 'General case' 0 C--O 1.235 0.337 0 C-N-CA 126.745 2.018 . . . . 0.0 111.577 177.774 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 37.8 mtpt 55.92 13.92 1.24 Allowed 'General case' 0 CA--C 1.532 0.275 0 C-N-CA 124.778 1.231 . . . . 0.0 112.311 -171.659 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 37' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER 59.36 25.99 14.78 Favored 'General case' 0 CA--C 1.542 0.653 0 C-N-CA 124.872 1.269 . . . . 0.0 110.903 -175.135 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 38' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -61.86 164.54 6.27 Favored 'General case' 0 N--CA 1.444 -0.748 0 O-C-N 120.449 -1.407 . . . . 0.0 111.575 173.015 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 39' ' ' ILE . . . . . . . . . . . . . 10.6 mt -134.05 139.26 48.72 Favored 'Isoleucine or valine' 0 C--O 1.238 0.455 0 N-CA-C 106.732 -1.581 . . . . 0.0 106.732 -172.108 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 40' ' ' SER . . . . . . . . . . . . . 58.8 m -136.29 152.82 51.1 Favored 'General case' 0 C--O 1.234 0.266 0 N-CA-C 109.591 -0.522 . . . . 0.0 109.591 156.067 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 41' ' ' GLY . . . . . . . . . . . . . . . -164.98 -175.26 35.55 Favored Glycine 0 CA--C 1.527 0.835 0 C-N-CA 124.645 1.117 . . . . 0.0 110.323 172.532 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 42' ' ' SER . . . . . . . . . . . . . 22.1 p -151.27 87.43 1.39 Allowed 'General case' 0 N--CA 1.445 -0.713 0 C-N-CA 124.69 1.196 . . . . 0.0 110.02 177.737 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 43' ' ' MET . . . . . . . . . . . . . 6.2 mmt -61.11 -66.95 0.45 Allowed 'General case' 0 C--N 1.341 0.236 0 N-CA-C 108.455 -0.942 . . . . 0.0 108.455 169.601 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 44' ' ' CYS . . . . . 1.288 ' SG ' ' SG ' ' A' ' 70' ' ' CYS . 17.1 t -138.01 -57.04 0.67 Allowed 'General case' 0 N--CA 1.447 -0.586 0 N-CA-C 106.446 -1.687 . . . . 0.0 106.446 164.571 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 45' ' ' ASN . . . . . . . . . . . . . 5.8 m-80 -76.68 8.28 3.78 Favored 'General case' 0 N--CA 1.464 0.259 0 C-N-CA 127.4 2.28 . . . . 0.0 115.854 -168.394 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 46' ' ' ARG . . . . . . . . . . . . . 8.7 mtm180 53.37 160.24 0.01 OUTLIER 'General case' 0 CA--C 1.52 -0.176 0 C-N-CA 126.78 2.032 . . . . 0.0 112.362 -155.936 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 47' ' ' PHE . . . . . . . . . . . . . 48.8 p90 -159.32 153.1 23.01 Favored 'General case' 0 C--N 1.321 -0.657 0 CA-C-N 113.653 -1.612 . . . . 0.0 107.672 164.83 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 48' ' ' SER . . . . . . . . . . . . . 3.3 m -154.26 156.93 37.93 Favored 'General case' 0 N--CA 1.444 -0.754 0 C-N-CA 125.696 1.598 . . . . 0.0 106.823 176.391 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 49' ' ' GLY . . . . . . . . . . . . . . . 174.57 163.86 28.5 Favored Glycine 0 N--CA 1.448 -0.543 0 N-CA-C 111.193 -0.763 . . . . 0.0 111.193 167.994 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 50' ' ' GLU . . . . . . . . . . . . . 34.0 tt0 -64.66 100.12 0.36 Allowed 'General case' 0 N--CA 1.445 -0.685 0 C-N-CA 125.437 1.495 . . . . 0.0 108.985 171.985 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 51' ' ' GLY . . . . . . . . . . . . . . . -72.18 177.45 39.25 Favored Glycine 0 CA--C 1.527 0.79 0 N-CA-C 111.483 -0.647 . . . . 0.0 111.483 161.027 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 52' ' ' LYS . . . . . . . . . . . . . 16.6 tttp -162.77 151.24 14.38 Favored 'General case' 0 N--CA 1.455 -0.201 0 N-CA-C 106.985 -1.487 . . . . 0.0 106.985 171.281 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 53' ' ' LEU . . . . . . . . . . . . . 42.7 tp -146.9 119.36 8.45 Favored 'General case' 0 CA--C 1.517 -0.299 0 N-CA-C 107.436 -1.32 . . . . 0.0 107.436 173.808 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 2.1 t -157.64 14.63 0.23 Allowed 'General case' 0 CA--C 1.541 0.608 0 C-N-CA 123.158 0.583 . . . . 0.0 110.768 166.945 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 55' ' ' ASN . . . . . . . . . . . . . 18.2 p-10 -154.87 26.68 0.43 Allowed 'General case' 0 CA--C 1.537 0.446 0 C-N-CA 125.178 1.391 . . . . 0.0 111.528 -169.743 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 56' ' ' GLY . . . . . . . . . . . . . . . 63.62 17.08 59.69 Favored Glycine 0 CA--C 1.531 1.044 0 O-C-N 121.609 -0.682 . . . . 0.0 113.62 -179.605 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 57' ' ' GLU . . . . . . . . . . . . . 33.9 tt0 -129.74 151.12 50.67 Favored 'General case' 0 N--CA 1.451 -0.394 0 C-N-CA 125.633 1.573 . . . . 0.0 107.271 -174.24 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 58' ' ' LEU . . . . . . . . . . . . . 59.0 tp -131.6 107.91 9.17 Favored 'General case' 0 N--CA 1.455 -0.203 0 C-N-CA 125.717 1.607 . . . . 0.0 108.012 175.932 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 59' ' ' THR . . . . . . . . . . . . . 4.5 p -107.57 160.01 16.01 Favored 'General case' 0 CA--C 1.536 0.416 0 C-N-CA 125.726 1.611 . . . . 0.0 110.171 176.594 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 60' ' ' ALA . . . . . . . . . . . . . . . -110.14 102.37 11.08 Favored 'General case' 0 C--O 1.234 0.27 0 C-N-CA 124.851 1.26 . . . . 0.0 111.713 168.569 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 61' ' ' LYS . . . . . . . . . . . . . 0.3 OUTLIER -79.23 5.4 12.35 Favored 'General case' 0 CA--C 1.539 0.526 0 N-CA-C 112.755 0.65 . . . . 0.0 112.755 168.639 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 62' ' ' GLY . . . . . . . . . . . . . . . -167.91 48.68 0.24 Allowed Glycine 0 C--N 1.331 0.303 0 CA-C-N 121.384 1.902 . . . . 0.0 111.487 -177.567 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 63' ' ' LEU . . . . . . . . . . . . . 0.9 OUTLIER -61.29 140.03 58.05 Favored 'General case' 0 N--CA 1.45 -0.457 0 N-CA-C 108.351 -0.981 . . . . 0.0 108.351 171.438 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 64' ' ' ALA . . . . . . . . . . . . . . . -144.12 134.81 24.96 Favored 'General case' 0 N--CA 1.454 -0.25 0 N-CA-C 109.024 -0.732 . . . . 0.0 109.024 171.457 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 65' ' ' MET . . . . . . . . . . . . . 68.4 mtp -139.98 179.49 6.58 Favored 'General case' 0 C--O 1.24 0.604 0 C-N-CA 124.656 1.182 . . . . 0.0 110.094 -170.179 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 66' ' ' THR . . . . . . . . . . . . 0.282 3.3 p -120.4 -163.04 0.98 Allowed 'General case' 0 CA--C 1.551 0.992 0 C-N-CA 125.508 1.523 . . . . 0.0 112.671 -176.306 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 67' ' ' ARG . . . . . . . . . . . . . 17.7 mmt180 -130.15 62.25 1.57 Allowed 'General case' 0 N--CA 1.475 0.813 0 C-N-CA 126.6 1.96 . . . . 0.0 111.715 173.741 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 68' ' ' MET . . . . . . . . . . . . . 77.2 mtm -99.53 171.53 7.87 Favored 'General case' 0 N--CA 1.468 0.429 0 C-N-CA 125.837 1.655 . . . . 0.0 111.684 172.901 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 69' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -129.28 161.81 29.36 Favored 'General case' 0 C--O 1.237 0.402 0 C-N-CA 127.627 2.371 . . . . 0.0 108.489 -176.42 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 70' ' ' CYS . . . . . 1.288 ' SG ' ' SG ' ' A' ' 44' ' ' CYS . 66.2 m -145.74 13.08 1.32 Allowed 'General case' 0 N--CA 1.474 0.773 0 N-CA-C 116.585 2.069 . . . . 0.0 116.585 -170.125 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 71' ' ' ALA . . . . . . . . . . . . . . . 68.39 -28.04 0.15 Allowed 'General case' 0 N--CA 1.473 0.697 0 C-N-CA 127.741 2.416 . . . . 0.0 116.182 166.301 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 72' ' ' ASN . . . . . . . . . . . . . 1.1 t-20 -88.73 163.42 35.52 Favored Pre-proline 0 C--O 1.24 0.564 0 C-N-CA 127.235 2.214 . . . . 0.0 105.844 159.634 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 73' ' ' PRO . . . . . . . . . . . . . 24.6 Cg_endo -92.55 -19.68 0.6 Allowed 'Trans proline' 0 N--CA 1.451 -0.98 0 C-N-CA 121.596 1.531 . . . . 0.0 110.951 169.917 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 74' ' ' GLN . . . . . . . . . . . . . 63.3 tt0 -52.65 -62.62 1.53 Allowed 'General case' 0 C--N 1.343 0.312 0 C-N-CA 125.135 1.374 . . . . 0.0 110.586 -176.657 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 75' ' ' LEU . . . . . . . . . . . . . 19.9 mt -62.93 -28.0 69.76 Favored 'General case' 0 CA--C 1.538 0.481 0 C-N-CA 122.959 0.504 . . . . 0.0 110.451 -173.45 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 76' ' ' ASN . . . . . . . . . . . . . 2.0 t-20 -72.52 -34.64 67.73 Favored 'General case' 0 CA--C 1.532 0.27 0 C-N-CA 126.284 1.834 . . . . 0.0 111.811 -179.867 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 77' ' ' GLU . . . . . . . . . . . . . 1.1 mm-40 -78.99 -30.96 44.67 Favored 'General case' 0 C--O 1.234 0.24 0 C-N-CA 123.757 0.823 . . . . 0.0 110.694 172.451 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 78' ' ' LEU . . . . . . . . . . . . . 3.0 mp -62.68 -35.63 80.3 Favored 'General case' 0 N--CA 1.456 -0.155 0 C-N-CA 124.778 1.231 . . . . 0.0 110.442 -179.688 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 79' ' ' ASP . . . . . . . . . . . . . 74.2 m-20 -53.17 -47.55 68.7 Favored 'General case' 0 CA--C 1.517 -0.312 0 C-N-CA 124.207 1.003 . . . . 0.0 110.699 171.514 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 80' ' ' ASN . . . . . . . . . . . . . 37.4 m-20 -78.16 -35.08 49.26 Favored 'General case' 0 N--CA 1.452 -0.328 0 N-CA-C 108.801 -0.815 . . . . 0.0 108.801 -171.482 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 81' ' ' THR . . . . . . . . . . . . . 12.8 m -58.41 -56.22 24.88 Favored 'General case' 0 N--CA 1.445 -0.719 0 C-N-CA 123.814 0.846 . . . . 0.0 109.701 172.316 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 82' ' ' ILE . . . . . . . . . . . . . 10.2 tp -65.25 -34.35 69.91 Favored 'Isoleucine or valine' 0 C--N 1.34 0.195 0 CA-C-N 120.093 1.315 . . . . 0.0 110.905 -174.089 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 83' ' ' SER . . . . . . . . . . . . . 11.2 t -62.35 -54.25 43.13 Favored 'General case' 0 N--CA 1.446 -0.649 0 N-CA-C 109.249 -0.648 . . . . 0.0 109.249 -179.0 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 84' ' ' GLU . . . . . . . . . . . . . 4.5 mm-40 -57.56 -44.83 85.57 Favored 'General case' 0 N--CA 1.449 -0.484 0 C-N-CA 124.864 1.266 . . . . 0.0 110.127 174.99 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 85' ' ' MET . . . . . . . . . . . . . 95.4 mtp -73.02 -1.1 15.85 Favored 'General case' 0 CA--C 1.518 -0.284 0 CA-C-N 119.175 0.898 . . . . 0.0 112.665 -173.86 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 86' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -112.73 -16.19 12.82 Favored 'General case' 0 C--N 1.327 -0.398 0 CA-C-N 119.686 1.13 . . . . 0.0 110.786 170.941 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 87' ' ' LYS . . . . . . . . . . . . . 1.8 mptp? -79.3 -26.84 42.21 Favored 'General case' 0 N--CA 1.453 -0.286 0 CA-C-O 117.861 -1.066 . . . . 0.0 112.385 -173.578 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 88' ' ' GLU . . . . . . . . . . . . . 22.7 pt-20 -110.23 0.77 18.29 Favored 'General case' 0 CA--C 1.54 0.573 0 C-N-CA 124.977 1.311 . . . . 0.0 113.476 -170.778 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 89' ' ' GLY . . . . . . . . . . . . . . . 86.04 99.78 0.75 Allowed Glycine 0 C--N 1.338 0.679 0 C-N-CA 126.862 2.173 . . . . 0.0 110.256 -173.276 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 90' ' ' ALA . . . . . . . . . . . . . . . -71.87 139.68 48.95 Favored 'General case' 0 N--CA 1.465 0.309 0 N-CA-C 107.591 -1.263 . . . . 0.0 107.591 164.988 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 91' ' ' GLN . . . . . . . . . . . . . 78.1 mm-40 -74.17 145.89 43.87 Favored 'General case' 0 N--CA 1.445 -0.677 0 N-CA-C 105.771 -1.937 . . . . 0.0 105.771 158.359 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 92' ' ' VAL . . . . . . . . . . . . . 7.9 p -135.02 124.51 43.19 Favored 'Isoleucine or valine' 0 N--CA 1.449 -0.476 0 N-CA-C 106.645 -1.613 . . . . 0.0 106.645 -172.346 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 93' ' ' ASP . . . . . . . . . . . . . 4.1 m-20 -142.21 85.97 1.94 Allowed 'General case' 0 C--O 1.232 0.169 0 N-CA-C 107.893 -1.151 . . . . 0.0 107.893 -174.098 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 94' ' ' LEU . . . . . . . . . . . . . 42.7 tp -77.9 111.08 13.38 Favored 'General case' 0 N--CA 1.461 0.118 0 N-CA-C 107.474 -1.306 . . . . 0.0 107.474 169.891 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 95' ' ' THR . . . . . . . . . . . . . 8.9 t -77.73 -176.38 4.34 Favored 'General case' 0 CA--C 1.535 0.402 0 N-CA-C 109.292 -0.633 . . . . 0.0 109.292 165.258 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 96' ' ' ALA . . . . . . . . . . . . . . . -44.17 -41.1 5.49 Favored 'General case' 0 CA--C 1.532 0.27 0 C-N-CA 126.58 1.952 . . . . 0.0 113.053 -171.999 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 97' ' ' ASN . . . . . . . . . . . . . 12.9 p30 -161.41 70.25 0.35 Allowed 'General case' 0 N--CA 1.449 -0.516 0 C-N-CA 124.474 1.11 . . . . 0.0 108.174 168.532 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 98' ' ' GLN . . . . . . . . . . . . . 0.3 OUTLIER -170.25 135.31 1.28 Allowed 'General case' 0 N--CA 1.472 0.654 0 C-N-CA 125.836 1.654 . . . . 0.0 107.501 157.582 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 99' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -85.5 112.13 20.63 Favored 'General case' 0 N--CA 1.451 -0.383 0 C-N-CA 123.681 0.792 . . . . 0.0 109.736 174.775 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 100' ' ' THR . . . . . . . . . . . . . 53.4 m -89.42 115.66 27.03 Favored 'General case' 0 C--N 1.324 -0.504 0 N-CA-C 106.338 -1.727 . . . . 0.0 106.338 166.751 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 101' ' ' LEU . . . . . . . . . . . . . 1.7 mm? -109.7 141.67 41.95 Favored 'General case' 0 CA--C 1.507 -0.7 0 C-N-CA 124.656 1.182 . . . . 0.0 108.661 171.892 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 102' ' ' ALA . . . . . . . . . . . . . . . -145.0 143.55 30.56 Favored 'General case' 0 C--O 1.234 0.277 0 O-C-N 124.504 1.128 . . . . 0.0 110.351 178.573 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 103' ' ' THR . . . . . . . . . . . . . 0.6 OUTLIER -158.65 171.84 19.37 Favored 'General case' 0 N--CA 1.443 -0.818 0 C-N-CA 126.868 2.067 . . . . 0.0 108.278 174.35 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 104' ' ' ALA . . . . . . . . . . . . . . . -58.24 -35.39 71.65 Favored 'General case' 0 CA--C 1.533 0.326 0 O-C-N 121.34 -0.85 . . . . 0.0 111.275 178.117 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 105' ' ' LYS . . . . . . . . . . . . . 1.4 mmpt? -55.76 -72.58 0.07 Allowed 'General case' 0 CA--C 1.534 0.337 0 CA-C-O 118.424 -0.798 . . . . 0.0 113.005 170.992 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 106' ' ' GLN . . . . . . . . . . . . . 3.0 pt20 -159.8 -165.12 1.45 Allowed 'General case' 0 CA--C 1.536 0.41 0 C-N-CA 124.215 1.006 . . . . 0.0 110.129 -174.301 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 107' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -134.26 134.22 41.7 Favored 'General case' 0 CA--C 1.537 0.449 0 C-N-CA 126.564 1.945 . . . . 0.0 106.445 -179.5 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 108' ' ' LEU . . . . . . . . . . . . . 3.8 mm? -112.14 156.65 21.93 Favored 'General case' 0 C--O 1.235 0.315 0 C-N-CA 124.867 1.267 . . . . 0.0 109.065 174.585 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 109' ' ' THR . . . . . . . . . . . . . 3.3 m -127.52 87.77 2.68 Favored 'General case' 0 C--O 1.237 0.408 0 N-CA-C 105.946 -1.872 . . . . 0.0 105.946 -177.097 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 110' ' ' TYR . . . . . . . . . . . . . 91.4 m-85 -91.54 139.01 31.12 Favored 'General case' 0 CA--C 1.531 0.217 0 N-CA-C 109.42 -0.585 . . . . 0.0 109.42 -175.344 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 111' ' ' LYS . . . . . 0.41 ' HE2' ' HG2' ' A' ' 15' ' ' GLU . 2.5 tppt? -94.61 141.69 28.32 Favored 'General case' 0 N--CA 1.464 0.234 0 C-N-CA 123.733 0.813 . . . . 0.0 108.894 -178.47 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 112' ' ' LEU . . . . . . . . . . . . . 19.8 tp -75.07 49.67 0.45 Allowed 'General case' 0 CA--C 1.544 0.713 0 C-N-CA 126.572 1.949 . . . . 0.0 110.078 173.48 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 113' ' ' ALA . . . . . . . . . . . . . . . -84.25 78.46 9.78 Favored 'General case' 0 C--O 1.234 0.261 0 O-C-N 119.771 -1.83 . . . . 0.0 108.709 177.366 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 114' ' ' ASP . . . . . . . . . . . . . 1.9 p-10 -102.26 15.38 29.31 Favored 'General case' 0 C--N 1.328 -0.341 0 C-N-CA 124.098 0.959 . . . . 0.0 113.231 -170.759 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 115' ' ' LEU . . . . . . . . . . . . . 33.2 mt 65.9 4.91 3.17 Favored 'General case' 0 N--CA 1.467 0.397 0 C-N-CA 127.956 2.503 . . . . 0.0 114.229 177.005 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 116' ' ' MET . . . . . . . . . . . . . 7.8 tpt -97.21 93.47 6.55 Favored 'General case' 0 N--CA 1.45 -0.433 0 N-CA-C 107.085 -1.45 . . . . 0.0 107.085 179.618 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 117' ' ' ASN . . . . . . . . . . . . . 19.1 m-20 . . . . . 0 N--CA 1.467 0.412 0 O-C-N 121.581 -0.7 . . . . 0.0 110.783 -179.745 . . . . . . . . 0 0 . 1 . 003 nuclear orig full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 C--O 1.234 0.239 0 N-CA-C 114.106 1.15 . . . . 0.0 114.106 . . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 2' ' ' VAL . . . . . . . . . . . . 0.267 10.0 p 54.68 165.7 0.0 OUTLIER 'Isoleucine or valine' 0 CA--C 1.547 0.857 0 C-N-CA 129.588 3.155 . . . . 0.0 111.705 -170.223 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 3' ' ' THR . . . . . . . . . . . . . 25.3 p -130.01 155.77 80.14 Favored Pre-proline 0 CA--C 1.533 0.307 0 O-C-N 119.628 -1.92 . . . . 0.0 109.774 170.942 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 4' ' ' PRO . . . . . . . . . . . . . 58.2 Cg_endo -62.28 -33.11 81.66 Favored 'Trans proline' 0 C--N 1.345 0.386 0 C-N-CA 124.139 3.226 . . . . 0.0 112.221 178.217 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 5' ' ' GLU . . . . . . . . . . . . . 11.8 tt0 -51.68 -36.29 45.89 Favored 'General case' 0 C--N 1.318 -0.778 0 C-N-CA 125.2 1.4 . . . . 0.0 112.197 171.343 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 6' ' ' GLN . . . . . . . . . . . . . 6.4 mt-30 -73.04 10.67 0.86 Allowed 'General case' 0 CA--C 1.545 0.783 0 C-N-CA 123.7 0.8 . . . . 0.0 112.265 173.725 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 7' ' ' LEU . . . . . . . . . . . . . 97.7 mt -136.54 -50.61 0.68 Allowed 'General case' 0 C--O 1.223 -0.335 0 C-N-CA 125.103 1.361 . . . . 0.0 112.56 -172.503 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 8' ' ' GLN . . . . . . . . . . . . . 1.8 mt-30 -53.01 -8.32 0.1 Allowed 'General case' 0 N--CA 1.481 1.106 0 C-N-CA 126.163 1.785 . . . . 0.0 115.748 -174.993 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 9' ' ' HIS . . . . . . . . . . . . . 98.1 m-70 -131.09 7.14 4.63 Favored 'General case' 0 CA--C 1.537 0.48 0 C-N-CA 125.017 1.327 . . . . 0.0 112.763 177.581 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 10' ' ' HIS . . . . . . . . . . . . . 95.1 m-70 -130.57 116.8 18.64 Favored 'General case' 0 C--O 1.233 0.212 0 C-N-CA 125.247 1.419 . . . . 0.0 110.464 -169.537 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 11' ' ' ARG . . . . . . . . . . . . . 32.3 ttm-85 -70.15 155.12 41.08 Favored 'General case' 0 CA--C 1.518 -0.263 0 C-N-CA 124.406 1.082 . . . . 0.0 108.64 169.656 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 12' ' ' PHE . . . . . . . . . . . . . 74.9 m-85 -139.06 153.87 48.12 Favored 'General case' 0 CA--C 1.501 -0.923 0 CA-C-O 122.732 1.253 . . . . 0.0 109.233 163.809 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 13' ' ' VAL . . . . . . . . . . . . . 0.0 OUTLIER -130.3 135.13 61.37 Favored 'Isoleucine or valine' 0 CA--C 1.494 -1.187 0 CA-C-N 113.286 -1.779 . . . . 0.0 114.99 -173.81 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 14' ' ' LEU . . . . . . . . . . . . . 2.2 tt -65.09 110.84 2.65 Favored 'General case' 0 CA--C 1.497 -1.091 0 O-C-N 126.135 2.147 . . . . 0.0 109.135 -173.144 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 0.9 OUTLIER -94.3 -52.46 4.34 Favored 'General case' 0 N--CA 1.426 -1.665 0 O-C-N 125.576 1.797 . . . . 0.0 108.446 -168.913 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 16' ' ' SER . . . . . 0.429 ' HA ' ' HA ' ' A' ' 21' ' ' PRO . 87.1 p -139.94 150.41 44.5 Favored 'General case' 0 N--CA 1.444 -0.738 0 CA-C-N 115.523 -0.762 . . . . 0.0 110.569 166.536 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 17' ' ' VAL . . . . . . . . . . . . . 2.7 t -83.8 178.35 0.55 Allowed 'Isoleucine or valine' 0 N--CA 1.443 -0.779 0 N-CA-C 107.251 -1.389 . . . . 0.0 107.251 176.334 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 18' ' ' ASN . . . . . . . . . . . . . 0.0 OUTLIER -50.44 -28.65 8.63 Favored 'General case' 0 N--CA 1.464 0.273 0 N-CA-C 114.633 1.346 . . . . 0.0 114.633 -178.812 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . -104.31 -76.96 1.13 Allowed Glycine 0 N--CA 1.445 -0.712 0 N-CA-C 109.652 -1.379 . . . . 0.0 109.652 171.167 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 16.3 mttt -125.07 165.73 24.28 Favored Pre-proline 0 N--CA 1.466 0.345 0 C-N-CA 124.702 1.201 . . . . 0.0 112.318 -167.473 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 21' ' ' PRO . . . . . 0.429 ' HA ' ' HA ' ' A' ' 16' ' ' SER . 56.1 Cg_endo -61.8 167.85 9.59 Favored 'Trans proline' 0 N--CA 1.458 -0.617 0 C-N-CA 123.607 2.871 . . . . 0.0 113.142 170.126 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 22' ' ' VAL . . . . . . . . . . . . . 7.9 p -141.1 157.47 22.52 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.357 0 C-N-CA 127.733 2.413 . . . . 0.0 105.731 -178.419 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 23' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -145.89 91.82 2.13 Favored 'General case' 0 C--O 1.236 0.38 0 N-CA-C 108.571 -0.9 . . . . 0.0 108.571 176.539 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 24' ' ' SER . . . . . . . . . . . . . 61.1 m -77.64 49.2 0.73 Allowed 'General case' 0 CA--C 1.533 0.29 0 C-N-CA 125.284 1.434 . . . . 0.0 110.271 178.467 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 25' ' ' ASP . . . . . . . . . . . . . 0.7 OUTLIER 56.8 -84.46 0.02 OUTLIER 'General case' 0 CA--C 1.514 -0.408 0 C-N-CA 127.728 2.411 . . . . 0.0 110.536 -169.602 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 26' ' ' LYS . . . . . . . . . . . . . 35.5 tttt -142.74 3.91 1.47 Allowed 'General case' 0 C--N 1.325 -0.483 0 C-N-CA 127.957 2.503 . . . . 0.0 110.29 -168.342 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 27' ' ' ASN . . . . . . . . . . . . . 70.6 m-80 -122.05 62.98 15.77 Favored Pre-proline 0 N--CA 1.453 -0.281 0 C-N-CA 127.156 2.182 . . . . 0.0 107.207 -173.165 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 28' ' ' PRO . . . . . . . . . . . . . 65.7 Cg_endo -64.54 159.14 46.06 Favored 'Trans proline' 0 C--O 1.24 0.622 0 C-N-CA 122.615 2.21 . . . . 0.0 110.864 -172.657 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 29' ' ' PRO . . . . . . . . . . . . . 28.0 Cg_endo -71.99 63.99 3.31 Favored 'Trans proline' 0 N--CA 1.456 -0.682 0 C-N-CA 122.829 2.352 . . . . 0.0 110.048 166.818 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 30' ' ' GLU . . . . . . . . . . . . . 1.6 pt-20 -72.09 166.23 22.71 Favored 'General case' 0 CA--C 1.542 0.664 0 N-CA-C 108.31 -0.996 . . . . 0.0 108.31 177.439 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 31' ' ' ILE . . . . . . . . . . . . . 10.6 tt -138.31 150.66 24.45 Favored 'Isoleucine or valine' 0 N--CA 1.445 -0.711 0 N-CA-C 105.627 -1.99 . . . . 0.0 105.627 172.789 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 32' ' ' SER . . . . . . . . . . . . . 78.0 p -144.97 174.3 11.14 Favored 'General case' 0 N--CA 1.432 -1.359 0 CA-C-O 122.691 1.234 . . . . 0.0 108.907 165.919 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 33' ' ' PHE . . . . . . . . . . . . . 77.0 m-85 -136.31 164.43 28.11 Favored 'General case' 0 N--CA 1.434 -1.246 0 N-CA-C 106.372 -1.714 . . . . 0.0 106.372 -173.371 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 34' ' ' GLY . . . . . . . . . . . . . . . 165.08 -168.83 39.42 Favored Glycine 0 N--CA 1.445 -0.765 0 N-CA-C 110.073 -1.211 . . . . 0.0 110.073 176.918 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 35' ' ' GLU . . . . . . . . . . . . . 3.4 mt-10 63.69 -86.14 0.02 OUTLIER 'General case' 0 C--N 1.331 -0.202 0 C-N-CA 125.813 1.645 . . . . 0.0 110.064 -178.396 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 29.7 mtpt -154.42 72.31 0.86 Allowed 'General case' 0 N--CA 1.44 -0.965 0 C-N-CA 126.926 2.09 . . . . 0.0 110.67 -176.277 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 37' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER 55.72 26.68 9.69 Favored 'General case' 0 CA--C 1.539 0.543 0 C-N-CA 123.998 0.919 . . . . 0.0 109.428 -178.036 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 38' ' ' MET . . . . . . . . . . . . . 10.4 mtp -73.82 164.89 26.04 Favored 'General case' 0 N--CA 1.448 -0.557 0 N-CA-C 108.246 -1.02 . . . . 0.0 108.246 172.279 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 39' ' ' ILE . . . . . . . . . . . . . 34.1 mt -135.93 134.4 50.85 Favored 'Isoleucine or valine' 0 C--O 1.235 0.323 0 N-CA-C 108.163 -1.051 . . . . 0.0 108.163 -178.428 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 40' ' ' SER . . . . . . . . . . . . . 34.5 t -142.02 144.83 33.83 Favored 'General case' 0 CA--C 1.536 0.405 0 C-N-CA 125.051 1.34 . . . . 0.0 108.824 177.377 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 41' ' ' GLY . . . . . . . . . . . . . . . -177.64 -176.35 45.6 Favored Glycine 0 CA--C 1.528 0.845 0 N-CA-C 111.333 -0.707 . . . . 0.0 111.333 177.98 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 42' ' ' SER . . . . . . . . . . . . . 34.0 p -143.81 80.3 1.65 Allowed 'General case' 0 CA--C 1.538 0.497 0 C-N-CA 123.007 0.523 . . . . 0.0 111.829 -171.89 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 43' ' ' MET . . . . . . . . . . . . . 3.1 mmt -63.79 -59.75 4.16 Favored 'General case' 0 N--CA 1.472 0.662 0 O-C-N 121.107 -0.996 . . . . 0.0 109.918 173.76 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 44' ' ' CYS . . . . . 1.288 ' SG ' ' SG ' ' A' ' 70' ' ' CYS . 41.9 t -129.06 -66.0 0.84 Allowed 'General case' 0 N--CA 1.451 -0.383 0 N-CA-C 108.156 -1.053 . . . . 0.0 108.156 151.298 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 45' ' ' ASN . . . . . . . . . . . . . 0.6 OUTLIER -87.84 19.78 3.36 Favored 'General case' 0 C--N 1.33 -0.259 0 N-CA-C 114.215 1.191 . . . . 0.0 114.215 -152.242 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 46' ' ' ARG . . . . . . . . . . . . . 17.4 mmm-85 57.46 162.74 0.03 OUTLIER 'General case' 0 CA--C 1.52 -0.178 0 C-N-CA 128.823 2.849 . . . . 0.0 112.025 -158.385 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 47' ' ' PHE . . . . . . . . . . . . . 53.9 p90 -158.28 162.4 37.77 Favored 'General case' 0 C--O 1.242 0.678 0 C-N-CA 125.513 1.525 . . . . 0.0 107.163 172.361 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 48' ' ' SER . . . . . . . . . . . . . 2.5 p -167.87 142.24 3.55 Favored 'General case' 0 C--O 1.236 0.381 0 C-N-CA 123.747 0.819 . . . . 0.0 109.073 -178.01 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 49' ' ' GLY . . . . . . . . . . . . . . . -171.12 169.63 42.62 Favored Glycine 0 C--N 1.337 0.633 0 CA-C-N 119.979 1.263 . . . . 0.0 110.648 -177.661 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 50' ' ' GLU . . . . . . . . . . . . . 36.7 mt-10 -83.01 102.55 11.83 Favored 'General case' 0 N--CA 1.446 -0.632 0 N-CA-C 106.412 -1.699 . . . . 0.0 106.412 177.767 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 51' ' ' GLY . . . . . . . . . . . . . . . -64.16 167.08 27.8 Favored Glycine 0 CA--C 1.528 0.85 0 CA-C-O 122.705 1.169 . . . . 0.0 112.859 165.312 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 52' ' ' LYS . . . . . . . . . . . . . 60.6 tttm -152.97 140.36 19.62 Favored 'General case' 0 C--N 1.331 -0.232 0 N-CA-C 105.543 -2.021 . . . . 0.0 105.543 164.538 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 53' ' ' LEU . . . . . . . . . . . . . 15.2 tp -142.37 133.23 25.65 Favored 'General case' 0 CA--C 1.52 -0.173 0 C-N-CA 123.968 0.907 . . . . 0.0 108.745 179.09 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER -149.52 -38.62 0.15 Allowed 'General case' 0 CA--C 1.541 0.616 0 C-N-CA 125.54 1.536 . . . . 0.0 110.144 177.489 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 55' ' ' ASN . . . . . . . . . . . . . 2.6 t30 -124.38 7.0 8.36 Favored 'General case' 0 N--CA 1.471 0.583 0 N-CA-C 115.49 1.663 . . . . 0.0 115.49 -157.115 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 56' ' ' GLY . . . . . . . . . . . . . . . 90.22 13.16 60.67 Favored Glycine 0 N--CA 1.468 0.769 0 O-C-N 121.185 -0.947 . . . . 0.0 112.148 -166.013 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 57' ' ' GLU . . . . . . . . . . . . . 42.3 tt0 -130.16 144.4 51.34 Favored 'General case' 0 N--CA 1.446 -0.663 0 C-N-CA 124.652 1.181 . . . . 0.0 109.036 179.326 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 58' ' ' LEU . . . . . . . . . . . . . 5.1 tp -127.99 159.11 36.02 Favored 'General case' 0 N--CA 1.447 -0.618 0 C-N-CA 126.376 1.87 . . . . 0.0 108.788 178.878 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 59' ' ' THR . . . . . . . . . . . . . 0.7 OUTLIER -141.61 174.98 10.05 Favored 'General case' 0 C--N 1.321 -0.649 0 C-N-CA 125.936 1.695 . . . . 0.0 106.988 171.201 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 60' ' ' ALA . . . . . . . . . . . . . . . -134.39 99.91 4.51 Favored 'General case' 0 CA--C 1.516 -0.337 0 N-CA-C 108.043 -1.095 . . . . 0.0 108.043 160.085 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 61' ' ' LYS . . . . . 0.409 ' HE2' ' N ' ' A' ' 62' ' ' GLY . 0.2 OUTLIER -55.74 123.19 13.32 Favored 'General case' 0 C--O 1.234 0.27 0 N-CA-C 107.06 -1.459 . . . . 0.0 107.06 172.017 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' A' A ' 62' ' ' GLY . . . . . 0.409 ' N ' ' HE2' ' A' ' 61' ' ' LYS . . . 96.23 -59.67 1.37 Allowed Glycine 0 CA--C 1.525 0.664 0 C-N-CA 124.981 1.276 . . . . 0.0 111.586 166.109 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 63' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER 47.07 90.69 0.02 OUTLIER 'General case' 0 CA--C 1.537 0.447 0 C-N-CA 129.187 2.995 . . . . 0.0 114.425 -178.003 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 64' ' ' ALA . . . . . . . . . . . . . . . -88.48 104.53 16.89 Favored 'General case' 0 C--O 1.237 0.411 0 C-N-CA 124.126 0.97 . . . . 0.0 111.026 -178.462 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 65' ' ' MET . . . . . . . . . . . . . 54.8 mtp -97.48 176.47 5.85 Favored 'General case' 0 N--CA 1.471 0.599 0 C-N-CA 123.622 0.769 . . . . 0.0 110.188 172.487 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 66' ' ' THR . . . . . . . . . . . . 0.348 1.5 p -113.77 -164.92 0.96 Allowed 'General case' 0 CA--C 1.556 1.193 0 C-N-CA 124.101 0.96 . . . . 0.0 110.171 178.214 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 67' ' ' ARG . . . . . . . . . . . . . 16.2 mtt180 -136.52 30.94 2.86 Favored 'General case' 0 N--CA 1.489 1.476 0 CA-C-N 120.816 1.644 . . . . 0.0 114.429 -170.808 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 68' ' ' MET . . . . . . . . . . . . . 44.1 mtm -77.81 176.71 8.8 Favored 'General case' 0 CA--C 1.537 0.471 0 O-C-N 120.265 -1.522 . . . . 0.0 111.206 176.646 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 69' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -86.01 170.17 12.52 Favored 'General case' 0 C--O 1.243 0.758 0 C-N-CA 128.693 2.797 . . . . 0.0 108.479 165.842 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 70' ' ' CYS . . . . . 1.288 ' SG ' ' SG ' ' A' ' 44' ' ' CYS . 0.1 OUTLIER -110.02 -177.86 3.37 Favored 'General case' 0 N--CA 1.454 -0.267 0 C-N-CA 125.847 1.659 . . . . 0.0 112.83 -177.869 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' A' A ' 71' ' ' ALA . . . . . . . . . . . . . . . -104.24 -12.45 16.65 Favored 'General case' 0 N--CA 1.466 0.328 0 N-CA-C 112.163 0.431 . . . . 0.0 112.163 165.5 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 72' ' ' ASN . . . . . . . . . . . . . 52.7 t30 -156.07 143.12 13.64 Favored Pre-proline 0 N--CA 1.466 0.357 0 N-CA-C 107.503 -1.295 . . . . 0.0 107.503 -174.353 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 73' ' ' PRO . . . . . . . . . . . . . 38.9 Cg_endo -75.67 -33.52 3.9 Favored 'Trans proline' 0 C--N 1.345 0.342 0 C-N-CA 121.736 1.624 . . . . 0.0 111.447 -167.627 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 74' ' ' GLN . . . . . . . . . . . . . 20.7 tt0 -57.92 -32.91 68.23 Favored 'General case' 0 CA--C 1.535 0.377 0 C-N-CA 124.638 1.175 . . . . 0.0 112.065 177.952 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 75' ' ' LEU . . . . . 0.472 ' HB2' ' SG ' ' A' ' 70' ' ' CYS . 82.3 mt -70.03 -43.34 71.5 Favored 'General case' 0 N--CA 1.465 0.301 0 O-C-N 121.83 -0.544 . . . . 0.0 110.129 172.648 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 76' ' ' ASN . . . . . . . . . . . . . 3.3 t-20 -68.24 -8.02 35.59 Favored 'General case' 0 CA--C 1.532 0.278 0 C-N-CA 125.681 1.592 . . . . 0.0 112.017 -178.913 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 77' ' ' GLU . . . . . . . . . . . . . 32.8 tt0 -102.46 -48.13 4.25 Favored 'General case' 0 N--CA 1.45 -0.459 0 C-N-CA 127.227 2.211 . . . . 0.0 109.295 178.39 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 78' ' ' LEU . . . . . . . . . . . . . 0.9 OUTLIER -58.02 -25.04 60.61 Favored 'General case' 0 N--CA 1.468 0.443 0 C-N-CA 124.083 0.953 . . . . 0.0 112.762 171.095 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 79' ' ' ASP . . . . . . . . . . . . . 13.4 t70 -46.0 -54.98 7.47 Favored 'General case' 0 N--CA 1.443 -0.777 0 C-N-CA 126.464 1.906 . . . . 0.0 111.236 166.952 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 80' ' ' ASN . . . . . . . . . . . . . 76.8 m-20 -78.77 -34.44 45.62 Favored 'General case' 0 N--CA 1.453 -0.312 0 CA-C-O 118.743 -0.646 . . . . 0.0 109.499 -174.093 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 81' ' ' THR . . . . . . . . . . . . . 13.7 m -49.72 -59.32 3.92 Favored 'General case' 0 CA--C 1.535 0.391 0 C-N-CA 123.898 0.879 . . . . 0.0 110.334 171.088 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 82' ' ' ILE . . . . . . . . . . . . . 7.8 tp -63.49 -35.79 73.82 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.393 0 CA-C-N 119.608 1.095 . . . . 0.0 110.667 -174.291 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 83' ' ' SER . . . . . . . . . . . . . 0.5 OUTLIER -66.78 -12.56 59.29 Favored 'General case' 0 C--O 1.234 0.277 0 C-N-CA 127.345 2.258 . . . . 0.0 113.939 179.128 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 84' ' ' GLU . . . . . . . . . . . . . 89.3 tt0 -114.79 -22.47 9.65 Favored 'General case' 0 C--N 1.324 -0.512 0 C-N-CA 124.888 1.275 . . . . 0.0 111.351 179.902 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 85' ' ' MET . . . . . . . . . . . . . 87.9 mtp -73.04 -55.17 6.88 Favored 'General case' 0 C--O 1.23 0.056 0 CA-C-O 122.682 1.23 . . . . 0.0 108.81 178.375 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 86' ' ' LEU . . . . . . . . . . . . . 1.4 mm? -73.92 -17.56 61.01 Favored 'General case' 0 N--CA 1.454 -0.233 0 C-N-CA 124.979 1.312 . . . . 0.0 111.654 -167.791 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 87' ' ' LYS . . . . . . . . . . . . . 25.1 tttt -72.14 -48.79 41.02 Favored 'General case' 0 N--CA 1.447 -0.603 0 C-N-CA 124.201 1.0 . . . . 0.0 109.156 177.667 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 88' ' ' GLU . . . . . . . . . . . . . 1.9 mm-40 -69.84 -62.9 1.2 Allowed 'General case' 0 N--CA 1.448 -0.548 0 O-C-N 124.254 0.971 . . . . 0.0 108.426 -178.806 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 89' ' ' GLY . . . . . . . . . . . . . . . 144.72 110.27 0.69 Allowed Glycine 0 C--N 1.336 0.557 0 N-CA-C 109.179 -1.568 . . . . 0.0 109.179 -176.276 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 90' ' ' ALA . . . . . . . . . . . . . . . -91.45 142.99 27.08 Favored 'General case' 0 C--N 1.333 -0.119 0 C-N-CA 124.061 0.945 . . . . 0.0 109.06 -178.807 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 91' ' ' GLN . . . . . . . . . . . . . 6.8 mm-40 -74.49 142.33 44.85 Favored 'General case' 0 N--CA 1.443 -0.824 0 N-CA-C 105.752 -1.944 . . . . 0.0 105.752 161.098 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 92' ' ' VAL . . . . . . . . . . . . . 26.6 t -137.45 107.71 5.17 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.491 0 N-CA-C 105.068 -2.197 . . . . 0.0 105.068 -170.761 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 93' ' ' ASP . . . . . . . . . . . . . 2.1 t0 -127.19 97.61 4.99 Favored 'General case' 0 N--CA 1.448 -0.527 0 N-CA-C 108.085 -1.08 . . . . 0.0 108.085 -157.148 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 94' ' ' LEU . . . . . . . . . . . . . 55.9 tp -98.24 104.15 16.16 Favored 'General case' 0 CA--C 1.511 -0.535 0 CA-C-O 122.046 0.927 . . . . 0.0 109.247 -175.045 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 95' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -65.67 174.19 2.43 Favored 'General case' 0 C--N 1.319 -0.726 0 CA-C-N 113.633 -1.621 . . . . 0.0 109.569 167.605 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 96' ' ' ALA . . . . . . . . . . . . . . . -48.51 -33.24 9.18 Favored 'General case' 0 CA--C 1.539 0.55 0 O-C-N 120.826 -1.172 . . . . 0.0 113.856 -172.565 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 97' ' ' ASN . . . . . . . . . . . . . 23.8 p30 -151.41 17.94 0.73 Allowed 'General case' 0 CA--C 1.539 0.526 0 C-N-CA 125.145 1.378 . . . . 0.0 113.559 172.324 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 98' ' ' GLN . . . . . . . . . . . . . 21.5 tt0 -137.32 121.04 17.39 Favored 'General case' 0 N--CA 1.461 0.119 0 O-C-N 120.821 -1.174 . . . . 0.0 110.654 177.323 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 99' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -69.19 140.86 54.62 Favored 'General case' 0 N--CA 1.451 -0.408 0 C-N-CA 126.019 1.728 . . . . 0.0 109.183 169.479 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 100' ' ' THR . . . . . . . . . . . . . 2.5 m -133.65 130.65 38.55 Favored 'General case' 0 C--N 1.323 -0.567 0 N-CA-C 106.795 -1.558 . . . . 0.0 106.795 167.789 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 101' ' ' LEU . . . . . . . . . . . . . 2.6 mp -108.97 158.67 17.48 Favored 'General case' 0 CA--C 1.509 -0.609 0 C-N-CA 125.209 1.404 . . . . 0.0 110.458 174.856 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 102' ' ' ALA . . . . . . . . . . . . . . . -152.18 158.56 43.07 Favored 'General case' 0 C--N 1.327 -0.385 0 C-N-CA 124.559 1.144 . . . . 0.0 108.228 164.558 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 103' ' ' THR . . . . . . . . . . . . . 1.3 m -157.24 -172.08 3.87 Favored 'General case' 0 N--CA 1.441 -0.916 0 C-N-CA 127.484 2.314 . . . . 0.0 105.659 167.141 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 104' ' ' ALA . . . . . . . . . . . . . . . -62.3 -35.48 79.17 Favored 'General case' 0 C--N 1.34 0.196 0 CA-C-N 119.918 1.235 . . . . 0.0 111.536 168.623 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 105' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -59.74 -79.83 0.03 OUTLIER 'General case' 0 C--N 1.339 0.123 0 C-N-CA 123.59 0.756 . . . . 0.0 110.712 -178.03 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 106' ' ' GLN . . . . . . . . . . . . . 26.0 mt-30 -151.53 -176.88 5.78 Favored 'General case' 0 CA--C 1.536 0.424 0 C-N-CA 125.89 1.676 . . . . 0.0 107.301 -169.672 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 107' ' ' THR . . . . . . . . . . . . . 0.1 OUTLIER -138.56 134.47 33.9 Favored 'General case' 0 N--CA 1.453 -0.314 0 C-N-CA 125.943 1.697 . . . . 0.0 106.571 -177.222 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 108' ' ' LEU . . . . . . . . . . . . . 1.5 mm? -125.75 158.48 34.81 Favored 'General case' 0 C--O 1.233 0.197 0 C-N-CA 124.345 1.058 . . . . 0.0 108.401 179.413 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 109' ' ' THR . . . . . . . . . . . . . 27.8 m -122.63 137.52 54.88 Favored 'General case' 0 C--O 1.236 0.356 0 N-CA-C 107.797 -1.186 . . . . 0.0 107.797 177.086 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 110' ' ' TYR . . . . . . . . . . . . . 4.4 m-85 -135.92 145.19 46.0 Favored 'General case' 0 CA--C 1.535 0.395 0 C-N-CA 124.107 0.963 . . . . 0.0 111.761 -178.815 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 111' ' ' LYS . . . . . . . . . . . . . 4.1 tppt? -90.23 150.78 21.82 Favored 'General case' 0 N--CA 1.474 0.764 0 O-C-N 120.82 -1.175 . . . . 0.0 110.806 -179.367 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 112' ' ' LEU . . . . . . . . . . . . . 35.7 tp -74.6 46.47 0.28 Allowed 'General case' 0 CA--C 1.541 0.626 0 C-N-CA 124.792 1.237 . . . . 0.0 109.881 158.653 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 113' ' ' ALA . . . . . . . . . . . . . . . -84.02 102.34 12.42 Favored 'General case' 0 N--CA 1.444 -0.775 0 N-CA-C 104.383 -2.451 . . . . 0.0 104.383 162.147 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 114' ' ' ASP . . . . . 0.408 ' C ' ' H ' ' A' ' 116' ' ' MET . 57.2 t0 -120.93 64.06 0.86 Allowed 'General case' 0 CA--C 1.516 -0.331 0 CA-C-O 122.287 1.041 . . . . 0.0 109.495 170.278 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 115' ' ' LEU . . . . . . . . . . . . . 57.6 mt 57.51 4.53 0.24 Allowed 'General case' 0 C--O 1.234 0.254 0 C-N-CA 128.178 2.591 . . . . 0.0 114.964 179.28 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 116' ' ' MET . . . . . 0.408 ' H ' ' C ' ' A' ' 114' ' ' ASP . 6.9 ttp 55.97 76.52 0.28 Allowed 'General case' 0 CA--C 1.53 0.179 0 C-N-CA 124.878 1.271 . . . . 0.0 108.709 -159.179 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 117' ' ' ASN . . . . . . . . . . . . . 2.8 t30 . . . . . 0 C--O 1.242 0.659 0 C-N-CA 124.13 0.972 . . . . 0.0 110.05 -178.062 . . . . . . . . 0 0 . 1 . 004 nuclear orig full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 10.0 tpt . . . . . 0 C--O 1.235 0.326 0 N-CA-C 107.325 -1.361 . . . . 0.0 107.325 . . . . . . . . . 0 0 . 1 . 004 nuclear orig full ' A' A ' 2' ' ' VAL . . . . . . . . . . . . . 2.3 p -59.87 144.56 12.7 Favored 'Isoleucine or valine' 0 C--O 1.234 0.243 0 N-CA-C 108.399 -0.963 . . . . 0.0 108.399 170.227 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 3' ' ' THR . . . . . . . . . . . . . 0.6 OUTLIER -110.42 153.83 43.27 Favored Pre-proline 0 N--CA 1.445 -0.723 0 C-N-CA 123.163 0.585 . . . . 0.0 110.756 172.521 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 4' ' ' PRO . . . . . . . . . . . . . 52.7 Cg_endo -64.95 -33.73 50.66 Favored 'Trans proline' 0 N--CA 1.461 -0.386 0 C-N-CA 123.825 3.017 . . . . 0.0 111.91 -179.263 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 5' ' ' GLU . . . . . . . . . . . . . 65.3 tt0 -49.77 -35.32 22.08 Favored 'General case' 0 CA--C 1.549 0.928 0 C-N-CA 124.216 1.006 . . . . 0.0 111.647 169.759 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 6' ' ' GLN . . . . . . . . . . . . . 11.3 mt-30 -72.46 5.62 2.87 Favored 'General case' 0 CA--C 1.539 0.543 0 O-C-N 120.955 -1.091 . . . . 0.0 112.886 176.08 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 7' ' ' LEU . . . . . . . . . . . . . 93.6 mt -131.52 -54.91 1.02 Allowed 'General case' 0 C--O 1.225 -0.229 0 C-N-CA 125.533 1.533 . . . . 0.0 110.368 -171.615 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 8' ' ' GLN . . . . . . . . . . . . . 4.9 mt-30 -55.41 -6.72 0.19 Allowed 'General case' 0 N--CA 1.479 0.992 0 C-N-CA 127.686 2.394 . . . . 0.0 115.736 -172.815 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 9' ' ' HIS . . . . . . . . . . . . . 76.1 m-70 -139.38 30.31 2.16 Favored 'General case' 0 CA--C 1.54 0.558 0 C-N-CA 125.428 1.491 . . . . 0.0 111.491 178.394 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 10' ' ' HIS . . . . . . . . . . . . . 94.4 m-70 -140.87 142.18 34.55 Favored 'General case' 0 CA--C 1.534 0.344 0 C-N-CA 124.636 1.174 . . . . 0.0 110.917 176.891 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 11' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -88.5 149.03 23.85 Favored 'General case' 0 N--CA 1.463 0.19 0 C-N-CA 124.452 1.101 . . . . 0.0 108.824 167.669 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 12' ' ' PHE . . . . . . . . . . . . . 82.9 m-85 -139.91 154.57 47.27 Favored 'General case' 0 CA--C 1.494 -1.176 0 CA-C-O 122.525 1.155 . . . . 0.0 108.841 169.712 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 13' ' ' VAL . . . . . 0.426 ' HA ' ' HA ' ' A' ' 30' ' ' GLU . 0.0 OUTLIER -127.84 139.46 51.84 Favored 'Isoleucine or valine' 0 N--CA 1.434 -1.242 0 CA-C-N 113.983 -1.462 . . . . 0.0 107.059 -174.103 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' A' A ' 14' ' ' LEU . . . . . . . . . . . . . 19.1 tp -73.11 97.52 2.39 Favored 'General case' 0 N--CA 1.453 -0.321 0 N-CA-C 106.97 -1.493 . . . . 0.0 106.97 174.463 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 2.9 mm-40 -64.04 -54.88 27.28 Favored 'General case' 0 N--CA 1.451 -0.415 0 N-CA-C 108.434 -0.95 . . . . 0.0 108.434 176.962 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 10.1 m -156.14 153.24 28.99 Favored 'General case' 0 N--CA 1.451 -0.425 0 CA-C-O 121.927 0.87 . . . . 0.0 110.85 -174.011 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 17' ' ' VAL . . . . . . . . . . . . . 1.9 t -111.03 169.24 4.04 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.317 0 C-N-CA 126.097 1.759 . . . . 0.0 107.108 -171.832 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 18' ' ' ASN . . . . . . . . . . . . . 1.7 p-10 -57.32 -2.38 0.11 Allowed 'General case' 0 CA--C 1.54 0.578 0 N-CA-C 116.494 2.035 . . . . 0.0 116.494 179.949 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . -146.67 -2.64 0.55 Allowed Glycine 0 CA--C 1.527 0.793 0 CA-C-N 120.496 1.498 . . . . 0.0 115.8 -178.312 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 10.9 pttm 179.67 162.24 0.81 Allowed Pre-proline 0 N--CA 1.469 0.495 0 CA-C-N 119.952 1.876 . . . . 0.0 109.71 175.245 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 21' ' ' PRO . . . . . . . . . . . . . 55.3 Cg_endo -67.94 179.48 2.74 Favored 'Trans proline' 0 N--CA 1.459 -0.541 0 C-N-CA 123.753 2.969 . . . . 0.0 110.775 170.551 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 22' ' ' VAL . . . . . . . . . . . . . 90.1 t -110.15 153.5 11.91 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.384 0 N-CA-C 109.804 -0.443 . . . . 0.0 109.804 169.638 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 23' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -129.89 105.08 7.76 Favored 'General case' 0 CA--C 1.534 0.345 0 C-N-CA 126.548 1.939 . . . . 0.0 107.515 174.424 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 24' ' ' SER . . . . . . . . . . . . . 10.3 t -163.36 94.01 0.79 Allowed 'General case' 0 C--O 1.234 0.244 0 N-CA-C 108.55 -0.907 . . . . 0.0 108.55 168.633 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 25' ' ' ASP . . . . . . . . . . . . . 11.5 m-20 -79.24 -6.31 56.35 Favored 'General case' 0 CA--C 1.535 0.377 0 O-C-N 121.793 -0.567 . . . . 0.0 111.149 -172.748 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 26' ' ' LYS . . . . . . . . . . . . . 13.6 tttp -116.69 -32.88 5.02 Favored 'General case' 0 N--CA 1.471 0.59 0 CA-C-N 119.621 1.1 . . . . 0.0 113.225 -179.091 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 27' ' ' ASN . . . . . . . . . . . . . 1.4 p30 -138.3 77.41 35.68 Favored Pre-proline 0 C--N 1.323 -0.546 0 C-N-CA 123.848 0.859 . . . . 0.0 109.944 175.157 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 28' ' ' PRO . . . . . . . . . . . . . 70.6 Cg_endo -64.3 155.56 64.86 Favored 'Trans proline' 0 N--CA 1.455 -0.791 0 C-N-CA 121.689 1.592 . . . . 0.0 110.052 174.176 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 29' ' ' PRO . . . . . . . . . . . . . 18.1 Cg_endo -69.24 74.92 1.02 Allowed 'Trans proline' 0 N--CA 1.453 -0.883 0 C-N-CA 123.008 2.472 . . . . 0.0 108.505 159.606 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 30' ' ' GLU . . . . . 0.426 ' HA ' ' HA ' ' A' ' 13' ' ' VAL . 0.1 OUTLIER -87.86 163.98 16.12 Favored 'General case' 0 N--CA 1.446 -0.669 0 N-CA-C 108.391 -0.966 . . . . 0.0 108.391 168.445 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' A' A ' 31' ' ' ILE . . . . . . . . . . . . . 19.1 tt -130.69 142.4 43.76 Favored 'Isoleucine or valine' 0 N--CA 1.437 -1.082 0 C-N-CA 126.79 2.036 . . . . 0.0 105.534 172.658 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 32' ' ' SER . . . . . . . . . . . . . 19.9 m -138.65 163.91 30.87 Favored 'General case' 0 N--CA 1.443 -0.815 0 N-CA-C 106.294 -1.743 . . . . 0.0 106.294 171.347 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 33' ' ' PHE . . . . . . . . . . . . . 96.6 m-85 -144.64 143.28 30.68 Favored 'General case' 0 N--CA 1.439 -0.998 0 N-CA-C 106.043 -1.836 . . . . 0.0 106.043 -167.421 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 34' ' ' GLY . . . . . . . . . . . . . . . -166.39 152.22 21.11 Favored Glycine 0 CA--C 1.518 0.263 0 N-CA-C 109.746 -1.342 . . . . 0.0 109.746 160.958 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 35' ' ' GLU . . . . . . . . . . . . . 3.0 pt-20 44.94 145.93 0.0 OUTLIER 'General case' 0 C--O 1.219 -0.508 1 C-N-CA 134.756 5.222 . . . . 0.0 113.556 -171.864 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 52.8 mtpt 51.19 17.38 0.47 Allowed 'General case' 0 N--CA 1.475 0.818 0 O-C-N 120.002 -1.687 . . . . 0.0 114.852 170.387 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 37' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER 62.57 26.74 15.87 Favored 'General case' 0 CA--C 1.544 0.731 0 CA-C-N 120.432 1.469 . . . . 0.0 113.515 -167.837 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 38' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -63.01 158.75 18.63 Favored 'General case' 0 C--N 1.34 0.185 0 O-C-N 119.702 -1.873 . . . . 0.0 110.326 173.589 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 39' ' ' ILE . . . . . . . . . . . . . 37.8 mt -134.2 129.3 53.48 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.493 0 N-CA-C 107.261 -1.385 . . . . 0.0 107.261 -167.32 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 40' ' ' SER . . . . . . . . . . . . . 22.5 m -131.32 114.07 14.56 Favored 'General case' 0 N--CA 1.454 -0.251 0 C-N-CA 124.86 1.264 . . . . 0.0 107.928 176.181 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 41' ' ' GLY . . . . . . . . . . . . . . . -154.09 178.94 30.68 Favored Glycine 0 CA--C 1.523 0.576 0 N-CA-C 110.311 -1.116 . . . . 0.0 110.311 -179.226 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 42' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -161.47 92.86 0.91 Allowed 'General case' 0 N--CA 1.451 -0.376 0 O-C-N 121.302 -1.117 . . . . 0.0 108.961 -176.19 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 43' ' ' MET . . . . . . . . . . . . . 34.1 mmm -69.89 -53.0 19.97 Favored 'General case' 0 C--O 1.224 -0.238 0 N-CA-C 108.649 -0.871 . . . . 0.0 108.649 174.92 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 44' ' ' CYS . . . . . 1.287 ' SG ' ' SG ' ' A' ' 70' ' ' CYS . 11.6 t -152.79 -61.74 0.15 Allowed 'General case' 0 CA--C 1.517 -0.304 0 N-CA-C 107.959 -1.126 . . . . 0.0 107.959 176.336 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 45' ' ' ASN . . . . . . . . . . . . . 13.7 m120 -75.25 14.02 0.63 Allowed 'General case' 0 CA--C 1.536 0.41 0 C-N-CA 125.213 1.405 . . . . 0.0 113.109 -174.242 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 46' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER 53.35 169.15 0.02 OUTLIER 'General case' 0 N--CA 1.468 0.454 0 C-N-CA 127.278 2.231 . . . . 0.0 112.073 -157.675 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 47' ' ' PHE . . . . . . . . . . . . . 33.8 p90 -161.81 172.97 15.25 Favored 'General case' 0 C--O 1.24 0.579 0 C-N-CA 124.357 1.063 . . . . 0.0 110.922 164.162 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 48' ' ' SER . . . . . . . . . . . . . 1.7 p -179.89 150.07 0.37 Allowed 'General case' 0 N--CA 1.444 -0.733 0 C-N-CA 126.871 2.068 . . . . 0.0 109.086 178.142 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 49' ' ' GLY . . . . . . . . . . . . . . . 179.71 166.02 34.67 Favored Glycine 0 CA--C 1.525 0.697 0 N-CA-C 110.446 -1.062 . . . . 0.0 110.446 172.486 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 50' ' ' GLU . . . . . . . . . . . . . 19.2 mt-10 -80.17 97.26 6.83 Favored 'General case' 0 C--N 1.332 -0.18 0 C-N-CA 123.967 0.907 . . . . 0.0 108.97 176.451 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 51' ' ' GLY . . . . . . . . . . . . . . . -63.15 177.71 6.71 Favored Glycine 0 CA--C 1.53 0.983 0 C-N-CA 123.976 0.798 . . . . 0.0 112.263 163.689 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 52' ' ' LYS . . . . . . . . . . . . . 78.6 tttt -156.16 159.75 39.28 Favored 'General case' 0 CA--C 1.536 0.413 0 C-N-CA 125.026 1.33 . . . . 0.0 107.949 166.028 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 53' ' ' LEU . . . . . . . . . . . . . 18.6 tp -156.51 90.15 1.15 Allowed 'General case' 0 N--CA 1.466 0.337 0 C-N-CA 124.681 1.193 . . . . 0.0 109.127 175.306 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 16.3 t -139.53 35.46 2.03 Favored 'General case' 0 CA--C 1.534 0.363 0 C-N-CA 124.449 1.1 . . . . 0.0 108.726 -178.119 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 55' ' ' ASN . . . . . . . . . . . . . 3.7 p30 -165.11 -80.5 0.03 OUTLIER 'General case' 0 N--CA 1.452 -0.347 0 C-N-CA 127.597 2.359 . . . . 0.0 105.676 -167.549 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 56' ' ' GLY . . . . . . . . . . . . . . . 163.11 15.66 0.03 OUTLIER Glycine 0 CA--C 1.534 1.224 0 C-N-CA 128.966 3.174 . . . . 0.0 109.686 -173.124 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 57' ' ' GLU . . . . . . . . . . . . . 51.1 tt0 -135.33 131.57 36.58 Favored 'General case' 0 C--N 1.343 0.293 0 N-CA-C 108.026 -1.101 . . . . 0.0 108.026 -166.869 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 58' ' ' LEU . . . . . . . . . . . . . 65.5 tp -111.35 90.31 3.3 Favored 'General case' 0 CA--C 1.533 0.307 0 C-N-CA 126.692 1.997 . . . . 0.0 108.929 -177.102 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 59' ' ' THR . . . . . . . . . . . . . 17.7 p -95.37 131.36 41.58 Favored 'General case' 0 C--O 1.236 0.387 0 C-N-CA 124.29 1.036 . . . . 0.0 108.59 171.244 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 60' ' ' ALA . . . . . . . . . . . . . . . -76.87 137.34 39.1 Favored 'General case' 0 N--CA 1.454 -0.252 0 N-CA-C 108.742 -0.836 . . . . 0.0 108.742 167.27 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 61' ' ' LYS . . . . . . . . . . . . . 72.9 tttt -66.59 -22.86 66.13 Favored 'General case' 0 C--N 1.329 -0.304 0 O-C-N 121.913 -0.492 . . . . 0.0 112.003 172.622 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 62' ' ' GLY . . . . . . . . . . . . . . . 168.93 111.89 0.25 Allowed Glycine 0 C--N 1.332 0.316 0 N-CA-C 107.989 -2.044 . . . . 0.0 107.989 -178.523 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 63' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -77.75 112.81 14.98 Favored 'General case' 0 N--CA 1.454 -0.239 0 N-CA-C 107.621 -1.251 . . . . 0.0 107.621 175.735 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 64' ' ' ALA . . . . . . . . . . . . . . . -90.31 90.77 8.21 Favored 'General case' 0 C--N 1.326 -0.456 0 C-N-CA 124.802 1.241 . . . . 0.0 111.25 168.408 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 65' ' ' MET . . . . . . . . . . . . . 51.7 mtp -94.58 -179.73 4.98 Favored 'General case' 0 CA--C 1.539 0.54 0 O-C-N 120.842 -1.161 . . . . 0.0 109.314 179.513 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 66' ' ' THR . . . . . . . . . . . . . 16.9 p -121.32 -164.51 1.14 Allowed 'General case' 0 CA--C 1.54 0.571 0 O-C-N 120.973 -1.08 . . . . 0.0 109.683 -172.211 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 67' ' ' ARG . . . . . . . . . . . . . 10.9 mmm180 -128.13 51.2 1.99 Allowed 'General case' 0 CA--C 1.542 0.645 0 C-N-CA 125.929 1.692 . . . . 0.0 109.732 -176.049 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 68' ' ' MET . . . . . . . . . . . . . 19.6 ptp -113.17 -176.44 2.9 Favored 'General case' 0 CA--C 1.54 0.563 0 C-N-CA 127.451 2.3 . . . . 0.0 111.292 -179.889 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 69' ' ' MET . . . . . . . . . . . . . 0.4 OUTLIER -140.9 175.67 9.43 Favored 'General case' 0 C--O 1.235 0.308 0 C-N-CA 126.717 2.007 . . . . 0.0 108.905 -178.942 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 70' ' ' CYS . . . . . 1.287 ' SG ' ' SG ' ' A' ' 44' ' ' CYS . 1.1 p -140.33 152.97 46.26 Favored 'General case' 0 C--N 1.33 -0.254 0 C-N-CA 126.544 1.938 . . . . 0.0 109.633 -168.179 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 71' ' ' ALA . . . . . . . . . . . . . . . -79.44 6.63 9.74 Favored 'General case' 0 CA--C 1.534 0.329 0 C-N-CA 124.747 1.219 . . . . 0.0 113.963 -178.202 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 72' ' ' ASN . . . . . . . . . . . . . 24.8 t30 -135.79 143.34 44.19 Favored Pre-proline 0 C--O 1.233 0.192 0 CA-C-N 119.885 1.221 . . . . 0.0 108.023 172.427 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 73' ' ' PRO . . . . . . . . . . . . . 36.7 Cg_endo -75.56 -34.94 3.03 Favored 'Trans proline' 0 N--CA 1.463 -0.314 0 C-N-CA 122.103 1.869 . . . . 0.0 113.071 -169.888 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 74' ' ' GLN . . . . . . . . . . . . . 34.8 tt0 -60.35 -37.34 80.39 Favored 'General case' 0 CA--C 1.537 0.475 0 C-N-CA 123.746 0.818 . . . . 0.0 110.61 175.788 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 75' ' ' LEU . . . . . . . . . . . . . 91.1 mt -59.09 -41.24 87.58 Favored 'General case' 0 N--CA 1.467 0.384 0 CA-C-N 119.421 1.01 . . . . 0.0 109.407 176.461 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 76' ' ' ASN . . . . . . . . . . . . . 0.6 OUTLIER -68.1 -22.11 64.92 Favored 'General case' 0 N--CA 1.466 0.366 0 C-N-CA 124.204 1.002 . . . . 0.0 111.683 -179.661 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 77' ' ' GLU . . . . . . . . . . . . . 1.6 mt-10 -80.36 -41.39 24.82 Favored 'General case' 0 CA--C 1.53 0.187 0 C-N-CA 123.704 0.802 . . . . 0.0 110.51 173.001 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 78' ' ' LEU . . . . . . . . . . . . . 27.5 mt -62.76 -13.01 27.92 Favored 'General case' 0 N--CA 1.464 0.258 0 C-N-CA 124.839 1.256 . . . . 0.0 113.204 -174.098 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 79' ' ' ASP . . . . . . . . . . . . . 4.6 t70 -44.59 -58.58 2.93 Favored 'General case' 0 C--O 1.232 0.135 0 C-N-CA 125.309 1.444 . . . . 0.0 111.18 162.653 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 80' ' ' ASN . . . . . . . . . . . . . 0.7 OUTLIER -68.7 -37.44 79.54 Favored 'General case' 0 CA--C 1.516 -0.36 0 C-N-CA 120.394 -0.522 . . . . 0.0 109.882 -175.469 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 81' ' ' THR . . . . . . . . . . . . . 7.1 m -58.5 -52.97 63.41 Favored 'General case' 0 N--CA 1.447 -0.625 0 N-CA-C 108.689 -0.856 . . . . 0.0 108.689 -175.958 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 82' ' ' ILE . . . . . . . . . . . . . 11.1 tp -68.85 -39.48 80.05 Favored 'Isoleucine or valine' 0 N--CA 1.456 -0.128 0 CA-C-N 119.107 0.867 . . . . 0.0 111.062 -177.319 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 83' ' ' SER . . . . . . . . . . . . . 5.4 t -60.42 -53.02 62.61 Favored 'General case' 0 N--CA 1.451 -0.378 0 N-CA-C 108.915 -0.772 . . . . 0.0 108.915 -175.138 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 84' ' ' GLU . . . . . . . . . . . . . 5.9 mm-40 -61.03 -44.79 96.87 Favored 'General case' 0 N--CA 1.446 -0.671 0 C-N-CA 124.835 1.254 . . . . 0.0 111.142 179.8 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 85' ' ' MET . . . . . . . . . . . . . 90.8 mtp -66.98 -17.51 64.95 Favored 'General case' 0 N--CA 1.451 -0.41 0 CA-C-N 118.023 0.374 . . . . 0.0 110.798 -175.269 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 86' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -105.79 -25.43 12.19 Favored 'General case' 0 N--CA 1.456 -0.137 0 C-N-CA 124.12 0.968 . . . . 0.0 111.754 -177.309 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 87' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -72.81 -55.38 6.79 Favored 'General case' 0 CA--C 1.518 -0.256 0 N-CA-C 108.466 -0.939 . . . . 0.0 108.466 172.456 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 88' ' ' GLU . . . . . . . . . . . . . 54.9 mt-10 -72.72 -28.13 62.47 Favored 'General case' 0 CA--C 1.53 0.184 0 C-N-CA 119.315 -0.954 . . . . 0.0 112.244 -170.788 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 89' ' ' GLY . . . . . . . . . . . . . . . 120.37 95.56 1.51 Allowed Glycine 0 C--N 1.338 0.681 0 C-N-CA 124.361 0.982 . . . . 0.0 110.685 173.996 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 90' ' ' ALA . . . . . . . . . . . . . . . -62.51 134.21 56.07 Favored 'General case' 0 N--CA 1.451 -0.392 0 CA-C-O 118.12 -0.943 . . . . 0.0 108.508 177.286 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 91' ' ' GLN . . . . . . . . . . . . . 11.6 mm-40 -73.87 140.94 46.05 Favored 'General case' 0 C--O 1.239 0.52 0 N-CA-C 104.801 -2.296 . . . . 0.0 104.801 154.998 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 92' ' ' VAL . . . . . . . . . . . . . 7.2 p -132.73 120.3 41.14 Favored 'Isoleucine or valine' 0 N--CA 1.448 -0.546 0 N-CA-C 105.522 -2.029 . . . . 0.0 105.522 -174.134 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 93' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -142.13 90.14 2.23 Favored 'General case' 0 C--N 1.332 -0.184 0 N-CA-C 107.284 -1.376 . . . . 0.0 107.284 -171.23 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 94' ' ' LEU . . . . . . . . . . . . . 1.1 tm? -97.79 110.36 22.94 Favored 'General case' 0 N--CA 1.464 0.252 0 N-CA-C 107.254 -1.387 . . . . 0.0 107.254 -179.29 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 95' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -76.91 -164.68 0.46 Allowed 'General case' 0 CA--C 1.542 0.669 0 C-N-CA 125.162 1.385 . . . . 0.0 109.278 175.313 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 96' ' ' ALA . . . . . . . . . . . . . . . -62.28 -7.25 4.0 Favored 'General case' 0 CA--C 1.541 0.624 0 O-C-N 119.864 -1.772 . . . . 0.0 115.266 -178.106 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 97' ' ' ASN . . . . . . . . . . . . . 2.0 p30 -173.9 4.49 0.01 OUTLIER 'General case' 0 N--CA 1.476 0.844 0 C-N-CA 125.904 1.681 . . . . 0.0 114.521 169.882 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 98' ' ' GLN . . . . . . . . . . . . . 8.6 tt0 -120.28 132.56 55.37 Favored 'General case' 0 N--CA 1.472 0.634 0 CA-C-N 121.011 1.732 . . . . 0.0 108.976 -178.877 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 99' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -98.91 116.25 30.72 Favored 'General case' 0 C--O 1.233 0.231 0 C-N-CA 124.529 1.132 . . . . 0.0 109.385 176.694 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 100' ' ' THR . . . . . . . . . . . . . 26.7 m -93.27 117.66 30.34 Favored 'General case' 0 C--N 1.322 -0.601 0 C-N-CA 125.386 1.474 . . . . 0.0 107.381 170.363 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 101' ' ' LEU . . . . . . . . . . . . . 3.2 mm? -111.19 120.32 41.9 Favored 'General case' 0 N--CA 1.464 0.239 0 N-CA-C 106.803 -1.554 . . . . 0.0 106.803 166.678 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 102' ' ' ALA . . . . . . . . . . . . . . . -123.82 145.9 48.74 Favored 'General case' 0 N--CA 1.467 0.378 0 C-N-CA 124.676 1.19 . . . . 0.0 109.37 169.375 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 103' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -150.99 174.51 13.06 Favored 'General case' 0 N--CA 1.448 -0.53 0 C-N-CA 125.063 1.345 . . . . 0.0 109.796 178.125 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 104' ' ' ALA . . . . . . . . . . . . . . . -51.34 -29.51 15.46 Favored 'General case' 0 CA--C 1.537 0.467 0 C-N-CA 124.948 1.299 . . . . 0.0 113.032 171.846 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 105' ' ' LYS . . . . . . . . . . . . . 3.7 mtpt -80.93 -73.67 0.36 Allowed 'General case' 0 C--N 1.342 0.258 0 O-C-N 121.343 -0.848 . . . . 0.0 110.721 173.95 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 106' ' ' GLN . . . . . . . . . . . . . 29.1 mt-30 -144.26 177.56 8.52 Favored 'General case' 0 C--N 1.329 -0.325 0 C-N-CA 124.103 0.961 . . . . 0.0 108.6 -156.692 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 107' ' ' THR . . . . . . . . . . . . . 1.0 OUTLIER -130.42 142.31 50.51 Favored 'General case' 0 CA--C 1.531 0.222 0 N-CA-C 108.132 -1.062 . . . . 0.0 108.132 170.332 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 108' ' ' LEU . . . . . . . . . . . . . 6.4 mp -126.61 161.89 27.0 Favored 'General case' 0 N--CA 1.447 -0.609 0 C-N-CA 127.657 2.383 . . . . 0.0 108.488 -179.357 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 109' ' ' THR . . . . . . . . . . . . . 1.3 m -131.51 110.06 10.71 Favored 'General case' 0 C--O 1.238 0.46 0 N-CA-C 108.07 -1.085 . . . . 0.0 108.07 174.732 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 110' ' ' TYR . . . . . . . . . . . . . 37.0 m-85 -98.15 163.98 12.51 Favored 'General case' 0 C--O 1.235 0.29 0 N-CA-C 109.143 -0.688 . . . . 0.0 109.143 174.093 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 111' ' ' LYS . . . . . . . . . . . . . 0.7 OUTLIER -131.05 137.61 49.23 Favored 'General case' 0 CA--C 1.521 -0.138 0 C-N-CA 125.371 1.468 . . . . 0.0 109.347 -173.898 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 112' ' ' LEU . . . . . . . . . . . . . 25.6 tp -67.84 62.84 0.08 Allowed 'General case' 0 CA--C 1.542 0.66 0 C-N-CA 128.309 2.644 . . . . 0.0 110.382 168.527 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 113' ' ' ALA . . . . . . . . . . . . . . . -88.46 79.75 7.58 Favored 'General case' 0 CA--C 1.528 0.134 0 N-CA-C 105.909 -1.886 . . . . 0.0 105.909 165.018 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 114' ' ' ASP . . . . . . . . . . . . . 23.4 t0 -82.33 19.07 1.28 Allowed 'General case' 0 CA--C 1.538 0.489 0 C-N-CA 125.324 1.45 . . . . 0.0 112.163 -167.807 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 115' ' ' LEU . . . . . . . . . . . . . 22.5 mt 60.14 17.08 6.52 Favored 'General case' 0 N--CA 1.467 0.388 0 C-N-CA 128.643 2.777 . . . . 0.0 112.626 -170.886 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 116' ' ' MET . . . . . . . . . . . . . 7.5 ttp -149.89 143.82 25.53 Favored 'General case' 0 N--CA 1.444 -0.728 0 N-CA-C 106.289 -1.745 . . . . 0.0 106.289 169.029 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 117' ' ' ASN . . . . . . . . . . . . . 70.9 m-80 . . . . . 0 C--O 1.233 0.212 0 CA-C-O 118.836 -0.602 . . . . 0.0 110.663 -175.008 . . . . . . . . 0 0 . 1 . 005 nuclear orig full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 22.5 ttm . . . . . 0 C--O 1.237 0.424 0 N-CA-C 109.086 -0.709 . . . . 0.0 109.086 . . . . . . . . . 0 0 . 1 . 005 nuclear orig full ' A' A ' 2' ' ' VAL . . . . . . . . . . . . . 11.3 p -67.47 146.21 13.24 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.419 0 N-CA-C 109.517 -0.549 . . . . 0.0 109.517 177.794 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 3' ' ' THR . . . . . . . . . . . . . 6.1 p -135.34 162.57 56.6 Favored Pre-proline 0 CA--C 1.53 0.205 0 O-C-N 121.99 -0.444 . . . . 0.0 110.989 -173.977 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 4' ' ' PRO . . . . . . . . . . . . . 6.2 Cg_endo -59.68 -51.0 6.76 Favored 'Trans proline' 0 N--CA 1.454 -0.814 0 C-N-CA 122.059 1.839 . . . . 0.0 112.886 175.141 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 5' ' ' GLU . . . . . . . . . . . . . 6.5 mt-10 -58.73 -28.51 65.92 Favored 'General case' 0 CA--C 1.534 0.363 0 N-CA-C 113.74 1.015 . . . . 0.0 113.74 -170.747 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 6' ' ' GLN . . . . . . . . . . . . . 17.5 pt20 -79.89 9.08 5.72 Favored 'General case' 0 CA--C 1.533 0.31 0 N-CA-C 113.622 0.971 . . . . 0.0 113.622 175.939 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 7' ' ' LEU . . . . . . . . . . . . . 78.5 mt -127.17 -50.06 1.43 Allowed 'General case' 0 CA--C 1.52 -0.188 0 CA-C-N 119.272 0.942 . . . . 0.0 109.971 -170.322 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 8' ' ' GLN . . . . . . . . . . . . . 2.2 mp0 -55.38 -17.04 4.2 Favored 'General case' 0 N--CA 1.47 0.538 0 N-CA-C 114.985 1.476 . . . . 0.0 114.985 -175.977 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 9' ' ' HIS . . . . . . . . . . . . . 5.8 m170 -124.65 8.11 8.24 Favored 'General case' 0 CA--C 1.54 0.582 0 C-N-CA 124.234 1.014 . . . . 0.0 110.849 -172.582 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 10' ' ' HIS . . . . . . . . . . . . . 73.7 m-70 -131.75 108.68 9.63 Favored 'General case' 0 CA--C 1.533 0.299 0 C-N-CA 125.465 1.506 . . . . 0.0 109.454 -168.564 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 11' ' ' ARG . . . . . . . . . . . . . 1.5 ttt85 -65.61 154.37 38.95 Favored 'General case' 0 N--CA 1.465 0.276 0 C-N-CA 123.156 0.582 . . . . 0.0 110.674 176.676 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 12' ' ' PHE . . . . . . . . . . . . . 59.4 m-85 -131.87 158.0 42.5 Favored 'General case' 0 N--CA 1.447 -0.594 0 C-N-CA 124.47 1.108 . . . . 0.0 109.731 167.882 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 13' ' ' VAL . . . . . 0.408 ' HA ' ' HA ' ' A' ' 30' ' ' GLU . 7.6 p -129.44 136.52 59.14 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.373 0 N-CA-C 108.876 -0.787 . . . . 0.0 108.876 171.128 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 14' ' ' LEU . . . . . . . . . . . . . 20.2 tp -71.26 85.78 0.78 Allowed 'General case' 0 C--O 1.232 0.162 0 N-CA-C 106.784 -1.561 . . . . 0.0 106.784 176.654 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 15' ' ' GLU . . . . . 0.403 ' C ' ' HG ' ' A' ' 16' ' ' SER . 2.7 mm-40 -67.9 -47.26 69.3 Favored 'General case' 0 C--N 1.325 -0.48 0 C-N-CA 124.098 0.959 . . . . 0.0 109.277 179.059 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 16' ' ' SER . . . . . 0.403 ' HG ' ' C ' ' A' ' 15' ' ' GLU . 69.8 m -154.08 140.86 19.08 Favored 'General case' 0 N--CA 1.452 -0.35 0 O-C-N 121.139 -0.976 . . . . 0.0 112.184 -176.762 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 17' ' ' VAL . . . . . . . . . . . . . 85.8 t -98.98 171.12 1.31 Allowed 'Isoleucine or valine' 0 C--N 1.328 -0.328 0 C-N-CA 125.952 1.701 . . . . 0.0 108.601 -174.082 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 18' ' ' ASN . . . . . . . . . . . . . 1.3 t30 -44.36 -49.98 9.33 Favored 'General case' 0 C--N 1.337 0.059 0 C-N-CA 125.81 1.644 . . . . 0.0 112.02 -178.551 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . -79.65 -69.14 1.42 Allowed Glycine 0 CA--C 1.526 0.725 0 O-C-N 123.856 0.722 . . . . 0.0 111.459 177.269 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 30.2 mttm -136.72 165.68 33.3 Favored Pre-proline 0 CA--C 1.529 0.142 0 C-N-CA 125.728 1.611 . . . . 0.0 111.035 -164.273 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 21' ' ' PRO . . . . . . . . . . . . . 91.9 Cg_endo -67.37 176.41 4.85 Favored 'Trans proline' 0 N--CA 1.454 -0.852 0 C-N-CA 121.596 1.53 . . . . 0.0 110.045 162.728 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 22' ' ' VAL . . . . . . . . . . . . . 7.7 p -131.47 162.31 39.6 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.513 0 C-N-CA 124.834 1.254 . . . . 0.0 108.336 177.429 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 23' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -141.9 142.46 33.06 Favored 'General case' 0 CA--C 1.535 0.392 0 CA-C-N 119.008 0.822 . . . . 0.0 108.794 172.568 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 24' ' ' SER . . . . . . . . . . . . . 16.2 m -146.06 35.25 1.0 Allowed 'General case' 0 CA--C 1.537 0.448 0 C-N-CA 125.64 1.576 . . . . 0.0 110.483 -175.647 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 25' ' ' ASP . . . . . . . . . . . . . 18.0 m-20 53.13 52.68 13.24 Favored 'General case' 0 N--CA 1.47 0.563 0 C-N-CA 125.088 1.355 . . . . 0.0 110.801 -179.715 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 26' ' ' LYS . . . . . . . . . . . . . 5.0 tmtt? 64.71 9.24 5.05 Favored 'General case' 0 N--CA 1.45 -0.437 0 C-N-CA 124.456 1.102 . . . . 0.0 112.406 178.227 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 27' ' ' ASN . . . . . . . . . . . . . 73.3 m-20 -113.55 58.4 0.74 Allowed Pre-proline 0 CA--C 1.542 0.664 0 C-N-CA 125.151 1.38 . . . . 0.0 110.428 172.524 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 28' ' ' PRO . . . . . . . . . . . . . 23.2 Cg_endo -76.76 171.66 17.6 Favored 'Trans proline' 0 CA--C 1.543 0.936 0 C-N-CA 124.502 3.468 . . . . 0.0 113.457 -166.84 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 29' ' ' PRO . . . . . . . . . . . . . 19.5 Cg_endo -66.02 64.91 0.45 Allowed 'Trans proline' 0 C--N 1.357 0.978 0 C-N-CA 124.974 3.783 . . . . 0.0 111.811 170.984 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 30' ' ' GLU . . . . . 0.408 ' HA ' ' HA ' ' A' ' 13' ' ' VAL . 1.9 pt-20 -70.15 164.54 23.97 Favored 'General case' 0 C--O 1.239 0.525 0 O-C-N 120.222 -1.549 . . . . 0.0 109.339 172.28 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 31' ' ' ILE . . . . . . . . . . . . . 12.9 tt -139.94 147.63 23.57 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.474 0 CA-C-O 122.336 1.065 . . . . 0.0 108.492 176.935 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 32' ' ' SER . . . . . . . . . . . . . 5.0 p -138.75 154.29 48.52 Favored 'General case' 0 N--CA 1.443 -0.775 0 N-CA-C 107.064 -1.458 . . . . 0.0 107.064 -179.276 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 33' ' ' PHE . . . . . . . . . . . . . 91.7 m-85 -126.37 168.38 14.25 Favored 'General case' 0 N--CA 1.446 -0.638 0 N-CA-C 106.84 -1.541 . . . . 0.0 106.84 178.03 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 34' ' ' GLY . . . . . . . . . . . . . . . 157.85 170.49 22.69 Favored Glycine 0 CA--C 1.522 0.524 0 N-CA-C 109.197 -1.561 . . . . 0.0 109.197 -178.284 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 35' ' ' GLU . . . . . . . . . . . . . 25.1 mt-10 43.57 88.38 0.01 OUTLIER 'General case' 0 N--CA 1.467 0.406 0 C-N-CA 126.796 2.038 . . . . 0.0 113.38 163.647 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 29.3 mttm 69.67 24.42 5.49 Favored 'General case' 0 N--CA 1.466 0.369 0 C-N-CA 125.429 1.492 . . . . 0.0 112.609 -177.224 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 37' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER 64.98 21.66 12.34 Favored 'General case' 0 CA--C 1.542 0.673 0 CA-C-N 120.178 1.353 . . . . 0.0 109.878 -177.828 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 38' ' ' MET . . . . . . . . . . . . . 14.9 mtp -62.42 157.49 19.92 Favored 'General case' 0 N--CA 1.45 -0.445 0 O-C-N 120.959 -1.088 . . . . 0.0 110.006 171.406 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 39' ' ' ILE . . . . . . . . . . . . . 7.3 mt -119.26 131.22 72.56 Favored 'Isoleucine or valine' 0 N--CA 1.447 -0.587 0 C-N-CA 125.443 1.497 . . . . 0.0 107.2 -177.988 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 40' ' ' SER . . . . . . . . . . . . . 55.5 m -129.0 116.02 18.69 Favored 'General case' 0 N--CA 1.452 -0.363 0 C-N-CA 126.377 1.871 . . . . 0.0 107.182 178.78 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 41' ' ' GLY . . . . . . . . . . . . . . . -167.75 179.47 41.09 Favored Glycine 0 CA--C 1.526 0.738 0 N-CA-C 109.631 -1.388 . . . . 0.0 109.631 -179.395 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 42' ' ' SER . . . . . . . . . . . . . 1.0 OUTLIER -154.54 103.28 2.46 Favored 'General case' 0 N--CA 1.453 -0.283 0 O-C-N 121.989 -0.712 . . . . 0.0 109.257 -176.605 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 43' ' ' MET . . . . . . . . . . . . . 6.9 mmt -71.25 -43.55 67.02 Favored 'General case' 0 C--O 1.223 -0.335 0 N-CA-C 108.998 -0.741 . . . . 0.0 108.998 175.248 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 44' ' ' CYS . . . . . 1.275 ' SG ' ' SG ' ' A' ' 70' ' ' CYS . 38.7 t -153.84 -75.32 0.12 Allowed 'General case' 0 N--CA 1.453 -0.284 0 N-CA-C 104.61 -2.367 . . . . 0.0 104.61 172.878 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 45' ' ' ASN . . . . . . . . . . . . . 2.7 m120 -78.48 17.66 0.64 Allowed 'General case' 0 C--N 1.329 -0.3 0 C-N-CA 126.463 1.905 . . . . 0.0 112.494 -163.703 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 46' ' ' ARG . . . . . . . . . . . . . 3.9 mmm180 55.48 158.94 0.01 OUTLIER 'General case' 0 N--CA 1.465 0.299 0 C-N-CA 128.248 2.619 . . . . 0.0 112.631 -161.744 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 47' ' ' PHE . . . . . . . . . . . . . 47.3 p90 -152.69 171.74 17.73 Favored 'General case' 0 N--CA 1.448 -0.556 0 C-N-CA 125.352 1.461 . . . . 0.0 108.199 165.835 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 48' ' ' SER . . . . . . . . . . . . . 7.0 p -163.6 158.87 21.12 Favored 'General case' 0 N--CA 1.444 -0.765 0 N-CA-C 107.031 -1.47 . . . . 0.0 107.031 176.258 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 49' ' ' GLY . . . . . . . . . . . . . . . 173.62 169.17 35.64 Favored Glycine 0 C--N 1.34 0.756 0 CA-C-N 119.951 1.251 . . . . 0.0 112.265 164.7 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 50' ' ' GLU . . . . . . . . . . . . . 23.1 mt-10 -72.84 96.8 2.13 Favored 'General case' 0 C--O 1.239 0.503 0 C-N-CA 125.395 1.478 . . . . 0.0 108.884 171.607 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 51' ' ' GLY . . . . . . . . . . . . . . . -71.97 176.55 40.03 Favored Glycine 0 CA--C 1.527 0.818 0 CA-C-N 115.414 -0.812 . . . . 0.0 111.255 156.965 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 52' ' ' LYS . . . . . . . . . . . . . 29.9 ttpt -167.25 150.33 6.31 Favored 'General case' 0 CA--C 1.529 0.15 0 C-N-CA 126.21 1.804 . . . . 0.0 107.605 179.688 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 53' ' ' LEU . . . . . . . . . . . . . 46.7 tp -155.26 120.53 4.93 Favored 'General case' 0 C--O 1.232 0.142 0 C-N-CA 123.667 0.787 . . . . 0.0 109.345 177.132 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 1.2 t -162.21 39.56 0.12 Allowed 'General case' 0 CA--C 1.538 0.507 0 C-N-CA 123.639 0.776 . . . . 0.0 108.992 174.176 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 55' ' ' ASN . . . . . . . . . . . . . 15.8 p-10 -174.01 -51.4 0.01 OUTLIER 'General case' 0 N--CA 1.462 0.162 0 C-N-CA 124.779 1.232 . . . . 0.0 111.372 -161.497 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 56' ' ' GLY . . . . . . . . . . . . . . . 131.57 10.18 2.42 Favored Glycine 0 CA--C 1.529 0.91 0 C-N-CA 125.102 1.334 . . . . 0.0 113.128 -176.694 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 57' ' ' GLU . . . . . . . . . . . . . 51.7 tt0 -132.05 134.89 46.04 Favored 'General case' 0 C--O 1.233 0.233 0 CA-C-N 118.657 1.228 . . . . 0.0 109.118 -175.019 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 58' ' ' LEU . . . . . . . . . . . . . 38.1 tp -115.71 82.19 1.72 Allowed 'General case' 0 CA--C 1.535 0.393 0 C-N-CA 126.221 1.809 . . . . 0.0 110.685 -171.928 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 59' ' ' THR . . . . . . . . . . . . . 16.9 p -82.45 141.23 32.89 Favored 'General case' 0 C--O 1.237 0.427 0 O-C-N 121.445 -0.784 . . . . 0.0 110.931 177.366 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 60' ' ' ALA . . . . . . . . . . . . . . . -89.87 117.05 28.41 Favored 'General case' 0 CA--C 1.517 -0.309 0 C-N-CA 125.011 1.325 . . . . 0.0 110.584 173.604 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 61' ' ' LYS . . . . . . . . . . . . . 16.2 tttt -67.11 -9.47 40.03 Favored 'General case' 0 CA--C 1.543 0.683 0 N-CA-C 113.453 0.908 . . . . 0.0 113.453 176.05 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 62' ' ' GLY . . . . . . . . . . . . . . . 159.25 116.08 0.43 Allowed Glycine 0 CA--C 1.523 0.535 0 N-CA-C 108.606 -1.798 . . . . 0.0 108.606 179.597 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 63' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -97.59 108.54 21.28 Favored 'General case' 0 N--CA 1.452 -0.367 0 C-N-CA 124.227 1.011 . . . . 0.0 110.396 -173.07 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 64' ' ' ALA . . . . . . . . . . . . . . . -96.18 108.71 21.2 Favored 'General case' 0 C--N 1.324 -0.517 0 CA-C-N 115.634 -0.712 . . . . 0.0 110.114 -177.083 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 65' ' ' MET . . . . . . . . . . . . . 50.4 mtp -111.43 -178.72 3.52 Favored 'General case' 0 C--O 1.241 0.61 0 C-N-CA 126.091 1.756 . . . . 0.0 109.972 -174.588 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 66' ' ' THR . . . . . . . . . . . . . 10.1 p -122.6 -175.25 3.1 Favored 'General case' 0 CA--C 1.537 0.444 0 C-N-CA 123.625 0.77 . . . . 0.0 112.94 178.937 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 67' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -124.68 74.05 1.31 Allowed 'General case' 0 C--O 1.237 0.418 0 C-N-CA 126.727 2.011 . . . . 0.0 110.044 -174.622 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 68' ' ' MET . . . . . . . . . . . . . 2.0 ptt? -142.93 158.37 43.67 Favored 'General case' 0 N--CA 1.452 -0.343 0 C-N-CA 124.638 1.175 . . . . 0.0 111.694 172.824 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 69' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -104.92 134.67 47.65 Favored 'General case' 0 N--CA 1.448 -0.566 0 C-N-CA 127.388 2.275 . . . . 0.0 109.234 179.827 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 70' ' ' CYS . . . . . 1.275 ' SG ' ' SG ' ' A' ' 44' ' ' CYS . 60.0 m -100.05 -6.72 25.97 Favored 'General case' 0 N--CA 1.467 0.408 0 C-N-CA 125.611 1.564 . . . . 0.0 114.499 -173.489 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 71' ' ' ALA . . . . . . . . . . . . . . . 67.81 -45.04 0.49 Allowed 'General case' 0 C--O 1.234 0.248 0 C-N-CA 127.324 2.25 . . . . 0.0 113.936 -168.29 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 72' ' ' ASN . . . . . . . . . . . . . 43.4 t30 -68.38 142.71 94.81 Favored Pre-proline 0 C--O 1.234 0.26 0 CA-C-O 117.503 -1.237 . . . . 0.0 108.697 -177.598 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 73' ' ' PRO . . . . . . . . . . . . . 44.3 Cg_endo -78.92 -41.32 0.24 Allowed 'Trans proline' 0 N--CA 1.455 -0.756 0 C-N-CA 121.957 1.772 . . . . 0.0 110.999 178.414 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 74' ' ' GLN . . . . . . . . . . . . . 23.7 tt0 -61.58 -44.98 96.02 Favored 'General case' 0 CA--C 1.534 0.358 0 C-N-CA 123.126 0.57 . . . . 0.0 110.76 -169.506 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 75' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -52.31 -52.65 51.78 Favored 'General case' 0 N--CA 1.447 -0.605 0 C-N-CA 125.139 1.376 . . . . 0.0 110.583 169.543 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 76' ' ' ASN . . . . . . . . . . . . . 1.2 m-20 -71.18 -0.89 10.8 Favored 'General case' 0 N--CA 1.47 0.53 0 C-N-CA 126.657 1.983 . . . . 0.0 113.144 -174.767 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 77' ' ' GLU . . . . . . . . . . . . . 3.3 mm-40 -101.93 -40.31 6.95 Favored 'General case' 0 C--O 1.235 0.328 0 C-N-CA 126.214 1.806 . . . . 0.0 109.708 171.075 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 78' ' ' LEU . . . . . . . . . . . . . 4.9 mp -67.49 -24.24 65.56 Favored 'General case' 0 N--CA 1.456 -0.167 0 C-N-CA 125.589 1.556 . . . . 0.0 112.103 -178.58 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 79' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -58.24 -34.35 70.35 Favored 'General case' 0 C--O 1.232 0.171 0 C-N-CA 123.4 0.68 . . . . 0.0 111.695 175.233 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 80' ' ' ASN . . . . . . . . . . . . . 91.1 m-20 -87.17 -36.41 18.05 Favored 'General case' 0 CA--C 1.512 -0.496 0 CA-C-O 117.893 -1.051 . . . . 0.0 109.862 177.753 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 81' ' ' THR . . . . . . . . . . . . . 3.8 m -52.38 -55.33 22.41 Favored 'General case' 0 CA--C 1.531 0.246 0 CA-C-N 118.646 0.657 . . . . 0.0 109.985 174.657 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 82' ' ' ILE . . . . . . . . . . . . . 9.8 tp -66.56 -37.61 79.93 Favored 'Isoleucine or valine' 0 N--CA 1.454 -0.27 0 C-N-CA 119.808 -0.757 . . . . 0.0 111.361 -174.382 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 83' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER -59.75 -49.55 77.29 Favored 'General case' 0 N--CA 1.443 -0.802 0 N-CA-C 109.283 -0.636 . . . . 0.0 109.283 179.495 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 84' ' ' GLU . . . . . . . . . . . . . 36.8 tt0 -66.41 -46.31 76.99 Favored 'General case' 0 N--CA 1.449 -0.5 0 C-N-CA 125.065 1.346 . . . . 0.0 111.219 -176.725 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 85' ' ' MET . . . . . . . . . . . . . 85.0 mtp -58.21 -52.26 66.31 Favored 'General case' 0 C--N 1.342 0.265 0 C-N-CA 124.413 1.085 . . . . 0.0 109.318 -177.766 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 86' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -75.27 -22.97 57.39 Favored 'General case' 0 N--CA 1.453 -0.311 0 CA-C-N 115.906 -0.588 . . . . 0.0 111.329 -171.41 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 87' ' ' LYS . . . . . . . . . . . . . 9.5 mttt -67.14 -47.05 72.26 Favored 'General case' 0 N--CA 1.456 -0.172 0 N-CA-C 108.164 -1.05 . . . . 0.0 108.164 -178.797 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 88' ' ' GLU . . . . . . . . . . . . . 69.5 mt-10 -72.07 -51.45 21.54 Favored 'General case' 0 N--CA 1.454 -0.255 0 O-C-N 123.738 0.649 . . . . 0.0 110.077 177.567 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 89' ' ' GLY . . . . . . . . . . . . . . . 134.26 97.57 0.59 Allowed Glycine 0 C--N 1.337 0.597 0 N-CA-C 108.509 -1.836 . . . . 0.0 108.509 -169.732 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 90' ' ' ALA . . . . . . . . . . . . . . . -74.11 130.72 40.34 Favored 'General case' 0 N--CA 1.451 -0.387 0 N-CA-C 107.423 -1.325 . . . . 0.0 107.423 171.813 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 91' ' ' GLN . . . . . . . . . . . . . 82.1 mm-40 -62.64 130.91 47.14 Favored 'General case' 0 N--CA 1.442 -0.833 0 N-CA-C 106.109 -1.812 . . . . 0.0 106.109 159.239 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 92' ' ' VAL . . . . . . . . . . . . . 4.2 p -118.27 124.67 73.46 Favored 'Isoleucine or valine' 0 N--CA 1.44 -0.927 0 N-CA-C 104.069 -2.567 . . . . 0.0 104.069 -179.008 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 93' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -138.69 138.48 37.78 Favored 'General case' 0 N--CA 1.444 -0.739 0 N-CA-C 106.316 -1.735 . . . . 0.0 106.316 173.37 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 94' ' ' LEU . . . . . . . . . . . . . 10.8 tp -133.23 116.22 15.93 Favored 'General case' 0 N--CA 1.445 -0.687 0 N-CA-C 106.543 -1.651 . . . . 0.0 106.543 -178.923 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 95' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -82.59 -164.62 0.87 Allowed 'General case' 0 C--N 1.322 -0.619 0 CA-C-N 114.417 -1.265 . . . . 0.0 110.112 172.62 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 96' ' ' ALA . . . . . . . . . . . . . . . -49.59 -40.82 40.12 Favored 'General case' 0 CA--C 1.538 0.501 0 C-N-CA 124.611 1.164 . . . . 0.0 113.079 -178.004 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 97' ' ' ASN . . . . . . . . . . . . . 42.8 p30 -156.38 23.47 0.35 Allowed 'General case' 0 CA--C 1.541 0.63 0 N-CA-C 113.683 0.994 . . . . 0.0 113.683 -178.876 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 98' ' ' GLN . . . . . . . . . . . . . 13.7 tt0 -137.11 122.79 19.83 Favored 'General case' 0 N--CA 1.467 0.381 0 C-N-CA 124.45 1.1 . . . . 0.0 108.568 -177.735 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 99' ' ' LEU . . . . . . . . . . . . . 3.7 tp -82.38 130.81 35.19 Favored 'General case' 0 C--O 1.235 0.306 0 N-CA-C 107.709 -1.219 . . . . 0.0 107.709 170.723 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 100' ' ' THR . . . . . . . . . . . . . 5.0 m -117.73 114.32 23.15 Favored 'General case' 0 C--N 1.325 -0.471 0 C-N-CA 126.506 1.923 . . . . 0.0 106.743 171.371 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 101' ' ' LEU . . . . . . . . . . . . . 0.7 OUTLIER -115.54 123.82 49.47 Favored 'General case' 0 CA--C 1.505 -0.777 0 N-CA-C 106.832 -1.544 . . . . 0.0 106.832 -179.073 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 102' ' ' ALA . . . . . . . . . . . . . . . -139.14 158.48 44.1 Favored 'General case' 0 C--N 1.325 -0.488 0 C-N-CA 123.655 0.782 . . . . 0.0 108.97 178.577 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 103' ' ' THR . . . . . . . . . . . . . 0.6 OUTLIER -154.61 -179.95 8.47 Favored 'General case' 0 N--CA 1.443 -0.815 0 C-N-CA 126.438 1.895 . . . . 0.0 106.214 176.838 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 104' ' ' ALA . . . . . . . . . . . . . . . -60.53 -26.24 66.72 Favored 'General case' 0 C--O 1.236 0.363 0 O-C-N 120.992 -1.067 . . . . 0.0 112.284 174.613 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 105' ' ' LYS . . . . . . . . . . . . . 13.0 mmtt -77.63 -71.7 0.4 Allowed 'General case' 0 CA--C 1.512 -0.504 0 O-C-N 121.962 -0.461 . . . . 0.0 111.048 -179.992 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 106' ' ' GLN . . . . . . . . . . . . . 1.4 tt0 -154.07 -169.87 3.38 Favored 'General case' 0 N--CA 1.45 -0.446 0 N-CA-C 109.719 -0.475 . . . . 0.0 109.719 -166.435 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 107' ' ' THR . . . . . . . . . . . . . 10.0 t -143.74 164.13 31.35 Favored 'General case' 0 C--O 1.24 0.601 0 C-N-CA 123.431 0.692 . . . . 0.0 110.281 -173.682 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 108' ' ' LEU . . . . . . . . . . . . . 75.6 mt -150.05 134.05 16.99 Favored 'General case' 0 CA--C 1.536 0.434 0 C-N-CA 128.399 2.679 . . . . 0.0 106.123 -170.688 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 109' ' ' THR . . . . . . . . . . . . . 82.6 m -115.21 116.21 27.97 Favored 'General case' 0 C--O 1.237 0.398 0 N-CA-C 107.022 -1.473 . . . . 0.0 107.022 174.721 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 110' ' ' TYR . . . . . . . . . . . . . 21.7 m-85 -106.99 168.57 9.11 Favored 'General case' 0 C--O 1.237 0.424 0 CA-C-O 121.637 0.732 . . . . 0.0 109.811 176.652 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 111' ' ' LYS . . . . . . . . . . . . . 0.9 OUTLIER -130.03 143.71 50.94 Favored 'General case' 0 CA--C 1.519 -0.225 0 C-N-CA 126.013 1.725 . . . . 0.0 108.343 -170.847 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 112' ' ' LEU . . . . . . . . . . . . . 21.2 tp -70.71 60.63 0.23 Allowed 'General case' 0 CA--C 1.54 0.581 0 C-N-CA 126.222 1.809 . . . . 0.0 111.575 171.152 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 113' ' ' ALA . . . . . . . . . . . . . . . -88.04 103.34 15.63 Favored 'General case' 0 N--CA 1.453 -0.303 0 N-CA-C 105.297 -2.112 . . . . 0.0 105.297 163.251 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 114' ' ' ASP . . . . . . . . . . . . . 46.5 t0 -133.67 45.82 2.62 Favored 'General case' 0 C--N 1.33 -0.241 0 CA-C-O 122.918 1.342 . . . . 0.0 109.39 174.357 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 115' ' ' LEU . . . . . . . . . . . . . 48.8 mt 57.23 4.84 0.22 Allowed 'General case' 0 C--O 1.237 0.408 0 C-N-CA 128.102 2.561 . . . . 0.0 115.676 179.289 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 116' ' ' MET . . . . . . . . . . . . . 7.1 ttp 54.12 81.66 0.1 Allowed 'General case' 0 C--O 1.236 0.347 0 C-N-CA 127.131 2.172 . . . . 0.0 108.505 -160.441 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 117' ' ' ASN . . . . . . . . . . . . . 7.5 t-20 . . . . . 0 C--O 1.234 0.284 0 C-N-CA 124.181 0.992 . . . . 0.0 112.238 -175.282 . . . . . . . . 0 0 . 1 . 006 nuclear orig full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 21.1 ttm . . . . . 0 N--CA 1.455 -0.181 0 N-CA-C 108.321 -0.992 . . . . 0.0 108.321 . . . . . . . . . 0 0 . 1 . 006 nuclear orig full ' A' A ' 2' ' ' VAL . . . . . . . . . . . . . 8.2 p -57.64 142.3 13.51 Favored 'Isoleucine or valine' 0 CA--C 1.542 0.648 0 CA-C-N 115.951 -0.568 . . . . 0.0 110.251 173.237 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 3' ' ' THR . . . . . . . . . . . . . 21.5 p -123.03 163.9 30.61 Favored Pre-proline 0 C--O 1.226 -0.153 0 O-C-N 121.353 -0.842 . . . . 0.0 109.956 172.724 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 4' ' ' PRO . . . . . . . . . . . . . 31.1 Cg_endo -63.89 -36.63 49.05 Favored 'Trans proline' 0 N--CA 1.461 -0.427 0 C-N-CA 122.227 1.951 . . . . 0.0 112.183 174.377 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 5' ' ' GLU . . . . . 0.446 ' C ' ' H ' ' A' ' 7' ' ' LEU . 13.3 tt0 -57.27 -56.67 18.84 Favored 'General case' 0 CA--C 1.534 0.333 0 C-N-CA 123.524 0.729 . . . . 0.0 111.25 -172.721 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 6' ' ' GLN . . . . . . . . . . . . . 20.0 pt20 -64.05 18.3 0.01 OUTLIER 'General case' 0 CA--C 1.543 0.691 0 C-N-CA 128.174 2.59 . . . . 0.0 114.252 178.877 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 7' ' ' LEU . . . . . 0.446 ' H ' ' C ' ' A' ' 5' ' ' GLU . 72.9 mt -134.95 -50.3 0.76 Allowed 'General case' 0 N--CA 1.453 -0.313 0 C-N-CA 126.272 1.829 . . . . 0.0 109.58 -176.649 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 8' ' ' GLN . . . . . . . . . . . . . 5.4 mt-30 -57.65 -21.31 39.17 Favored 'General case' 0 N--CA 1.472 0.652 0 N-CA-C 114.114 1.153 . . . . 0.0 114.114 -177.182 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 9' ' ' HIS . . . . . . . . . . . . . 8.3 m170 -110.76 11.46 22.57 Favored 'General case' 0 CA--C 1.537 0.475 0 C-N-CA 123.421 0.688 . . . . 0.0 111.218 -179.916 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 10' ' ' HIS . . . . . . . . . . . . . 60.5 m-70 -136.33 112.25 9.57 Favored 'General case' 0 CA--C 1.535 0.39 0 C-N-CA 124.686 1.195 . . . . 0.0 109.223 -165.754 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 11' ' ' ARG . . . . . . . . . . . . . 4.6 ttt85 -69.11 152.61 44.95 Favored 'General case' 0 N--CA 1.466 0.351 0 O-C-N 121.304 -0.873 . . . . 0.0 108.961 172.159 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 12' ' ' PHE . . . . . . . . . . . . . 21.3 m-85 -139.11 156.6 47.03 Favored 'General case' 0 CA--C 1.512 -0.513 0 N-CA-C 108.387 -0.968 . . . . 0.0 108.387 173.676 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 13' ' ' VAL . . . . . . . . . . . . . 1.8 p -140.5 128.68 24.59 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.583 0 N-CA-C 113.135 0.791 . . . . 0.0 113.135 -179.339 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 14' ' ' LEU . . . . . . . . . . . . . 6.4 tt -57.32 119.91 7.25 Favored 'General case' 0 CA--C 1.508 -0.666 0 N-CA-C 107.512 -1.292 . . . . 0.0 107.512 178.055 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 15' ' ' GLU . . . . . 0.46 ' HG3' ' HE2' ' A' ' 111' ' ' LYS . 0.1 OUTLIER -106.12 -45.23 4.38 Favored 'General case' 0 N--CA 1.439 -0.978 0 CA-C-N 115.092 -0.958 . . . . 0.0 108.996 -173.229 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -143.56 152.18 41.11 Favored 'General case' 0 N--CA 1.443 -0.79 0 CA-C-O 121.972 0.891 . . . . 0.0 111.406 174.242 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 17' ' ' VAL . . . . . . . . . . . . . 10.5 t -76.93 175.68 0.73 Allowed 'Isoleucine or valine' 0 C--O 1.242 0.673 0 N-CA-C 106.871 -1.529 . . . . 0.0 106.871 173.1 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 18' ' ' ASN . . . . . . . . . . . . . 0.2 OUTLIER -44.79 -34.49 2.32 Favored 'General case' 0 CA--C 1.535 0.374 0 C-N-CA 126.773 2.029 . . . . 0.0 113.103 169.6 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . -115.3 -54.31 0.38 Allowed Glycine 0 CA--C 1.525 0.687 0 CA-C-O 118.937 -0.924 . . . . 0.0 113.339 -168.198 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 12.9 mttm -134.07 160.76 67.3 Favored Pre-proline 0 N--CA 1.466 0.331 0 CA-C-N 118.694 1.247 . . . . 0.0 111.702 178.08 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 21' ' ' PRO . . . . . . . . . . . . . 59.8 Cg_endo -67.06 160.72 46.0 Favored 'Trans proline' 0 N--CA 1.45 -1.029 0 C-N-CA 122.012 1.808 . . . . 0.0 110.321 162.468 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 22' ' ' VAL . . . . . . . . . . . . . 13.3 p -139.74 165.52 22.16 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.41 0 C-N-CA 124.536 1.134 . . . . 0.0 109.166 -179.265 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 23' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -130.07 157.98 40.89 Favored 'General case' 0 C--O 1.235 0.338 0 CA-C-O 121.528 0.68 . . . . 0.0 111.465 -179.166 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 24' ' ' SER . . . . . . . . . . . . . 32.2 t -150.9 47.88 0.85 Allowed 'General case' 0 CA--C 1.536 0.435 0 C-N-CA 126.462 1.905 . . . . 0.0 106.624 -178.397 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 25' ' ' ASP . . . . . . . . . . . . . 32.6 m-20 44.54 54.59 6.33 Favored 'General case' 0 N--CA 1.469 0.506 0 C-N-CA 126.044 1.737 . . . . 0.0 112.466 -176.391 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 26' ' ' LYS . . . . . . . . . . . . . 7.1 tmtm? 69.99 -2.57 2.01 Favored 'General case' 0 N--CA 1.471 0.605 0 O-C-N 120.91 -1.119 . . . . 0.0 112.664 176.619 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 27' ' ' ASN . . . . . . . . . . . . . 82.5 m-20 -113.43 71.03 1.56 Allowed Pre-proline 0 CA--C 1.537 0.471 0 C-N-CA 125.761 1.624 . . . . 0.0 107.471 175.455 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 28' ' ' PRO . . . . . . . . . . . . . 60.2 Cg_endo -67.99 170.35 14.48 Favored 'Trans proline' 0 C--N 1.349 0.6 0 C-N-CA 124.664 3.576 . . . . 0.0 113.412 -173.335 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 29' ' ' PRO . . . . . . . . . . . . . 12.2 Cg_endo -61.46 69.49 0.1 OUTLIER 'Trans proline' 0 CA--C 1.544 1.013 0 C-N-CA 125.167 3.911 . . . . 0.0 112.042 164.569 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 30' ' ' GLU . . . . . . . . . . . . . 11.7 pt-20 -95.74 168.95 10.35 Favored 'General case' 0 C--N 1.327 -0.379 0 O-C-N 119.768 -1.833 . . . . 0.0 111.105 177.512 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 31' ' ' ILE . . . . . . . . . . . . . 14.4 tt -147.64 165.62 5.83 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.399 0 C-N-CA 124.392 1.077 . . . . 0.0 108.307 -168.854 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 32' ' ' SER . . . . . . . . . . . . . 5.9 p -145.92 161.67 39.53 Favored 'General case' 0 N--CA 1.443 -0.824 0 N-CA-C 107.985 -1.117 . . . . 0.0 107.985 165.884 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 33' ' ' PHE . . . . . . . . . . . . . 84.6 m-85 -127.57 167.43 16.35 Favored 'General case' 0 N--CA 1.442 -0.874 0 N-CA-C 106.619 -1.623 . . . . 0.0 106.619 175.357 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 34' ' ' GLY . . . . . . . . . . . . . . . 165.57 -167.28 38.92 Favored Glycine 0 N--CA 1.447 -0.596 0 N-CA-C 105.815 -2.914 . . . . 0.0 105.815 -177.189 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 35' ' ' GLU . . . . . . . . . . . . . 37.7 mt-10 44.38 72.51 0.19 Allowed 'General case' 0 C--N 1.33 -0.242 0 C-N-CA 124.952 1.301 . . . . 0.0 112.41 161.658 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 24.9 mtmt 60.33 28.31 17.92 Favored 'General case' 0 CA--C 1.541 0.633 0 CA-C-N 115.182 -0.917 . . . . 0.0 112.224 174.635 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 37' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER 75.23 15.92 2.81 Favored 'General case' 0 N--CA 1.469 0.521 0 C-N-CA 128.152 2.581 . . . . 0.0 112.649 -175.867 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 38' ' ' MET . . . . . . . . . . . . . 19.6 mtp -55.92 147.44 19.48 Favored 'General case' 0 C--O 1.237 0.395 0 O-C-N 120.697 -1.252 . . . . 0.0 110.664 167.451 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 39' ' ' ILE . . . . . . . . . . . . . 7.5 mt -108.61 135.47 47.33 Favored 'Isoleucine or valine' 0 N--CA 1.447 -0.588 0 N-CA-C 107.158 -1.423 . . . . 0.0 107.158 -177.428 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 40' ' ' SER . . . . . . . . . . . . . 4.4 m -136.18 135.57 39.27 Favored 'General case' 0 N--CA 1.452 -0.36 0 N-CA-C 107.584 -1.265 . . . . 0.0 107.584 171.757 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 41' ' ' GLY . . . . . . . . . . . . . . . -178.08 -175.46 45.25 Favored Glycine 0 C--O 1.237 0.325 0 CA-C-N 119.179 0.9 . . . . 0.0 111.114 -178.474 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 42' ' ' SER . . . . . . . . . . . . . 15.7 t -143.54 167.62 21.79 Favored 'General case' 0 N--CA 1.444 -0.75 0 N-CA-C 108.197 -1.038 . . . . 0.0 108.197 165.548 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 43' ' ' MET . . . . . . . . . . . . . 36.4 mmm -126.79 -45.33 1.61 Allowed 'General case' 0 N--CA 1.447 -0.614 0 N-CA-C 107.86 -1.163 . . . . 0.0 107.86 162.014 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 44' ' ' CYS . . . . . 1.283 ' SG ' ' SG ' ' A' ' 70' ' ' CYS . 41.6 t -149.16 -51.21 0.15 Allowed 'General case' 0 CA--C 1.542 0.664 0 C-N-CA 126.112 1.765 . . . . 0.0 108.009 167.706 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 45' ' ' ASN . . . . . . . . . . . . . 8.0 m-80 -88.95 10.34 21.74 Favored 'General case' 0 N--CA 1.467 0.4 0 N-CA-C 115.898 1.814 . . . . 0.0 115.898 -174.203 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 46' ' ' ARG . . . . . . . . . . . . . 0.4 OUTLIER 60.99 164.78 0.08 Allowed 'General case' 0 N--CA 1.474 0.774 0 C-N-CA 125.809 1.644 . . . . 0.0 111.661 -169.737 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 47' ' ' PHE . . . . . . . . . . . . . 51.6 p90 -162.76 169.09 20.5 Favored 'General case' 0 C--O 1.238 0.492 0 C-N-CA 124.954 1.301 . . . . 0.0 108.887 167.852 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 48' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -157.23 162.21 39.25 Favored 'General case' 0 CA--C 1.541 0.608 0 C-N-CA 124.656 1.182 . . . . 0.0 108.673 164.731 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 49' ' ' GLY . . . . . . . . . . . . . . . -179.1 167.96 38.45 Favored Glycine 0 CA--C 1.532 1.109 0 CA-C-N 120.572 1.533 . . . . 0.0 113.156 171.104 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 50' ' ' GLU . . . . . . . . . . . . . 40.4 mt-10 -68.81 95.35 0.67 Allowed 'General case' 0 CA--C 1.534 0.329 0 C-N-CA 125.013 1.325 . . . . 0.0 110.193 170.473 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 51' ' ' GLY . . . . . . . . . . . . . . . -76.85 165.01 53.4 Favored Glycine 0 CA--C 1.529 0.951 0 N-CA-C 110.296 -1.122 . . . . 0.0 110.296 161.242 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 52' ' ' LYS . . . . . . . . . . . . . 62.3 tttt -168.85 137.01 2.03 Favored 'General case' 0 CA--C 1.517 -0.289 0 C-N-CA 126.833 2.053 . . . . 0.0 106.036 174.837 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 53' ' ' LEU . . . . . . . . . . . . . 16.1 tp -130.77 128.96 41.81 Favored 'General case' 0 CA--C 1.517 -0.316 0 CA-C-O 122.317 1.055 . . . . 0.0 110.391 -177.441 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 21.1 t -144.94 -37.18 0.29 Allowed 'General case' 0 N--CA 1.443 -0.796 0 C-N-CA 125.433 1.493 . . . . 0.0 109.903 174.729 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 55' ' ' ASN . . . . . . . . . . . . . 65.9 t30 -121.64 23.23 10.31 Favored 'General case' 0 CA--C 1.538 0.502 0 C-N-CA 124.175 0.99 . . . . 0.0 113.647 -164.66 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 56' ' ' GLY . . . . . . . . . . . . . . . 78.03 5.28 86.9 Favored Glycine 0 CA--C 1.532 1.095 0 O-C-N 120.606 -1.309 . . . . 0.0 113.512 -176.089 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 57' ' ' GLU . . . . . . . . . . . . . 40.3 tt0 -123.67 148.6 46.36 Favored 'General case' 0 C--O 1.237 0.399 0 CA-C-N 118.612 1.206 . . . . 0.0 108.589 -174.13 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 58' ' ' LEU . . . . . . . . . . . . . 8.4 tp -132.51 138.83 47.67 Favored 'General case' 0 C--N 1.33 -0.251 0 C-N-CA 125.364 1.466 . . . . 0.0 110.54 178.421 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 59' ' ' THR . . . . . . . . . . . . . 1.6 p -125.82 167.11 15.66 Favored 'General case' 0 C--O 1.237 0.429 0 C-N-CA 125.76 1.624 . . . . 0.0 111.17 -176.66 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 60' ' ' ALA . . . . . . . . . . . . . . . -139.45 107.32 5.67 Favored 'General case' 0 CA--C 1.53 0.18 0 C-N-CA 125.505 1.522 . . . . 0.0 111.706 168.381 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 61' ' ' LYS . . . . . . . . . . . . . 24.7 tttt -72.55 77.23 1.07 Allowed 'General case' 0 CA--C 1.542 0.636 0 C-N-CA 124.027 0.931 . . . . 0.0 111.027 178.273 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 62' ' ' GLY . . . . . . . . . . . . . . . 124.29 -65.29 0.54 Allowed Glycine 0 N--CA 1.466 0.674 0 C-N-CA 125.68 1.61 . . . . 0.0 111.397 172.801 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 63' ' ' LEU . . . . . . . . . . . . . 6.0 tt 65.51 103.39 0.04 OUTLIER 'General case' 0 CA--C 1.535 0.4 0 C-N-CA 128.578 2.751 . . . . 0.0 114.243 174.003 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 64' ' ' ALA . . . . . . . . . . . . . . . -84.22 97.48 9.42 Favored 'General case' 0 CA--C 1.533 0.32 0 C-N-CA 126.759 2.024 . . . . 0.0 112.635 -169.693 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 65' ' ' MET . . . . . . . . . . . . . 3.0 mtt -98.2 -179.66 4.45 Favored 'General case' 0 CA--C 1.543 0.675 0 C-N-CA 124.684 1.194 . . . . 0.0 111.127 176.064 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 66' ' ' THR . . . . . . . . . . . . . 9.2 p -118.2 -163.89 0.98 Allowed 'General case' 0 CA--C 1.552 1.028 0 C-N-CA 125.989 1.715 . . . . 0.0 111.822 -179.744 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 67' ' ' ARG . . . . . . . . . . . . . 28.9 mmt180 -133.21 49.12 2.33 Favored 'General case' 0 CA--C 1.553 1.089 0 C-N-CA 126.296 1.838 . . . . 0.0 111.474 172.985 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 68' ' ' MET . . . . . . . . . . . . . 59.4 mtm -84.12 -175.0 5.59 Favored 'General case' 0 CA--C 1.544 0.743 0 C-N-CA 128.113 2.565 . . . . 0.0 110.612 167.942 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 69' ' ' MET . . . . . . . . . . . . . 1.4 pmm? -151.01 173.83 13.86 Favored 'General case' 0 N--CA 1.466 0.341 0 C-N-CA 126.255 1.822 . . . . 0.0 111.449 171.058 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 70' ' ' CYS . . . . . 1.283 ' SG ' ' SG ' ' A' ' 44' ' ' CYS . 86.0 m -141.36 148.05 39.04 Favored 'General case' 0 C--O 1.234 0.263 0 CA-C-O 122.041 0.924 . . . . 0.0 112.028 -169.74 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 71' ' ' ALA . . . . . . . . . . . . . . . -71.9 26.92 0.05 OUTLIER 'General case' 0 CA--C 1.543 0.705 0 C-N-CA 128.374 2.669 . . . . 0.0 112.265 175.927 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 72' ' ' ASN . . . . . . . . . . . . . 53.3 t-20 -146.96 141.38 15.92 Favored Pre-proline 0 CA--C 1.535 0.4 0 N-CA-C 103.859 -2.645 . . . . 0.0 103.859 156.114 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 73' ' ' PRO . . . . . . . . . . . . . 56.1 Cg_endo -83.94 -26.84 1.79 Allowed 'Trans proline' 0 N--CA 1.465 -0.158 0 C-N-CA 122.271 1.981 . . . . 0.0 111.759 -176.968 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 74' ' ' GLN . . . . . . . . . . . . . 11.2 tt0 -63.14 -26.18 68.7 Favored 'General case' 0 CA--C 1.538 0.508 0 O-C-N 121.669 -0.645 . . . . 0.0 110.852 179.807 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 75' ' ' LEU . . . . . . . . . . . . . 62.1 mt -69.45 -32.14 70.9 Favored 'General case' 0 N--CA 1.47 0.542 0 C-N-CA 123.71 0.804 . . . . 0.0 111.728 173.121 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 76' ' ' ASN . . . . . . . . . . . . . 2.1 t-20 -79.79 -20.87 45.17 Favored 'General case' 0 CA--C 1.531 0.237 0 C-N-CA 124.177 0.991 . . . . 0.0 111.261 -177.555 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 77' ' ' GLU . . . . . . . . . . . . . 4.3 mm-40 -78.49 -34.08 47.76 Favored 'General case' 0 CA--C 1.536 0.41 0 C-N-CA 123.944 0.898 . . . . 0.0 110.114 169.591 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 78' ' ' LEU . . . . . . . . . . . . . 0.9 OUTLIER -57.05 -24.83 56.66 Favored 'General case' 0 C--N 1.345 0.407 0 O-C-N 121.513 -0.742 . . . . 0.0 111.869 176.369 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 79' ' ' ASP . . . . . . . . . . . . . 69.3 m-20 -64.35 -27.32 68.94 Favored 'General case' 0 N--CA 1.454 -0.273 0 C-N-CA 122.977 0.511 . . . . 0.0 111.991 -176.708 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 80' ' ' ASN . . . . . . . . . . . . . 10.7 p30 -101.76 -29.82 11.66 Favored 'General case' 0 N--CA 1.437 -1.106 0 CA-C-O 116.613 -1.661 . . . . 0.0 111.77 174.961 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 81' ' ' THR . . . . . . . . . . . . . 25.2 m -44.94 -74.42 0.04 OUTLIER 'General case' 0 CA--C 1.535 0.403 0 CA-C-N 119.164 0.893 . . . . 0.0 108.82 161.818 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 82' ' ' ILE . . . . . . . . . . . . . 5.2 tp -66.62 -34.58 71.02 Favored 'Isoleucine or valine' 0 N--CA 1.455 -0.205 0 O-C-N 121.012 -1.055 . . . . 0.0 111.448 -167.589 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 83' ' ' SER . . . . . . . . . . . . . 4.3 m -61.91 -45.07 95.34 Favored 'General case' 0 N--CA 1.445 -0.701 0 O-C-N 122.155 -0.341 . . . . 0.0 110.646 -177.662 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 84' ' ' GLU . . . . . . . . . . . . . 31.9 tt0 -77.94 -34.51 51.16 Favored 'General case' 0 N--CA 1.446 -0.669 0 CA-C-O 118.03 -0.986 . . . . 0.0 110.173 -178.032 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 85' ' ' MET . . . . . . . . . . . . . 86.8 mtp -54.64 -48.64 72.03 Favored 'General case' 0 C--N 1.343 0.297 0 CA-C-O 121.956 0.884 . . . . 0.0 108.728 174.709 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 86' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -76.63 -26.62 55.11 Favored 'General case' 0 N--CA 1.45 -0.457 0 CA-C-O 118.612 -0.708 . . . . 0.0 111.566 -176.648 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 87' ' ' LYS . . . . . . . . . . . . . 31.5 mttt -70.89 -38.14 73.03 Favored 'General case' 0 CA--C 1.532 0.284 0 CA-C-N 119.94 1.245 . . . . 0.0 108.938 178.203 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 88' ' ' GLU . . . . . . . . . . . . . 31.8 mm-40 -66.47 -63.79 1.0 Allowed 'General case' 0 CA--C 1.532 0.283 0 C-N-CA 125.274 1.43 . . . . 0.0 109.494 173.168 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 89' ' ' GLY . . . . . . . . . . . . . . . 135.55 99.22 0.58 Allowed Glycine 0 C--N 1.335 0.523 0 N-CA-C 107.517 -2.233 . . . . 0.0 107.517 -161.873 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 90' ' ' ALA . . . . . . . . . . . . . . . -90.47 139.88 30.26 Favored 'General case' 0 N--CA 1.455 -0.221 0 N-CA-C 108.996 -0.742 . . . . 0.0 108.996 -179.327 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 91' ' ' GLN . . . . . . . . . . . . . 41.9 mm-40 -78.63 134.99 37.11 Favored 'General case' 0 N--CA 1.442 -0.865 0 N-CA-C 106.075 -1.824 . . . . 0.0 106.075 174.916 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 92' ' ' VAL . . . . . . . . . . . . . 24.2 t -130.14 98.0 3.6 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.476 0 C-N-CA 127.444 2.297 . . . . 0.0 106.144 -167.133 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 93' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -116.71 94.19 4.51 Favored 'General case' 0 C--O 1.235 0.335 0 CA-C-O 121.225 0.536 . . . . 0.0 110.317 -175.736 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 94' ' ' LEU . . . . . . . . . . . . . 1.5 tm? -93.2 106.66 18.6 Favored 'General case' 0 C--O 1.233 0.213 0 N-CA-C 108.479 -0.934 . . . . 0.0 108.479 174.856 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 95' ' ' THR . . . . . . . . . . . . . 5.8 t -85.55 -164.81 1.07 Allowed 'General case' 0 CA--C 1.543 0.69 0 C-N-CA 125.932 1.693 . . . . 0.0 108.724 171.108 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 96' ' ' ALA . . . . . . . . . . . . . . . -55.33 -22.74 20.38 Favored 'General case' 0 CA--C 1.545 0.775 0 N-CA-C 115.638 1.718 . . . . 0.0 115.638 -172.953 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 97' ' ' ASN . . . . . . . . . . . . . 0.0 OUTLIER -152.83 2.63 0.31 Allowed 'General case' 0 N--CA 1.477 0.922 0 CA-C-N 120.313 1.415 . . . . 0.0 113.941 176.395 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 98' ' ' GLN . . . . . . . . . . . . . 6.5 tt0 -140.14 136.37 33.44 Favored 'General case' 0 CA--C 1.53 0.211 0 O-C-N 120.423 -1.423 . . . . 0.0 109.525 -163.551 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 99' ' ' LEU . . . . . . . . . . . . . 20.2 tp -113.99 115.3 27.41 Favored 'General case' 0 N--CA 1.464 0.272 0 C-N-CA 126.84 2.056 . . . . 0.0 108.455 -172.468 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 100' ' ' THR . . . . . . . . . . . . . 0.9 OUTLIER -89.73 149.68 22.63 Favored 'General case' 0 CA--C 1.541 0.61 0 N-CA-C 104.787 -2.301 . . . . 0.0 104.787 177.044 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 101' ' ' LEU . . . . . . . . . . . . . 1.2 mm? -120.74 117.29 27.1 Favored 'General case' 0 N--CA 1.455 -0.189 0 C-N-CA 127.211 2.204 . . . . 0.0 106.583 163.125 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 102' ' ' ALA . . . . . . . . . . . . . . . -129.17 140.78 51.38 Favored 'General case' 0 N--CA 1.464 0.233 0 CA-C-N 119.406 1.003 . . . . 0.0 109.603 174.526 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 103' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -160.33 175.49 12.77 Favored 'General case' 0 N--CA 1.448 -0.554 0 C-N-CA 126.636 1.975 . . . . 0.0 108.336 171.599 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 104' ' ' ALA . . . . . . . . . . . . . . . -47.64 -36.34 10.82 Favored 'General case' 0 N--CA 1.453 -0.283 0 CA-C-O 117.549 -1.215 . . . . 0.0 112.855 173.391 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 105' ' ' LYS . . . . . 0.426 ' HE3' ' HA ' ' A' ' 105' ' ' LYS . 0.0 OUTLIER -55.98 -69.04 0.16 Allowed 'General case' 0 C--N 1.344 0.355 0 CA-C-N 120.004 1.274 . . . . 0.0 111.588 178.716 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' A' A ' 106' ' ' GLN . . . . . . . . . . . . . 10.2 pt20 -176.62 -164.95 0.12 Allowed 'General case' 0 C--N 1.329 -0.325 0 C-N-CA 127.303 2.241 . . . . 0.0 106.526 -174.69 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 107' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -135.42 138.9 43.7 Favored 'General case' 0 N--CA 1.443 -0.786 0 N-CA-C 107.663 -1.236 . . . . 0.0 107.663 -163.459 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 108' ' ' LEU . . . . . . . . . . . . . 1.1 mm? -133.58 162.84 30.81 Favored 'General case' 0 C--N 1.331 -0.226 0 C-N-CA 125.73 1.612 . . . . 0.0 107.401 174.039 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 109' ' ' THR . . . . . . . . . . . . . 81.1 m -139.64 116.7 11.07 Favored 'General case' 0 C--O 1.237 0.435 0 N-CA-C 108.307 -0.998 . . . . 0.0 108.307 174.746 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 110' ' ' TYR . . . . . . . . . . . . . 0.8 OUTLIER -94.68 157.04 16.14 Favored 'General case' 0 CA--C 1.536 0.409 0 C-N-CA 126.498 1.919 . . . . 0.0 109.012 177.731 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 111' ' ' LYS . . . . . 0.46 ' HE2' ' HG3' ' A' ' 15' ' ' GLU . 3.7 tppt? -102.02 150.69 22.98 Favored 'General case' 0 C--O 1.237 0.41 0 C-N-CA 126.795 2.038 . . . . 0.0 108.994 176.05 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 112' ' ' LEU . . . . . . . . . . . . . 44.4 tp -72.95 59.34 0.5 Allowed 'General case' 0 CA--C 1.54 0.58 0 C-N-CA 124.968 1.307 . . . . 0.0 108.649 158.967 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 113' ' ' ALA . . . . . . . . . . . . . . . -96.63 83.83 3.54 Favored 'General case' 0 C--N 1.328 -0.351 0 N-CA-C 106.112 -1.811 . . . . 0.0 106.112 164.97 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 114' ' ' ASP . . . . . . . . . . . . . 3.2 p-10 -104.15 20.7 17.82 Favored 'General case' 0 CA--C 1.53 0.183 0 C-N-CA 125.271 1.429 . . . . 0.0 111.886 -176.89 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 115' ' ' LEU . . . . . . . . . . . . . 22.2 mt 70.63 13.82 7.26 Favored 'General case' 0 CA--C 1.541 0.608 0 C-N-CA 127.298 2.239 . . . . 0.0 112.886 177.267 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 116' ' ' MET . . . . . . . . . . . . . 5.5 ppp? -57.81 173.51 0.3 Allowed 'General case' 0 CA--C 1.531 0.236 0 C-N-CA 126.823 2.049 . . . . 0.0 114.395 175.919 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 117' ' ' ASN . . . . . . . . . . . . . 14.2 t30 . . . . . 0 C--O 1.234 0.26 0 C-N-CA 125.195 1.398 . . . . 0.0 108.418 168.208 . . . . . . . . 0 0 . 1 . 007 nuclear orig full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 0.2 OUTLIER . . . . . 0 N--CA 1.451 -0.389 0 N-CA-C 109.099 -0.704 . . . . 0.0 109.099 . . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 2' ' ' VAL . . . . . . . . . . . . . 7.6 p -59.5 144.76 12.18 Favored 'Isoleucine or valine' 0 C--O 1.237 0.418 0 CA-C-O 120.879 0.371 . . . . 0.0 110.877 175.713 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 3' ' ' THR . . . . . . . . . . . . . 4.3 p -132.39 164.48 43.1 Favored Pre-proline 0 N--CA 1.453 -0.301 0 C-N-CA 124.508 1.123 . . . . 0.0 110.297 -178.064 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 4' ' ' PRO . . . . . . . . . . . . . 29.6 Cg_endo -66.15 -38.99 19.61 Favored 'Trans proline' 0 N--CA 1.462 -0.368 0 C-N-CA 122.559 2.173 . . . . 0.0 113.032 178.121 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 5' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -58.48 -47.48 83.92 Favored 'General case' 0 C--N 1.328 -0.353 0 C-N-CA 123.433 0.693 . . . . 0.0 110.907 -174.857 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 6' ' ' GLN . . . . . . . . . . . . . 15.8 pt20 -69.75 15.55 0.08 Allowed 'General case' 0 CA--C 1.541 0.603 0 C-N-CA 124.975 1.31 . . . . 0.0 114.048 176.161 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 7' ' ' LEU . . . . . . . . . . . . . 94.4 mt -130.3 -47.02 1.09 Allowed 'General case' 0 CA--C 1.529 0.17 0 C-N-CA 125.475 1.51 . . . . 0.0 110.882 -178.149 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 8' ' ' GLN . . . . . . . . . . . . . 7.1 mt-30 -60.77 -6.34 1.7 Allowed 'General case' 0 N--CA 1.479 1.012 0 N-CA-C 114.945 1.461 . . . . 0.0 114.945 -175.356 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 9' ' ' HIS . . . . . . . . . . . . . 10.7 m170 -126.94 13.29 7.32 Favored 'General case' 0 C--N 1.323 -0.554 0 C-N-CA 124.701 1.2 . . . . 0.0 111.359 -175.667 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 10' ' ' HIS . . . . . . . . . . . . . 73.8 m-70 -137.82 106.4 5.86 Favored 'General case' 0 CA--C 1.542 0.636 0 C-N-CA 124.466 1.107 . . . . 0.0 110.583 -161.341 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 11' ' ' ARG . . . . . . . . . . . . . 1.8 ttt180 -69.65 144.73 52.83 Favored 'General case' 0 N--CA 1.472 0.659 0 O-C-N 121.241 -0.912 . . . . 0.0 109.909 173.87 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 12' ' ' PHE . . . . . . . . . . . . . 39.4 m-85 -133.84 117.6 17.02 Favored 'General case' 0 N--CA 1.454 -0.26 0 C-N-CA 125.571 1.548 . . . . 0.0 107.709 177.584 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 13' ' ' VAL . . . . . 0.419 ' HA ' ' HA ' ' A' ' 30' ' ' GLU . 11.8 p -89.73 146.22 6.45 Favored 'Isoleucine or valine' 0 C--O 1.237 0.423 0 O-C-N 120.939 -1.101 . . . . 0.0 109.53 171.836 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 14' ' ' LEU . . . . . . . . . . . . . 25.0 tp -71.59 94.79 1.35 Allowed 'General case' 0 N--CA 1.453 -0.291 0 N-CA-C 107.572 -1.27 . . . . 0.0 107.572 173.078 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 4.3 mm-40 -61.89 -57.27 12.41 Favored 'General case' 0 N--CA 1.452 -0.327 0 N-CA-C 107.68 -1.23 . . . . 0.0 107.68 168.822 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 16' ' ' SER . . . . . 0.404 ' HA ' ' HA ' ' A' ' 21' ' ' PRO . 40.8 p -144.11 134.68 24.82 Favored 'General case' 0 N--CA 1.45 -0.457 0 N-CA-C 114.023 1.12 . . . . 0.0 114.023 -170.38 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 17' ' ' VAL . . . . . . . . . . . . . 65.9 t -72.52 165.07 3.16 Favored 'Isoleucine or valine' 0 C--O 1.24 0.577 0 N-CA-C 107.148 -1.427 . . . . 0.0 107.148 168.916 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 18' ' ' ASN . . . . . . . . . . . . . 0.0 OUTLIER -44.81 -39.56 5.4 Favored 'General case' 0 CA--C 1.534 0.33 0 C-N-CA 124.701 1.2 . . . . 0.0 112.185 174.776 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . -79.68 -81.11 0.76 Allowed Glycine 0 CA--C 1.526 0.734 0 C-N-CA 124.848 1.213 . . . . 0.0 110.609 177.565 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 37.7 mttt -141.99 166.29 22.46 Favored Pre-proline 0 CA--C 1.534 0.354 0 C-N-CA 127.057 2.143 . . . . 0.0 109.771 -173.517 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 21' ' ' PRO . . . . . 0.404 ' HA ' ' HA ' ' A' ' 16' ' ' SER . 30.8 Cg_endo -58.14 168.54 3.54 Favored 'Trans proline' 0 N--CA 1.453 -0.865 0 C-N-CA 122.283 1.989 . . . . 0.0 113.042 172.58 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 22' ' ' VAL . . . . . . . . . . . . . 10.1 p -117.36 166.79 11.34 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.48 0 C-N-CA 127.31 2.244 . . . . 0.0 107.747 -179.45 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 23' ' ' THR . . . . . . . . . . . . . 39.7 m -131.14 156.35 45.42 Favored 'General case' 0 C--O 1.238 0.454 0 O-C-N 120.019 -1.676 . . . . 0.0 110.09 -177.772 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 24' ' ' SER . . . . . . . . . . . . . 1.7 p -154.98 136.15 13.94 Favored 'General case' 0 N--CA 1.435 -1.216 0 C-N-CA 125.806 1.642 . . . . 0.0 108.783 -162.379 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 25' ' ' ASP . . . . . . . . . . . . . 3.2 m-20 -71.14 63.33 0.33 Allowed 'General case' 0 C--N 1.32 -0.713 0 C-N-CA 124.936 1.295 . . . . 0.0 108.472 165.049 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 26' ' ' LYS . . . . . . . . . . . . . 31.0 tttp 62.79 4.9 1.57 Allowed 'General case' 0 CA--C 1.546 0.802 0 C-N-CA 124.329 1.052 . . . . 0.0 113.487 -179.554 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 27' ' ' ASN . . . . . . . . . . . . . 84.7 m-20 -127.2 76.54 76.26 Favored Pre-proline 0 C--O 1.239 0.525 0 C-N-CA 125.89 1.676 . . . . 0.0 108.306 -178.213 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 28' ' ' PRO . . . . . . . . . . . . . 85.4 Cg_endo -77.67 165.88 26.32 Favored 'Trans proline' 0 N--CA 1.461 -0.434 0 C-N-CA 124.078 3.186 . . . . 0.0 111.791 -176.42 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 29' ' ' PRO . . . . . . . . . . . . . 38.5 Cg_endo -66.89 83.41 0.32 Allowed 'Trans proline' 0 N--CA 1.452 -0.938 0 C-N-CA 122.789 2.326 . . . . 0.0 108.392 161.946 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 30' ' ' GLU . . . . . 0.419 ' HA ' ' HA ' ' A' ' 13' ' ' VAL . 12.9 pt-20 -91.67 163.73 13.99 Favored 'General case' 0 C--O 1.239 0.54 0 O-C-N 120.725 -1.235 . . . . 0.0 108.763 163.17 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 31' ' ' ILE . . . . . . . . . . . . . 12.1 tt -130.42 153.97 39.83 Favored 'Isoleucine or valine' 0 N--CA 1.449 -0.49 0 N-CA-C 106.06 -1.83 . . . . 0.0 106.06 171.806 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 32' ' ' SER . . . . . . . . . . . . . 3.6 t -144.86 172.46 13.0 Favored 'General case' 0 N--CA 1.445 -0.722 0 N-CA-C 107.074 -1.454 . . . . 0.0 107.074 167.765 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 33' ' ' PHE . . . . . . . . . . . . . 66.1 m-85 -136.12 163.07 31.19 Favored 'General case' 0 N--CA 1.445 -0.687 0 N-CA-C 107.027 -1.472 . . . . 0.0 107.027 -179.328 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 34' ' ' GLY . . . . . . . . . . . . . . . 167.54 113.95 0.29 Allowed Glycine 0 CA--C 1.495 -1.164 0 C-N-CA 118.226 -1.94 . . . . 0.0 114.639 172.263 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 35' ' ' GLU . . . . . . . . . . . . . 2.4 pt-20 77.12 140.57 0.07 Allowed 'General case' 0 N--CA 1.443 -0.787 1 C-N-CA 134.381 5.073 . . . . 0.0 106.845 -169.121 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 8.8 mtpm? 47.12 20.27 0.13 Allowed 'General case' 0 CA--C 1.544 0.733 0 N-CA-C 116.245 1.943 . . . . 0.0 116.245 176.167 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 37' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER 53.56 33.97 17.49 Favored 'General case' 0 C--N 1.331 -0.235 0 C-N-CA 126.418 1.887 . . . . 0.0 113.155 -167.964 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 38' ' ' MET . . . . . 0.46 ' HA ' ' H ' ' A' ' 51' ' ' GLY . 0.1 OUTLIER -62.83 166.17 5.88 Favored 'General case' 0 N--CA 1.45 -0.451 0 N-CA-C 108.943 -0.762 . . . . 0.0 108.943 168.342 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' A' A ' 39' ' ' ILE . . . . . . . . . . . . . 9.1 mt -134.97 128.27 49.56 Favored 'Isoleucine or valine' 0 C--O 1.239 0.51 0 N-CA-C 107.471 -1.307 . . . . 0.0 107.471 -168.288 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 40' ' ' SER . . . . . . . . . . . . . 27.6 m -119.82 148.0 43.98 Favored 'General case' 0 CA--C 1.532 0.274 0 C-N-CA 124.735 1.214 . . . . 0.0 108.082 166.734 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 41' ' ' GLY . . . . . . . . . . . . . . . 173.23 178.61 43.34 Favored Glycine 0 CA--C 1.522 0.493 0 N-CA-C 109.725 -1.35 . . . . 0.0 109.725 -177.817 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 42' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -163.27 96.09 0.86 Allowed 'General case' 0 CA--C 1.536 0.418 0 O-C-N 121.942 -0.74 . . . . 0.0 110.863 -176.566 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 43' ' ' MET . . . . . . . . . . . . . 13.0 mmt -71.47 -68.73 0.43 Allowed 'General case' 0 N--CA 1.469 0.481 0 CA-C-N 118.456 0.571 . . . . 0.0 110.391 173.862 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 44' ' ' CYS . . . . . 1.286 ' SG ' ' SG ' ' A' ' 70' ' ' CYS . 45.6 t -135.59 -58.97 0.77 Allowed 'General case' 0 CA--C 1.527 0.089 0 N-CA-C 106.469 -1.678 . . . . 0.0 106.469 171.452 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 45' ' ' ASN . . . . . . . . . . . . . 25.7 m-20 -78.38 22.74 0.32 Allowed 'General case' 0 C--O 1.233 0.214 0 C-N-CA 126.811 2.044 . . . . 0.0 114.315 -175.118 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 46' ' ' ARG . . . . . . . . . . . . . 5.7 mpt_? 53.64 -173.85 0.04 OUTLIER 'General case' 0 C--O 1.225 -0.214 0 C-N-CA 124.028 0.931 . . . . 0.0 109.447 -163.737 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 47' ' ' PHE . . . . . . . . . . . . . 6.7 p90 -178.09 145.76 0.38 Allowed 'General case' 0 C--O 1.238 0.456 0 C-N-CA 126.399 1.88 . . . . 0.0 107.309 156.854 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 48' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -153.36 146.18 24.38 Favored 'General case' 0 C--N 1.324 -0.521 0 N-CA-C 107.749 -1.204 . . . . 0.0 107.749 177.23 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 49' ' ' GLY . . . . . . . . . . . . . . . -179.34 163.91 31.68 Favored Glycine 0 C--N 1.336 0.572 0 C-N-CA 120.398 -0.906 . . . . 0.0 112.615 179.133 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 50' ' ' GLU . . . . . . . . . . . . . 35.6 mt-10 -70.16 97.14 1.16 Allowed 'General case' 0 C--O 1.238 0.475 0 C-N-CA 124.809 1.244 . . . . 0.0 108.041 166.965 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 51' ' ' GLY . . . . . 0.46 ' H ' ' HA ' ' A' ' 38' ' ' MET . . . -72.08 175.58 41.97 Favored Glycine 0 CA--C 1.523 0.579 0 N-CA-C 110.416 -1.074 . . . . 0.0 110.416 155.888 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 52' ' ' LYS . . . . . . . . . . . . . 50.8 tttm -164.16 152.65 13.09 Favored 'General case' 0 C--N 1.332 -0.189 0 C-N-CA 125.795 1.638 . . . . 0.0 106.739 168.025 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 53' ' ' LEU . . . . . . . . . . . . . 46.2 tp -131.26 130.63 43.1 Favored 'General case' 0 C--O 1.232 0.179 0 C-N-CA 124.505 1.122 . . . . 0.0 109.169 170.813 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 40.1 t -139.37 -27.24 0.8 Allowed 'General case' 0 CA--C 1.535 0.399 0 C-N-CA 125.04 1.336 . . . . 0.0 111.292 177.832 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 55' ' ' ASN . . . . . . . . . . . . . 16.7 p-10 -146.41 17.96 1.34 Allowed 'General case' 0 CA--C 1.534 0.331 0 C-N-CA 124.486 1.114 . . . . 0.0 113.397 -153.319 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 56' ' ' GLY . . . . . . . . . . . . . . . 81.12 22.69 60.5 Favored Glycine 0 CA--C 1.525 0.692 0 CA-C-N 118.818 0.736 . . . . 0.0 112.958 -177.266 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 57' ' ' GLU . . . . . . . . . . . . . 35.8 tt0 -146.58 142.4 27.93 Favored 'General case' 0 C--O 1.237 0.425 0 C-N-CA 124.954 1.302 . . . . 0.0 109.183 -174.084 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 58' ' ' LEU . . . . . . . . . . . . . 57.9 tp -122.77 102.17 7.88 Favored 'General case' 0 CA--C 1.53 0.181 0 C-N-CA 127.115 2.166 . . . . 0.0 110.668 176.706 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 59' ' ' THR . . . . . . . . . . . . . 13.6 p -88.18 167.35 13.68 Favored 'General case' 0 CA--C 1.54 0.564 0 C-N-CA 124.611 1.164 . . . . 0.0 109.898 164.692 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 60' ' ' ALA . . . . . . . . . . . . . . . -132.23 107.54 8.65 Favored 'General case' 0 CA--C 1.528 0.131 0 C-N-CA 124.934 1.294 . . . . 0.0 109.574 163.069 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 61' ' ' LYS . . . . . . . . . . . . . 12.8 mttt -67.24 6.78 0.51 Allowed 'General case' 0 CA--C 1.54 0.585 0 N-CA-C 115.355 1.613 . . . . 0.0 115.355 -173.016 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 62' ' ' GLY . . . . . . . . . . . . . . . -150.35 -71.11 0.01 OUTLIER Glycine 0 CA--C 1.522 0.48 0 CA-C-N 120.818 1.645 . . . . 0.0 109.417 179.877 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 63' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER 60.55 89.75 0.07 Allowed 'General case' 0 N--CA 1.444 -0.728 0 C-N-CA 129.993 3.317 . . . . 0.0 113.261 179.304 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 64' ' ' ALA . . . . . . . . . . . . . . . -75.97 103.37 6.0 Favored 'General case' 0 C--O 1.236 0.393 0 C-N-CA 124.88 1.272 . . . . 0.0 111.239 -178.141 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 65' ' ' MET . . . . . . . . . . . . . 5.2 mtt -108.21 168.67 9.14 Favored 'General case' 0 N--CA 1.466 0.361 0 C-N-CA 124.0 0.92 . . . . 0.0 112.211 172.523 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 66' ' ' THR . . . . . . . . . . . . . 72.5 p -107.34 -163.96 0.94 Allowed 'General case' 0 CA--C 1.54 0.57 0 C-N-CA 126.392 1.877 . . . . 0.0 111.167 -176.474 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 67' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -141.01 84.26 1.92 Allowed 'General case' 0 N--CA 1.467 0.378 0 C-N-CA 124.282 1.033 . . . . 0.0 109.685 172.604 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 68' ' ' MET . . . . . . . . . . . . . 51.0 mtm -134.79 176.83 8.29 Favored 'General case' 0 C--N 1.324 -0.529 0 C-N-CA 129.566 3.147 . . . . 0.0 108.536 -178.641 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 69' ' ' MET . . . . . . . . . . . . . 1.6 pmm? -134.31 177.57 7.66 Favored 'General case' 0 N--CA 1.451 -0.392 0 C-N-CA 126.766 2.026 . . . . 0.0 109.872 170.114 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 70' ' ' CYS . . . . . 1.286 ' SG ' ' SG ' ' A' ' 44' ' ' CYS . 65.6 m -143.57 149.48 37.46 Favored 'General case' 0 C--N 1.33 -0.265 0 C-N-CA 126.37 1.868 . . . . 0.0 109.081 -170.037 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 71' ' ' ALA . . . . . . . . . . . . . . . -77.73 20.68 0.33 Allowed 'General case' 0 CA--C 1.539 0.524 0 N-CA-C 114.098 1.147 . . . . 0.0 114.098 -169.188 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 72' ' ' ASN . . . . . . . . . . . . . 21.8 t30 -147.22 142.26 16.73 Favored Pre-proline 0 C--O 1.236 0.393 0 N-CA-C 106.087 -1.82 . . . . 0.0 106.087 162.425 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 73' ' ' PRO . . . . . . . . . . . . . 30.4 Cg_endo -70.85 -21.98 27.71 Favored 'Trans proline' 0 C--N 1.346 0.399 0 C-N-CA 122.329 2.019 . . . . 0.0 112.621 -172.089 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 74' ' ' GLN . . . . . . . . . . . . . 39.0 tt0 -52.97 -38.3 62.04 Favored 'General case' 0 CA--C 1.534 0.332 0 C-N-CA 124.001 0.921 . . . . 0.0 111.581 -179.111 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 75' ' ' LEU . . . . . . . . . . . . . 32.5 mt -76.58 -31.37 57.46 Favored 'General case' 0 CA--C 1.533 0.312 0 C-N-CA 123.677 0.791 . . . . 0.0 111.732 -178.768 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 76' ' ' ASN . . . . . . . . . . . . . 3.2 t-20 -79.82 -14.34 58.75 Favored 'General case' 0 N--CA 1.469 0.52 0 C-N-CA 125.25 1.42 . . . . 0.0 110.991 179.975 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 77' ' ' GLU . . . . . . . . . . . . . 5.5 mm-40 -80.99 -44.83 17.53 Favored 'General case' 0 C--O 1.236 0.372 0 C-N-CA 126.265 1.826 . . . . 0.0 109.867 163.101 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 78' ' ' LEU . . . . . . . . . . . . . 23.9 mt -66.06 -36.21 82.61 Favored 'General case' 0 CA--C 1.51 -0.562 0 O-C-N 121.658 -0.651 . . . . 0.0 112.482 -171.822 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 79' ' ' ASP . . . . . . . . . . . . . 0.0 OUTLIER -61.65 -34.99 76.66 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-O 119.155 -0.45 . . . . 0.0 111.49 176.033 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 80' ' ' ASN . . . . . . . . . . . . . 11.2 t30 -75.61 -48.59 21.55 Favored 'General case' 0 N--CA 1.447 -0.591 0 N-CA-C 108.595 -0.891 . . . . 0.0 108.595 179.618 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 81' ' ' THR . . . . . . . . . . . . . 36.6 m -46.79 -59.8 2.82 Favored 'General case' 0 N--CA 1.449 -0.511 0 C-N-CA 125.175 1.39 . . . . 0.0 109.212 176.976 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 82' ' ' ILE . . . . . . . . . . . . . 4.6 tp -69.33 -34.77 64.25 Favored 'Isoleucine or valine' 0 C--O 1.237 0.407 0 O-C-N 121.615 -0.678 . . . . 0.0 111.914 -172.865 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 83' ' ' SER . . . . . . . . . . . . . 0.6 OUTLIER -58.94 -47.36 85.34 Favored 'General case' 0 N--CA 1.452 -0.365 0 N-CA-C 109.166 -0.679 . . . . 0.0 109.166 179.594 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 84' ' ' GLU . . . . . . . . . . . . . 16.8 tt0 -67.21 -42.8 83.51 Favored 'General case' 0 N--CA 1.447 -0.591 0 C-N-CA 124.453 1.101 . . . . 0.0 110.689 -179.163 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 85' ' ' MET . . . . . . . . . . . . . 48.4 mtp -59.66 -47.91 83.73 Favored 'General case' 0 C--N 1.343 0.317 0 CA-C-N 119.611 1.096 . . . . 0.0 110.115 -174.89 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 86' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -76.57 -20.3 56.96 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-O 118.824 -0.608 . . . . 0.0 112.114 -175.702 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 87' ' ' LYS . . . . . . . . . . . . . 3.3 tptt -71.93 -37.36 70.05 Favored 'General case' 0 N--CA 1.45 -0.43 0 N-CA-C 109.027 -0.731 . . . . 0.0 109.027 174.462 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 88' ' ' GLU . . . . . . . . . . . . . 89.2 mt-10 -89.24 -28.74 19.73 Favored 'General case' 0 C--O 1.233 0.218 0 CA-C-O 117.76 -1.114 . . . . 0.0 112.895 -173.106 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 89' ' ' GLY . . . . . . . . . . . . . . . 112.52 97.25 2.32 Favored Glycine 0 C--N 1.337 0.603 0 N-CA-C 109.483 -1.447 . . . . 0.0 109.483 -176.472 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 90' ' ' ALA . . . . . . . . . . . . . . . -78.89 128.86 33.88 Favored 'General case' 0 N--CA 1.449 -0.489 0 N-CA-C 108.02 -1.104 . . . . 0.0 108.02 174.514 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 91' ' ' GLN . . . . . . . . . . . . . 2.6 mp0 -62.8 140.65 58.78 Favored 'General case' 0 C--N 1.327 -0.402 0 N-CA-C 107.334 -1.358 . . . . 0.0 107.334 169.015 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 92' ' ' VAL . . . . . . . . . . . . . 25.4 t -126.45 114.6 38.85 Favored 'Isoleucine or valine' 0 N--CA 1.444 -0.753 0 C-N-CA 125.623 1.569 . . . . 0.0 108.14 -172.399 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 93' ' ' ASP . . . . . . . . . . . . . 14.4 m-20 -137.37 72.21 1.42 Allowed 'General case' 0 CA--C 1.538 0.486 0 C-N-CA 126.568 1.947 . . . . 0.0 106.709 -179.213 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 94' ' ' LEU . . . . . . . . . . . . . 0.9 OUTLIER -74.93 107.82 7.26 Favored 'General case' 0 N--CA 1.464 0.265 0 N-CA-C 106.694 -1.595 . . . . 0.0 106.694 168.311 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 95' ' ' THR . . . . . . . . . . . . . 2.2 t -71.93 -164.51 0.13 Allowed 'General case' 0 CA--C 1.54 0.564 0 C-N-CA 125.062 1.345 . . . . 0.0 108.313 172.127 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 96' ' ' ALA . . . . . . . . . . . . . . . -44.56 -49.26 10.2 Favored 'General case' 0 CA--C 1.543 0.68 0 O-C-N 121.26 -0.9 . . . . 0.0 112.725 -177.665 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 97' ' ' ASN . . . . . . . . . . . . . 31.3 p30 -157.66 28.44 0.28 Allowed 'General case' 0 CA--C 1.542 0.662 0 C-N-CA 125.707 1.603 . . . . 0.0 113.28 -174.529 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 98' ' ' GLN . . . . . . . . . . . . . 11.4 tt0 -137.72 121.91 18.05 Favored 'General case' 0 N--CA 1.466 0.329 0 C-N-CA 124.924 1.289 . . . . 0.0 107.953 173.822 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 99' ' ' LEU . . . . . . . . . . . . . 6.8 tp -69.43 123.63 21.77 Favored 'General case' 0 N--CA 1.451 -0.378 0 N-CA-C 105.793 -1.928 . . . . 0.0 105.793 172.666 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 100' ' ' THR . . . . . . . . . . . . . 3.7 m -121.64 113.82 20.29 Favored 'General case' 0 N--CA 1.452 -0.336 0 N-CA-C 105.698 -1.964 . . . . 0.0 105.698 172.478 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 101' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -121.01 150.76 40.64 Favored 'General case' 0 C--O 1.234 0.271 0 N-CA-C 107.345 -1.354 . . . . 0.0 107.345 -177.387 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 102' ' ' ALA . . . . . . . . . . . . . . . -144.86 161.37 39.47 Favored 'General case' 0 C--N 1.33 -0.277 0 C-N-CA 124.988 1.315 . . . . 0.0 108.595 172.745 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 103' ' ' THR . . . . . . . . . . . . . 2.9 m -155.78 -168.14 2.7 Favored 'General case' 0 N--CA 1.446 -0.656 0 C-N-CA 127.404 2.282 . . . . 0.0 105.331 170.178 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 104' ' ' ALA . . . . . . . . . . . . . . . -57.42 -46.56 83.37 Favored 'General case' 0 CA--C 1.535 0.396 0 O-C-N 120.313 -1.492 . . . . 0.0 110.971 161.874 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 105' ' ' LYS . . . . . . . . . . . . . 3.3 tmtt? -49.61 -64.8 0.7 Allowed 'General case' 0 N--CA 1.465 0.298 0 C-N-CA 125.257 1.423 . . . . 0.0 113.056 -170.685 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 106' ' ' GLN . . . . . . . . . . . . . 3.5 pt20 -166.83 -167.78 1.02 Allowed 'General case' 0 CA--C 1.536 0.411 0 C-N-CA 126.092 1.757 . . . . 0.0 108.437 -175.838 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 107' ' ' THR . . . . . . . . . . . . . 0.5 OUTLIER -124.0 149.05 46.47 Favored 'General case' 0 CA--C 1.533 0.324 0 N-CA-C 107.504 -1.295 . . . . 0.0 107.504 168.672 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 108' ' ' LEU . . . . . . . . . . . . . 9.5 mp -120.35 157.16 29.84 Favored 'General case' 0 C--O 1.239 0.53 0 C-N-CA 126.362 1.865 . . . . 0.0 108.979 178.307 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 109' ' ' THR . . . . . . . . . . . . . 3.5 m -136.69 93.4 2.86 Favored 'General case' 0 C--O 1.238 0.479 0 N-CA-C 108.935 -0.765 . . . . 0.0 108.935 176.14 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 110' ' ' TYR . . . . . . . . . . . . . 34.5 m-85 -90.21 155.92 18.68 Favored 'General case' 0 CA--C 1.534 0.337 0 CA-C-O 121.168 0.509 . . . . 0.0 109.795 172.451 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 111' ' ' LYS . . . . . . . . . . . . . 0.3 OUTLIER -108.83 143.66 37.73 Favored 'General case' 0 CA--C 1.518 -0.271 0 C-N-CA 124.857 1.263 . . . . 0.0 108.145 178.426 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 112' ' ' LEU . . . . . . . . . . . . . 45.8 tp -70.45 68.17 0.36 Allowed 'General case' 0 CA--C 1.543 0.689 0 C-N-CA 125.155 1.382 . . . . 0.0 109.578 168.158 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 113' ' ' ALA . . . . . . . . . . . . . . . -100.26 75.24 1.8 Allowed 'General case' 0 N--CA 1.464 0.265 0 N-CA-C 106.571 -1.64 . . . . 0.0 106.571 -179.956 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 114' ' ' ASP . . . . . . . . . . . . . 42.6 t0 -107.16 32.97 4.23 Favored 'General case' 0 C--N 1.326 -0.414 0 CA-C-O 121.539 0.685 . . . . 0.0 110.802 -160.256 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 115' ' ' LEU . . . . . . . . . . . . . 29.3 mt 63.71 12.2 6.42 Favored 'General case' 0 CA--C 1.535 0.366 0 C-N-CA 126.28 1.832 . . . . 0.0 113.322 173.67 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 116' ' ' MET . . . . . . . . . . . . . 0.3 OUTLIER -96.65 5.0 51.58 Favored 'General case' 0 C--N 1.33 -0.245 0 C-N-CA 125.051 1.341 . . . . 0.0 113.384 -175.634 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 117' ' ' ASN . . . . . . . . . . . . . 8.2 t-20 . . . . . 0 C--O 1.232 0.162 0 C-N-CA 124.14 0.976 . . . . 0.0 109.837 -173.968 . . . . . . . . 0 0 . 1 . 008 nuclear orig full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 1.4 pmm? . . . . . 0 CA--C 1.536 0.427 0 N-CA-C 109.437 -0.579 . . . . 0.0 109.437 . . . . . . . . . 0 0 . 1 . 008 nuclear orig full ' A' A ' 2' ' ' VAL . . . . . . . . . . . . . 6.7 p -72.34 153.37 7.74 Favored 'Isoleucine or valine' 0 C--O 1.236 0.357 0 N-CA-C 109.363 -0.606 . . . . 0.0 109.363 174.202 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 3' ' ' THR . . . . . . . . . . . . . 0.5 OUTLIER -132.79 159.15 73.74 Favored Pre-proline 0 CA--C 1.532 0.25 0 C-N-CA 124.053 0.941 . . . . 0.0 109.976 171.829 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 4' ' ' PRO . . . . . . . . . . . . . 55.4 Cg_endo -64.77 -34.28 50.63 Favored 'Trans proline' 0 C--N 1.345 0.358 0 C-N-CA 123.102 2.534 . . . . 0.0 111.341 -176.728 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 5' ' ' GLU . . . . . . . . . . . . . 19.2 tt0 -52.21 -55.31 21.94 Favored 'General case' 0 N--CA 1.449 -0.476 0 C-N-CA 125.471 1.508 . . . . 0.0 110.146 175.636 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 6' ' ' GLN . . . . . . . . . . . . . 11.8 pt20 -70.14 20.79 0.04 OUTLIER 'General case' 0 CA--C 1.543 0.694 0 N-CA-C 114.243 1.201 . . . . 0.0 114.243 176.039 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 7' ' ' LEU . . . . . . . . . . . . . 76.0 mt -129.54 -56.1 1.15 Allowed 'General case' 0 N--CA 1.461 0.119 0 C-N-CA 124.87 1.268 . . . . 0.0 110.922 178.435 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 8' ' ' GLN . . . . . . . . . . . . . 6.3 mt-30 -44.59 -8.73 0.01 OUTLIER 'General case' 0 N--CA 1.474 0.759 0 C-N-CA 129.257 3.023 . . . . 0.0 117.969 -178.159 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 9' ' ' HIS . . . . . . . . . . . . . 19.4 p80 -148.88 35.72 0.77 Allowed 'General case' 0 C--N 1.325 -0.473 0 C-N-CA 123.531 0.733 . . . . 0.0 112.276 177.651 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 10' ' ' HIS . . . . . . . . . . . . . 91.5 m-70 -130.86 165.1 23.77 Favored 'General case' 0 C--O 1.235 0.3 0 CA-C-O 121.626 0.727 . . . . 0.0 110.695 174.972 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 11' ' ' ARG . . . . . . . . . . . . . 60.3 ttt180 -128.94 139.46 52.1 Favored 'General case' 0 C--O 1.235 0.317 0 C-N-CA 126.252 1.821 . . . . 0.0 107.057 -173.606 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 12' ' ' PHE . . . . . . . . . . . . . 45.0 m-85 -137.43 112.28 8.93 Favored 'General case' 0 N--CA 1.441 -0.883 0 C-N-CA 125.181 1.392 . . . . 0.0 107.341 -164.684 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 13' ' ' VAL . . . . . . . . . . . . . 2.8 t -103.67 144.31 14.31 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.482 0 N-CA-C 106.709 -1.589 . . . . 0.0 106.709 -174.401 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 14' ' ' LEU . . . . . . . . . . . . . 11.5 tp -79.08 96.08 5.71 Favored 'General case' 0 N--CA 1.449 -0.494 0 N-CA-C 109.513 -0.551 . . . . 0.0 109.513 -169.834 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 1.4 mm-40 -76.3 -39.14 54.95 Favored 'General case' 0 N--CA 1.452 -0.344 0 CA-C-O 118.46 -0.781 . . . . 0.0 111.292 -170.943 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 2.6 t -156.03 156.73 34.92 Favored 'General case' 0 C--O 1.237 0.417 0 CA-C-N 119.721 1.146 . . . . 0.0 111.126 161.126 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 17' ' ' VAL . . . . . . . . . . . . . 21.3 t -86.3 171.66 1.12 Allowed 'Isoleucine or valine' 0 CA--C 1.534 0.331 0 C-N-CA 126.017 1.727 . . . . 0.0 107.504 172.519 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 18' ' ' ASN . . . . . . . . . . . . . 20.6 t30 -53.16 -35.59 59.95 Favored 'General case' 0 CA--C 1.53 0.195 0 C-N-CA 124.304 1.041 . . . . 0.0 112.494 166.393 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . -93.97 -54.16 1.67 Allowed Glycine 0 CA--C 1.525 0.659 0 C-N-CA 123.755 0.693 . . . . 0.0 112.806 -170.336 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 16.6 ptpt -160.0 163.83 21.45 Favored Pre-proline 0 N--CA 1.465 0.307 0 C-N-CA 125.665 1.586 . . . . 0.0 108.806 -174.723 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 21' ' ' PRO . . . . . . . . . . . . . 59.1 Cg_endo -70.93 171.21 16.2 Favored 'Trans proline' 0 N--CA 1.454 -0.815 0 CA-C-N 120.806 1.324 . . . . 0.0 110.973 170.67 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 22' ' ' VAL . . . . . . . . . . . . . 2.7 p -135.56 136.31 50.73 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.369 0 C-N-CA 126.552 1.941 . . . . 0.0 107.155 -178.155 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 23' ' ' THR . . . . . . . . . . . . . 0.8 OUTLIER -144.92 123.99 12.83 Favored 'General case' 0 C--O 1.238 0.459 0 N-CA-C 107.005 -1.48 . . . . 0.0 107.005 -175.398 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 24' ' ' SER . . . . . . . . . . . . . 14.7 m -123.26 41.25 3.52 Favored 'General case' 0 C--O 1.235 0.333 0 C-N-CA 124.957 1.303 . . . . 0.0 110.146 -163.958 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 25' ' ' ASP . . . . . . . . . . . . . 38.7 m-20 62.45 -78.46 0.03 OUTLIER 'General case' 0 C--O 1.234 0.254 0 C-N-CA 127.972 2.509 . . . . 0.0 108.582 -167.953 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 26' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -131.4 -8.58 3.72 Favored 'General case' 0 CA--C 1.523 -0.067 0 N-CA-C 115.684 1.735 . . . . 0.0 115.684 178.198 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 27' ' ' ASN . . . . . . . . . . . . . 13.2 m120 -115.41 75.91 4.92 Favored Pre-proline 0 N--CA 1.471 0.595 0 CA-C-N 120.167 1.349 . . . . 0.0 111.328 -175.624 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 28' ' ' PRO . . . . . . . . . . . . . 49.0 Cg_endo -66.53 162.41 36.93 Favored 'Trans proline' 0 CA--C 1.539 0.769 0 C-N-CA 123.392 2.728 . . . . 0.0 113.051 -177.611 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 29' ' ' PRO . . . . . . . . . . . . . 19.5 Cg_endo -66.04 64.85 0.45 Allowed 'Trans proline' 0 CA--C 1.54 0.802 0 C-N-CA 125.088 3.859 . . . . 0.0 113.443 170.833 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 30' ' ' GLU . . . . . . . . . . . . . 10.8 pt-20 -76.38 169.77 17.62 Favored 'General case' 0 CA--C 1.544 0.733 0 O-C-N 119.709 -1.869 . . . . 0.0 111.301 177.779 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 31' ' ' ILE . . . . . . . . . . . . . 16.8 tt -139.04 159.77 29.54 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.406 0 C-N-CA 127.212 2.205 . . . . 0.0 107.013 170.96 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 32' ' ' SER . . . . . . . . . . . . . 45.4 p -149.33 177.02 10.04 Favored 'General case' 0 N--CA 1.444 -0.773 0 C-N-CA 125.747 1.619 . . . . 0.0 107.345 167.453 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 33' ' ' PHE . . . . . . . . . . . . . 39.8 m-85 -134.65 148.8 50.45 Favored 'General case' 0 N--CA 1.447 -0.575 0 N-CA-C 106.458 -1.682 . . . . 0.0 106.458 175.284 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 34' ' ' GLY . . . . . . . . . . . . . . . -163.68 -176.23 35.4 Favored Glycine 0 N--CA 1.445 -0.749 0 N-CA-C 107.453 -2.259 . . . . 0.0 107.453 178.419 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 35' ' ' GLU . . . . . . . . . . . . 0.275 1.9 mt-10 47.36 -162.95 0.03 OUTLIER 'General case' 0 CA--C 1.538 0.506 0 C-N-CA 124.569 1.148 . . . . 0.0 110.083 -171.329 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 6.6 mmpt? -69.29 56.15 0.11 Allowed 'General case' 0 CA--C 1.546 0.791 0 O-C-N 119.207 -2.183 . . . . 0.0 112.644 -174.499 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 37' ' ' MET . . . . . . . . . . . . . 79.4 mmm 46.89 86.69 0.02 OUTLIER 'General case' 0 CA--C 1.539 0.549 0 C-N-CA 126.055 1.742 . . . . 0.0 110.401 -156.698 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 38' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -123.6 4.29 8.94 Favored 'General case' 0 N--CA 1.476 0.836 0 N-CA-C 114.062 1.134 . . . . 0.0 114.062 -175.489 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 39' ' ' ILE . . . . . . . . . . . . . 24.2 mt 46.92 133.47 0.0 OUTLIER 'Isoleucine or valine' 0 CA--C 1.539 0.555 1 C-N-CA 133.135 4.574 . . . . 0.0 111.963 179.888 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 40' ' ' SER . . . . . . . . . . . . . 8.3 m -140.2 101.95 4.26 Favored 'General case' 0 C--N 1.329 -0.31 0 O-C-N 120.163 -1.585 . . . . 0.0 107.227 178.792 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 41' ' ' GLY . . . . . . . . . . . . . . . -145.2 174.2 25.33 Favored Glycine 0 C--N 1.336 0.579 0 CA-C-N 118.841 0.746 . . . . 0.0 112.558 179.286 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 42' ' ' SER . . . . . . . . . . . . . 13.3 p -149.79 85.44 1.42 Allowed 'General case' 0 N--CA 1.451 -0.388 0 C-N-CA 123.108 0.563 . . . . 0.0 110.665 -178.635 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 43' ' ' MET . . . . . . . . . . . . . 3.4 mmt -59.52 -46.5 88.66 Favored 'General case' 0 N--CA 1.462 0.158 0 CA-C-O 122.081 0.943 . . . . 0.0 108.61 167.675 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 44' ' ' CYS . . . . . 1.305 ' SG ' ' SG ' ' A' ' 70' ' ' CYS . 36.5 t -149.32 -66.87 0.22 Allowed 'General case' 0 N--CA 1.442 -0.869 0 C-N-CA 125.178 1.391 . . . . 0.0 107.311 161.363 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 45' ' ' ASN . . . . . . . . . . . . . 3.0 m120 -87.23 22.42 2.11 Favored 'General case' 0 C--N 1.327 -0.387 0 C-N-CA 124.244 1.018 . . . . 0.0 111.884 -155.792 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 46' ' ' ARG . . . . . . . . . . . . . 7.0 mmm180 51.41 162.26 0.0 OUTLIER 'General case' 0 N--CA 1.465 0.291 0 C-N-CA 127.461 2.304 . . . . 0.0 113.09 -162.853 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 47' ' ' PHE . . . . . . . . . . . . . 49.6 p90 -163.64 163.74 24.26 Favored 'General case' 0 C--N 1.324 -0.521 0 C-N-CA 124.826 1.251 . . . . 0.0 109.521 170.03 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 48' ' ' SER . . . . . . . . . . . . . 6.2 m -158.79 165.66 33.75 Favored 'General case' 0 N--CA 1.44 -0.94 0 C-N-CA 126.866 2.066 . . . . 0.0 108.113 173.134 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 49' ' ' GLY . . . . . . . . . . . . . . . -178.59 167.71 38.32 Favored Glycine 0 CA--C 1.519 0.31 0 N-CA-C 110.354 -1.098 . . . . 0.0 110.354 166.981 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 50' ' ' GLU . . . . . . . . . . . . . 32.6 mt-10 -61.69 98.46 0.09 Allowed 'General case' 0 C--N 1.33 -0.253 0 N-CA-C 109.3 -0.629 . . . . 0.0 109.3 176.621 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 51' ' ' GLY . . . . . . . . . . . . . . . -60.14 -67.91 1.93 Allowed Glycine 0 C--N 1.335 0.475 0 O-C-N 124.485 1.116 . . . . 0.0 110.998 -176.94 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 52' ' ' LYS . . . . . . . . . . . . . 0.4 OUTLIER 64.49 164.27 0.14 Allowed 'General case' 0 N--CA 1.453 -0.282 0 C-N-CA 125.173 1.389 . . . . 0.0 109.187 -166.73 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 53' ' ' LEU . . . . . . . . . . . . . 5.9 tp -164.58 111.08 1.02 Allowed 'General case' 0 N--CA 1.45 -0.435 0 N-CA-C 107.429 -1.322 . . . . 0.0 107.429 164.065 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 1.4 t -148.95 -11.59 0.32 Allowed 'General case' 0 C--O 1.234 0.282 0 CA-C-O 117.561 -1.209 . . . . 0.0 112.701 178.087 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 55' ' ' ASN . . . . . . . . . . . . . 0.8 OUTLIER -156.96 46.87 0.42 Allowed 'General case' 0 CA--C 1.538 0.501 0 C-N-CA 124.897 1.279 . . . . 0.0 109.347 -170.201 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 56' ' ' GLY . . . . . . . . . . . . . . . 66.65 5.87 32.87 Favored Glycine 0 CA--C 1.533 1.192 0 N-CA-C 115.968 1.147 . . . . 0.0 115.968 170.425 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 57' ' ' GLU . . . . . . . . . . . . . 18.3 tt0 -132.6 110.61 10.56 Favored 'General case' 0 C--O 1.239 0.504 0 CA-C-N 118.579 1.189 . . . . 0.0 109.183 -164.633 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 58' ' ' LEU . . . . . . . . . . . . . 27.2 tp -89.69 104.44 17.0 Favored 'General case' 0 C--O 1.234 0.267 0 C-N-CA 126.364 1.866 . . . . 0.0 108.148 177.912 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 59' ' ' THR . . . . . . . . . . . . . 0.8 OUTLIER -91.72 168.91 11.14 Favored 'General case' 0 C--N 1.327 -0.393 0 CA-C-O 121.809 0.814 . . . . 0.0 110.302 169.706 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 60' ' ' ALA . . . . . . . . . . . . . . . -123.52 131.62 53.68 Favored 'General case' 0 N--CA 1.45 -0.426 0 N-CA-C 107.173 -1.417 . . . . 0.0 107.173 148.593 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 61' ' ' LYS . . . . . . . . . . . . . 24.3 ttmt -79.54 82.6 5.64 Favored 'General case' 0 N--CA 1.454 -0.24 0 N-CA-C 107.841 -1.17 . . . . 0.0 107.841 173.909 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 62' ' ' GLY . . . . . . . . . . . . . . . 103.99 -48.68 0.98 Allowed Glycine 0 CA--C 1.529 0.958 0 CA-C-O 118.827 -0.985 . . . . 0.0 113.044 174.402 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 63' ' ' LEU . . . . . . . . . . . . . 3.5 tp 64.88 106.29 0.03 OUTLIER 'General case' 0 N--CA 1.442 -0.86 0 C-N-CA 130.804 3.642 . . . . 0.0 113.777 -176.789 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 64' ' ' ALA . . . . . . . . . . . . . . . -77.69 146.25 36.13 Favored 'General case' 0 CA--C 1.533 0.291 0 N-CA-C 108.961 -0.755 . . . . 0.0 108.961 171.206 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 65' ' ' MET . . . . . . . . . . . . . 76.0 mtp -140.83 -164.91 1.83 Allowed 'General case' 0 CA--C 1.542 0.668 0 C-N-CA 126.58 1.952 . . . . 0.0 108.491 179.261 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 66' ' ' THR . . . . . . . . . . . . . 27.2 p -130.76 -165.89 1.62 Allowed 'General case' 0 N--CA 1.472 0.625 0 CA-C-N 120.062 1.301 . . . . 0.0 109.909 168.149 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 67' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -136.55 76.92 1.62 Allowed 'General case' 0 C--O 1.233 0.188 0 C-N-CA 126.167 1.787 . . . . 0.0 108.822 -179.199 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 68' ' ' MET . . . . . . . . . . . . . 15.3 ptp -124.51 158.23 33.41 Favored 'General case' 0 CA--C 1.533 0.323 0 C-N-CA 124.297 1.039 . . . . 0.0 111.97 -177.028 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 69' ' ' MET . . . . . . . . . . . . . 0.1 OUTLIER -73.97 162.31 29.18 Favored 'General case' 0 CA--C 1.533 0.305 0 C-N-CA 123.643 0.777 . . . . 0.0 109.424 171.432 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 70' ' ' CYS . . . . . 1.305 ' SG ' ' SG ' ' A' ' 44' ' ' CYS . 1.2 m -119.01 -179.53 3.85 Favored 'General case' 0 CA--C 1.537 0.476 0 C-N-CA 126.284 1.834 . . . . 0.0 108.692 161.551 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 71' ' ' ALA . . . . . . . . . . . . . . . -82.79 -26.6 31.65 Favored 'General case' 0 CA--C 1.535 0.393 0 C-N-CA 124.555 1.142 . . . . 0.0 111.615 166.012 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 72' ' ' ASN . . . . . . . . . . . . . 1.2 m-20 -119.97 152.67 54.43 Favored Pre-proline 0 N--CA 1.467 0.397 0 C-N-CA 123.962 0.905 . . . . 0.0 110.474 -172.167 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 73' ' ' PRO . . . . . . . . . . . . . 49.0 Cg_endo -70.39 -46.2 1.04 Allowed 'Trans proline' 0 N--CA 1.458 -0.585 0 C-N-CA 124.008 3.138 . . . . 0.0 111.198 173.146 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 74' ' ' GLN . . . . . . . . . . . . . 64.3 tt0 -51.31 -35.34 37.38 Favored 'General case' 0 C--O 1.221 -0.424 0 C-N-CA 123.569 0.748 . . . . 0.0 110.85 -174.172 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 75' ' ' LEU . . . . . . . . . . . . . 87.5 mt -66.33 -38.88 88.7 Favored 'General case' 0 CA--C 1.538 0.519 0 C-N-CA 123.686 0.794 . . . . 0.0 111.701 -177.373 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 76' ' ' ASN . . . . . . . . . . . . . 3.0 m-80 -79.07 -20.46 48.74 Favored 'General case' 0 N--CA 1.475 0.791 0 CA-C-N 119.506 1.048 . . . . 0.0 111.478 174.994 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 77' ' ' GLU . . . . . . . . . . . . . 0.7 OUTLIER -65.48 -38.18 89.02 Favored 'General case' 0 CA--C 1.545 0.766 0 O-C-N 121.056 -1.027 . . . . 0.0 109.48 164.918 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 78' ' ' LEU . . . . . . . . . . . . . 32.4 mt -80.34 -17.62 51.47 Favored 'General case' 0 N--CA 1.453 -0.3 0 CA-C-O 118.039 -0.982 . . . . 0.0 113.364 -174.847 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 79' ' ' ASP . . . . . . . . . . . . . 4.8 t70 -46.72 -57.52 4.76 Favored 'General case' 0 N--CA 1.469 0.476 0 C-N-CA 125.165 1.386 . . . . 0.0 109.406 162.511 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 80' ' ' ASN . . . . . . . . . . . . . 69.8 m-80 -74.48 -36.8 63.3 Favored 'General case' 0 N--CA 1.448 -0.544 0 CA-C-N 115.258 -0.883 . . . . 0.0 108.973 -171.818 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 81' ' ' THR . . . . . . . . . . . . . 28.0 m -54.49 -51.03 66.36 Favored 'General case' 0 CA--C 1.54 0.579 0 C-N-CA 124.052 0.941 . . . . 0.0 110.117 177.679 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 82' ' ' ILE . . . . . . . . . . . . . 7.0 tp -73.86 -33.27 36.7 Favored 'Isoleucine or valine' 0 C--N 1.345 0.385 0 CA-C-N 119.719 1.145 . . . . 0.0 111.015 -179.251 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 83' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -58.4 -53.24 60.58 Favored 'General case' 0 C--O 1.236 0.371 0 N-CA-C 108.832 -0.803 . . . . 0.0 108.832 178.713 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 84' ' ' GLU . . . . . . . . . . . . . 14.2 tp10 -75.6 -3.01 31.97 Favored 'General case' 0 CA--C 1.542 0.64 0 C-N-CA 124.873 1.269 . . . . 0.0 112.07 -174.667 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 85' ' ' MET . . . . . . . . . . . . . 84.7 mtp -107.45 -5.16 17.83 Favored 'General case' 0 CA--C 1.535 0.383 0 C-N-CA 124.338 1.055 . . . . 0.0 113.212 174.307 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 86' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -105.55 -22.86 12.9 Favored 'General case' 0 N--CA 1.475 0.802 0 CA-C-N 120.639 1.563 . . . . 0.0 111.628 173.818 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 87' ' ' LYS . . . . . . . . . . . . . 8.1 tttm -68.36 -44.6 74.88 Favored 'General case' 0 CA--C 1.543 0.707 0 N-CA-C 110.172 -0.307 . . . . 0.0 110.172 -169.035 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 88' ' ' GLU . . . . . . . . . . . . . 35.4 mt-10 -82.36 -14.67 54.89 Favored 'General case' 0 N--CA 1.468 0.425 0 C-N-CA 126.562 1.945 . . . . 0.0 112.265 177.581 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 89' ' ' GLY . . . . . . . . . . . . . . . 98.54 105.03 2.49 Favored Glycine 0 C--N 1.337 0.617 0 N-CA-C 110.572 -1.011 . . . . 0.0 110.572 -175.934 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 90' ' ' ALA . . . . . . . . . . . . . . . -74.16 138.08 43.58 Favored 'General case' 0 C--O 1.232 0.15 0 N-CA-C 108.596 -0.89 . . . . 0.0 108.596 171.57 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 91' ' ' GLN . . . . . . . . . . . . . 0.4 OUTLIER -64.81 129.05 38.3 Favored 'General case' 0 C--O 1.239 0.542 0 N-CA-C 105.231 -2.137 . . . . 0.0 105.231 161.039 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 92' ' ' VAL . . . . . . . . . . . . . 7.6 p -125.53 107.69 18.31 Favored 'Isoleucine or valine' 0 N--CA 1.447 -0.588 0 N-CA-C 106.762 -1.57 . . . . 0.0 106.762 -170.235 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 93' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -122.17 81.63 1.86 Allowed 'General case' 0 C--N 1.324 -0.521 0 N-CA-C 106.716 -1.587 . . . . 0.0 106.716 -179.213 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 94' ' ' LEU . . . . . . . . . . . . . 2.3 tm? -82.9 98.52 9.24 Favored 'General case' 0 CA--C 1.51 -0.572 0 N-CA-C 106.034 -1.839 . . . . 0.0 106.034 166.961 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 95' ' ' THR . . . . . . . . . . . . . 3.1 m -83.05 170.87 14.38 Favored 'General case' 0 C--N 1.316 -0.868 0 CA-C-N 112.195 -2.275 . . . . 0.0 106.182 172.501 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 96' ' ' ALA . . . . . . . . . . . . . . . -44.84 -32.63 1.64 Allowed 'General case' 0 CA--C 1.545 0.761 0 N-CA-C 116.395 1.998 . . . . 0.0 116.395 -160.877 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 97' ' ' ASN . . . . . . . . . . . . . 0.2 OUTLIER -141.11 9.69 2.12 Favored 'General case' 0 N--CA 1.472 0.665 0 CA-C-N 120.74 1.609 . . . . 0.0 113.035 173.16 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 98' ' ' GLN . . . . . . . . . . . . . 12.9 tt0 -143.5 129.79 19.87 Favored 'General case' 0 CA--C 1.52 -0.182 0 O-C-N 120.484 -1.385 . . . . 0.0 109.216 -169.874 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 99' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -91.34 123.12 34.54 Favored 'General case' 0 N--CA 1.444 -0.765 0 C-N-CA 125.298 1.439 . . . . 0.0 109.045 179.642 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 100' ' ' THR . . . . . . . . . . . . . 79.7 m -98.87 115.87 29.82 Favored 'General case' 0 C--N 1.323 -0.584 0 C-N-CA 125.883 1.673 . . . . 0.0 106.495 165.83 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 101' ' ' LEU . . . . . . . . . . . . . 1.4 mm? -110.7 126.22 54.31 Favored 'General case' 0 CA--C 1.501 -0.924 0 N-CA-C 106.649 -1.612 . . . . 0.0 106.649 171.356 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 102' ' ' ALA . . . . . . . . . . . . . . . -138.02 153.21 49.4 Favored 'General case' 0 C--N 1.323 -0.545 0 O-C-N 124.396 1.06 . . . . 0.0 109.807 174.171 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 103' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -160.51 174.08 14.59 Favored 'General case' 0 N--CA 1.443 -0.78 0 C-N-CA 126.026 1.731 . . . . 0.0 108.04 177.526 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 104' ' ' ALA . . . . . . . . . . . . . . . -53.09 -34.6 57.35 Favored 'General case' 0 C--O 1.231 0.079 0 C-N-CA 123.662 0.785 . . . . 0.0 112.731 173.915 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 105' ' ' LYS . . . . . . . . . . . . . 1.6 mmpm? -62.84 -80.57 0.03 OUTLIER 'General case' 0 N--CA 1.455 -0.179 0 CA-C-N 118.545 0.611 . . . . 0.0 111.178 172.635 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 106' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -150.38 -172.73 4.25 Favored 'General case' 0 N--CA 1.453 -0.304 0 C-N-CA 125.812 1.645 . . . . 0.0 108.241 -164.523 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 107' ' ' THR . . . . . . . . . . . . . 15.3 t -144.36 145.78 32.16 Favored 'General case' 0 N--CA 1.451 -0.389 0 C-N-CA 124.826 1.25 . . . . 0.0 108.303 -174.895 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 108' ' ' LEU . . . . . . . . . . . . . 4.2 mp -134.4 162.16 32.99 Favored 'General case' 0 N--CA 1.449 -0.491 0 C-N-CA 128.018 2.527 . . . . 0.0 108.725 -165.788 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 109' ' ' THR . . . . . . . . . . . . . 57.8 m -133.66 110.3 9.77 Favored 'General case' 0 C--N 1.329 -0.315 0 N-CA-C 107.744 -1.206 . . . . 0.0 107.744 171.455 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 110' ' ' TYR . . . . . . . . . . . . . 95.2 m-85 -98.93 161.4 13.65 Favored 'General case' 0 N--CA 1.453 -0.301 0 N-CA-C 108.608 -0.886 . . . . 0.0 108.608 167.787 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 111' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -123.06 133.36 54.32 Favored 'General case' 0 CA--C 1.517 -0.316 0 CA-C-O 117.964 -1.017 . . . . 0.0 108.338 -175.614 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 112' ' ' LEU . . . . . . . . . . . . . 28.0 tp -58.8 103.47 0.17 Allowed 'General case' 0 C--O 1.232 0.175 0 N-CA-C 107.018 -1.475 . . . . 0.0 107.018 167.567 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 113' ' ' ALA . . . . . . . . . . . . . . . -147.17 77.03 1.44 Allowed 'General case' 0 C--N 1.33 -0.275 0 N-CA-C 107.267 -1.383 . . . . 0.0 107.267 -175.577 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 114' ' ' ASP . . . . . 0.431 ' C ' ' H ' ' A' ' 116' ' ' MET 0.251 56.9 p30 -103.46 58.21 0.75 Allowed 'General case' 0 C--N 1.331 -0.199 0 CA-C-O 124.205 1.955 . . . . 0.0 112.02 -173.927 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' A' A ' 115' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -64.6 3.83 0.46 Allowed 'General case' 0 CA--C 1.535 0.403 0 C-N-CA 128.659 2.784 . . . . 0.0 113.861 170.875 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 116' ' ' MET . . . . . 0.431 ' H ' ' C ' ' A' ' 114' ' ' ASP . 7.5 ttp -166.08 143.84 5.51 Favored 'General case' 0 N--CA 1.443 -0.824 0 C-N-CA 130.545 3.538 . . . . 0.0 105.571 176.63 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 117' ' ' ASN . . . . . . . . . . . . . 0.7 OUTLIER . . . . . 0 CA--C 1.532 0.279 0 C-N-CA 124.602 1.161 . . . . 0.0 109.865 -175.95 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 11.6 ttp . . . . . 0 CA--C 1.534 0.346 0 N-CA-C 113.226 0.825 . . . . 0.0 113.226 . . . . . . . . . 0 0 . 1 . 009 nuclear orig full ' A' A ' 2' ' ' VAL . . . . . . . . . . . . . 7.1 p 42.96 66.85 0.12 Allowed 'Isoleucine or valine' 0 C--N 1.334 -0.109 0 C-N-CA 124.744 1.218 . . . . 0.0 111.233 145.581 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 3' ' ' THR . . . . . . . . . . . . . 71.5 p -79.86 161.72 65.12 Favored Pre-proline 0 C--N 1.328 -0.363 0 C-N-CA 118.034 -1.466 . . . . 0.0 108.976 -167.599 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 4' ' ' PRO . . . . . . . . . . . . . 15.7 Cg_endo -54.37 -42.3 68.94 Favored 'Trans proline' 0 CA--C 1.532 0.411 0 C-N-CA 122.236 1.957 . . . . 0.0 112.644 175.066 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 5' ' ' GLU . . . . . . . . . . . . . 1.2 tm-20 -51.13 -60.61 2.91 Favored 'General case' 0 C--N 1.329 -0.322 0 C-N-CA 126.068 1.747 . . . . 0.0 111.539 -175.951 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 6' ' ' GLN . . . . . . . . . . . . . 18.1 pt20 -66.03 15.42 0.03 OUTLIER 'General case' 0 CA--C 1.54 0.558 0 C-N-CA 127.333 2.253 . . . . 0.0 114.242 -177.711 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 7' ' ' LEU . . . . . . . . . . . . . 67.3 mt -133.93 -48.03 0.8 Allowed 'General case' 0 CA--C 1.522 -0.115 0 C-N-CA 125.345 1.458 . . . . 0.0 111.254 -172.57 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 8' ' ' GLN . . . . . . . . . . . . . 17.5 mt-30 -57.74 -4.1 0.26 Allowed 'General case' 0 CA--C 1.543 0.701 0 N-CA-C 115.681 1.734 . . . . 0.0 115.681 -179.54 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 9' ' ' HIS . . . . . . . . . . . . . 9.4 m-70 -133.26 15.4 4.15 Favored 'General case' 0 CA--C 1.538 0.511 0 C-N-CA 124.569 1.148 . . . . 0.0 112.624 174.333 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 10' ' ' HIS . . . . . . . . . . . . . 63.8 m-70 -130.55 109.99 11.09 Favored 'General case' 0 CA--C 1.539 0.554 0 C-N-CA 125.136 1.374 . . . . 0.0 109.885 -169.118 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 11' ' ' ARG . . . . . . . . . . . . . 32.3 ttt180 -68.64 150.69 47.66 Favored 'General case' 0 N--CA 1.474 0.732 0 C-N-CA 125.231 1.412 . . . . 0.0 110.765 175.127 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 12' ' ' PHE . . . . . . . . . . . . . 23.0 m-85 -136.48 157.55 46.52 Favored 'General case' 0 N--CA 1.451 -0.411 0 CA-C-O 121.693 0.758 . . . . 0.0 109.3 169.351 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 13' ' ' VAL . . . . . . . . . . . . . 11.4 p -132.97 150.59 33.04 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.336 0 O-C-N 120.992 -1.068 . . . . 0.0 109.958 175.754 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 14' ' ' LEU . . . . . . . . . . . . . 30.6 tp -80.1 97.57 6.91 Favored 'General case' 0 N--CA 1.454 -0.258 0 N-CA-C 108.001 -1.111 . . . . 0.0 108.001 177.53 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 3.1 mm-40 -68.24 -55.96 10.38 Favored 'General case' 0 C--N 1.323 -0.546 0 C-N-CA 125.184 1.393 . . . . 0.0 109.584 172.737 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 6.1 p -148.56 164.53 33.96 Favored 'General case' 0 N--CA 1.449 -0.478 0 CA-C-O 122.445 1.117 . . . . 0.0 110.219 -175.75 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 17' ' ' VAL . . . . . 0.466 HG11 ' H ' ' A' ' 18' ' ' ASN . 1.7 t -109.78 -164.64 0.21 Allowed 'Isoleucine or valine' 0 N--CA 1.445 -0.681 0 N-CA-C 104.892 -2.262 . . . . 0.0 104.892 -172.07 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 18' ' ' ASN . . . . . 0.466 ' H ' HG11 ' A' ' 17' ' ' VAL . 2.0 p-10 -44.47 -38.48 4.12 Favored 'General case' 0 CA--C 1.538 0.482 0 C-N-CA 126.902 2.081 . . . . 0.0 113.485 -171.465 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . -141.78 -44.89 0.06 OUTLIER Glycine 0 CA--C 1.523 0.543 0 C-N-CA 125.22 1.39 . . . . 0.0 110.539 169.616 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 0.5 OUTLIER -81.14 158.07 70.2 Favored Pre-proline 0 CA--C 1.534 0.336 0 C-N-CA 123.857 0.863 . . . . 0.0 111.472 -170.11 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 21' ' ' PRO . . . . . . . . . . . . . 80.2 Cg_endo -79.21 172.58 14.52 Favored 'Trans proline' 0 N--CA 1.457 -0.655 0 C-N-CA 123.223 2.615 . . . . 0.0 110.954 178.803 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 22' ' ' VAL . . . . . . . . . . . . . 88.7 t -94.81 157.17 3.08 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.422 0 N-CA-C 107.691 -1.226 . . . . 0.0 107.691 162.938 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 23' ' ' THR . . . . . . . . . . . . . 7.5 p -134.58 87.83 2.39 Favored 'General case' 0 N--CA 1.444 -0.75 0 N-CA-C 107.35 -1.352 . . . . 0.0 107.35 166.513 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 24' ' ' SER . . . . . . . . . . . . . 0.6 OUTLIER -159.89 135.19 8.16 Favored 'General case' 0 N--CA 1.447 -0.612 0 N-CA-C 105.669 -1.975 . . . . 0.0 105.669 172.234 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 25' ' ' ASP . . . . . . . . . . . . . 54.9 t0 -136.41 -42.18 0.63 Allowed 'General case' 0 C--N 1.324 -0.523 0 C-N-CA 126.678 1.991 . . . . 0.0 108.959 -174.086 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 26' ' ' LYS . . . . . . . . . . . . . 17.9 pttt -48.45 -45.98 37.25 Favored 'General case' 0 CA--C 1.516 -0.349 0 C-N-CA 125.496 1.518 . . . . 0.0 111.797 177.79 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 27' ' ' ASN . . . . . . . . . . . . . 0.2 OUTLIER -162.14 87.07 1.49 Allowed Pre-proline 0 C--N 1.325 -0.486 0 C-N-CA 130.022 3.329 . . . . 0.0 107.443 174.319 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 28' ' ' PRO . . . . . . . . . . . . . 17.0 Cg_endo -60.03 162.2 17.1 Favored 'Trans proline' 0 C--N 1.349 0.583 0 C-N-CA 122.972 2.448 . . . . 0.0 113.737 177.154 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 29' ' ' PRO . . . . . . . . . . . . . 17.9 Cg_endo -60.69 103.15 0.21 Allowed 'Trans proline' 0 N--CA 1.445 -1.359 0 C-N-CA 122.104 1.869 . . . . 0.0 108.401 152.388 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 30' ' ' GLU . . . . . . . . . . . . . 20.2 pt-20 -126.11 170.27 11.94 Favored 'General case' 0 C--N 1.323 -0.584 0 C-N-CA 125.578 1.551 . . . . 0.0 109.708 -179.905 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 31' ' ' ILE . . . . . . . . . . . . . 15.7 tt -141.15 157.02 22.24 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.412 0 N-CA-C 107.883 -1.154 . . . . 0.0 107.883 177.66 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 32' ' ' SER . . . . . . . . . . . . . 8.2 t -149.84 171.92 15.99 Favored 'General case' 0 C--N 1.323 -0.572 0 N-CA-C 106.64 -1.615 . . . . 0.0 106.64 166.2 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 33' ' ' PHE . . . . . . . . . . . . . 67.5 m-85 -141.07 168.21 20.34 Favored 'General case' 0 N--CA 1.447 -0.583 0 C-N-CA 124.004 0.921 . . . . 0.0 109.415 -173.895 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 34' ' ' GLY . . . . . . . . . . . . . . . -168.6 -165.0 25.26 Favored Glycine 0 C--N 1.332 0.345 0 C-N-CA 125.549 1.547 . . . . 0.0 109.332 168.092 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 35' ' ' GLU . . . . . . . . . . . . . 1.1 tm-20 -47.33 156.89 0.23 Allowed 'General case' 0 C--N 1.326 -0.445 0 C-N-CA 126.961 2.104 . . . . 0.0 112.96 -171.222 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 29.6 mtmm 52.59 26.52 4.39 Favored 'General case' 0 CA--C 1.531 0.221 0 C-N-CA 124.606 1.162 . . . . 0.0 112.015 -164.193 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 37' ' ' MET . . . . . . . . . . . . . 10.4 mmm 56.91 26.45 11.73 Favored 'General case' 0 CA--C 1.54 0.594 0 C-N-CA 124.3 1.04 . . . . 0.0 109.885 178.873 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 38' ' ' MET . . . . . . . . . . . . . 19.0 mtp -54.67 151.47 8.15 Favored 'General case' 0 N--CA 1.45 -0.437 0 C-N-CA 123.798 0.839 . . . . 0.0 110.113 176.473 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 39' ' ' ILE . . . . . . . . . . . . . 9.8 mt -134.13 116.22 22.5 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.465 0 N-CA-C 105.101 -2.185 . . . . 0.0 105.101 -176.664 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 40' ' ' SER . . . . . . . . . . . . . 66.8 m -141.7 119.63 11.96 Favored 'General case' 0 C--N 1.328 -0.33 0 N-CA-C 108.418 -0.956 . . . . 0.0 108.418 -172.479 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 41' ' ' GLY . . . . . . . . . . . . . . . -156.84 -165.36 14.73 Favored Glycine 0 CA--C 1.525 0.663 0 C-N-CA 124.42 1.009 . . . . 0.0 111.565 -171.111 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 42' ' ' SER . . . . . . . . . . . . . 28.7 t -157.43 123.37 4.74 Favored 'General case' 0 CA--C 1.511 -0.524 0 O-C-N 121.808 -0.819 . . . . 0.0 108.942 165.792 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 43' ' ' MET . . . . . . . . . . . . . 5.1 mmm -86.65 -43.15 12.86 Favored 'General case' 0 N--CA 1.45 -0.448 0 O-C-N 124.15 0.906 . . . . 0.0 111.18 160.142 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 44' ' ' CYS . . . . . 1.28 ' SG ' ' SG ' ' A' ' 70' ' ' CYS . 54.0 t -157.15 -71.23 0.1 Allowed 'General case' 0 CA--C 1.534 0.346 0 N-CA-C 107.413 -1.329 . . . . 0.0 107.413 177.907 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 45' ' ' ASN . . . . . . . . . . . . . 33.2 m-80 -77.66 26.81 0.17 Allowed 'General case' 0 N--CA 1.472 0.653 0 C-N-CA 127.488 2.315 . . . . 0.0 113.19 -179.054 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 46' ' ' ARG . . . . . . . . . . . . . 34.3 mtp85 53.08 -170.15 0.04 OUTLIER 'General case' 0 C--N 1.332 -0.194 0 C-N-CA 125.972 1.709 . . . . 0.0 108.973 -169.51 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 47' ' ' PHE . . . . . . . . . . . . . 29.6 p90 -178.99 153.11 0.6 Allowed 'General case' 0 C--O 1.238 0.493 0 C-N-CA 126.764 2.025 . . . . 0.0 108.516 160.753 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 48' ' ' SER . . . . . . . . . . . . . 6.3 p -163.93 143.13 7.85 Favored 'General case' 0 N--CA 1.449 -0.518 0 CA-C-O 117.695 -1.145 . . . . 0.0 110.669 179.184 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 49' ' ' GLY . . . . . . . . . . . . . . . -177.6 163.66 32.26 Favored Glycine 0 C--N 1.337 0.614 0 CA-C-N 119.647 1.112 . . . . 0.0 110.864 177.541 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 50' ' ' GLU . . . . . . . . . . . . . 38.1 mt-10 -75.84 100.45 4.78 Favored 'General case' 0 C--O 1.235 0.315 0 N-CA-C 109.241 -0.651 . . . . 0.0 109.241 173.902 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 51' ' ' GLY . . . . . . . . . . . . . . . -66.17 166.81 36.66 Favored Glycine 0 CA--C 1.529 0.921 0 CA-C-O 121.87 0.706 . . . . 0.0 112.343 170.199 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 52' ' ' LYS . . . . . . . . . . . . . 0.5 OUTLIER -132.71 143.16 49.43 Favored 'General case' 0 C--N 1.328 -0.356 0 C-N-CA 126.422 1.889 . . . . 0.0 107.301 165.982 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 53' ' ' LEU . . . . . . . . . . . . . 32.8 tp -156.66 151.77 26.3 Favored 'General case' 0 C--O 1.235 0.292 0 C-N-CA 126.286 1.834 . . . . 0.0 107.508 176.144 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 11.7 t -161.66 -24.26 0.05 Allowed 'General case' 0 CA--C 1.538 0.5 0 C-N-CA 124.818 1.247 . . . . 0.0 111.424 173.72 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 55' ' ' ASN . . . . . . . . . . . . . 17.8 p-10 -153.71 28.53 0.48 Allowed 'General case' 0 CA--C 1.54 0.562 0 C-N-CA 126.332 1.853 . . . . 0.0 112.304 -148.367 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 56' ' ' GLY . . . . . . . . . . . . . . . 71.89 27.12 71.2 Favored Glycine 0 CA--C 1.534 1.221 0 O-C-N 120.918 -1.114 . . . . 0.0 112.271 -177.721 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 57' ' ' GLU . . . . . . . . . . . . . 29.8 tt0 -135.02 142.83 46.5 Favored 'General case' 0 CA--C 1.533 0.303 0 N-CA-C 107.929 -1.138 . . . . 0.0 107.929 173.403 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 58' ' ' LEU . . . . . . . . . . . . . 31.7 tp -134.33 101.66 5.08 Favored 'General case' 0 C--O 1.234 0.287 0 C-N-CA 125.805 1.642 . . . . 0.0 109.403 -172.467 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 59' ' ' THR . . . . . . . . . . . . . 4.4 p -106.02 145.22 31.65 Favored 'General case' 0 C--N 1.328 -0.342 0 C-N-CA 124.345 1.058 . . . . 0.0 109.854 175.213 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 60' ' ' ALA . . . . . . . . . . . . . . . -95.41 130.06 42.34 Favored 'General case' 0 CA--C 1.531 0.225 0 C-N-CA 124.548 1.139 . . . . 0.0 110.202 169.781 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 61' ' ' LYS . . . . . . . . . . . . . 18.4 tttt -79.8 -15.23 57.85 Favored 'General case' 0 N--CA 1.473 0.684 0 N-CA-C 113.852 1.056 . . . . 0.0 113.852 177.853 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 62' ' ' GLY . . . . . . . . . . . . . . . 169.75 123.64 0.69 Allowed Glycine 0 C--N 1.332 0.33 0 N-CA-C 108.579 -1.808 . . . . 0.0 108.579 -178.86 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 63' ' ' LEU . . . . . . . . . . . . . 0.9 OUTLIER -128.26 94.24 3.85 Favored 'General case' 0 N--CA 1.45 -0.45 0 C-N-CA 124.769 1.228 . . . . 0.0 110.599 -151.971 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 64' ' ' ALA . . . . . . . . . . . . . . . -78.74 109.39 12.93 Favored 'General case' 0 C--O 1.236 0.361 0 C-N-CA 124.136 0.975 . . . . 0.0 111.601 -172.018 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 65' ' ' MET . . . . . . . . . . . . . 67.3 mtp -120.63 159.62 24.92 Favored 'General case' 0 CA--C 1.537 0.459 0 C-N-CA 124.24 1.016 . . . . 0.0 110.217 176.993 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 66' ' ' THR . . . . . . . . . . . . . 28.3 p -100.09 -164.89 1.16 Allowed 'General case' 0 CA--C 1.543 0.704 0 C-N-CA 125.444 1.498 . . . . 0.0 111.953 -169.379 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 67' ' ' ARG . . . . . . . . . . . . . 5.7 mmm180 -133.36 68.3 1.5 Allowed 'General case' 0 N--CA 1.471 0.597 0 C-N-CA 125.467 1.507 . . . . 0.0 109.968 -178.855 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 68' ' ' MET . . . . . . . . . . . . . 27.2 ptm -133.53 -172.22 2.91 Favored 'General case' 0 CA--C 1.538 0.506 0 C-N-CA 127.147 2.179 . . . . 0.0 110.369 -175.307 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 69' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -138.69 176.87 8.32 Favored 'General case' 0 C--O 1.236 0.35 0 C-N-CA 125.575 1.55 . . . . 0.0 110.061 -173.815 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 70' ' ' CYS . . . . . 1.28 ' SG ' ' SG ' ' A' ' 44' ' ' CYS . 60.2 m -138.05 4.88 2.53 Favored 'General case' 0 CA--C 1.54 0.582 0 N-CA-C 114.409 1.263 . . . . 0.0 114.409 -175.392 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 71' ' ' ALA . . . . . . . . . . . . . . . 58.61 3.98 0.33 Allowed 'General case' 0 N--CA 1.472 0.665 0 C-N-CA 125.743 1.617 . . . . 0.0 113.983 -177.057 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 72' ' ' ASN . . . . . . . . . . . . . 43.3 t-20 -143.19 142.05 20.75 Favored Pre-proline 0 C--O 1.238 0.498 0 N-CA-C 106.684 -1.599 . . . . 0.0 106.684 172.645 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 73' ' ' PRO . . . . . . . . . . . . . 37.3 Cg_endo -78.71 -27.65 4.77 Favored 'Trans proline' 0 C--O 1.221 -0.363 0 C-N-CA 121.564 1.509 . . . . 0.0 113.041 -169.189 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 74' ' ' GLN . . . . . . . . . . . . . 41.0 tt0 -51.43 -46.44 62.96 Favored 'General case' 0 N--CA 1.47 0.569 0 CA-C-N 119.501 1.046 . . . . 0.0 111.486 -177.435 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 75' ' ' LEU . . . . . . . . . . . . . 49.9 mt -70.02 -36.83 75.38 Favored 'General case' 0 C--N 1.329 -0.309 0 C-N-CA 124.914 1.286 . . . . 0.0 110.906 -178.286 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 76' ' ' ASN . . . . . . . . . . . . . 1.0 OUTLIER -78.9 2.11 21.28 Favored 'General case' 0 CA--C 1.541 0.599 0 C-N-CA 127.179 2.191 . . . . 0.0 112.325 178.046 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 77' ' ' GLU . . . . . . . . . . . . . 1.5 mm-40 -109.47 -39.82 5.06 Favored 'General case' 0 C--N 1.331 -0.212 0 C-N-CA 127.421 2.288 . . . . 0.0 108.338 173.819 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 78' ' ' LEU . . . . . . . . . . . . . 55.8 mt -56.29 -27.4 55.31 Favored 'General case' 0 C--N 1.343 0.319 0 C-N-CA 122.881 0.472 . . . . 0.0 110.653 168.285 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 79' ' ' ASP . . . . . . . . . . . . . 0.0 OUTLIER -63.76 -13.57 44.95 Favored 'General case' 0 CA--C 1.539 0.541 0 C-N-CA 126.3 1.84 . . . . 0.0 112.653 177.369 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 80' ' ' ASN . . . . . . . . . . . . . 67.8 m-20 -105.54 -44.84 4.59 Favored 'General case' 0 N--CA 1.465 0.277 0 C-N-CA 124.478 1.111 . . . . 0.0 109.962 169.452 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 81' ' ' THR . . . . . . . . . . . . . 85.9 m -44.59 -70.16 0.11 Allowed 'General case' 0 CA--C 1.535 0.38 0 C-N-CA 125.836 1.654 . . . . 0.0 111.273 -179.143 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 82' ' ' ILE . . . . . . . . . . . . . 8.2 tp -72.37 -29.72 32.5 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.347 0 O-C-N 121.428 -0.795 . . . . 0.0 111.088 -167.072 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 83' ' ' SER . . . . . . . . . . . . . 30.0 t -52.68 -60.09 3.67 Favored 'General case' 0 C--O 1.236 0.38 0 C-N-CA 124.735 1.214 . . . . 0.0 109.409 171.096 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 84' ' ' GLU . . . . . . . . . . . . . 30.8 tp10 -67.97 -39.03 83.42 Favored 'General case' 0 N--CA 1.449 -0.482 0 CA-C-O 118.209 -0.901 . . . . 0.0 110.875 -173.216 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 85' ' ' MET . . . . . . . . . . . . . 78.6 mtp -60.58 -42.78 97.4 Favored 'General case' 0 N--CA 1.464 0.275 0 CA-C-O 122.402 1.096 . . . . 0.0 109.309 -176.136 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 86' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -75.95 -23.71 55.4 Favored 'General case' 0 C--N 1.33 -0.257 0 C-N-CA 124.262 1.025 . . . . 0.0 111.722 -178.643 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 87' ' ' LYS . . . . . . . . . . . . . 3.0 tppt? -75.96 -52.29 10.58 Favored 'General case' 0 N--CA 1.441 -0.886 0 C-N-CA 124.589 1.156 . . . . 0.0 109.188 177.847 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 88' ' ' GLU . . . . . . . . . . . . . 17.3 pt-20 -64.95 -38.78 92.1 Favored 'General case' 0 CA--C 1.539 0.546 0 CA-C-O 118.927 -0.559 . . . . 0.0 110.536 178.124 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 89' ' ' GLY . . . . . . . . . . . . . . . 120.15 105.75 2.08 Favored Glycine 0 C--N 1.339 0.746 0 C-N-CA 126.743 2.116 . . . . 0.0 108.732 173.161 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 90' ' ' ALA . . . . . . . . . . . . . . . -77.18 133.29 38.97 Favored 'General case' 0 N--CA 1.448 -0.541 0 CA-C-O 118.457 -0.783 . . . . 0.0 109.566 -176.072 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 91' ' ' GLN . . . . . . . . . . . . . 59.1 mm-40 -65.21 139.2 58.63 Favored 'General case' 0 C--O 1.239 0.503 0 N-CA-C 105.099 -2.185 . . . . 0.0 105.099 152.533 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 92' ' ' VAL . . . . . . . . . . . . . 10.4 p -135.78 134.48 51.25 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.56 0 N-CA-C 106.154 -1.795 . . . . 0.0 106.154 -176.448 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 93' ' ' ASP . . . . . . . . . . . . . 0.7 OUTLIER -142.09 91.88 2.38 Favored 'General case' 0 N--CA 1.452 -0.373 0 N-CA-C 107.911 -1.144 . . . . 0.0 107.911 -170.442 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 94' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -96.91 109.49 22.2 Favored 'General case' 0 C--O 1.235 0.31 0 N-CA-C 106.922 -1.51 . . . . 0.0 106.922 174.395 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 95' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -70.13 -163.77 0.07 Allowed 'General case' 0 CA--C 1.542 0.664 0 N-CA-C 108.173 -1.047 . . . . 0.0 108.173 166.139 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 96' ' ' ALA . . . . . . . . . . . . . . . -56.97 -27.86 61.73 Favored 'General case' 0 CA--C 1.536 0.437 0 O-C-N 119.291 -2.131 . . . . 0.0 113.138 -178.616 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 97' ' ' ASN . . . . . . . . . . . . . 28.4 p30 -167.41 18.69 0.03 OUTLIER 'General case' 0 CA--C 1.539 0.538 0 C-N-CA 124.072 0.949 . . . . 0.0 112.705 -168.766 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 98' ' ' GLN . . . . . . . . . . . . . 2.3 tt0 -130.93 124.35 30.88 Favored 'General case' 0 N--CA 1.47 0.527 0 CA-C-N 120.297 1.408 . . . . 0.0 107.724 169.997 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 99' ' ' LEU . . . . . . . . . . . . . 15.3 tp -86.13 139.89 30.69 Favored 'General case' 0 C--O 1.233 0.185 0 C-N-CA 124.238 1.015 . . . . 0.0 109.519 170.109 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 100' ' ' THR . . . . . . . . . . . . . 15.8 m -123.38 126.17 46.34 Favored 'General case' 0 C--N 1.322 -0.592 0 C-N-CA 126.308 1.843 . . . . 0.0 107.127 171.346 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 101' ' ' LEU . . . . . . . . . . . . . 0.7 OUTLIER -114.23 135.45 54.04 Favored 'General case' 0 C--N 1.334 -0.071 0 C-N-CA 127.502 2.321 . . . . 0.0 106.04 167.9 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 102' ' ' ALA . . . . . . . . . . . . . . . -157.23 82.5 0.92 Allowed 'General case' 0 CA--C 1.536 0.417 0 CA-C-N 120.057 1.299 . . . . 0.0 111.325 178.852 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 103' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -98.87 171.01 8.34 Favored 'General case' 0 C--O 1.236 0.374 0 C-N-CA 125.947 1.699 . . . . 0.0 110.392 179.867 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 104' ' ' ALA . . . . . . . . . . . . . . . -56.16 -28.14 56.93 Favored 'General case' 0 C--O 1.233 0.213 0 CA-C-O 118.466 -0.778 . . . . 0.0 112.239 176.705 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 105' ' ' LYS . . . . . . . . . . . . . 32.8 mmtt -58.81 -80.5 0.02 OUTLIER 'General case' 0 CA--C 1.531 0.24 0 CA-C-N 119.244 0.929 . . . . 0.0 110.927 165.345 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 106' ' ' GLN . . . . . . . . . . . . . 7.1 mt-30 -157.0 -170.36 3.26 Favored 'General case' 0 CA--C 1.536 0.428 0 C-N-CA 125.098 1.359 . . . . 0.0 109.803 -173.136 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 107' ' ' THR . . . . . . . . . . . . . 3.4 t -130.32 140.4 50.64 Favored 'General case' 0 CA--C 1.537 0.444 0 C-N-CA 126.376 1.87 . . . . 0.0 108.29 -174.949 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 108' ' ' LEU . . . . . . . . . . . . . 4.8 mp -134.09 153.16 51.99 Favored 'General case' 0 C--O 1.235 0.325 0 C-N-CA 130.097 3.359 . . . . 0.0 108.461 -172.665 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 109' ' ' THR . . . . . . . . . . . . . 7.1 m -138.6 96.97 3.25 Favored 'General case' 0 CA--C 1.539 0.534 0 N-CA-C 109.419 -0.586 . . . . 0.0 109.419 -175.771 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 110' ' ' TYR . . . . . . . . . . . . . 66.9 m-85 -99.08 155.83 17.25 Favored 'General case' 0 N--CA 1.464 0.259 0 C-N-CA 124.056 0.943 . . . . 0.0 110.712 -175.244 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 111' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -114.5 145.21 42.19 Favored 'General case' 0 C--N 1.331 -0.199 0 C-N-CA 125.703 1.601 . . . . 0.0 108.758 -171.487 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 112' ' ' LEU . . . . . . . . . . . . . 54.4 tp -75.62 60.98 1.29 Allowed 'General case' 0 CA--C 1.534 0.36 0 C-N-CA 127.957 2.503 . . . . 0.0 108.396 175.558 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 113' ' ' ALA . . . . . . . . . . . . . . . -93.31 94.69 8.89 Favored 'General case' 0 N--CA 1.448 -0.544 0 N-CA-C 106.189 -1.782 . . . . 0.0 106.189 177.299 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 114' ' ' ASP . . . . . . . . . . . . . 37.9 t0 -128.35 45.57 2.74 Favored 'General case' 0 CA--C 1.515 -0.39 0 CA-C-O 121.62 0.724 . . . . 0.0 110.993 -178.927 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 115' ' ' LEU . . . . . . . . . . . . . 19.0 mt 60.15 13.01 3.57 Favored 'General case' 0 CA--C 1.534 0.334 0 C-N-CA 124.817 1.247 . . . . 0.0 113.008 167.88 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 116' ' ' MET . . . . . . . . . . . . . 0.5 OUTLIER -114.88 112.03 22.11 Favored 'General case' 0 N--CA 1.449 -0.49 0 C-N-CA 125.058 1.343 . . . . 0.0 107.797 -172.221 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 117' ' ' ASN . . . . . . . . . . . . . 55.2 m-20 . . . . . 0 C--O 1.234 0.288 0 C-N-CA 124.222 1.009 . . . . 0.0 110.45 -169.774 . . . . . . . . 0 0 . 1 . 010 nuclear orig full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 4.4 ptm . . . . . 0 CA--C 1.535 0.391 0 CA-C-O 121.471 0.653 . . . . 0.0 111.065 . . . . . . . . . 0 0 . 1 . 010 nuclear orig full ' A' A ' 2' ' ' VAL . . . . . . . . . . . . . 14.6 p -61.92 155.24 4.73 Favored 'Isoleucine or valine' 0 CA--C 1.54 0.561 0 C-N-CA 125.622 1.569 . . . . 0.0 111.127 175.575 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 3' ' ' THR . . . . . . . . . . . . . 31.5 p -124.45 163.8 34.26 Favored Pre-proline 0 CA--C 1.535 0.368 0 C-N-CA 124.292 1.037 . . . . 0.0 108.64 173.269 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 4' ' ' PRO . . . . . . . . . . . . . 57.9 Cg_endo -67.38 -34.8 25.7 Favored 'Trans proline' 0 N--CA 1.459 -0.5 0 C-N-CA 121.524 1.483 . . . . 0.0 111.046 170.066 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 5' ' ' GLU . . . . . 0.41 ' C ' ' H ' ' A' ' 7' ' ' LEU . 28.6 tt0 -56.14 -54.64 42.69 Favored 'General case' 0 C--N 1.328 -0.338 0 C-N-CA 125.005 1.322 . . . . 0.0 109.992 -174.918 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 6' ' ' GLN . . . . . 0.474 HE21 ' CD2' ' A' ' 94' ' ' LEU . 21.7 pt20 -63.87 6.4 0.17 Allowed 'General case' 0 CA--C 1.536 0.412 0 C-N-CA 125.318 1.447 . . . . 0.0 114.314 -179.48 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 7' ' ' LEU . . . . . 0.41 ' H ' ' C ' ' A' ' 5' ' ' GLU . 95.4 mt -123.77 -50.91 1.83 Allowed 'General case' 0 N--CA 1.451 -0.416 0 C-N-CA 125.895 1.678 . . . . 0.0 110.02 -177.763 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 8' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -61.37 -6.22 2.13 Favored 'General case' 0 N--CA 1.468 0.471 0 N-CA-C 113.967 1.099 . . . . 0.0 113.967 -169.794 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 9' ' ' HIS . . . . . . . . . . . . . 16.8 m170 -124.6 9.68 8.38 Favored 'General case' 0 CA--C 1.543 0.705 0 C-N-CA 127.078 2.151 . . . . 0.0 110.301 -171.002 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 10' ' ' HIS . . . . . . . . . . . . . 94.5 m-70 -132.99 154.97 49.99 Favored 'General case' 0 C--O 1.236 0.389 0 CA-C-N 119.438 1.017 . . . . 0.0 111.614 -175.771 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 11' ' ' ARG . . . . . . . . . . . . . 63.4 ttt180 -96.9 147.03 24.38 Favored 'General case' 0 CA--C 1.513 -0.445 0 C-N-CA 124.525 1.13 . . . . 0.0 108.694 173.821 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 12' ' ' PHE . . . . . . . . . . . . . 60.2 m-85 -126.24 161.4 27.84 Favored 'General case' 0 N--CA 1.45 -0.468 0 N-CA-C 108.953 -0.758 . . . . 0.0 108.953 165.487 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 13' ' ' VAL . . . . . . . . . . . . . 8.8 p -129.6 155.48 41.36 Favored 'Isoleucine or valine' 0 CA--C 1.545 0.782 0 C-N-CA 125.333 1.453 . . . . 0.0 109.797 166.889 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 14' ' ' LEU . . . . . . . . . . . . . 1.3 tp -85.75 100.61 12.14 Favored 'General case' 0 N--CA 1.47 0.527 0 C-N-CA 125.519 1.528 . . . . 0.0 108.909 -175.673 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 4.9 tm-20 -88.45 -36.21 16.62 Favored 'General case' 0 CA--C 1.534 0.329 0 C-N-CA 122.653 0.381 . . . . 0.0 110.056 -174.006 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -152.12 146.26 25.36 Favored 'General case' 0 C--O 1.234 0.247 0 CA-C-O 122.656 1.217 . . . . 0.0 109.97 -177.907 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 17' ' ' VAL . . . . . 0.494 HG11 ' H ' ' A' ' 18' ' ' ASN . 3.0 t -79.65 -164.64 0.07 OUTLIER 'Isoleucine or valine' 0 CA--C 1.546 0.807 0 C-N-CA 126.071 1.748 . . . . 0.0 107.597 172.095 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 18' ' ' ASN . . . . . 0.494 ' H ' HG11 ' A' ' 17' ' ' VAL . 40.3 t30 -51.83 -9.54 0.09 Allowed 'General case' 0 CA--C 1.547 0.853 0 C-N-CA 127.731 2.413 . . . . 0.0 115.648 170.207 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . 156.9 32.2 0.02 OUTLIER Glycine 0 CA--C 1.524 0.594 0 O-C-N 120.92 -1.113 . . . . 0.0 112.373 -179.122 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 26.0 mttp -150.73 156.02 35.95 Favored Pre-proline 0 C--O 1.236 0.387 0 C-N-CA 126.975 2.11 . . . . 0.0 108.05 176.18 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 21' ' ' PRO . . . . . . . . . . . . . 72.7 Cg_endo -86.06 172.5 7.39 Favored 'Trans proline' 0 N--CA 1.448 -1.195 0 C-N-CA 122.212 1.942 . . . . 0.0 111.426 -179.498 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 22' ' ' VAL . . . . . . . . . . . . . 54.4 t -115.18 127.39 72.76 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.342 0 C-N-CA 125.192 1.397 . . . . 0.0 109.449 -166.76 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 23' ' ' THR . . . . . . . . . . . . . 2.5 p -105.61 95.71 6.0 Favored 'General case' 0 CA--C 1.534 0.351 0 C-N-CA 125.219 1.407 . . . . 0.0 111.506 -167.637 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 24' ' ' SER . . . . . . . . . . . . . 34.7 t -163.4 135.34 5.06 Favored 'General case' 0 N--CA 1.449 -0.476 0 N-CA-C 108.069 -1.086 . . . . 0.0 108.069 172.714 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 25' ' ' ASP . . . . . . . . . . . . . 13.6 m-20 -107.26 -3.47 19.72 Favored 'General case' 0 N--CA 1.472 0.666 0 C-N-CA 124.567 1.147 . . . . 0.0 112.111 166.478 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 26' ' ' LYS . . . . . . . . . . . . . 92.2 mttt -142.97 129.5 20.15 Favored 'General case' 0 C--N 1.345 0.376 0 O-C-N 120.162 -1.586 . . . . 0.0 110.04 -176.667 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 27' ' ' ASN . . . . . . . . . . . . . 2.4 m-80 45.53 68.07 3.67 Favored Pre-proline 0 CA--C 1.535 0.382 0 C-N-CA 125.634 1.574 . . . . 0.0 109.443 -179.979 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 28' ' ' PRO . . . . . . . . . . . . . 18.0 Cg_endo -63.79 172.76 5.41 Favored 'Trans proline' 0 C--O 1.236 0.387 0 C-N-CA 123.314 2.676 . . . . 0.0 112.37 -173.361 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 29' ' ' PRO . . . . . . . . . . . . . 42.2 Cg_endo -74.05 62.71 5.03 Favored 'Trans proline' 0 N--CA 1.454 -0.826 0 C-N-CA 121.333 1.355 . . . . 0.0 110.435 166.497 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 30' ' ' GLU . . . . . . . . . . . . . 0.3 OUTLIER -81.37 169.85 16.72 Favored 'General case' 0 CA--C 1.536 0.42 0 O-C-N 120.581 -1.325 . . . . 0.0 108.897 174.812 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 31' ' ' ILE . . . . . . . . . . . . . 7.5 tt -146.17 105.86 0.66 Allowed 'Isoleucine or valine' 0 N--CA 1.452 -0.328 0 N-CA-C 105.665 -1.976 . . . . 0.0 105.665 169.6 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 32' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER -80.45 129.66 34.65 Favored 'General case' 0 N--CA 1.445 -0.706 0 N-CA-C 106.604 -1.628 . . . . 0.0 106.604 160.17 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 33' ' ' PHE . . . . . . . . . . . . . 59.7 m-85 -93.42 156.44 16.77 Favored 'General case' 0 C--O 1.239 0.512 0 N-CA-C 106.803 -1.554 . . . . 0.0 106.803 158.673 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 34' ' ' GLY . . . . . . . . . . . . . . . -167.53 122.34 1.03 Allowed Glycine 0 C--O 1.219 -0.803 0 CA-C-O 117.107 -1.941 . . . . 0.0 109.713 -177.221 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 35' ' ' GLU . . . . . . . . . . . . . 1.8 tm-20 70.24 114.46 0.05 OUTLIER 'General case' 0 CA--C 1.542 0.659 0 CA-C-N 120.341 2.071 . . . . 0.0 111.436 178.986 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 44.9 mtmt 63.91 -50.21 0.26 Allowed 'General case' 0 N--CA 1.477 0.913 0 C-N-CA 130.578 3.551 . . . . 0.0 116.478 176.751 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 37' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER 171.27 8.18 0.0 OUTLIER 'General case' 0 CA--C 1.543 0.676 1 C-N-CA 132.347 4.259 . . . . 0.0 111.342 177.173 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' A' A ' 38' ' ' MET . . . . . . . . . . . . . 65.5 mmm -57.02 157.32 5.92 Favored 'General case' 0 N--CA 1.473 0.683 0 CA-C-N 120.667 1.576 . . . . 0.0 111.596 -169.478 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 39' ' ' ILE . . . . . . . . . . . . . 52.9 mt -124.57 124.91 69.23 Favored 'Isoleucine or valine' 0 C--O 1.235 0.327 0 C-N-CA 126.641 1.976 . . . . 0.0 106.662 -166.687 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 40' ' ' SER . . . . . . . . . . . . . 59.8 p -138.21 123.39 19.23 Favored 'General case' 0 C--O 1.241 0.635 0 C-N-CA 125.309 1.444 . . . . 0.0 108.334 177.554 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 41' ' ' GLY . . . . . . . . . . . . . . . -171.93 178.44 44.16 Favored Glycine 0 CA--C 1.529 0.926 0 CA-C-N 119.974 1.261 . . . . 0.0 112.959 -173.677 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 42' ' ' SER . . . . . . . . . . . . . 20.6 t -154.47 109.98 3.15 Favored 'General case' 0 C--O 1.236 0.393 0 O-C-N 121.622 -0.929 . . . . 0.0 109.859 169.012 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 43' ' ' MET . . . . . . . . . . . . . 15.3 mmt -65.91 -64.58 0.83 Allowed 'General case' 0 N--CA 1.455 -0.185 0 N-CA-C 106.998 -1.482 . . . . 0.0 106.998 159.597 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 44' ' ' CYS . . . . . 1.296 ' SG ' ' SG ' ' A' ' 70' ' ' CYS . 19.7 t -146.37 -61.99 0.31 Allowed 'General case' 0 N--CA 1.454 -0.253 0 N-CA-C 108.807 -0.812 . . . . 0.0 108.807 -178.245 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 45' ' ' ASN . . . . . . . . . . . . . 2.9 m120 -77.24 15.95 0.66 Allowed 'General case' 0 CA--C 1.544 0.738 0 C-N-CA 125.731 1.612 . . . . 0.0 113.139 -175.371 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 46' ' ' ARG . . . . . . . . . . . . . 1.2 mtt180 56.94 164.93 0.03 OUTLIER 'General case' 0 N--CA 1.472 0.644 0 C-N-CA 126.765 2.026 . . . . 0.0 113.164 -156.421 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 47' ' ' PHE . . . . . . . . . . . . . 39.1 p90 -160.65 166.04 29.54 Favored 'General case' 0 C--O 1.234 0.249 0 C-N-CA 124.152 0.981 . . . . 0.0 110.416 153.873 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 48' ' ' SER . . . . . . . . . . . . . 0.2 OUTLIER -167.92 162.41 13.47 Favored 'General case' 0 C--O 1.236 0.366 0 C-N-CA 124.305 1.042 . . . . 0.0 109.457 174.545 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 49' ' ' GLY . . . . . . . . . . . . . . . -176.66 173.74 46.51 Favored Glycine 0 CA--C 1.53 1.021 0 CA-C-N 119.925 1.239 . . . . 0.0 113.23 175.573 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 50' ' ' GLU . . . . . . . . . . . . . 47.1 mt-10 -79.31 94.09 5.41 Favored 'General case' 0 C--O 1.238 0.452 0 C-N-CA 125.008 1.323 . . . . 0.0 107.771 167.263 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 51' ' ' GLY . . . . . . . . . . . . . . . -69.59 164.39 51.02 Favored Glycine 0 C--O 1.238 0.375 0 N-CA-C 110.995 -0.842 . . . . 0.0 110.995 168.455 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 52' ' ' LYS . . . . . . . . . . . . . 2.0 tttp -162.6 151.34 14.82 Favored 'General case' 0 N--CA 1.457 -0.084 0 C-N-CA 123.378 0.671 . . . . 0.0 110.06 169.915 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 53' ' ' LEU . . . . . . . . . . . . . 23.6 tp -148.68 135.13 19.54 Favored 'General case' 0 C--N 1.333 -0.12 0 N-CA-C 107.04 -1.467 . . . . 0.0 107.04 174.731 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 2.8 t -157.42 11.57 0.21 Allowed 'General case' 0 CA--C 1.543 0.687 0 CA-C-N 118.435 0.562 . . . . 0.0 111.929 170.123 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 55' ' ' ASN . . . . . . . . . . . . . 40.1 p30 -151.83 -2.02 0.3 Allowed 'General case' 0 N--CA 1.471 0.61 0 N-CA-C 114.232 1.197 . . . . 0.0 114.232 -172.572 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 56' ' ' GLY . . . . . . . . . . . . . . . 107.39 -2.24 34.75 Favored Glycine 0 CA--C 1.532 1.139 0 C-N-CA 125.437 1.494 . . . . 0.0 113.574 -175.049 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 57' ' ' GLU . . . . . . . . . . . . . 28.0 tt0 -119.25 142.79 47.73 Favored 'General case' 0 CA--C 1.539 0.524 0 CA-C-N 118.678 1.239 . . . . 0.0 109.542 -177.215 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 58' ' ' LEU . . . . . . . . . . . . . 57.2 tp -117.6 122.84 44.68 Favored 'General case' 0 C--O 1.232 0.175 0 C-N-CA 126.086 1.754 . . . . 0.0 109.713 175.919 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 59' ' ' THR . . . . . . . . . . . . . 63.5 p -109.24 166.24 11.0 Favored 'General case' 0 CA--C 1.534 0.331 0 C-N-CA 124.223 1.009 . . . . 0.0 110.782 165.103 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 60' ' ' ALA . . . . . . . . . . . . . . . -129.76 86.32 2.4 Favored 'General case' 0 C--O 1.235 0.301 0 CA-C-O 122.415 1.102 . . . . 0.0 108.67 150.266 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 61' ' ' LYS . . . . . . . . . . . . . 74.7 tttt -74.85 100.02 3.95 Favored 'General case' 0 C--O 1.236 0.38 0 N-CA-C 107.601 -1.259 . . . . 0.0 107.601 168.18 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 62' ' ' GLY . . . . . . . . . . . . . . . 111.87 48.18 0.69 Allowed Glycine 0 CA--C 1.525 0.716 0 C-N-CA 124.105 0.859 . . . . 0.0 111.744 -176.638 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 63' ' ' LEU . . . . . . . . . . . . . 4.0 tp -67.33 168.57 10.37 Favored 'General case' 0 CA--C 1.539 0.542 0 C-N-CA 125.071 1.348 . . . . 0.0 110.516 172.654 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 64' ' ' ALA . . . . . . . . . . . . . . . -143.4 160.92 39.68 Favored 'General case' 0 C--N 1.329 -0.316 0 O-C-N 119.885 -1.76 . . . . 0.0 107.395 159.731 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 65' ' ' MET . . . . . . . . . . . . . 68.3 mtp -152.82 -171.39 3.92 Favored 'General case' 0 CA--C 1.54 0.56 0 C-N-CA 126.848 2.059 . . . . 0.0 107.777 179.38 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 66' ' ' THR . . . . . . . . . . . . . 0.9 OUTLIER -131.86 -164.87 1.5 Allowed 'General case' 0 CA--C 1.545 0.755 0 C-N-CA 124.239 1.016 . . . . 0.0 109.36 164.993 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 67' ' ' ARG . . . . . . . . . . . . . 3.1 ppt_? -125.11 52.56 1.58 Allowed 'General case' 0 N--CA 1.466 0.347 0 C-N-CA 124.964 1.306 . . . . 0.0 110.931 176.916 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 68' ' ' MET . . . . . . . . . . . . . 22.5 ptp -102.56 163.08 12.43 Favored 'General case' 0 CA--C 1.52 -0.207 0 O-C-N 121.29 -0.881 . . . . 0.0 109.205 167.007 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 69' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -124.42 155.67 38.45 Favored 'General case' 0 C--N 1.323 -0.582 0 C-N-CA 126.772 2.029 . . . . 0.0 108.316 -170.639 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 70' ' ' CYS . . . . . 1.296 ' SG ' ' SG ' ' A' ' 44' ' ' CYS . 1.6 p -116.67 160.59 20.49 Favored 'General case' 0 C--N 1.324 -0.541 0 C-N-CA 125.528 1.531 . . . . 0.0 110.097 -174.984 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 71' ' ' ALA . . . . . . . . . . . . . . . -78.96 16.86 0.82 Allowed 'General case' 0 CA--C 1.54 0.591 0 C-N-CA 124.29 1.036 . . . . 0.0 112.097 176.548 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 72' ' ' ASN . . . . . . . . . . . . . 17.3 t-20 -136.17 143.62 44.63 Favored Pre-proline 0 CA--C 1.534 0.348 0 O-C-N 120.509 -1.369 . . . . 0.0 108.464 -173.589 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 73' ' ' PRO . . . . . . . . . . . . . 48.4 Cg_endo -71.72 -52.63 0.2 Allowed 'Trans proline' 0 C--N 1.349 0.587 0 C-N-CA 122.965 2.443 . . . . 0.0 111.455 179.721 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 74' ' ' GLN . . . . . . . . . . . . . 45.7 tt0 -57.83 -45.31 86.36 Favored 'General case' 0 C--O 1.22 -0.498 0 C-N-CA 124.277 1.031 . . . . 0.0 109.798 -175.691 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 75' ' ' LEU . . . . . . . . . . . . . 98.2 mt -61.29 -39.16 89.43 Favored 'General case' 0 CA--C 1.535 0.371 0 CA-C-N 118.966 0.803 . . . . 0.0 111.106 -177.331 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 76' ' ' ASN . . . . . . . . . . . . . 1.4 m-80 -64.46 -50.47 67.37 Favored 'General case' 0 N--CA 1.468 0.426 0 C-N-CA 124.554 1.142 . . . . 0.0 110.018 174.749 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 77' ' ' GLU . . . . . . . . . . . . . 18.5 tt0 -54.08 -34.75 60.97 Favored 'General case' 0 CA--C 1.539 0.542 0 C-N-CA 126.0 1.72 . . . . 0.0 111.145 175.082 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 78' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -73.88 -20.74 60.32 Favored 'General case' 0 N--CA 1.446 -0.655 0 CA-C-O 116.836 -1.554 . . . . 0.0 112.696 -175.116 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 79' ' ' ASP . . . . . . . . . . . . . 0.0 OUTLIER -54.49 -45.45 73.25 Favored 'General case' 0 N--CA 1.471 0.617 0 CA-C-N 120.474 1.488 . . . . 0.0 110.433 176.23 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 80' ' ' ASN . . . . . . . . . . . . . 3.1 p30 -99.15 -23.78 15.11 Favored 'General case' 0 N--CA 1.441 -0.887 0 C-N-CA 124.402 1.081 . . . . 0.0 109.811 -168.013 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 81' ' ' THR . . . . . . . . . . . . . 15.3 m -57.44 -57.24 13.55 Favored 'General case' 0 CA--C 1.541 0.618 0 N-CA-C 109.157 -0.683 . . . . 0.0 109.157 161.539 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 82' ' ' ILE . . . . . . . . . . . . . 10.8 tp -66.38 -37.94 80.72 Favored 'Isoleucine or valine' 0 C--N 1.345 0.372 0 CA-C-N 119.855 1.207 . . . . 0.0 111.089 -172.107 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 83' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -57.21 -46.63 82.73 Favored 'General case' 0 CA--C 1.533 0.319 0 CA-C-N 119.236 0.926 . . . . 0.0 110.529 -176.053 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 84' ' ' GLU . . . . . . . . . . . . . 4.0 mt-10 -81.56 -5.24 57.81 Favored 'General case' 0 N--CA 1.448 -0.547 0 CA-C-O 118.448 -0.787 . . . . 0.0 112.864 179.536 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 85' ' ' MET . . . . . . . . . . . . . 90.0 mtp -90.71 -4.21 56.89 Favored 'General case' 0 CA--C 1.537 0.445 0 CA-C-N 120.07 1.305 . . . . 0.0 111.985 164.8 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 86' ' ' LEU . . . . . . . . . . . . . 3.4 mm? -113.13 -32.36 6.35 Favored 'General case' 0 C--N 1.333 -0.112 0 O-C-N 121.231 -0.918 . . . . 0.0 112.071 178.043 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 87' ' ' LYS . . . . . . . . . . . . . 76.9 mttt -72.14 -49.4 36.22 Favored 'General case' 0 N--CA 1.448 -0.554 0 CA-C-N 118.817 0.735 . . . . 0.0 110.501 -177.408 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 88' ' ' GLU . . . . . . . . . . . . . 7.3 mm-40 -80.81 -3.31 50.65 Favored 'General case' 0 CA--C 1.54 0.591 0 C-N-CA 126.097 1.759 . . . . 0.0 112.642 -174.87 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 89' ' ' GLY . . . . . . . . . . . . . . . 84.5 106.04 0.6 Allowed Glycine 0 CA--C 1.524 0.656 0 CA-C-N 120.137 1.335 . . . . 0.0 110.916 -179.762 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 90' ' ' ALA . . . . . . . . . . . . . . . -79.87 152.25 29.76 Favored 'General case' 0 CA--C 1.516 -0.33 0 N-CA-C 109.014 -0.736 . . . . 0.0 109.014 170.632 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 91' ' ' GLN . . . . . . . . . . . . . 93.2 mm-40 -73.62 141.75 46.55 Favored 'General case' 0 N--CA 1.442 -0.858 0 N-CA-C 105.398 -2.075 . . . . 0.0 105.398 156.206 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 92' ' ' VAL . . . . . . . . . . . . . 7.4 p -128.9 108.8 17.74 Favored 'Isoleucine or valine' 0 N--CA 1.443 -0.821 0 N-CA-C 104.967 -2.234 . . . . 0.0 104.967 -179.502 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 93' ' ' ASP . . . . . . . . . . . . . 0.7 OUTLIER -124.81 75.48 1.43 Allowed 'General case' 0 C--N 1.327 -0.37 0 N-CA-C 106.444 -1.687 . . . . 0.0 106.444 -167.552 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 94' ' ' LEU . . . . . 0.474 ' CD2' HE21 ' A' ' 6' ' ' GLN . 42.0 tp -77.45 121.52 23.93 Favored 'General case' 0 C--O 1.234 0.254 0 N-CA-C 107.923 -1.14 . . . . 0.0 107.923 -178.188 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 95' ' ' THR . . . . . . . . . . . . . 1.4 m -86.65 -167.22 1.8 Allowed 'General case' 0 C--N 1.319 -0.743 0 C-N-CA 126.496 1.918 . . . . 0.0 108.057 168.238 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 96' ' ' ALA . . . . . . . . . . . . . . . -50.55 -37.87 41.87 Favored 'General case' 0 CA--C 1.543 0.676 0 O-C-N 119.563 -1.96 . . . . 0.0 113.729 -171.647 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 97' ' ' ASN . . . . . . . . . . . . . 1.3 p30 -157.3 18.48 0.29 Allowed 'General case' 0 CA--C 1.54 0.577 0 C-N-CA 125.783 1.633 . . . . 0.0 111.479 -173.363 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 98' ' ' GLN . . . . . . . . . . . . . 12.3 tt0 -136.03 116.87 14.11 Favored 'General case' 0 C--N 1.339 0.149 0 O-C-N 121.137 -0.977 . . . . 0.0 109.813 -177.673 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 99' ' ' LEU . . . . . . . . . . . . . 7.5 tp -77.2 117.94 19.22 Favored 'General case' 0 C--O 1.237 0.421 0 C-N-CA 127.509 2.324 . . . . 0.0 108.02 176.854 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 100' ' ' THR . . . . . . . . . . . . . 8.8 m -94.63 106.76 18.76 Favored 'General case' 0 CA--C 1.537 0.462 0 N-CA-C 106.758 -1.571 . . . . 0.0 106.758 165.192 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 101' ' ' LEU . . . . . . . . . . . . . 1.6 mm? -95.18 116.77 29.17 Favored 'General case' 0 CA--C 1.515 -0.373 0 N-CA-C 107.534 -1.284 . . . . 0.0 107.534 167.006 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 102' ' ' ALA . . . . . . . . . . . . . . . -126.71 139.47 53.12 Favored 'General case' 0 C--O 1.233 0.196 0 C-N-CA 123.499 0.719 . . . . 0.0 109.578 176.365 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 103' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -155.25 171.75 19.31 Favored 'General case' 0 N--CA 1.444 -0.755 0 C-N-CA 126.296 1.839 . . . . 0.0 107.959 178.346 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 104' ' ' ALA . . . . . . . . . . . . . . . -64.27 -22.14 66.84 Favored 'General case' 0 CA--C 1.539 0.536 0 N-CA-C 112.911 0.708 . . . . 0.0 112.911 178.025 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 105' ' ' LYS . . . . . . . . . . . . . 0.3 OUTLIER -67.61 -75.25 0.1 Allowed 'General case' 0 C--N 1.345 0.391 0 CA-C-N 119.19 0.905 . . . . 0.0 109.687 174.491 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 106' ' ' GLN . . . . . . . . . . . . . 7.8 mt-30 -147.29 178.5 8.36 Favored 'General case' 0 CA--C 1.536 0.431 0 C-N-CA 127.47 2.308 . . . . 0.0 107.825 -177.119 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 107' ' ' THR . . . . . . . . . . . . . 1.0 OUTLIER -128.7 158.22 39.19 Favored 'General case' 0 CA--C 1.542 0.636 0 C-N-CA 125.672 1.589 . . . . 0.0 107.467 171.333 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 108' ' ' LEU . . . . . . . . . . . . . 87.1 mt -145.76 162.56 37.34 Favored 'General case' 0 N--CA 1.468 0.455 0 C-N-CA 126.085 1.754 . . . . 0.0 110.491 -170.901 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 109' ' ' THR . . . . . . . . . . . . . 99.5 m -122.13 115.43 22.42 Favored 'General case' 0 C--O 1.238 0.456 0 C-N-CA 125.203 1.401 . . . . 0.0 108.196 172.293 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 110' ' ' TYR . . . . . . . . . . . . . 95.6 m-85 -109.68 143.32 39.61 Favored 'General case' 0 C--O 1.232 0.16 0 N-CA-C 109.617 -0.512 . . . . 0.0 109.617 171.461 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 111' ' ' LYS . . . . . . . . . . . . . 11.0 tppt? -99.08 142.97 29.89 Favored 'General case' 0 C--O 1.234 0.248 0 C-N-CA 123.954 0.902 . . . . 0.0 109.064 -178.134 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 112' ' ' LEU . . . . . . . . . . . . . 15.6 tp -73.95 60.01 0.73 Allowed 'General case' 0 CA--C 1.536 0.435 0 C-N-CA 125.275 1.43 . . . . 0.0 108.731 167.343 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 113' ' ' ALA . . . . . . . . . . . . . . . -81.8 75.43 8.74 Favored 'General case' 0 N--CA 1.449 -0.51 0 N-CA-C 106.863 -1.532 . . . . 0.0 106.863 167.67 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 114' ' ' ASP . . . . . 0.45 ' C ' ' H ' ' A' ' 116' ' ' MET 0.269 19.5 p-10 -94.52 55.15 1.91 Allowed 'General case' 0 CA--C 1.522 -0.102 0 CA-C-O 123.085 1.421 . . . . 0.0 112.307 -178.773 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' A' A ' 115' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -64.51 3.66 0.47 Allowed 'General case' 0 CA--C 1.538 0.493 0 C-N-CA 126.959 2.104 . . . . 0.0 113.774 172.706 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 116' ' ' MET . . . . . 0.45 ' H ' ' C ' ' A' ' 114' ' ' ASP . 8.1 tpt -66.19 108.29 2.23 Favored 'General case' 0 N--CA 1.451 -0.417 0 C-N-CA 126.493 1.917 . . . . 0.0 108.733 -172.268 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 117' ' ' ASN . . . . . . . . . . . . . 8.0 m120 . . . . . 0 C--O 1.233 0.214 0 CA-C-O 121.189 0.518 . . . . 0.0 110.741 -176.654 . . . . . . . . 0 0 . 1 . 011 nuclear orig full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 20.8 ttt . . . . . 0 CA--C 1.536 0.427 0 CA-C-O 121.396 0.617 . . . . 0.0 110.878 . . . . . . . . . 0 0 . 1 . 011 nuclear orig full ' A' A ' 2' ' ' VAL . . . . . . . . . . . . . 14.7 p -52.77 158.12 0.48 Allowed 'Isoleucine or valine' 0 CA--C 1.545 0.777 0 C-N-CA 128.088 2.555 . . . . 0.0 112.271 171.906 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 3' ' ' THR . . . . . . . . . . . . . 57.1 p -133.82 164.99 40.06 Favored Pre-proline 0 N--CA 1.467 0.425 0 O-C-N 121.24 -0.913 . . . . 0.0 111.071 178.367 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 4' ' ' PRO . . . . . . . . . . . . . 37.9 Cg_endo -62.84 -38.94 44.92 Favored 'Trans proline' 0 C--N 1.344 0.311 0 C-N-CA 123.565 2.843 . . . . 0.0 113.058 170.243 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 5' ' ' GLU . . . . . 0.411 ' C ' ' H ' ' A' ' 7' ' ' LEU . 8.7 tt0 -63.92 -44.73 92.02 Favored 'General case' 0 C--N 1.329 -0.284 0 C-N-CA 122.583 0.353 . . . . 0.0 111.019 -173.757 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 6' ' ' GLN . . . . . . . . . . . . . 13.5 pt20 -71.95 13.81 0.26 Allowed 'General case' 0 CA--C 1.541 0.611 0 C-N-CA 123.53 0.732 . . . . 0.0 112.744 179.542 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 7' ' ' LEU . . . . . 0.411 ' H ' ' C ' ' A' ' 5' ' ' GLU . 95.6 mt -126.52 -51.36 1.49 Allowed 'General case' 0 N--CA 1.452 -0.361 0 C-N-CA 125.928 1.691 . . . . 0.0 110.441 -176.58 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 8' ' ' GLN . . . . . . . . . . . . 0.267 0.0 OUTLIER -54.97 -12.07 0.76 Allowed 'General case' 0 N--CA 1.478 0.929 0 N-CA-C 115.098 1.518 . . . . 0.0 115.098 -173.303 . . . . . . . . 3 3 . 1 . 011 nuclear orig full ' A' A ' 9' ' ' HIS . . . . . . . . . . . . . 10.3 m170 -125.63 13.84 8.09 Favored 'General case' 0 N--CA 1.443 -0.815 0 C-N-CA 125.44 1.496 . . . . 0.0 110.469 -169.509 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 10' ' ' HIS . . . . . . . . . . . . . 81.2 m-70 -141.42 126.02 17.86 Favored 'General case' 0 CA--C 1.538 0.483 0 C-N-CA 124.844 1.258 . . . . 0.0 112.162 -175.196 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 11' ' ' ARG . . . . . . . . . . . . . 39.3 ttt180 -68.66 149.63 48.88 Favored 'General case' 0 N--CA 1.467 0.417 0 C-N-CA 123.7 0.8 . . . . 0.0 110.004 165.63 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 12' ' ' PHE . . . . . . . . . . . . . 30.9 m-85 -129.64 167.07 18.53 Favored 'General case' 0 CA--C 1.538 0.489 0 C-N-CA 124.314 1.046 . . . . 0.0 109.66 163.417 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 13' ' ' VAL . . . . . . . . . . . . . 12.7 p -135.44 147.15 28.99 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.619 0 O-C-N 121.053 -1.029 . . . . 0.0 110.313 176.346 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 14' ' ' LEU . . . . . . . . . . . . . 43.6 tp -73.17 97.58 2.43 Favored 'General case' 0 N--CA 1.456 -0.155 0 N-CA-C 107.763 -1.199 . . . . 0.0 107.763 172.011 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 4.9 mm-40 -79.36 -50.64 10.54 Favored 'General case' 0 C--N 1.324 -0.503 0 N-CA-C 108.983 -0.747 . . . . 0.0 108.983 173.527 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 77.5 p -147.72 165.38 30.67 Favored 'General case' 0 C--O 1.236 0.365 0 CA-C-O 122.236 1.017 . . . . 0.0 112.595 -176.643 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 17' ' ' VAL . . . . . . . . . . . . . 13.3 t -132.83 161.85 40.91 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.53 0 C-N-CA 127.04 2.136 . . . . 0.0 107.16 -164.73 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 18' ' ' ASN . . . . . . . . . . . . . 30.9 t30 -56.41 -36.45 68.96 Favored 'General case' 0 N--CA 1.468 0.436 0 C-N-CA 124.272 1.029 . . . . 0.0 113.424 -177.379 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . -94.09 -31.73 7.9 Favored Glycine 0 C--N 1.335 0.473 0 CA-C-O 118.593 -1.115 . . . . 0.0 113.919 -167.521 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 1.3 pttt 174.47 154.85 0.31 Allowed Pre-proline 0 N--CA 1.465 0.317 0 C-N-CA 127.922 2.489 . . . . 0.0 107.012 -177.636 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 21' ' ' PRO . . . . . . . . . . . . . 72.0 Cg_endo -71.29 177.29 6.79 Favored 'Trans proline' 0 N--CA 1.454 -0.816 0 C-N-CA 121.537 1.492 . . . . 0.0 111.289 -179.13 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 22' ' ' VAL . . . . . . . . . . . . . 7.0 p -129.8 164.67 31.84 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.408 0 C-N-CA 125.403 1.481 . . . . 0.0 108.497 -172.792 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 23' ' ' THR . . . . . . . . . . . . . 0.6 OUTLIER -146.64 129.56 16.32 Favored 'General case' 0 CA--C 1.534 0.342 0 N-CA-C 107.11 -1.441 . . . . 0.0 107.11 174.671 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 24' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER -152.29 84.85 1.26 Allowed 'General case' 0 C--N 1.328 -0.347 0 N-CA-C 104.448 -2.427 . . . . 0.0 104.448 171.134 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 25' ' ' ASP . . . . . . . . . . . . . 0.8 OUTLIER -51.51 -40.7 60.11 Favored 'General case' 0 C--N 1.33 -0.25 0 C-N-CA 123.976 0.91 . . . . 0.0 109.492 175.441 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 26' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -91.4 107.18 19.03 Favored 'General case' 0 N--CA 1.449 -0.492 0 C-N-CA 125.829 1.652 . . . . 0.0 108.893 177.99 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 27' ' ' ASN . . . . . . . . . . . . . 73.9 m-80 47.75 73.37 1.01 Allowed Pre-proline 0 CA--C 1.537 0.456 0 C-N-CA 127.356 2.262 . . . . 0.0 112.116 173.228 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 28' ' ' PRO . . . . . . . . . . . . . 52.2 Cg_endo -66.59 170.76 11.83 Favored 'Trans proline' 0 C--O 1.242 0.678 0 C-N-CA 122.839 2.359 . . . . 0.0 112.615 -176.545 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 29' ' ' PRO . . . . . . . . . . . . . 43.6 Cg_endo -71.22 63.64 2.69 Favored 'Trans proline' 0 CA--C 1.538 0.705 0 C-N-CA 123.747 2.964 . . . . 0.0 111.615 173.411 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 30' ' ' GLU . . . . . . . . . . . . . 16.4 pt-20 -81.64 166.49 20.13 Favored 'General case' 0 C--O 1.24 0.557 0 O-C-N 120.461 -1.399 . . . . 0.0 109.927 174.275 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 31' ' ' ILE . . . . . . . . . . . . . 12.7 tt -139.57 138.23 39.6 Favored 'Isoleucine or valine' 0 N--CA 1.455 -0.224 0 N-CA-C 107.632 -1.247 . . . . 0.0 107.632 -179.969 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 32' ' ' SER . . . . . . . . . . . . . 36.8 p -124.01 120.97 33.99 Favored 'General case' 0 N--CA 1.445 -0.689 0 N-CA-C 106.627 -1.62 . . . . 0.0 106.627 176.882 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 33' ' ' PHE . . . . . . . . . . . . . 75.3 m-85 -86.88 137.55 32.29 Favored 'General case' 0 N--CA 1.448 -0.536 0 N-CA-C 105.035 -2.209 . . . . 0.0 105.035 171.97 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 34' ' ' GLY . . . . . . . . . . . . . . . -156.97 163.95 32.53 Favored Glycine 0 C--N 1.335 0.504 0 O-C-N 121.063 -1.023 . . . . 0.0 110.663 178.46 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 35' ' ' GLU . . . . . . . . . . . . . 3.9 tt0 63.73 -161.98 0.28 Allowed 'General case' 0 N--CA 1.452 -0.363 0 CA-C-N 118.675 1.238 . . . . 0.0 110.525 175.432 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 2.8 mtpt -59.32 71.71 0.01 OUTLIER 'General case' 0 CA--C 1.539 0.557 0 C-N-CA 127.046 2.139 . . . . 0.0 111.503 -177.005 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 37' ' ' MET . . . . . . . . . . . . 0.297 0.0 OUTLIER 50.71 19.36 0.59 Allowed 'General case' 0 N--CA 1.445 -0.688 0 C-N-CA 128.19 2.596 . . . . 0.0 115.449 -169.52 . . . . . . . . 3 3 . 1 . 011 nuclear orig full ' A' A ' 38' ' ' MET . . . . . . . . . . . . . 0.7 OUTLIER -67.34 165.4 16.47 Favored 'General case' 0 N--CA 1.443 -0.777 0 O-C-N 120.877 -1.139 . . . . 0.0 110.757 -174.772 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 39' ' ' ILE . . . . . . . . . . . . . 5.2 mt -135.11 126.46 46.32 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.368 0 N-CA-C 105.75 -1.944 . . . . 0.0 105.75 -169.754 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 40' ' ' SER . . . . . . . . . . . . . 7.4 m -129.92 151.59 50.31 Favored 'General case' 0 CA--C 1.531 0.235 0 N-CA-C 107.819 -1.178 . . . . 0.0 107.819 169.039 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 41' ' ' GLY . . . . . . . . . . . . . . . 178.46 173.91 44.25 Favored Glycine 0 C--O 1.237 0.316 0 N-CA-C 109.599 -1.4 . . . . 0.0 109.599 -178.34 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 42' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -147.38 83.61 1.55 Allowed 'General case' 0 N--CA 1.451 -0.405 0 O-C-N 122.226 -0.573 . . . . 0.0 111.134 179.982 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 43' ' ' MET . . . . . . . . . . . . . 6.1 mmt -47.82 -55.71 9.12 Favored 'General case' 0 C--N 1.342 0.266 0 C-N-CA 123.68 0.792 . . . . 0.0 109.006 169.14 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 44' ' ' CYS . . . . . 1.293 ' SG ' ' SG ' ' A' ' 70' ' ' CYS . 18.0 p -163.26 -27.38 0.04 OUTLIER 'General case' 0 N--CA 1.443 -0.819 0 C-N-CA 125.115 1.366 . . . . 0.0 110.989 176.093 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 45' ' ' ASN . . . . . . . . . . . . . 0.5 OUTLIER -121.38 20.23 11.26 Favored 'General case' 0 N--CA 1.47 0.559 0 C-N-CA 126.265 1.826 . . . . 0.0 112.217 -167.107 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 46' ' ' ARG . . . . . . . . . . . . . 34.3 mtm180 48.35 166.88 0.0 OUTLIER 'General case' 0 C--N 1.329 -0.312 0 C-N-CA 127.011 2.124 . . . . 0.0 111.661 -155.124 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 47' ' ' PHE . . . . . . . . . . . . . 6.0 p90 -164.41 147.93 9.29 Favored 'General case' 0 C--N 1.317 -0.819 0 N-CA-C 106.127 -1.805 . . . . 0.0 106.127 166.029 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 48' ' ' SER . . . . . . . . . . . . . 1.5 p -160.75 151.79 18.82 Favored 'General case' 0 C--N 1.314 -0.954 0 N-CA-C 107.304 -1.369 . . . . 0.0 107.304 179.529 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 49' ' ' GLY . . . . . . . . . . . . . . . -172.51 163.05 35.01 Favored Glycine 0 CA--C 1.524 0.635 0 N-CA-C 106.574 -2.61 . . . . 0.0 106.574 165.852 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 50' ' ' GLU . . . . . . . . . . . . . 25.8 mt-10 -64.27 115.68 5.28 Favored 'General case' 0 C--O 1.238 0.498 0 N-CA-C 107.781 -1.192 . . . . 0.0 107.781 172.109 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 51' ' ' GLY . . . . . . . . . . . . . . . -61.42 161.36 26.48 Favored Glycine 0 CA--C 1.531 1.064 0 O-C-N 123.628 0.58 . . . . 0.0 113.388 174.545 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 52' ' ' LYS . . . . . . . . . . . . . 25.9 ttpt -133.4 135.53 44.71 Favored 'General case' 0 N--CA 1.464 0.227 0 O-C-N 121.692 -0.887 . . . . 0.0 109.219 165.894 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 53' ' ' LEU . . . . . . . . . . . . . 9.6 tp -160.47 93.76 1.04 Allowed 'General case' 0 N--CA 1.453 -0.31 0 C-N-CA 123.511 0.724 . . . . 0.0 109.881 -176.356 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 2.5 t -136.74 -12.45 1.75 Allowed 'General case' 0 C--N 1.326 -0.445 0 C-N-CA 123.721 0.808 . . . . 0.0 111.047 168.765 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 55' ' ' ASN . . . . . . . . . . . . . 4.3 t30 -136.6 24.67 3.14 Favored 'General case' 0 CA--C 1.541 0.602 0 C-N-CA 127.114 2.165 . . . . 0.0 109.944 -171.851 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 56' ' ' GLY . . . . . . . . . . . . . . . 73.66 -3.55 33.8 Favored Glycine 0 CA--C 1.532 1.096 0 O-C-N 120.584 -1.322 . . . . 0.0 114.716 -175.968 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 57' ' ' GLU . . . . . . . . . . . . . 30.9 tt0 -110.45 105.28 14.2 Favored 'General case' 0 N--CA 1.452 -0.363 0 CA-C-N 118.747 1.274 . . . . 0.0 110.159 -161.539 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 58' ' ' LEU . . . . . . . . . . . . . 21.2 tp -75.99 93.83 3.32 Favored 'General case' 0 CA--C 1.536 0.408 0 C-N-CA 125.222 1.409 . . . . 0.0 112.251 176.84 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 59' ' ' THR . . . . . . . . . . . . . 14.9 p -108.02 127.74 54.04 Favored 'General case' 0 N--CA 1.474 0.742 0 C-N-CA 124.815 1.246 . . . . 0.0 109.955 172.916 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 60' ' ' ALA . . . . . . . . . . . . . . . -132.0 87.34 2.43 Favored 'General case' 0 N--CA 1.454 -0.226 0 C-N-CA 124.443 1.097 . . . . 0.0 109.504 173.571 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 61' ' ' LYS . . . . . . . . . . . . . 47.6 tttm -44.89 -62.4 1.24 Allowed 'General case' 0 C--N 1.331 -0.209 0 C-N-CA 125.817 1.647 . . . . 0.0 110.082 167.745 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 62' ' ' GLY . . . . . . . . . . . . . . . -79.38 45.57 2.87 Favored Glycine 0 CA--C 1.521 0.441 0 C-N-CA 125.251 1.405 . . . . 0.0 112.725 -176.52 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 63' ' ' LEU . . . . . . . . . . . . . 5.7 tp -63.56 142.6 58.34 Favored 'General case' 0 N--CA 1.441 -0.879 0 CA-C-N 118.474 1.137 . . . . 0.0 108.248 166.641 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 64' ' ' ALA . . . . . . . . . . . . . . . -128.88 93.11 3.53 Favored 'General case' 0 N--CA 1.455 -0.223 0 C-N-CA 124.727 1.211 . . . . 0.0 109.741 -173.351 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 65' ' ' MET . . . . . . . . . . . . . 74.9 mtp -115.64 156.36 26.01 Favored 'General case' 0 N--CA 1.467 0.406 0 C-N-CA 124.717 1.207 . . . . 0.0 110.346 -177.377 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 66' ' ' THR . . . . . . . . . . . . . 34.7 p -88.73 -172.06 3.57 Favored 'General case' 0 CA--C 1.544 0.717 0 C-N-CA 123.933 0.893 . . . . 0.0 109.736 173.245 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 67' ' ' ARG . . . . . . . . . . . . . 34.0 mtm180 -130.45 14.34 5.52 Favored 'General case' 0 N--CA 1.47 0.564 0 C-N-CA 124.005 0.922 . . . . 0.0 112.97 170.614 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 68' ' ' MET . . . . . . . . . . . . . 4.0 mpp? -61.5 166.53 4.0 Favored 'General case' 0 CA--C 1.532 0.254 0 O-C-N 120.033 -1.667 . . . . 0.0 111.688 178.367 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 69' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -58.02 111.08 1.06 Allowed 'General case' 0 N--CA 1.445 -0.677 0 C-N-CA 125.96 1.704 . . . . 0.0 108.291 171.305 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 70' ' ' CYS . . . . . 1.293 ' SG ' ' SG ' ' A' ' 44' ' ' CYS . 69.7 m -62.12 -14.09 33.34 Favored 'General case' 0 C--O 1.231 0.111 0 CA-C-O 118.485 -0.769 . . . . 0.0 112.86 170.585 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 71' ' ' ALA . . . . . . . . . . . . . . . 61.03 3.98 0.76 Allowed 'General case' 0 CA--C 1.533 0.295 0 C-N-CA 126.69 1.996 . . . . 0.0 115.38 163.941 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 72' ' ' ASN . . . . . . . . . . . . . 7.4 t30 -142.73 143.4 25.72 Favored Pre-proline 0 N--CA 1.466 0.373 0 N-CA-C 107.775 -1.194 . . . . 0.0 107.775 158.315 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 73' ' ' PRO . . . . . . . . . . . . . 19.0 Cg_endo -63.83 -47.02 7.54 Favored 'Trans proline' 0 C--N 1.346 0.411 0 C-N-CA 123.148 2.565 . . . . 0.0 111.815 -165.963 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 74' ' ' GLN . . . . . . . . . . . . . 48.2 tt0 -59.79 -38.65 82.5 Favored 'General case' 0 CA--C 1.532 0.272 0 CA-C-O 119.238 -0.41 . . . . 0.0 110.616 -179.052 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 75' ' ' LEU . . . . . . . . . . . . . 36.7 mt -72.24 -41.99 66.17 Favored 'General case' 0 CA--C 1.533 0.301 0 N-CA-C 109.269 -0.641 . . . . 0.0 109.269 -178.115 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 76' ' ' ASN . . . . . . . . . . . . . 4.1 t-20 -63.14 -37.85 88.86 Favored 'General case' 0 N--CA 1.469 0.494 0 C-N-CA 123.104 0.562 . . . . 0.0 111.188 -179.721 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 77' ' ' GLU . . . . . . . . . . . . . 0.7 OUTLIER -60.53 -24.33 65.28 Favored 'General case' 0 CA--C 1.542 0.647 0 N-CA-C 113.331 0.863 . . . . 0.0 113.331 175.257 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 78' ' ' LEU . . . . . . . . . . . . . 94.3 mt -89.37 -15.42 33.36 Favored 'General case' 0 CA--C 1.522 -0.128 0 CA-C-O 118.352 -0.832 . . . . 0.0 111.585 -176.375 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 79' ' ' ASP . . . . . . . . . . . . . 35.5 t70 -55.9 -42.26 75.74 Favored 'General case' 0 CA--C 1.518 -0.26 0 C-N-CA 124.952 1.301 . . . . 0.0 111.895 175.58 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 80' ' ' ASN . . . . . . . . . . . . . 71.6 m-20 -77.16 -55.49 5.39 Favored 'General case' 0 N--CA 1.451 -0.398 0 N-CA-C 107.47 -1.307 . . . . 0.0 107.47 -179.104 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 81' ' ' THR . . . . . . . . . . . . . 22.5 m -45.23 -54.95 6.34 Favored 'General case' 0 CA--C 1.536 0.405 0 C-N-CA 126.241 1.816 . . . . 0.0 110.938 -176.931 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 82' ' ' ILE . . . . . . . . . . . . . 9.5 tp -64.93 -40.74 90.08 Favored 'Isoleucine or valine' 0 C--O 1.236 0.362 0 CA-C-N 119.089 0.859 . . . . 0.0 111.373 -175.529 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 83' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -64.86 -38.63 91.61 Favored 'General case' 0 N--CA 1.449 -0.513 0 N-CA-C 109.083 -0.71 . . . . 0.0 109.083 -175.893 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 84' ' ' GLU . . . . . . . . . . . . . 94.7 mt-10 -74.75 -34.1 62.46 Favored 'General case' 0 N--CA 1.446 -0.631 0 C-N-CA 126.705 2.002 . . . . 0.0 111.374 -177.402 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 85' ' ' MET . . . . . . . . . . . . . 84.3 mtp -67.31 -55.09 15.29 Favored 'General case' 0 C--N 1.34 0.192 0 CA-C-O 122.131 0.967 . . . . 0.0 108.556 -179.678 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 86' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -66.6 -20.79 66.09 Favored 'General case' 0 C--N 1.333 -0.122 0 C-N-CA 123.657 0.783 . . . . 0.0 111.98 -173.93 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 87' ' ' LYS . . . . . . . . . . . . . 2.5 tptt -71.19 -40.49 71.16 Favored 'General case' 0 N--CA 1.453 -0.321 0 CA-C-O 117.668 -1.158 . . . . 0.0 111.303 179.153 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 88' ' ' GLU . . . . . . . . . . . . . 0.6 OUTLIER -84.54 -37.94 20.62 Favored 'General case' 0 C--N 1.341 0.225 0 O-C-N 124.282 0.989 . . . . 0.0 112.169 -175.615 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 89' ' ' GLY . . . . . . . . . . . . . . . 122.09 84.94 0.75 Allowed Glycine 0 CA--C 1.503 -0.7 0 N-CA-C 109.937 -1.265 . . . . 0.0 109.937 -174.031 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 90' ' ' ALA . . . . . . . . . . . . . . . -67.33 139.43 57.23 Favored 'General case' 0 N--CA 1.447 -0.616 0 N-CA-C 108.441 -0.948 . . . . 0.0 108.441 175.336 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 91' ' ' GLN . . . . . . . . . . . . . 6.9 mp0 -67.33 141.94 56.97 Favored 'General case' 0 N--CA 1.439 -1.01 0 N-CA-C 105.305 -2.109 . . . . 0.0 105.305 164.897 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 92' ' ' VAL . . . . . . . . . . . . . 79.5 t -130.01 117.76 41.91 Favored 'Isoleucine or valine' 0 N--CA 1.447 -0.607 0 N-CA-C 105.561 -2.015 . . . . 0.0 105.561 178.597 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 93' ' ' ASP . . . . . . . . . . . . . 31.4 m-20 -128.0 84.79 2.28 Favored 'General case' 0 C--N 1.327 -0.375 0 C-N-CA 127.065 2.146 . . . . 0.0 105.309 -171.764 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 94' ' ' LEU . . . . . . . . . . . . . 57.8 tp -85.2 109.17 18.12 Favored 'General case' 0 CA--C 1.516 -0.359 0 CA-C-O 122.336 1.065 . . . . 0.0 108.568 173.131 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 95' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -77.75 179.27 6.74 Favored 'General case' 0 C--N 1.315 -0.933 0 C-N-CA 127.022 2.129 . . . . 0.0 109.115 169.086 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 96' ' ' ALA . . . . . . . . . . . . . . . -44.52 -41.94 6.81 Favored 'General case' 0 CA--C 1.535 0.373 0 C-N-CA 125.021 1.328 . . . . 0.0 114.026 -163.918 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 97' ' ' ASN . . . . . . . . . . . . . 17.0 p30 -150.96 31.55 0.62 Allowed 'General case' 0 CA--C 1.535 0.376 0 C-N-CA 125.352 1.461 . . . . 0.0 111.993 170.92 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 98' ' ' GLN . . . . . . . . . . . . . 13.7 tt0 -147.8 125.57 11.89 Favored 'General case' 0 N--CA 1.457 -0.122 0 O-C-N 121.484 -0.76 . . . . 0.0 109.83 -178.62 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 99' ' ' LEU . . . . . . . . . . . . . 22.5 tp -90.22 129.64 36.45 Favored 'General case' 0 C--N 1.327 -0.399 0 C-N-CA 126.615 1.966 . . . . 0.0 110.448 -177.007 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 100' ' ' THR . . . . . . . . . . . . . 74.5 m -104.58 128.64 52.63 Favored 'General case' 0 N--CA 1.454 -0.271 0 C-N-CA 123.815 0.846 . . . . 0.0 109.593 158.931 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 101' ' ' LEU . . . . . . . . . . . . . 1.0 OUTLIER -98.13 141.93 30.45 Favored 'General case' 0 CA--C 1.519 -0.222 0 C-N-CA 126.175 1.79 . . . . 0.0 107.126 159.881 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 102' ' ' ALA . . . . . . . . . . . . . . . -143.76 148.13 35.18 Favored 'General case' 0 C--N 1.328 -0.362 0 C-N-CA 124.814 1.246 . . . . 0.0 107.831 172.015 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 103' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -162.54 173.42 14.01 Favored 'General case' 0 N--CA 1.442 -0.838 0 C-N-CA 126.89 2.076 . . . . 0.0 107.651 173.591 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 104' ' ' ALA . . . . . . . . . . . . . . . -51.17 -36.64 42.11 Favored 'General case' 0 CA--C 1.531 0.214 0 C-N-CA 123.803 0.841 . . . . 0.0 112.146 173.868 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 105' ' ' LYS . . . . . . . . . . . . . 12.5 mmtp -63.33 -74.61 0.09 Allowed 'General case' 0 C--N 1.339 0.113 0 CA-C-O 118.683 -0.675 . . . . 0.0 111.162 174.706 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 106' ' ' GLN . . . . . . . . . . . . . 2.6 pt20 -152.73 -172.04 4.12 Favored 'General case' 0 CA--C 1.534 0.355 0 CA-C-N 118.625 0.648 . . . . 0.0 111.667 -176.261 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 107' ' ' THR . . . . . . . . . . . . . 1.8 t -128.58 135.81 49.87 Favored 'General case' 0 CA--C 1.534 0.345 0 C-N-CA 126.321 1.848 . . . . 0.0 107.875 177.498 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 108' ' ' LEU . . . . . . . . . . . . . 5.9 mp -123.78 149.83 45.17 Favored 'General case' 0 C--O 1.233 0.229 0 C-N-CA 128.346 2.658 . . . . 0.0 107.604 -173.838 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 109' ' ' THR . . . . . . . . . . . . . 1.3 m -132.08 102.19 5.71 Favored 'General case' 0 C--O 1.238 0.45 0 CA-C-O 121.746 0.784 . . . . 0.0 109.469 -176.367 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 110' ' ' TYR . . . . . . . . . . . . . 51.5 m-85 -103.26 144.61 31.11 Favored 'General case' 0 N--CA 1.453 -0.318 0 C-N-CA 124.925 1.29 . . . . 0.0 110.375 -173.893 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 111' ' ' LYS . . . . . . . . . . . . . 0.8 OUTLIER -98.81 142.65 30.07 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-O 117.739 -1.124 . . . . 0.0 109.398 -176.769 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 112' ' ' LEU . . . . . . . . . . . . . 39.1 tp -74.14 56.91 0.63 Allowed 'General case' 0 CA--C 1.542 0.644 0 C-N-CA 124.017 0.927 . . . . 0.0 109.214 162.586 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 113' ' ' ALA . . . . . . . . . . . . . . . -92.22 63.68 4.34 Favored 'General case' 0 C--O 1.236 0.368 0 CA-C-O 122.487 1.137 . . . . 0.0 108.456 -177.625 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 114' ' ' ASP . . . . . . . . . . . . . 5.1 p-10 -90.17 16.21 8.92 Favored 'General case' 0 C--N 1.326 -0.43 0 CA-C-N 114.633 -1.167 . . . . 0.0 113.203 -157.202 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 115' ' ' LEU . . . . . . . . . . . . . 46.7 mt 75.6 11.16 3.3 Favored 'General case' 0 C--O 1.23 0.062 0 C-N-CA 130.999 3.719 . . . . 0.0 114.573 -171.024 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 116' ' ' MET . . . . . . . . . . . . . 6.9 tpt 75.4 148.76 0.1 Allowed 'General case' 0 N--CA 1.463 0.2 0 C-N-CA 126.666 1.986 . . . . 0.0 109.497 -174.997 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 117' ' ' ASN . . . . . . . . . . . . . 10.9 t-20 . . . . . 0 C--O 1.237 0.413 0 C-N-CA 126.291 1.836 . . . . 0.0 113.755 -156.599 . . . . . . . . 0 0 . 1 . 012 nuclear orig full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 53.0 ttp . . . . . 0 N--CA 1.452 -0.371 0 N-CA-C 108.853 -0.795 . . . . 0.0 108.853 . . . . . . . . . 0 0 . 1 . 012 nuclear orig full ' A' A ' 2' ' ' VAL . . . . . . . . . . . . . 13.4 p -67.44 160.46 4.31 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.366 0 C-N-CA 123.986 0.914 . . . . 0.0 111.177 175.117 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 3' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -124.66 156.52 67.99 Favored Pre-proline 0 CA--C 1.541 0.616 0 C-N-CA 125.601 1.56 . . . . 0.0 111.093 163.885 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 4' ' ' PRO . . . . . . . . . . . . . 93.9 Cg_endo -72.72 -33.15 8.53 Favored 'Trans proline' 0 C--N 1.347 0.493 0 C-N-CA 124.001 3.134 . . . . 0.0 111.704 -174.943 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 5' ' ' GLU . . . . . . . . . . . . . 49.6 tt0 -44.51 -44.91 8.97 Favored 'General case' 0 CA--C 1.537 0.443 0 C-N-CA 124.304 1.041 . . . . 0.0 109.277 169.847 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 6' ' ' GLN . . . . . . . . . . . . . 10.6 mt-30 -70.35 4.88 2.0 Favored 'General case' 0 CA--C 1.538 0.503 0 N-CA-C 114.364 1.246 . . . . 0.0 114.364 -179.351 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 7' ' ' LEU . . . . . . . . . . . . . 19.7 mt -125.75 -48.98 1.63 Allowed 'General case' 0 C--N 1.333 -0.123 0 C-N-CA 125.712 1.605 . . . . 0.0 110.299 -174.922 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 8' ' ' GLN . . . . . . . . . . . . . 14.4 mt-30 -58.21 -2.73 0.2 Allowed 'General case' 0 CA--C 1.54 0.573 0 C-N-CA 127.395 2.278 . . . . 0.0 115.682 -171.708 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 9' ' ' HIS . . . . . . . . . . . . . 56.3 m-70 -141.15 8.07 2.03 Favored 'General case' 0 CA--C 1.537 0.461 0 C-N-CA 125.204 1.402 . . . . 0.0 112.809 173.296 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 10' ' ' HIS . . . . . . . . . . . . . 95.8 m-70 -122.6 120.17 32.97 Favored 'General case' 0 CA--C 1.529 0.152 0 CA-C-N 119.339 0.972 . . . . 0.0 109.937 -169.798 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 11' ' ' ARG . . . . . 0.463 HH21 ' CD ' ' A' ' 30' ' ' GLU . 1.2 ttt85 -81.76 150.79 27.76 Favored 'General case' 0 CA--C 1.517 -0.317 0 C-N-CA 124.049 0.94 . . . . 0.0 111.226 -179.577 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 12' ' ' PHE . . . . . . . . . . . . . 95.7 m-85 -139.11 159.08 43.0 Favored 'General case' 0 N--CA 1.438 -1.026 0 C-N-CA 125.829 1.652 . . . . 0.0 108.634 174.539 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 13' ' ' VAL . . . . . 0.419 ' HA ' ' HA ' ' A' ' 30' ' ' GLU . 0.0 OUTLIER -136.02 140.06 44.69 Favored 'Isoleucine or valine' 0 C--N 1.312 -1.025 0 C-N-CA 128.346 2.658 . . . . 0.0 106.391 -170.236 . . . . . . . . 3 3 . 1 . 012 nuclear orig full ' A' A ' 14' ' ' LEU . . . . . . . . . . . . . 15.2 tp -77.48 77.82 4.0 Favored 'General case' 0 N--CA 1.465 0.287 0 CA-C-O 122.407 1.099 . . . . 0.0 110.376 -177.958 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 7.3 tp10 -63.79 -41.01 98.02 Favored 'General case' 0 C--N 1.324 -0.536 0 C-N-CA 127.03 2.132 . . . . 0.0 110.655 -174.241 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 2.6 p -154.78 147.55 24.39 Favored 'General case' 0 CA--C 1.535 0.365 0 N-CA-C 113.949 1.092 . . . . 0.0 113.949 167.811 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 17' ' ' VAL . . . . . . . . . . . . . 13.7 t -95.9 166.96 1.75 Allowed 'Isoleucine or valine' 0 N--CA 1.462 0.157 0 C-N-CA 125.467 1.507 . . . . 0.0 108.177 176.842 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 18' ' ' ASN . . . . . . . . . . . . . 15.0 t30 -44.8 -23.54 0.14 Allowed 'General case' 0 CA--C 1.536 0.409 0 C-N-CA 128.476 2.71 . . . . 0.0 114.857 168.846 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . -112.01 -54.88 0.48 Allowed Glycine 0 C--N 1.335 0.498 0 C-N-CA 124.256 0.932 . . . . 0.0 112.789 179.761 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -153.99 161.92 28.07 Favored Pre-proline 0 CA--C 1.533 0.3 0 C-N-CA 124.696 1.198 . . . . 0.0 108.821 -166.856 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 21' ' ' PRO . . . . . . . . . . . . . 59.4 Cg_endo -71.95 173.54 12.66 Favored 'Trans proline' 0 N--CA 1.456 -0.688 0 C-N-CA 121.772 1.648 . . . . 0.0 110.995 175.165 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 22' ' ' VAL . . . . . . . . . . . . . 3.9 t -119.9 145.38 26.25 Favored 'Isoleucine or valine' 0 C--O 1.233 0.223 0 N-CA-C 106.917 -1.512 . . . . 0.0 106.917 175.465 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 23' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -145.37 117.55 8.38 Favored 'General case' 0 C--N 1.324 -0.527 0 N-CA-C 108.112 -1.07 . . . . 0.0 108.112 172.959 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 24' ' ' SER . . . . . . . . . . . . . 70.4 p -117.2 4.24 12.65 Favored 'General case' 0 N--CA 1.462 0.169 0 O-C-N 120.971 -1.081 . . . . 0.0 112.746 175.932 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 25' ' ' ASP . . . . . . . . . . . . . 1.7 t70 62.21 -37.61 0.13 Allowed 'General case' 0 N--CA 1.475 0.791 0 C-N-CA 131.183 3.793 . . . . 0.0 114.464 -179.209 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 26' ' ' LYS . . . . . . . . . . . . . 7.0 tptp -134.98 155.45 50.73 Favored 'General case' 0 N--CA 1.438 -1.072 0 C-N-CA 128.223 2.609 . . . . 0.0 105.468 171.435 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 27' ' ' ASN . . . . . . . . . . . . . 76.6 m-20 49.13 68.07 3.88 Favored Pre-proline 0 C--N 1.325 -0.469 0 C-N-CA 126.232 1.813 . . . . 0.0 110.28 177.382 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 28' ' ' PRO . . . . . . . . . . . . . 54.7 Cg_endo -64.51 155.1 68.28 Favored 'Trans proline' 0 N--CA 1.455 -0.738 0 C-N-CA 122.559 2.172 . . . . 0.0 110.633 177.108 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 29' ' ' PRO . . . . . . . . . . . . . 30.1 Cg_endo -69.13 78.95 0.77 Allowed 'Trans proline' 0 N--CA 1.455 -0.776 0 C-N-CA 123.045 2.496 . . . . 0.0 108.841 166.155 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 30' ' ' GLU . . . . . 0.463 ' CD ' HH21 ' A' ' 11' ' ' ARG . 8.4 pt-20 -106.49 150.03 26.5 Favored 'General case' 0 C--N 1.319 -0.735 0 C-N-CA 127.66 2.384 . . . . 0.0 106.38 -178.829 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 31' ' ' ILE . . . . . . . . . . . . . 16.6 tt -132.14 144.8 36.03 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.467 0 N-CA-C 107.001 -1.481 . . . . 0.0 107.001 -173.752 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 32' ' ' SER . . . . . . . . . . . . . 65.6 p -138.5 164.69 28.76 Favored 'General case' 0 N--CA 1.447 -0.602 0 N-CA-C 107.199 -1.408 . . . . 0.0 107.199 172.71 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 33' ' ' PHE . . . . . . . . . . . . . 59.2 m-85 -125.78 163.68 22.33 Favored 'General case' 0 N--CA 1.447 -0.623 0 N-CA-C 109.018 -0.734 . . . . 0.0 109.018 176.505 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 34' ' ' GLY . . . . . . . . . . . . . . . -151.4 -171.85 19.74 Favored Glycine 0 N--CA 1.451 -0.301 0 N-CA-C 109.033 -1.627 . . . . 0.0 109.033 172.748 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 35' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -44.34 150.69 0.29 Allowed 'General case' 0 CA--C 1.531 0.24 0 C-N-CA 126.374 1.87 . . . . 0.0 111.106 -175.577 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 36' ' ' LYS . . . . . 0.419 ' HA ' ' HE3' ' A' ' 36' ' ' LYS . 0.0 OUTLIER 57.1 26.83 12.52 Favored 'General case' 0 CA--C 1.533 0.316 0 C-N-CA 124.496 1.118 . . . . 0.0 111.0 -169.486 . . . . . . . . 3 3 . 1 . 012 nuclear orig full ' A' A ' 37' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER 51.6 28.66 4.85 Favored 'General case' 0 CA--C 1.542 0.658 0 C-N-CA 125.587 1.555 . . . . 0.0 111.573 -178.126 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 38' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -57.6 141.64 47.43 Favored 'General case' 0 N--CA 1.444 -0.761 0 C-N-CA 125.536 1.534 . . . . 0.0 109.633 -179.606 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 39' ' ' ILE . . . . . . . . . . . . . 18.8 mt -112.37 126.09 69.73 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.703 0 C-N-CA 126.429 1.892 . . . . 0.0 106.504 -170.099 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 40' ' ' SER . . . . . . . . . . . . . 69.4 m -135.71 135.7 40.26 Favored 'General case' 0 C--O 1.236 0.357 0 C-N-CA 124.213 1.005 . . . . 0.0 110.749 -178.964 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 41' ' ' GLY . . . . . . . . . . . . . . . 167.88 176.87 38.8 Favored Glycine 0 CA--C 1.534 1.245 0 C-N-CA 124.139 0.876 . . . . 0.0 112.225 -174.868 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 42' ' ' SER . . . . . . . . . . . . . 39.9 t -147.52 109.19 4.38 Favored 'General case' 0 N--CA 1.445 -0.725 0 C-N-CA 126.761 2.024 . . . . 0.0 107.901 169.873 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 43' ' ' MET . . . . . . . . . . . . . 11.8 mmt -62.17 -45.03 95.22 Favored 'General case' 0 C--O 1.222 -0.361 0 C-N-CA 120.603 -0.439 . . . . 0.0 110.804 164.339 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 44' ' ' CYS . . . . . 1.304 ' SG ' ' SG ' ' A' ' 70' ' ' CYS . 2.7 t -157.27 -60.87 0.09 Allowed 'General case' 0 CA--C 1.513 -0.444 0 N-CA-C 105.022 -2.214 . . . . 0.0 105.022 -172.32 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 45' ' ' ASN . . . . . . . . . . . . . 1.9 m-20 -101.34 12.85 36.69 Favored 'General case' 0 C--N 1.328 -0.328 0 C-N-CA 125.53 1.532 . . . . 0.0 114.746 -164.541 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 46' ' ' ARG . . . . . . . . . . . . . 18.1 mmm-85 61.38 152.26 0.03 OUTLIER 'General case' 0 C--O 1.218 -0.56 0 C-N-CA 128.191 2.596 . . . . 0.0 112.979 -164.512 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 47' ' ' PHE . . . . . . . . . . . . . 2.9 p90 -158.38 170.86 21.28 Favored 'General case' 0 CA--C 1.515 -0.401 0 C-N-CA 124.62 1.168 . . . . 0.0 107.919 169.639 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 48' ' ' SER . . . . . . . . . . . . . 19.4 m -160.62 163.34 32.67 Favored 'General case' 0 C--N 1.317 -0.824 0 N-CA-C 106.128 -1.804 . . . . 0.0 106.128 179.616 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 49' ' ' GLY . . . . . . . . . . . . . . . -175.91 170.07 42.9 Favored Glycine 0 N--CA 1.445 -0.755 0 CA-C-N 120.532 1.515 . . . . 0.0 110.739 155.487 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 50' ' ' GLU . . . . . . . . . . . . . 27.0 tt0 -74.17 111.68 9.57 Favored 'General case' 0 N--CA 1.441 -0.88 0 N-CA-C 107.266 -1.383 . . . . 0.0 107.266 162.79 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 51' ' ' GLY . . . . . . . . . . . . . . . -82.24 179.93 53.04 Favored Glycine 0 CA--C 1.536 1.377 0 C-N-CA 123.765 0.698 . . . . 0.0 112.927 158.317 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 52' ' ' LYS . . . . . . . . . . . . . 37.9 tttt -162.74 156.83 20.85 Favored 'General case' 0 N--CA 1.473 0.714 0 C-N-CA 126.554 1.941 . . . . 0.0 107.689 168.304 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 53' ' ' LEU . . . . . . . . . . . . . 1.2 tm? -123.89 115.47 21.35 Favored 'General case' 0 C--O 1.234 0.283 0 C-N-CA 124.143 0.977 . . . . 0.0 109.044 176.411 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 28.5 t -134.92 -54.25 0.81 Allowed 'General case' 0 CA--C 1.534 0.365 0 CA-C-O 118.429 -0.796 . . . . 0.0 111.19 175.541 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 55' ' ' ASN . . . . . . . . . . . . . 4.7 p30 -110.6 13.07 22.64 Favored 'General case' 0 N--CA 1.475 0.781 0 N-CA-C 113.55 0.944 . . . . 0.0 113.55 -178.237 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 56' ' ' GLY . . . . . . . . . . . . . . . 91.18 4.86 68.25 Favored Glycine 0 CA--C 1.528 0.887 0 C-N-CA 124.283 0.944 . . . . 0.0 111.911 -172.653 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 57' ' ' GLU . . . . . . . . . . . . . 39.5 tt0 -113.97 109.36 18.36 Favored 'General case' 0 N--CA 1.451 -0.394 0 C-N-CA 124.513 1.125 . . . . 0.0 108.672 -166.13 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 58' ' ' LEU . . . . . . . . . . . . . 35.7 tp -80.42 95.97 6.58 Favored 'General case' 0 N--CA 1.454 -0.257 0 C-N-CA 124.571 1.148 . . . . 0.0 109.074 173.609 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 59' ' ' THR . . . . . . . . . . . . . 1.2 p -95.11 146.86 24.0 Favored 'General case' 0 C--O 1.238 0.461 0 C-N-CA 123.749 0.82 . . . . 0.0 109.805 168.281 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 60' ' ' ALA . . . . . . . . . . . . . . . -68.84 170.28 9.9 Favored 'General case' 0 CA--C 1.537 0.477 0 CA-C-O 121.912 0.863 . . . . 0.0 110.955 163.931 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 61' ' ' LYS . . . . . . . . . . . . . 23.6 tttt -155.02 -9.76 0.12 Allowed 'General case' 0 CA--C 1.535 0.402 0 C-N-CA 128.191 2.596 . . . . 0.0 112.231 179.685 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 62' ' ' GLY . . . . . . . . . . . . . . . 171.03 77.34 0.04 OUTLIER Glycine 0 C--N 1.334 0.464 0 N-CA-C 106.279 -2.728 . . . . 0.0 106.279 -172.827 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 63' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -115.32 146.98 41.0 Favored 'General case' 0 N--CA 1.449 -0.512 0 C-N-CA 124.963 1.305 . . . . 0.0 109.326 -171.915 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 64' ' ' ALA . . . . . . . . . . . . . . . -120.87 167.13 12.87 Favored 'General case' 0 N--CA 1.45 -0.472 0 C-N-CA 125.025 1.33 . . . . 0.0 109.226 -175.01 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 65' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -150.85 -178.66 6.71 Favored 'General case' 0 C--O 1.238 0.456 0 C-N-CA 126.327 1.851 . . . . 0.0 107.223 171.354 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 66' ' ' THR . . . . . . . . . . . . . 4.0 p -129.83 179.53 5.79 Favored 'General case' 0 CA--C 1.538 0.515 0 CA-C-N 119.181 0.9 . . . . 0.0 110.206 164.268 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 67' ' ' ARG . . . . . . . . . . . . . 10.0 mmt85 -127.55 81.29 2.01 Favored 'General case' 0 CA--C 1.529 0.152 0 C-N-CA 125.953 1.701 . . . . 0.0 108.088 179.599 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 68' ' ' MET . . . . . . . . . . . . . 61.5 mtm -118.06 -174.4 2.64 Favored 'General case' 0 CA--C 1.538 0.501 0 C-N-CA 129.242 3.017 . . . . 0.0 109.389 170.933 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 69' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -104.69 173.1 6.45 Favored 'General case' 0 N--CA 1.465 0.284 0 C-N-CA 127.821 2.448 . . . . 0.0 108.709 168.244 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 70' ' ' CYS . . . . . 1.304 ' SG ' ' SG ' ' A' ' 44' ' ' CYS . 68.1 m -142.53 150.01 39.86 Favored 'General case' 0 C--O 1.233 0.214 0 C-N-CA 123.87 0.868 . . . . 0.0 110.265 174.854 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 71' ' ' ALA . . . . . . . . . . . . . . . -84.3 36.7 0.59 Allowed 'General case' 0 CA--C 1.538 0.489 0 C-N-CA 124.149 0.98 . . . . 0.0 111.398 179.074 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 72' ' ' ASN . . . . . . . . . . . . . 4.0 t30 -166.6 150.15 6.52 Favored Pre-proline 0 N--CA 1.465 0.324 0 C-N-CA 124.298 1.039 . . . . 0.0 108.821 159.302 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 73' ' ' PRO . . . . . . . . . . . . . 96.2 Cg_endo -84.2 -33.64 0.3 Allowed 'Trans proline' 0 N--CA 1.461 -0.424 0 C-N-CA 122.352 2.035 . . . . 0.0 113.288 -171.128 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 74' ' ' GLN . . . . . . . . . . . . . 43.2 tt0 -60.88 -37.4 82.06 Favored 'General case' 0 N--CA 1.465 0.317 0 O-C-N 121.671 -0.643 . . . . 0.0 111.541 -175.644 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 75' ' ' LEU . . . . . . . . . . . . . 50.2 mt -53.58 -43.61 68.67 Favored 'General case' 0 CA--C 1.535 0.382 0 C-N-CA 124.968 1.307 . . . . 0.0 108.678 173.186 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 76' ' ' ASN . . . . . . . . . . . . . 0.7 OUTLIER -77.85 5.07 10.33 Favored 'General case' 0 N--CA 1.47 0.528 0 C-N-CA 128.137 2.575 . . . . 0.0 112.4 -174.518 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 77' ' ' GLU . . . . . . . . . . . . . 0.2 OUTLIER -101.72 -46.02 5.06 Favored 'General case' 0 CA--C 1.535 0.394 0 C-N-CA 126.754 2.021 . . . . 0.0 107.79 168.901 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 78' ' ' LEU . . . . . . . . . . . . . 15.3 mt -65.41 -29.03 69.68 Favored 'General case' 0 CA--C 1.53 0.202 0 C-N-CA 124.977 1.311 . . . . 0.0 111.284 176.937 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 79' ' ' ASP . . . . . . . . . . . . . 0.0 OUTLIER -61.56 -6.48 2.47 Favored 'General case' 0 N--CA 1.469 0.498 0 C-N-CA 126.463 1.905 . . . . 0.0 114.467 168.835 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 80' ' ' ASN . . . . . . . . . . . . . 85.6 m-20 -106.95 -40.31 5.5 Favored 'General case' 0 CA--C 1.531 0.242 0 C-N-CA 124.614 1.166 . . . . 0.0 111.223 164.345 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 81' ' ' THR . . . . . . . . . . . . . 6.9 m -55.43 -65.02 0.66 Allowed 'General case' 0 C--N 1.347 0.493 0 CA-C-N 119.997 1.271 . . . . 0.0 111.524 -176.689 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 82' ' ' ILE . . . . . . . . . . . . . 9.4 tp -60.43 -37.08 73.36 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.297 0 CA-C-N 119.324 0.965 . . . . 0.0 110.345 -168.455 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 83' ' ' SER . . . . . . . . . . . . . 4.4 m -58.17 -46.82 85.05 Favored 'General case' 0 N--CA 1.446 -0.64 0 C-N-CA 124.891 1.276 . . . . 0.0 110.156 -178.857 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 84' ' ' GLU . . . . . . . . . . . . . 29.3 tt0 -76.8 -41.27 45.14 Favored 'General case' 0 N--CA 1.445 -0.704 0 C-N-CA 126.023 1.729 . . . . 0.0 110.368 -176.781 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 85' ' ' MET . . . . . . . . . . . . . 6.3 ptm -66.74 -40.28 88.27 Favored 'General case' 0 CA--C 1.516 -0.357 0 C-N-CA 123.923 0.889 . . . . 0.0 108.614 -176.59 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 86' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -71.32 -31.54 67.52 Favored 'General case' 0 N--CA 1.447 -0.577 0 C-N-CA 118.292 -1.363 . . . . 0.0 111.696 -171.138 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 87' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -55.92 -49.89 72.23 Favored 'General case' 0 N--CA 1.45 -0.468 0 N-CA-C 107.859 -1.163 . . . . 0.0 107.859 177.953 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 88' ' ' GLU . . . . . . . . . . . . . 28.0 mt-10 -69.12 -26.58 64.97 Favored 'General case' 0 N--CA 1.445 -0.699 0 CA-C-O 117.235 -1.364 . . . . 0.0 112.544 174.978 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 89' ' ' GLY . . . . . . . . . . . . . . . 94.25 104.23 1.81 Allowed Glycine 0 CA--C 1.499 -0.935 0 CA-C-N 120.474 1.488 . . . . 0.0 109.395 -171.865 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 90' ' ' ALA . . . . . . . . . . . . . . . -80.22 136.04 36.38 Favored 'General case' 0 N--CA 1.445 -0.724 0 N-CA-C 108.668 -0.864 . . . . 0.0 108.668 173.346 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 91' ' ' GLN . . . . . . . . . . . . . 86.3 mm-40 -65.89 138.54 57.93 Favored 'General case' 0 N--CA 1.448 -0.57 0 N-CA-C 106.205 -1.776 . . . . 0.0 106.205 163.558 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 92' ' ' VAL . . . . . . . . . . . . . 76.1 t -131.62 119.8 43.42 Favored 'Isoleucine or valine' 0 N--CA 1.445 -0.692 0 N-CA-C 105.746 -1.946 . . . . 0.0 105.746 -178.975 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 93' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -136.62 94.67 3.02 Favored 'General case' 0 N--CA 1.446 -0.629 0 CA-C-O 122.62 1.2 . . . . 0.0 108.796 170.589 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 94' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -65.93 108.73 2.27 Favored 'General case' 0 N--CA 1.446 -0.656 0 N-CA-C 106.661 -1.607 . . . . 0.0 106.661 165.85 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 95' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -71.21 -178.32 2.0 Allowed 'General case' 0 C--N 1.317 -0.811 0 C-N-CA 126.286 1.834 . . . . 0.0 106.862 168.987 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 96' ' ' ALA . . . . . . . . . . . . . . . -44.93 -34.22 2.31 Favored 'General case' 0 CA--C 1.542 0.668 0 N-CA-C 114.328 1.233 . . . . 0.0 114.328 -179.432 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 97' ' ' ASN . . . . . . . . . . . . . 14.2 p30 -152.02 22.43 0.67 Allowed 'General case' 0 N--CA 1.47 0.547 0 N-CA-C 114.459 1.281 . . . . 0.0 114.459 170.788 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 98' ' ' GLN . . . . . . . . . . . . . 1.5 tt0 -141.3 119.27 11.92 Favored 'General case' 0 N--CA 1.465 0.323 0 O-C-N 120.716 -1.24 . . . . 0.0 111.192 -175.56 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 99' ' ' LEU . . . . . . . . . . . . . 8.5 tp -70.85 107.29 3.95 Favored 'General case' 0 C--O 1.237 0.408 0 C-N-CA 126.957 2.103 . . . . 0.0 108.489 177.675 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 100' ' ' THR . . . . . . . . . . . . . 3.2 m -88.37 117.29 27.19 Favored 'General case' 0 C--N 1.327 -0.371 0 N-CA-C 106.0 -1.852 . . . . 0.0 106.0 172.778 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 101' ' ' LEU . . . . . . . . . . . . . 1.1 mm? -110.09 147.67 33.19 Favored 'General case' 0 CA--C 1.515 -0.367 0 N-CA-C 108.822 -0.807 . . . . 0.0 108.822 171.424 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 102' ' ' ALA . . . . . . . . . . . . . . . -149.09 161.27 42.29 Favored 'General case' 0 CA--C 1.53 0.209 0 C-N-CA 124.023 0.929 . . . . 0.0 109.654 166.289 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 103' ' ' THR . . . . . . . . . . . . . 1.6 p -147.7 177.19 9.49 Favored 'General case' 0 C--N 1.327 -0.385 0 C-N-CA 127.76 2.424 . . . . 0.0 107.358 159.682 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 104' ' ' ALA . . . . . . . . . . . . . . . -56.11 -25.04 44.18 Favored 'General case' 0 CA--C 1.534 0.334 0 CA-C-O 118.796 -0.621 . . . . 0.0 112.532 162.258 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 105' ' ' LYS . . . . . . . . . . . . . 24.5 mmtt -71.3 -82.41 0.04 OUTLIER 'General case' 0 N--CA 1.456 -0.141 0 C-N-CA 123.476 0.71 . . . . 0.0 109.392 170.835 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 106' ' ' GLN . . . . . . . . . . . . . 14.7 pt20 -156.29 176.6 12.47 Favored 'General case' 0 C--O 1.236 0.358 0 CA-C-O 121.401 0.619 . . . . 0.0 112.635 -171.057 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 107' ' ' THR . . . . . . . . . . . . . 0.8 OUTLIER -120.78 134.99 55.27 Favored 'General case' 0 C--O 1.232 0.172 0 C-N-CA 127.775 2.43 . . . . 0.0 108.848 -168.288 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 108' ' ' LEU . . . . . . . . . . . . . 2.4 mm? -117.29 151.22 37.41 Favored 'General case' 0 C--O 1.236 0.383 0 N-CA-C 107.843 -1.169 . . . . 0.0 107.843 176.904 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 109' ' ' THR . . . . . . . . . . . . . 0.1 OUTLIER -119.29 107.48 13.45 Favored 'General case' 0 C--N 1.324 -0.503 0 N-CA-C 103.564 -2.754 . . . . 0.0 103.564 179.614 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 110' ' ' TYR . . . . . . . . . . . . . 67.1 m-85 -110.77 134.05 52.82 Favored 'General case' 0 N--CA 1.447 -0.611 0 N-CA-C 108.645 -0.872 . . . . 0.0 108.645 173.555 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 111' ' ' LYS . . . . . . . . . . . . . 2.5 tmtt? -94.21 142.63 27.18 Favored 'General case' 0 C--N 1.322 -0.628 0 N-CA-C 108.246 -1.02 . . . . 0.0 108.246 -178.387 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 112' ' ' LEU . . . . . . . . . . . . . 56.8 tp -66.27 105.74 1.5 Allowed 'General case' 0 C--N 1.329 -0.31 0 N-CA-C 107.547 -1.279 . . . . 0.0 107.547 169.064 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 113' ' ' ALA . . . . . . . . . . . . . . . -137.72 98.38 3.66 Favored 'General case' 0 CA--C 1.516 -0.353 0 N-CA-C 107.038 -1.467 . . . . 0.0 107.038 177.846 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 114' ' ' ASP . . . . . 0.475 ' C ' ' H ' ' A' ' 116' ' ' MET . 30.9 t0 -96.65 44.61 1.06 Allowed 'General case' 0 C--N 1.325 -0.494 0 CA-C-O 123.67 1.7 . . . . 0.0 111.244 -169.115 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 115' ' ' LEU . . . . . . . . . . . . . 13.2 mt -70.37 8.38 0.82 Allowed 'General case' 0 N--CA 1.451 -0.406 0 C-N-CA 129.235 3.014 . . . . 0.0 111.23 -176.065 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 116' ' ' MET . . . . . 0.475 ' H ' ' C ' ' A' ' 114' ' ' ASP . 0.0 OUTLIER -54.28 -34.79 61.64 Favored 'General case' 0 N--CA 1.454 -0.23 0 C-N-CA 124.747 1.219 . . . . 0.0 113.36 -158.029 . . . . . . . . 3 3 . 1 . 012 nuclear orig full ' A' A ' 117' ' ' ASN . . . . . . . . . . . . . 50.1 t-20 . . . . . 0 C--O 1.238 0.479 0 C-N-CA 125.111 1.365 . . . . 0.0 110.637 -171.241 . . . . . . . . 0 0 . 1 . 013 nuclear orig full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 18.9 ttt . . . . . 0 C--O 1.236 0.385 0 N-CA-C 109.311 -0.626 . . . . 0.0 109.311 . . . . . . . . . 0 0 . 1 . 013 nuclear orig full ' A' A ' 2' ' ' VAL . . . . . . . . . . . . . 7.5 p -55.12 129.51 16.48 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.439 0 N-CA-C 109.397 -0.594 . . . . 0.0 109.397 175.78 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 3' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -122.64 159.93 50.93 Favored Pre-proline 0 N--CA 1.449 -0.487 0 N-CA-C 109.867 -0.42 . . . . 0.0 109.867 -179.164 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 4' ' ' PRO . . . . . . . . . . . . . 36.6 Cg_endo -70.67 -37.03 7.47 Favored 'Trans proline' 0 N--CA 1.464 -0.262 0 C-N-CA 122.472 2.115 . . . . 0.0 112.799 -173.757 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 5' ' ' GLU . . . . . 0.418 ' C ' ' H ' ' A' ' 7' ' ' LEU . 0.0 OUTLIER -57.84 -54.17 49.97 Favored 'General case' 0 C--N 1.328 -0.365 0 C-N-CA 125.788 1.635 . . . . 0.0 109.67 -179.289 . . . . . . . . 3 3 . 1 . 013 nuclear orig full ' A' A ' 6' ' ' GLN . . . . . . . . . . . . . 12.6 pt20 -67.02 25.34 0.02 OUTLIER 'General case' 0 CA--C 1.545 0.772 0 C-N-CA 126.24 1.816 . . . . 0.0 114.779 177.917 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 7' ' ' LEU . . . . . 0.418 ' H ' ' C ' ' A' ' 5' ' ' GLU . 97.4 mt -141.74 -49.41 0.39 Allowed 'General case' 0 N--CA 1.451 -0.398 0 C-N-CA 127.249 2.219 . . . . 0.0 108.869 -177.761 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 8' ' ' GLN . . . . . . . . . . . . . 0.1 OUTLIER -46.94 -6.3 0.01 OUTLIER 'General case' 0 N--CA 1.471 0.623 0 C-N-CA 130.119 3.367 . . . . 0.0 118.215 -177.914 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 9' ' ' HIS . . . . . . . . . . . . . 32.0 p80 -145.77 10.84 1.22 Allowed 'General case' 0 C--N 1.325 -0.463 0 CA-C-N 119.641 1.109 . . . . 0.0 112.972 174.798 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 10' ' ' HIS . . . . . . . . . . . . . 32.0 m-70 -100.69 163.96 12.09 Favored 'General case' 0 C--O 1.238 0.489 0 C-N-CA 123.711 0.804 . . . . 0.0 109.733 -176.631 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 11' ' ' ARG . . . . . 0.428 HH21 ' CD ' ' A' ' 30' ' ' GLU . 4.4 ttt85 -126.96 145.69 50.6 Favored 'General case' 0 CA--C 1.514 -0.407 0 C-N-CA 125.456 1.502 . . . . 0.0 107.811 173.184 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 12' ' ' PHE . . . . . . . . . . . . . 42.4 m-85 -136.21 148.13 47.96 Favored 'General case' 0 N--CA 1.445 -0.724 0 N-CA-C 105.717 -1.957 . . . . 0.0 105.717 179.478 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 13' ' ' VAL . . . . . . . . . . . . . 2.5 t -122.2 148.99 25.55 Favored 'Isoleucine or valine' 0 C--O 1.24 0.583 0 C-N-CA 125.413 1.485 . . . . 0.0 108.492 178.981 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 14' ' ' LEU . . . . . . . . . . . . . 7.5 tp -77.37 80.74 3.86 Favored 'General case' 0 N--CA 1.447 -0.596 0 O-C-N 124.418 1.074 . . . . 0.0 109.835 -178.471 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -61.08 -34.97 75.77 Favored 'General case' 0 CA--C 1.534 0.341 0 C-N-CA 123.969 0.908 . . . . 0.0 110.047 -179.961 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 3.2 m -165.83 143.69 5.71 Favored 'General case' 0 CA--C 1.535 0.373 0 O-C-N 121.35 -0.844 . . . . 0.0 111.717 176.368 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 17' ' ' VAL . . . . . . . . . . . . . 2.8 t -97.31 161.13 2.86 Favored 'Isoleucine or valine' 0 CA--C 1.542 0.644 0 C-N-CA 126.396 1.878 . . . . 0.0 108.25 -177.371 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 18' ' ' ASN . . . . . . . . . . . . . 19.9 t30 -51.85 -32.12 30.67 Favored 'General case' 0 N--CA 1.473 0.692 0 C-N-CA 123.438 0.695 . . . . 0.0 112.416 167.4 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . -78.66 -54.48 4.23 Favored Glycine 0 N--CA 1.445 -0.736 0 CA-C-O 119.039 -0.867 . . . . 0.0 111.842 -178.36 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 8.5 mtmt -168.87 166.35 6.49 Favored Pre-proline 0 N--CA 1.466 0.331 0 C-N-CA 126.709 2.003 . . . . 0.0 110.444 -168.703 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 21' ' ' PRO . . . . . . . . . . . . . 36.3 Cg_endo -58.29 161.93 12.98 Favored 'Trans proline' 0 N--CA 1.457 -0.648 0 C-N-CA 121.57 1.514 . . . . 0.0 111.151 163.572 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 22' ' ' VAL . . . . . . . . . . . . . 11.6 p -141.7 127.9 19.25 Favored 'Isoleucine or valine' 0 CA--C 1.529 0.162 0 C-N-CA 124.014 0.926 . . . . 0.0 108.677 175.267 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 23' ' ' THR . . . . . . . . . . . . . 0.6 OUTLIER -136.41 130.94 33.47 Favored 'General case' 0 N--CA 1.451 -0.377 0 N-CA-C 106.678 -1.601 . . . . 0.0 106.678 171.842 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 24' ' ' SER . . . . . . . . . . . . . 0.5 OUTLIER -126.74 67.59 1.25 Allowed 'General case' 0 N--CA 1.453 -0.315 0 N-CA-C 106.886 -1.524 . . . . 0.0 106.886 178.673 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 25' ' ' ASP . . . . . . . . . . . . . 2.0 t70 65.38 -70.69 0.09 Allowed 'General case' 0 C--O 1.233 0.2 0 C-N-CA 128.772 2.829 . . . . 0.0 113.878 173.003 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 26' ' ' LYS . . . . . . . . . . . . . 16.1 ttmt -145.88 -7.86 0.56 Allowed 'General case' 0 CA--C 1.531 0.217 0 C-N-CA 126.414 1.886 . . . . 0.0 111.928 175.07 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 27' ' ' ASN . . . . . . . . . . . . . 80.0 m-20 -124.18 73.33 57.64 Favored Pre-proline 0 C--O 1.232 0.135 0 C-N-CA 124.607 1.163 . . . . 0.0 108.424 -174.303 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 28' ' ' PRO . . . . . . . . . . . . . 55.5 Cg_endo -69.72 173.21 11.27 Favored 'Trans proline' 0 N--CA 1.457 -0.645 0 C-N-CA 123.259 2.639 . . . . 0.0 112.728 179.115 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 29' ' ' PRO . . . . . . . . . . . . . 34.8 Cg_endo -65.7 64.83 0.4 Allowed 'Trans proline' 0 CA--C 1.537 0.637 0 C-N-CA 125.145 3.897 . . . . 0.0 112.301 166.517 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 30' ' ' GLU . . . . . 0.428 ' CD ' HH21 ' A' ' 11' ' ' ARG . 4.5 pt-20 -79.99 169.68 17.52 Favored 'General case' 0 CA--C 1.538 0.489 0 O-C-N 120.592 -1.318 . . . . 0.0 110.218 175.203 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 31' ' ' ILE . . . . . . . . . . . . . 9.1 tt -145.48 143.5 21.84 Favored 'Isoleucine or valine' 0 C--O 1.238 0.45 0 N-CA-C 106.676 -1.602 . . . . 0.0 106.676 -179.058 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 32' ' ' SER . . . . . . . . . . . . . 80.4 p -140.08 150.5 44.41 Favored 'General case' 0 C--O 1.236 0.368 0 N-CA-C 108.762 -0.829 . . . . 0.0 108.762 174.139 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 33' ' ' PHE . . . . . . . . . . . . . 9.0 m-30 -127.66 133.11 49.63 Favored 'General case' 0 CA--C 1.535 0.385 0 C-N-CA 127.063 2.145 . . . . 0.0 105.237 -169.669 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 34' ' ' GLY . . . . . . . . . . . . . . . -112.43 -166.74 17.34 Favored Glycine 0 N--CA 1.471 0.999 0 C-N-CA 124.761 1.172 . . . . 0.0 111.642 -179.371 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 35' ' ' GLU . . . . . . . . . . . . . 16.8 tt0 -69.93 32.67 0.04 OUTLIER 'General case' 0 CA--C 1.546 0.823 0 C-N-CA 127.931 2.492 . . . . 0.0 116.143 -164.802 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 1.1 mmtm -157.16 10.98 0.21 Allowed 'General case' 0 N--CA 1.44 -0.959 0 C-N-CA 127.919 2.488 . . . . 0.0 116.609 -166.209 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 37' ' ' MET . . . . . . . . . . . . . 41.1 mmm 53.66 21.02 2.4 Favored 'General case' 0 CA--C 1.555 1.153 0 CA-C-N 120.129 1.332 . . . . 0.0 112.106 -161.576 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 38' ' ' MET . . . . . . . . . . . . . 11.0 mmm -69.76 165.6 21.05 Favored 'General case' 0 C--O 1.227 -0.127 0 O-C-N 120.178 -1.576 . . . . 0.0 110.979 177.765 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 39' ' ' ILE . . . . . . . . . . . . . 58.5 mt -137.27 138.03 45.66 Favored 'Isoleucine or valine' 0 C--O 1.237 0.411 0 O-C-N 121.85 -0.531 . . . . 0.0 109.749 -176.401 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 40' ' ' SER . . . . . . . . . . . . . 9.3 p -143.85 118.52 9.81 Favored 'General case' 0 CA--C 1.539 0.55 0 C-N-CA 125.194 1.398 . . . . 0.0 109.465 171.728 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 41' ' ' GLY . . . . . . . . . . . . . . . -157.48 -173.93 26.53 Favored Glycine 0 CA--C 1.533 1.187 0 C-N-CA 125.169 1.366 . . . . 0.0 111.138 178.114 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 42' ' ' SER . . . . . . . . . . . . . 74.0 p -157.39 94.2 1.36 Allowed 'General case' 0 C--O 1.223 -0.297 0 C-N-CA 124.208 1.003 . . . . 0.0 110.311 178.754 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 43' ' ' MET . . . . . . . . . . . . . 2.2 mmt -67.01 -40.98 87.4 Favored 'General case' 0 CA--C 1.534 0.331 0 CA-C-O 120.978 0.418 . . . . 0.0 110.868 176.622 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 44' ' ' CYS . . . . . 1.285 ' SG ' ' SG ' ' A' ' 70' ' ' CYS . 33.1 t -151.12 -63.24 0.19 Allowed 'General case' 0 N--CA 1.448 -0.554 0 N-CA-C 104.808 -2.293 . . . . 0.0 104.808 158.457 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 45' ' ' ASN . . . . . . . . . . . . . 71.4 m-20 -83.67 30.0 0.51 Allowed 'General case' 0 CA--C 1.528 0.134 0 C-N-CA 126.47 1.908 . . . . 0.0 114.328 -168.798 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 46' ' ' ARG . . . . . . . . . . . . . 61.7 mtt180 59.25 167.56 0.06 Allowed 'General case' 0 N--CA 1.472 0.649 0 C-N-CA 126.117 1.767 . . . . 0.0 110.965 -171.668 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 47' ' ' PHE . . . . . . . . . . . . . 34.8 p90 -159.31 167.2 29.49 Favored 'General case' 0 C--O 1.239 0.55 0 N-CA-C 108.506 -0.924 . . . . 0.0 108.506 154.122 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 48' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -162.1 137.03 7.07 Favored 'General case' 0 C--O 1.238 0.48 0 N-CA-C 108.352 -0.981 . . . . 0.0 108.352 177.529 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 49' ' ' GLY . . . . . . . . . . . . . . . -170.9 162.48 35.43 Favored Glycine 0 C--N 1.339 0.703 0 N-CA-C 110.209 -1.157 . . . . 0.0 110.209 172.152 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 50' ' ' GLU . . . . . . . . . . . . . 40.3 mt-10 -74.13 101.33 3.9 Favored 'General case' 0 C--O 1.237 0.407 0 C-N-CA 124.323 1.049 . . . . 0.0 108.442 170.258 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 51' ' ' GLY . . . . . . . . . . . . . . . -68.63 -179.46 19.4 Favored Glycine 0 CA--C 1.535 1.341 0 C-N-CA 123.542 0.592 . . . . 0.0 112.561 164.269 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 52' ' ' LYS . . . . . . . . . . . . . 13.9 ttmt -156.0 161.26 40.5 Favored 'General case' 0 CA--C 1.535 0.373 0 C-N-CA 126.373 1.869 . . . . 0.0 108.835 176.257 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 53' ' ' LEU . . . . . . . . . . . . . 1.2 tm? -146.67 129.59 16.32 Favored 'General case' 0 CA--C 1.519 -0.214 0 N-CA-C 105.597 -2.001 . . . . 0.0 105.597 174.162 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 2.2 t -152.25 -33.84 0.13 Allowed 'General case' 0 CA--C 1.536 0.426 0 CA-C-N 117.642 0.201 . . . . 0.0 111.258 162.9 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 55' ' ' ASN . . . . . . . . . . . . . 20.0 p-10 -131.33 31.15 4.4 Favored 'General case' 0 CA--C 1.534 0.36 0 C-N-CA 128.052 2.541 . . . . 0.0 111.2 -164.761 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 56' ' ' GLY . . . . . . . . . . . . . . . 60.56 31.65 75.51 Favored Glycine 0 CA--C 1.532 1.1 0 O-C-N 121.591 -0.693 . . . . 0.0 111.645 -176.72 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 57' ' ' GLU . . . . . . . . . . . . . 33.5 tt0 -134.15 139.6 45.98 Favored 'General case' 0 C--O 1.237 0.426 0 N-CA-C 107.631 -1.248 . . . . 0.0 107.631 177.528 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 58' ' ' LEU . . . . . . . . . . . . . 56.6 tp -120.59 95.92 4.92 Favored 'General case' 0 CA--C 1.534 0.349 0 C-N-CA 127.806 2.442 . . . . 0.0 108.843 -176.198 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 59' ' ' THR . . . . . . . . . . . . . 15.6 p -98.48 137.61 36.91 Favored 'General case' 0 C--O 1.237 0.434 0 C-N-CA 124.982 1.313 . . . . 0.0 110.671 174.719 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 60' ' ' ALA . . . . . . . . . . . . . . . -123.32 85.46 2.42 Favored 'General case' 0 CA--C 1.536 0.411 0 C-N-CA 125.145 1.378 . . . . 0.0 111.476 171.888 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 61' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -53.19 -15.45 0.91 Allowed 'General case' 0 N--CA 1.455 -0.189 0 C-N-CA 128.82 2.848 . . . . 0.0 117.151 -178.903 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 62' ' ' GLY . . . . . . . . . . . . . . . -148.8 45.66 0.7 Allowed Glycine 0 CA--C 1.52 0.392 0 C-N-CA 124.734 1.159 . . . . 0.0 110.985 -174.379 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 63' ' ' LEU . . . . . . . . . . . . . 9.3 tp -55.91 139.82 44.85 Favored 'General case' 0 N--CA 1.446 -0.649 0 N-CA-C 108.831 -0.803 . . . . 0.0 108.831 168.171 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 64' ' ' ALA . . . . . . . . . . . . . . . -127.13 162.02 27.1 Favored 'General case' 0 C--N 1.327 -0.373 0 N-CA-C 108.17 -1.048 . . . . 0.0 108.17 166.35 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 65' ' ' MET . . . . . . . . . . . . . 0.1 OUTLIER -150.5 177.09 10.34 Favored 'General case' 0 CA--C 1.538 0.507 0 C-N-CA 126.468 1.907 . . . . 0.0 108.591 -175.571 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 66' ' ' THR . . . . . . . . . . . . . 25.4 p -118.0 -178.21 3.45 Favored 'General case' 0 N--CA 1.469 0.524 0 C-N-CA 125.141 1.376 . . . . 0.0 111.12 -178.401 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 67' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -126.2 87.27 2.65 Favored 'General case' 0 C--O 1.236 0.353 0 C-N-CA 123.858 0.863 . . . . 0.0 110.477 172.955 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 68' ' ' MET . . . . . . . . . . . . . 37.0 mtm -132.16 -166.13 1.69 Allowed 'General case' 0 CA--C 1.537 0.471 0 C-N-CA 128.161 2.584 . . . . 0.0 108.534 174.424 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 69' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -145.57 173.95 11.6 Favored 'General case' 0 CA--C 1.539 0.531 0 C-N-CA 125.183 1.393 . . . . 0.0 109.645 174.692 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 70' ' ' CYS . . . . . 1.285 ' SG ' ' SG ' ' A' ' 44' ' ' CYS . 73.0 m -130.48 14.08 5.5 Favored 'General case' 0 C--O 1.234 0.284 0 N-CA-C 114.174 1.176 . . . . 0.0 114.174 -172.707 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 71' ' ' ALA . . . . . . . . . . . . . . . 60.8 10.4 2.68 Favored 'General case' 0 CA--C 1.534 0.338 0 C-N-CA 124.943 1.297 . . . . 0.0 113.271 178.419 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 72' ' ' ASN . . . . . . . . . . . . . 0.2 OUTLIER -133.46 164.96 40.25 Favored Pre-proline 0 CA--C 1.547 0.828 0 C-N-CA 125.213 1.405 . . . . 0.0 107.26 168.667 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 73' ' ' PRO . . . . . . . . . . . . . 60.7 Cg_endo -82.25 -45.91 0.07 OUTLIER 'Trans proline' 0 N--CA 1.46 -0.454 0 C-N-CA 123.71 2.94 . . . . 0.0 111.917 175.157 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 74' ' ' GLN . . . . . . . . . . . . . 58.7 tt0 -47.95 -53.93 14.43 Favored 'General case' 0 C--O 1.223 -0.29 0 C-N-CA 126.394 1.878 . . . . 0.0 110.615 -171.55 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 75' ' ' LEU . . . . . . . . . . . . . 55.0 mt -60.28 -37.18 79.67 Favored 'General case' 0 CA--C 1.535 0.403 0 C-N-CA 125.764 1.626 . . . . 0.0 110.875 -178.567 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 76' ' ' ASN . . . . . . . . . . . . . 1.7 t-20 -73.03 -4.68 33.95 Favored 'General case' 0 N--CA 1.469 0.483 0 C-N-CA 126.198 1.799 . . . . 0.0 111.938 177.926 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 77' ' ' GLU . . . . . . . . . . . . . 1.0 OUTLIER -113.65 -24.4 9.22 Favored 'General case' 0 CA--C 1.535 0.394 0 C-N-CA 125.265 1.426 . . . . 0.0 110.439 170.609 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 78' ' ' LEU . . . . . . . . . . . . . 6.2 mp -63.99 -36.66 84.7 Favored 'General case' 0 N--CA 1.464 0.253 0 O-C-N 120.842 -1.161 . . . . 0.0 109.861 170.453 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 79' ' ' ASP . . . . . . . . . . . . . 0.0 OUTLIER -56.95 -32.69 66.27 Favored 'General case' 0 CA--C 1.53 0.182 0 C-N-CA 123.816 0.846 . . . . 0.0 111.38 173.958 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 80' ' ' ASN . . . . . . . . . . . . . 12.2 m-20 -91.22 -28.57 17.73 Favored 'General case' 0 N--CA 1.452 -0.356 0 C-N-CA 123.017 0.527 . . . . 0.0 110.529 178.558 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 81' ' ' THR . . . . . . . . . . . . . 29.7 m -54.02 -65.14 0.62 Allowed 'General case' 0 CA--C 1.534 0.348 0 C-N-CA 124.926 1.29 . . . . 0.0 108.7 171.27 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 82' ' ' ILE . . . . . . . . . . . . . 10.4 tp -64.18 -35.1 72.8 Favored 'Isoleucine or valine' 0 C--O 1.234 0.284 0 O-C-N 121.84 -0.537 . . . . 0.0 111.011 -171.539 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 83' ' ' SER . . . . . . . . . . . . . 8.6 m -64.3 -40.92 96.92 Favored 'General case' 0 N--CA 1.443 -0.804 0 CA-C-O 118.305 -0.855 . . . . 0.0 111.983 -170.605 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 84' ' ' GLU . . . . . 0.472 ' OE1' ' HE2' ' A' ' 105' ' ' LYS . 4.6 mt-10 -77.86 -39.5 43.15 Favored 'General case' 0 N--CA 1.45 -0.432 0 CA-C-O 118.497 -0.763 . . . . 0.0 110.963 175.421 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 85' ' ' MET . . . . . . . . . . . . . 96.0 mtp -57.88 -49.15 77.68 Favored 'General case' 0 N--CA 1.463 0.201 0 CA-C-O 121.919 0.866 . . . . 0.0 108.725 -173.147 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 86' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -71.7 -25.49 62.11 Favored 'General case' 0 N--CA 1.453 -0.32 0 C-N-CA 123.714 0.806 . . . . 0.0 112.861 -177.197 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 87' ' ' LYS . . . . . . . . . . . . . 6.5 tptm -73.81 -49.74 23.84 Favored 'General case' 0 CA--C 1.516 -0.328 0 N-CA-C 108.338 -0.986 . . . . 0.0 108.338 -178.292 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 88' ' ' GLU . . . . . . . . . . . . . 5.6 mm-40 -69.83 -38.86 76.66 Favored 'General case' 0 N--CA 1.447 -0.616 0 O-C-N 124.449 1.093 . . . . 0.0 110.254 -177.177 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 89' ' ' GLY . . . . . . . . . . . . . . . 126.09 92.27 0.85 Allowed Glycine 0 C--N 1.339 0.695 0 N-CA-C 109.125 -1.59 . . . . 0.0 109.125 -179.594 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 90' ' ' ALA . . . . . . . . . . . . . . . -69.66 136.38 51.05 Favored 'General case' 0 N--CA 1.452 -0.341 0 N-CA-C 106.983 -1.488 . . . . 0.0 106.983 178.388 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 91' ' ' GLN . . . . . . . . . . . . . 4.9 mp0 -68.78 136.43 52.76 Favored 'General case' 0 N--CA 1.442 -0.845 0 N-CA-C 104.385 -2.45 . . . . 0.0 104.385 167.617 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 92' ' ' VAL . . . . . . . . . . . . . 4.0 p -127.47 122.58 59.74 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.392 0 N-CA-C 105.88 -1.896 . . . . 0.0 105.88 -177.27 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 93' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -139.23 92.4 2.59 Favored 'General case' 0 C--N 1.33 -0.277 0 N-CA-C 108.475 -0.935 . . . . 0.0 108.475 178.914 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 94' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -89.54 107.37 19.04 Favored 'General case' 0 C--N 1.333 -0.14 0 N-CA-C 106.809 -1.552 . . . . 0.0 106.809 174.125 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 95' ' ' THR . . . . . . . . . . . . . 13.4 t -67.8 -163.22 0.03 OUTLIER 'General case' 0 CA--C 1.536 0.424 0 C-N-CA 125.822 1.649 . . . . 0.0 108.767 169.588 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 96' ' ' ALA . . . . . . . . . . . . . . . -44.62 -40.95 6.21 Favored 'General case' 0 CA--C 1.544 0.714 0 O-C-N 120.288 -1.507 . . . . 0.0 112.421 178.929 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 97' ' ' ASN . . . . . . . . . . . . . 9.9 p30 -157.12 4.02 0.14 Allowed 'General case' 0 CA--C 1.541 0.619 0 N-CA-C 114.839 1.422 . . . . 0.0 114.839 -170.135 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 98' ' ' GLN . . . . . . . . . . . . . 8.5 tt0 -126.96 129.89 49.02 Favored 'General case' 0 N--CA 1.464 0.257 0 CA-C-N 120.361 1.437 . . . . 0.0 109.649 -176.809 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 99' ' ' LEU . . . . . . . . . . . . . 9.9 tp -81.32 133.56 35.45 Favored 'General case' 0 N--CA 1.449 -0.482 0 C-N-CA 123.864 0.866 . . . . 0.0 109.275 175.584 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 100' ' ' THR . . . . . . . . . . . . . 1.1 m -115.13 128.15 56.02 Favored 'General case' 0 C--N 1.323 -0.575 0 N-CA-C 105.223 -2.14 . . . . 0.0 105.223 171.247 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 101' ' ' LEU . . . . . . . . . . . . . 8.5 mp -112.74 163.96 13.95 Favored 'General case' 0 CA--C 1.512 -0.49 0 N-CA-C 110.073 -0.343 . . . . 0.0 110.073 163.311 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 102' ' ' ALA . . . . . . . . . . . . . . . -151.81 160.68 43.48 Favored 'General case' 0 C--N 1.325 -0.488 0 C-N-CA 126.764 2.026 . . . . 0.0 106.187 158.418 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 103' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -165.84 178.63 6.4 Favored 'General case' 0 N--CA 1.444 -0.73 0 C-N-CA 129.17 2.988 . . . . 0.0 106.208 164.134 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 104' ' ' ALA . . . . . . . . . . . . . . . -46.86 -45.06 20.06 Favored 'General case' 0 CA--C 1.533 0.292 0 O-C-N 121.417 -0.802 . . . . 0.0 111.089 169.511 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 105' ' ' LYS . . . . . 0.472 ' HE2' ' OE1' ' A' ' 84' ' ' GLU . 22.0 mttm -58.04 -74.32 0.06 Allowed 'General case' 0 C--N 1.343 0.284 0 N-CA-C 112.202 0.445 . . . . 0.0 112.202 179.955 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 106' ' ' GLN . . . . . . . . . . . . . 8.8 pt20 -163.0 -174.46 3.89 Favored 'General case' 0 C--N 1.33 -0.274 0 C-N-CA 123.247 0.619 . . . . 0.0 109.743 -173.368 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 107' ' ' THR . . . . . . . . . . . . . 2.1 t -105.51 166.2 10.6 Favored 'General case' 0 CA--C 1.539 0.55 0 C-N-CA 125.6 1.56 . . . . 0.0 107.924 168.746 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 108' ' ' LEU . . . . . . . . . . . . . 76.6 mt -139.92 150.43 44.55 Favored 'General case' 0 C--O 1.237 0.436 0 C-N-CA 126.556 1.942 . . . . 0.0 106.517 169.425 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 109' ' ' THR . . . . . . . . . . . . . 4.9 m -123.48 108.47 12.7 Favored 'General case' 0 C--O 1.238 0.497 0 N-CA-C 107.92 -1.141 . . . . 0.0 107.92 176.152 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 110' ' ' TYR . . . . . . . . . . . . . 75.2 m-85 -110.17 156.06 21.13 Favored 'General case' 0 N--CA 1.453 -0.282 0 N-CA-C 109.684 -0.487 . . . . 0.0 109.684 179.302 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 111' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -127.93 134.59 49.33 Favored 'General case' 0 C--O 1.236 0.377 0 CA-C-O 118.0 -1.0 . . . . 0.0 108.582 -172.394 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 112' ' ' LEU . . . . . . . . . . . . . 64.1 tp -60.63 82.28 0.01 OUTLIER 'General case' 0 CA--C 1.534 0.344 0 C-N-CA 127.911 2.484 . . . . 0.0 110.653 177.568 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 113' ' ' ALA . . . . . . . . . . . . . . . -115.39 83.0 1.85 Allowed 'General case' 0 C--N 1.33 -0.262 0 N-CA-C 106.015 -1.846 . . . . 0.0 106.015 172.673 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 114' ' ' ASP . . . . . . . . . . . . . 3.0 p-10 -98.2 38.55 1.31 Allowed 'General case' 0 C--N 1.332 -0.155 0 C-N-CA 123.809 0.844 . . . . 0.0 110.848 -176.382 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 115' ' ' LEU . . . . . . . . . . . . . 37.0 mt 55.34 18.04 2.38 Favored 'General case' 0 N--CA 1.468 0.466 0 C-N-CA 127.306 2.242 . . . . 0.0 113.348 179.871 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 116' ' ' MET . . . . . . . . . . . . . 4.6 ptm -61.12 6.17 0.05 Allowed 'General case' 0 CA--C 1.544 0.731 0 C-N-CA 128.574 2.75 . . . . 0.0 115.199 179.768 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 117' ' ' ASN . . . . . . . . . . . . . 22.4 t-20 . . . . . 0 C--O 1.234 0.258 0 O-C-N 120.508 -1.37 . . . . 0.0 110.937 172.761 . . . . . . . . 0 0 . 1 . 014 nuclear orig full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 CA--C 1.534 0.36 0 CA-C-O 121.827 0.823 . . . . 0.0 110.837 . . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 2' ' ' VAL . . . . . . . . . . . . . 8.7 p -57.11 152.09 2.83 Favored 'Isoleucine or valine' 0 CA--C 1.544 0.737 0 C-N-CA 126.672 1.989 . . . . 0.0 110.521 164.115 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 3' ' ' THR . . . . . . . . . . . . . 29.6 p -128.03 162.32 50.62 Favored Pre-proline 0 CA--C 1.537 0.467 0 O-C-N 120.993 -1.067 . . . . 0.0 110.594 176.573 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 4' ' ' PRO . . . . . . . . . . . . . 18.1 Cg_endo -65.99 -41.48 13.45 Favored 'Trans proline' 0 C--N 1.345 0.394 0 C-N-CA 122.436 2.091 . . . . 0.0 112.54 175.117 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 5' ' ' GLU . . . . . . . . . . . . . 2.9 mt-10 -57.33 -50.03 74.23 Favored 'General case' 0 C--N 1.329 -0.286 0 C-N-CA 124.163 0.985 . . . . 0.0 111.016 -176.425 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 6' ' ' GLN . . . . . . . . . . . . . 5.5 pt20 -71.7 14.56 0.19 Allowed 'General case' 0 CA--C 1.541 0.604 0 N-CA-C 114.649 1.351 . . . . 0.0 114.649 -170.951 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 7' ' ' LEU . . . . . . . . . . . . . 94.1 mt -126.22 -52.51 1.51 Allowed 'General case' 0 CA--C 1.516 -0.344 0 C-N-CA 126.358 1.863 . . . . 0.0 109.27 -170.555 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 8' ' ' GLN . . . . . . . . . . . . . 2.0 mt-30 -44.9 -20.67 0.04 OUTLIER 'General case' 0 CA--C 1.539 0.538 0 C-N-CA 127.829 2.452 . . . . 0.0 116.701 -176.187 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 9' ' ' HIS . . . . . . . . . . . . . 33.2 p80 -138.66 19.33 2.69 Favored 'General case' 0 CA--C 1.537 0.446 0 C-N-CA 123.825 0.85 . . . . 0.0 113.245 177.769 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 10' ' ' HIS . . . . . . . . . . . . . 78.1 m-70 -118.6 118.46 31.74 Favored 'General case' 0 CA--C 1.531 0.246 0 C-N-CA 124.104 0.961 . . . . 0.0 108.438 179.22 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 11' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -74.5 140.85 44.83 Favored 'General case' 0 N--CA 1.465 0.284 0 N-CA-C 108.692 -0.855 . . . . 0.0 108.692 175.916 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 12' ' ' PHE . . . . . . . . . . . . . 3.3 m-85 -121.19 162.25 20.47 Favored 'General case' 0 N--CA 1.446 -0.633 0 CA-C-O 124.749 2.214 . . . . 0.0 108.762 163.98 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 13' ' ' VAL . . . . . . . . . . . . . 0.0 OUTLIER -136.79 145.98 29.25 Favored 'Isoleucine or valine' 0 C--N 1.31 -1.112 0 C-N-CA 130.143 3.377 . . . . 0.0 106.873 -179.218 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 14' ' ' LEU . . . . . . . . . . . . . 0.8 OUTLIER -69.75 140.92 53.5 Favored 'General case' 0 CA--C 1.504 -0.805 0 N-CA-C 106.532 -1.655 . . . . 0.0 106.532 166.555 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -117.29 -55.7 2.3 Favored 'General case' 0 N--CA 1.44 -0.952 0 O-C-N 124.222 0.951 . . . . 0.0 108.859 177.017 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 55.3 p -133.43 113.22 12.28 Favored 'General case' 0 N--CA 1.447 -0.616 0 CA-C-O 122.364 1.078 . . . . 0.0 109.841 -173.548 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 17' ' ' VAL . . . . . . . . . . . . . 3.2 t -74.25 160.0 5.4 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.45 0 C-N-CA 125.485 1.514 . . . . 0.0 107.648 179.639 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 18' ' ' ASN . . . . . . . . . . . . . 0.2 OUTLIER -44.75 -35.99 2.97 Favored 'General case' 0 N--CA 1.466 0.371 0 C-N-CA 125.536 1.534 . . . . 0.0 113.773 174.795 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . -107.4 -8.84 30.28 Favored Glycine 0 CA--C 1.528 0.855 0 CA-C-O 116.88 -2.067 . . . . 0.0 115.392 -173.519 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 16.0 ptpt 174.62 165.21 0.35 Allowed Pre-proline 0 N--CA 1.476 0.833 0 CA-C-N 120.497 2.149 . . . . 0.0 112.146 178.742 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 21' ' ' PRO . . . . . . . . . . . . . 45.5 Cg_endo -62.12 173.69 3.04 Favored 'Trans proline' 0 CA--C 1.534 0.499 0 C-N-CA 123.284 2.656 . . . . 0.0 111.856 164.064 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 22' ' ' VAL . . . . . . . . . . . . . 9.0 p -145.6 150.99 15.16 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.508 0 CA-C-O 121.66 0.743 . . . . 0.0 111.013 168.428 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 23' ' ' THR . . . . . . . . . . . . . 14.6 p -115.47 103.96 11.28 Favored 'General case' 0 N--CA 1.452 -0.326 0 C-N-CA 126.458 1.903 . . . . 0.0 107.338 172.743 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 24' ' ' SER . . . . . . . . . . . . . 14.9 m -127.72 75.73 1.62 Allowed 'General case' 0 C--N 1.332 -0.154 0 N-CA-C 106.88 -1.526 . . . . 0.0 106.88 -179.07 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 25' ' ' ASP . . . . . . . . . . . . . 97.2 m-20 -81.79 14.3 2.75 Favored 'General case' 0 N--CA 1.468 0.431 0 C-N-CA 123.917 0.887 . . . . 0.0 111.873 -169.927 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 26' ' ' LYS . . . . . . . . . . . . . 32.8 ttpt -148.88 114.8 5.72 Favored 'General case' 0 N--CA 1.45 -0.447 0 N-CA-C 105.881 -1.896 . . . . 0.0 105.881 179.947 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 27' ' ' ASN . . . . . . . . . . . . . 0.0 OUTLIER 43.6 73.76 0.89 Allowed Pre-proline 0 CA--C 1.546 0.804 0 C-N-CA 127.73 2.412 . . . . 0.0 109.788 -172.724 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 28' ' ' PRO . . . . . . . . . . . . . 9.3 Cg_endo -60.0 164.53 11.98 Favored 'Trans proline' 0 CA--C 1.538 0.677 0 CA-C-N 120.952 1.376 . . . . 0.0 111.988 -176.091 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 29' ' ' PRO . . . . . . . . . . . . . 61.5 Cg_endo -63.9 92.89 0.18 Allowed 'Trans proline' 0 N--CA 1.452 -0.934 0 N-CA-C 106.972 -1.972 . . . . 0.0 106.972 161.045 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 30' ' ' GLU . . . . . . . . . . . . . 7.9 pt-20 -123.24 157.81 32.28 Favored 'General case' 0 C--N 1.32 -0.715 0 C-N-CA 124.652 1.181 . . . . 0.0 108.112 -168.199 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 31' ' ' ILE . . . . . . . . . . . . . 16.3 tt -143.48 109.83 1.51 Allowed 'Isoleucine or valine' 0 N--CA 1.453 -0.293 0 N-CA-C 108.223 -1.029 . . . . 0.0 108.223 178.596 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 32' ' ' SER . . . . . . . . . . . . . 22.9 t -88.31 171.77 9.92 Favored 'General case' 0 N--CA 1.445 -0.684 0 N-CA-C 107.341 -1.355 . . . . 0.0 107.341 159.684 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 33' ' ' PHE . . . . . . . . . . . . . 92.0 m-85 -133.73 -170.09 2.43 Favored 'General case' 0 N--CA 1.441 -0.893 0 C-N-CA 125.467 1.507 . . . . 0.0 107.327 178.08 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 34' ' ' GLY . . . . . . . . . . . . . . . 170.87 -163.43 36.5 Favored Glycine 0 N--CA 1.444 -0.771 0 N-CA-C 109.57 -1.412 . . . . 0.0 109.57 172.142 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 35' ' ' GLU . . . . . . . . . . . . . 2.2 tt0 -55.76 157.09 4.44 Favored 'General case' 0 CA--C 1.534 0.334 0 C-N-CA 124.229 1.012 . . . . 0.0 112.096 -162.378 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 30.2 mtmt 52.74 20.83 1.69 Allowed 'General case' 0 CA--C 1.537 0.448 0 C-N-CA 124.235 1.014 . . . . 0.0 113.109 -168.94 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 37' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER 61.93 29.07 17.71 Favored 'General case' 0 CA--C 1.542 0.666 0 C-N-CA 125.475 1.51 . . . . 0.0 110.638 -175.967 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 38' ' ' MET . . . . . . . . . . . . . 0.7 OUTLIER -60.32 162.05 6.53 Favored 'General case' 0 C--O 1.233 0.232 0 O-C-N 120.794 -1.191 . . . . 0.0 111.633 172.957 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 39' ' ' ILE . . . . . . . . . . . . . 19.7 mt -122.96 135.21 63.78 Favored 'Isoleucine or valine' 0 C--O 1.237 0.401 0 C-N-CA 126.123 1.769 . . . . 0.0 107.217 -174.262 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 40' ' ' SER . . . . . . . . . . . . . 56.8 m -137.49 114.53 10.74 Favored 'General case' 0 C--O 1.226 -0.156 0 N-CA-C 108.019 -1.104 . . . . 0.0 108.019 170.983 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 41' ' ' GLY . . . . . . . . . . . . . . . -146.96 174.65 26.7 Favored Glycine 0 C--N 1.335 0.495 0 CA-C-N 119.335 0.97 . . . . 0.0 112.53 177.288 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 42' ' ' SER . . . . . 0.418 ' HA ' ' HA ' ' A' ' 46' ' ' ARG . 8.4 t -150.75 70.7 1.01 Allowed 'General case' 0 C--O 1.226 -0.137 0 C-N-CA 123.567 0.747 . . . . 0.0 110.55 -172.009 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 43' ' ' MET . . . . . . . . . . . . . 82.8 mmm -54.71 -62.82 1.41 Allowed 'General case' 0 C--N 1.344 0.336 0 N-CA-C 108.324 -0.991 . . . . 0.0 108.324 173.475 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 44' ' ' CYS . . . . . 1.283 ' SG ' ' SG ' ' A' ' 70' ' ' CYS . 8.8 t -139.33 -50.43 0.51 Allowed 'General case' 0 N--CA 1.451 -0.387 0 C-N-CA 123.625 0.77 . . . . 0.0 110.548 165.664 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 45' ' ' ASN . . . . . . . . . . . . . 48.6 m-80 -103.69 19.35 20.03 Favored 'General case' 0 N--CA 1.472 0.649 0 CA-C-N 119.973 1.26 . . . . 0.0 113.342 -171.309 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 46' ' ' ARG . . . . . 0.418 ' HA ' ' HA ' ' A' ' 42' ' ' SER . 0.0 OUTLIER 66.04 152.47 0.06 Allowed 'General case' 0 N--CA 1.464 0.253 0 C-N-CA 125.431 1.493 . . . . 0.0 111.043 -177.848 . . . . . . . . 3 3 . 1 . 014 nuclear orig full ' A' A ' 47' ' ' PHE . . . . . . . . . . . . . 25.0 p90 -154.54 168.36 26.98 Favored 'General case' 0 N--CA 1.447 -0.611 0 CA-C-O 122.768 1.27 . . . . 0.0 108.621 171.26 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 48' ' ' SER . . . . . . . . . . . . . 3.9 p -152.15 171.94 17.13 Favored 'General case' 0 N--CA 1.44 -0.973 0 CA-C-N 113.889 -1.505 . . . . 0.0 108.027 177.597 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 49' ' ' GLY . . . . . . . . . . . . . . . 179.25 163.78 30.76 Favored Glycine 0 N--CA 1.445 -0.73 0 N-CA-C 109.337 -1.505 . . . . 0.0 109.337 164.628 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 50' ' ' GLU . . . . . . . . . . . . . 13.5 pt-20 -82.99 95.37 7.99 Favored 'General case' 0 N--CA 1.44 -0.939 0 N-CA-C 105.572 -2.011 . . . . 0.0 105.572 165.032 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 51' ' ' GLY . . . . . . . . . . . . . . . -70.13 169.93 45.38 Favored Glycine 0 N--CA 1.447 -0.62 0 N-CA-C 109.781 -1.328 . . . . 0.0 109.781 167.85 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 52' ' ' LYS . . . . . . . . . . . . . 2.1 tppm? -153.27 146.42 24.66 Favored 'General case' 0 N--CA 1.452 -0.344 0 N-CA-C 107.72 -1.215 . . . . 0.0 107.72 169.585 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 53' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -121.33 82.39 1.93 Allowed 'General case' 0 CA--C 1.515 -0.385 0 N-CA-C 106.236 -1.765 . . . . 0.0 106.236 -178.992 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 1.5 t -103.91 -53.53 2.74 Favored 'General case' 0 N--CA 1.448 -0.567 0 N-CA-C 108.222 -1.029 . . . . 0.0 108.222 178.502 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 55' ' ' ASN . . . . . . . . . . . . . 17.6 p-10 -132.39 28.88 4.32 Favored 'General case' 0 CA--C 1.537 0.474 0 C-N-CA 125.889 1.676 . . . . 0.0 112.749 -163.954 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 56' ' ' GLY . . . . . . . . . . . . . . . 69.26 30.25 71.69 Favored Glycine 0 CA--C 1.53 1.007 0 O-C-N 121.146 -0.971 . . . . 0.0 111.806 -179.077 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 57' ' ' GLU . . . . . . . . . . . . . 42.8 tt0 -131.84 126.27 33.85 Favored 'General case' 0 N--CA 1.449 -0.5 0 N-CA-C 107.28 -1.378 . . . . 0.0 107.28 -178.176 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 58' ' ' LEU . . . . . . . . . . . . . 49.5 tp -102.6 103.62 13.94 Favored 'General case' 0 C--O 1.234 0.274 0 C-N-CA 124.073 0.949 . . . . 0.0 109.163 173.109 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 59' ' ' THR . . . . . . . . . . . . . 2.8 p -93.04 153.44 18.7 Favored 'General case' 0 CA--C 1.532 0.273 0 C-N-CA 122.883 0.473 . . . . 0.0 110.478 168.439 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 60' ' ' ALA . . . . . . . . . . . . . . . -155.34 106.3 2.55 Favored 'General case' 0 C--O 1.234 0.256 0 C-N-CA 125.58 1.552 . . . . 0.0 108.399 153.852 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 61' ' ' LYS . . . . . . . . . . . . . 29.1 ttpt -79.48 -25.3 41.91 Favored 'General case' 0 CA--C 1.535 0.365 0 C-N-CA 123.226 0.611 . . . . 0.0 110.638 168.157 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 62' ' ' GLY . . . . . . . . . . . . . . . -83.83 37.45 2.82 Favored Glycine 0 C--N 1.334 0.434 0 C-N-CA 126.443 1.973 . . . . 0.0 112.852 -176.399 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 63' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -82.03 81.33 8.02 Favored 'General case' 0 N--CA 1.444 -0.729 0 CA-C-O 121.857 0.837 . . . . 0.0 111.7 -164.096 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 64' ' ' ALA . . . . . . . . . . . . . . . -72.46 131.43 42.55 Favored 'General case' 0 C--N 1.327 -0.402 0 CA-C-N 115.278 -0.874 . . . . 0.0 108.98 176.09 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 65' ' ' MET . . . . . . . . . . . . . 54.9 mtp -130.97 -178.22 4.72 Favored 'General case' 0 CA--C 1.543 0.691 0 C-N-CA 128.239 2.616 . . . . 0.0 109.832 179.666 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 66' ' ' THR . . . . . . . . . . . . . 18.2 p -116.68 -168.93 1.54 Allowed 'General case' 0 N--CA 1.472 0.643 0 C-N-CA 125.339 1.456 . . . . 0.0 111.834 -179.171 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 67' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -138.35 79.97 1.77 Allowed 'General case' 0 N--CA 1.452 -0.36 0 C-N-CA 126.556 1.943 . . . . 0.0 107.014 -177.024 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 68' ' ' MET . . . . . . . . . . . . . 76.1 mtm -131.72 -160.31 1.04 Allowed 'General case' 0 C--N 1.325 -0.475 0 C-N-CA 126.804 2.042 . . . . 0.0 107.575 178.962 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 69' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -143.53 155.96 44.47 Favored 'General case' 0 N--CA 1.445 -0.685 0 C-N-CA 124.993 1.317 . . . . 0.0 110.205 160.382 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 70' ' ' CYS . . . . . 1.283 ' SG ' ' SG ' ' A' ' 44' ' ' CYS . 1.6 p -92.0 -9.01 44.47 Favored 'General case' 0 C--N 1.321 -0.663 0 C-N-CA 126.946 2.099 . . . . 0.0 112.001 171.006 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 71' ' ' ALA . . . . . . . . . . . . . . . 59.64 5.99 0.77 Allowed 'General case' 0 CA--C 1.538 0.503 0 C-N-CA 126.675 1.99 . . . . 0.0 114.183 -167.636 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 72' ' ' ASN . . . . . . . . . . . . . 21.2 t-20 -111.24 144.66 30.91 Favored Pre-proline 0 CA--C 1.533 0.301 0 C-N-CA 124.828 1.251 . . . . 0.0 108.567 174.362 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 73' ' ' PRO . . . . . . . . . . . . . 87.5 Cg_endo -77.48 -47.05 0.13 Allowed 'Trans proline' 0 CA--C 1.534 0.513 0 C-N-CA 122.652 2.235 . . . . 0.0 111.912 -178.471 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 74' ' ' GLN . . . . . . . . . . . . . 15.4 tt0 -59.12 -45.75 90.11 Favored 'General case' 0 N--CA 1.452 -0.361 0 C-N-CA 127.381 2.272 . . . . 0.0 110.175 -171.749 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 75' ' ' LEU . . . . . . . . . . . . . 98.6 mt -65.06 -42.99 93.71 Favored 'General case' 0 N--CA 1.452 -0.344 0 C-N-CA 125.138 1.375 . . . . 0.0 110.498 177.687 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 76' ' ' ASN . . . . . . . . . . . . . 0.6 OUTLIER -60.55 -44.99 95.53 Favored 'General case' 0 N--CA 1.468 0.473 0 C-N-CA 123.854 0.861 . . . . 0.0 111.679 177.977 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 77' ' ' GLU . . . . . . . . . . . . . 21.3 tp10 -63.99 -34.5 78.15 Favored 'General case' 0 CA--C 1.536 0.435 0 C-N-CA 123.699 0.8 . . . . 0.0 111.23 175.077 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 78' ' ' LEU . . . . . . . . . . . . . 21.7 mt -64.2 -20.49 66.06 Favored 'General case' 0 CA--C 1.533 0.3 0 CA-C-O 118.166 -0.921 . . . . 0.0 112.259 178.682 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 79' ' ' ASP . . . . . . . . . . . . . 67.6 m-20 -65.1 -27.67 68.92 Favored 'General case' 0 N--CA 1.467 0.406 0 CA-C-N 119.641 1.109 . . . . 0.0 111.39 172.153 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 80' ' ' ASN . . . . . . . . . . . . . 0.9 OUTLIER -76.12 -52.93 9.09 Favored 'General case' 0 N--CA 1.455 -0.214 0 N-CA-C 107.749 -1.204 . . . . 0.0 107.749 175.85 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 81' ' ' THR . . . . . 0.425 HG21 HE21 ' A' ' 106' ' ' GLN . 28.9 m -47.98 -57.27 5.97 Favored 'General case' 0 CA--C 1.535 0.391 0 C-N-CA 124.066 0.946 . . . . 0.0 110.468 178.482 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 82' ' ' ILE . . . . . . . . . . . . . 10.7 tp -58.13 -39.98 75.26 Favored 'Isoleucine or valine' 0 C--O 1.233 0.193 0 CA-C-N 119.538 1.063 . . . . 0.0 111.401 -172.851 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 83' ' ' SER . . . . . . . . . . . . . 28.6 t -60.65 -53.9 51.88 Favored 'General case' 0 N--CA 1.446 -0.645 0 C-N-CA 123.572 0.749 . . . . 0.0 109.008 -177.459 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 84' ' ' GLU . . . . . . . . . . . . . 9.7 tt0 -76.34 -16.21 59.8 Favored 'General case' 0 CA--C 1.539 0.53 0 N-CA-C 112.765 0.654 . . . . 0.0 112.765 -175.765 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 85' ' ' MET . . . . . . . . . . . . . 77.6 mtp -67.41 -61.18 2.03 Favored 'General case' 0 C--N 1.34 0.175 0 CA-C-N 120.175 1.352 . . . . 0.0 107.499 166.657 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 86' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -63.45 -29.09 70.43 Favored 'General case' 0 C--N 1.33 -0.249 0 C-N-CA 124.63 1.172 . . . . 0.0 112.025 -172.614 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 87' ' ' LYS . . . . . . . . . . . . . 10.9 mttt -64.4 -34.88 79.2 Favored 'General case' 0 C--N 1.333 -0.116 0 CA-C-N 118.752 0.706 . . . . 0.0 110.735 179.703 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 88' ' ' GLU . . . . . . . . . . . . . 9.4 mm-40 -105.07 0.56 27.66 Favored 'General case' 0 CA--C 1.53 0.2 0 C-N-CA 124.669 1.188 . . . . 0.0 111.845 -167.876 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 89' ' ' GLY . . . . . . . . . . . . . . . 86.77 96.68 0.84 Allowed Glycine 0 C--N 1.336 0.545 0 N-CA-C 108.797 -1.721 . . . . 0.0 108.797 -177.432 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 90' ' ' ALA . . . . . . . . . . . . . . . -78.29 135.23 37.49 Favored 'General case' 0 N--CA 1.449 -0.481 0 N-CA-C 109.074 -0.713 . . . . 0.0 109.074 175.759 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 91' ' ' GLN . . . . . . . . . . . . . 2.4 mp0 -72.76 112.14 8.53 Favored 'General case' 0 N--CA 1.449 -0.481 0 N-CA-C 105.548 -2.019 . . . . 0.0 105.548 176.125 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 92' ' ' VAL . . . . . . . . . . . . . 55.4 t -104.15 105.94 19.4 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.35 0 N-CA-C 106.551 -1.648 . . . . 0.0 106.551 -178.731 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 93' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER -121.58 91.49 3.53 Favored 'General case' 0 CA--C 1.516 -0.36 0 N-CA-C 108.478 -0.934 . . . . 0.0 108.478 176.72 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 94' ' ' LEU . . . . . . . . . . . . . 44.0 tp -76.73 134.34 39.22 Favored 'General case' 0 N--CA 1.451 -0.408 0 N-CA-C 107.527 -1.286 . . . . 0.0 107.527 167.519 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 95' ' ' THR . . . . . . . . . . . . . 1.2 t -117.7 178.36 4.43 Favored 'General case' 0 C--N 1.319 -0.746 0 N-CA-C 104.969 -2.234 . . . . 0.0 104.969 169.581 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 96' ' ' ALA . . . . . . . . . . . . . . . -44.78 -21.15 0.05 OUTLIER 'General case' 0 CA--C 1.545 0.758 0 N-CA-C 118.542 2.793 . . . . 0.0 118.542 -157.617 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 97' ' ' ASN . . . . . . . . . . . . . 0.4 OUTLIER -160.35 14.72 0.12 Allowed 'General case' 0 CA--C 1.542 0.643 0 C-N-CA 125.257 1.423 . . . . 0.0 111.68 162.693 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 98' ' ' GLN . . . . . . . . . . . . . 16.4 tt0 -130.57 124.95 32.97 Favored 'General case' 0 N--CA 1.466 0.326 0 O-C-N 120.466 -1.396 . . . . 0.0 109.197 -176.388 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 99' ' ' LEU . . . . . . . . . . . . . 12.6 tp -79.06 148.22 32.53 Favored 'General case' 0 C--N 1.326 -0.441 0 C-N-CA 125.875 1.67 . . . . 0.0 109.052 172.676 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 100' ' ' THR . . . . . . . . . . . . . 22.8 m -122.07 129.27 52.25 Favored 'General case' 0 N--CA 1.454 -0.228 0 N-CA-C 106.973 -1.491 . . . . 0.0 106.973 152.077 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 101' ' ' LEU . . . . . . . . . . . . . 1.5 mm? -102.2 100.39 10.59 Favored 'General case' 0 CA--C 1.517 -0.313 0 N-CA-C 105.716 -1.957 . . . . 0.0 105.716 160.703 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 102' ' ' ALA . . . . . . . . . . . . . . . -94.42 151.03 19.7 Favored 'General case' 0 CA--C 1.532 0.286 0 N-CA-C 107.863 -1.162 . . . . 0.0 107.863 167.793 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 103' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -161.82 177.76 9.58 Favored 'General case' 0 N--CA 1.443 -0.809 0 C-N-CA 126.209 1.803 . . . . 0.0 108.177 166.524 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 104' ' ' ALA . . . . . . . . . . . . . . . -50.86 -37.87 45.93 Favored 'General case' 0 N--CA 1.447 -0.589 0 C-N-CA 123.418 0.687 . . . . 0.0 112.715 174.05 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 105' ' ' LYS . . . . . . . . . . . . . 0.3 OUTLIER -60.85 -71.99 0.13 Allowed 'General case' 0 C--N 1.342 0.255 0 N-CA-C 112.604 0.594 . . . . 0.0 112.604 178.928 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 106' ' ' GLN . . . . . 0.425 HE21 HG21 ' A' ' 81' ' ' THR . 26.7 mt-30 -150.75 176.86 10.64 Favored 'General case' 0 C--N 1.329 -0.307 0 C-N-CA 127.573 2.349 . . . . 0.0 106.76 -171.956 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 107' ' ' THR . . . . . . . . . . . . . 5.8 t -114.13 149.6 35.39 Favored 'General case' 0 N--CA 1.448 -0.555 0 N-CA-C 106.523 -1.658 . . . . 0.0 106.523 161.697 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 108' ' ' LEU . . . . . . . . . . . . . 78.9 mt -140.59 123.22 16.19 Favored 'General case' 0 C--O 1.237 0.403 0 N-CA-C 106.773 -1.566 . . . . 0.0 106.773 -175.6 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 109' ' ' THR . . . . . . . . . . . . . 24.4 m -89.65 122.27 32.62 Favored 'General case' 0 C--O 1.24 0.566 0 N-CA-C 107.286 -1.376 . . . . 0.0 107.286 176.974 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 110' ' ' TYR . . . . . . . . . . . . . 95.4 m-85 -114.32 157.52 22.68 Favored 'General case' 0 N--CA 1.453 -0.324 0 N-CA-C 108.717 -0.846 . . . . 0.0 108.717 174.045 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 111' ' ' LYS . . . . . . . . . . . . . 0.8 OUTLIER -122.38 141.02 52.02 Favored 'General case' 0 C--N 1.332 -0.163 0 C-N-CA 124.029 0.932 . . . . 0.0 109.016 -173.271 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 112' ' ' LEU . . . . . . . . . . . . . 25.3 tp -73.86 54.19 0.49 Allowed 'General case' 0 CA--C 1.534 0.343 0 C-N-CA 128.347 2.659 . . . . 0.0 108.875 171.857 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 113' ' ' ALA . . . . . . . . . . . . . . . -93.64 79.75 4.28 Favored 'General case' 0 N--CA 1.448 -0.526 0 N-CA-C 105.26 -2.126 . . . . 0.0 105.26 174.808 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 114' ' ' ASP . . . . . . . . . . . . . 20.4 t0 -87.44 62.29 7.06 Favored 'General case' 0 C--N 1.327 -0.384 0 CA-C-O 123.745 1.736 . . . . 0.0 109.99 -170.153 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 115' ' ' LEU . . . . . . . . . . . . . 32.5 mt -82.03 10.96 5.64 Favored 'General case' 0 C--N 1.327 -0.387 0 CA-C-N 113.751 -1.568 . . . . 0.0 111.318 -170.992 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 116' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER 53.13 -159.42 0.14 Allowed 'General case' 0 CA--C 1.545 0.755 0 N-CA-C 108.972 -0.751 . . . . 0.0 108.972 -165.399 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 117' ' ' ASN . . . . . . . . . . . . . 9.2 t30 . . . . . 0 C--O 1.235 0.33 0 O-C-N 120.111 -1.618 . . . . 0.0 111.262 -167.674 . . . . . . . . 0 0 . 1 . 015 nuclear orig full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 4.6 ttp . . . . . 0 C--O 1.234 0.269 0 N-CA-C 108.195 -1.039 . . . . 0.0 108.195 . . . . . . . . . 0 0 . 1 . 015 nuclear orig full ' A' A ' 2' ' ' VAL . . . . . . . . . . . . . 54.2 t -61.89 156.32 4.07 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.446 0 C-N-CA 124.573 1.149 . . . . 0.0 109.861 179.781 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 3' ' ' THR . . . . . . . . . . . . . 62.2 p -134.16 165.66 35.05 Favored Pre-proline 0 CA--C 1.53 0.209 0 O-C-N 121.844 -0.535 . . . . 0.0 111.919 170.277 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 4' ' ' PRO . . . . . . . . . . . . . 29.9 Cg_endo -63.38 -35.96 58.51 Favored 'Trans proline' 0 N--CA 1.459 -0.53 0 C-N-CA 123.116 2.544 . . . . 0.0 113.791 170.951 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 5' ' ' GLU . . . . . . . . . . . . . 57.2 tt0 -57.37 -49.63 75.55 Favored 'General case' 0 C--N 1.325 -0.48 0 C-N-CA 123.217 0.607 . . . . 0.0 111.116 -171.935 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 6' ' ' GLN . . . . . . . . . . . . . 18.4 pt20 -68.56 14.22 0.08 Allowed 'General case' 0 CA--C 1.537 0.447 0 C-N-CA 127.374 2.27 . . . . 0.0 114.491 -178.259 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 7' ' ' LEU . . . . . . . . . . . . . 72.1 mt -134.7 -49.54 0.77 Allowed 'General case' 0 N--CA 1.456 -0.129 0 C-N-CA 124.449 1.1 . . . . 0.0 112.372 -170.726 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 8' ' ' GLN . . . . . . . . . . . . . 0.2 OUTLIER -52.65 -1.35 0.02 OUTLIER 'General case' 0 N--CA 1.466 0.362 0 C-N-CA 128.518 2.727 . . . . 0.0 117.902 -172.771 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 9' ' ' HIS . . . . . . . . . . . . . 91.8 m-70 -143.55 10.94 1.66 Allowed 'General case' 0 CA--C 1.535 0.393 0 CA-C-N 120.269 1.395 . . . . 0.0 111.695 172.538 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 10' ' ' HIS . . . . . . . . . . . . . 81.7 m-70 -108.42 115.26 29.77 Favored 'General case' 0 N--CA 1.452 -0.346 0 C-N-CA 124.909 1.284 . . . . 0.0 108.563 -167.892 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 11' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -70.38 142.08 52.13 Favored 'General case' 0 N--CA 1.464 0.27 0 N-CA-C 107.777 -1.194 . . . . 0.0 107.777 169.726 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 12' ' ' PHE . . . . . . . . . . . . . 41.9 m-85 -125.47 164.61 20.09 Favored 'General case' 0 N--CA 1.444 -0.76 0 C-N-CA 125.623 1.569 . . . . 0.0 107.874 162.459 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 13' ' ' VAL . . . . . . . . . . . . . 4.3 t -134.29 146.91 30.44 Favored 'Isoleucine or valine' 0 C--O 1.236 0.345 0 N-CA-C 107.784 -1.191 . . . . 0.0 107.784 -178.794 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 14' ' ' LEU . . . . . . . . . . . . . 27.2 tp -75.18 91.28 2.6 Favored 'General case' 0 N--CA 1.454 -0.252 0 O-C-N 123.787 0.679 . . . . 0.0 109.402 -175.301 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 0.7 OUTLIER -66.44 -42.38 87.74 Favored 'General case' 0 C--O 1.237 0.397 0 C-N-CA 124.656 1.182 . . . . 0.0 109.514 -177.134 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -161.9 152.95 18.02 Favored 'General case' 0 N--CA 1.449 -0.51 0 CA-C-O 121.737 0.78 . . . . 0.0 111.174 -174.146 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 17' ' ' VAL . . . . . . . . . . . . . 2.0 t -116.72 161.29 15.58 Favored 'Isoleucine or valine' 0 C--O 1.235 0.324 0 N-CA-C 107.011 -1.477 . . . . 0.0 107.011 -179.53 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 18' ' ' ASN . . . . . . . . . . . . . 17.9 t30 -51.17 -42.2 60.68 Favored 'General case' 0 N--CA 1.46 0.07 0 C-N-CA 123.147 0.579 . . . . 0.0 111.902 176.846 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . -62.54 -72.89 0.58 Allowed Glycine 0 CA--C 1.525 0.697 0 N-CA-C 110.159 -1.176 . . . . 0.0 110.159 174.265 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 17.0 mttt -165.74 166.88 9.58 Favored Pre-proline 0 C--N 1.332 -0.176 0 C-N-CA 128.239 2.616 . . . . 0.0 108.405 -171.445 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 21' ' ' PRO . . . . . . . . . . . . . 56.8 Cg_endo -58.96 169.43 3.51 Favored 'Trans proline' 0 N--CA 1.455 -0.751 0 CA-C-N 120.389 1.175 . . . . 0.0 110.679 172.389 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 22' ' ' VAL . . . . . . . . . . . . . 2.7 t -105.97 162.4 5.06 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.396 0 N-CA-C 107.067 -1.457 . . . . 0.0 107.067 174.922 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 23' ' ' THR . . . . . . . . . . . . . 0.6 OUTLIER -136.96 81.0 1.85 Allowed 'General case' 0 C--N 1.329 -0.289 0 C-N-CA 124.3 1.04 . . . . 0.0 108.533 -172.868 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 24' ' ' SER . . . . . . . . . . . . . 27.7 m -128.88 100.51 5.71 Favored 'General case' 0 C--N 1.325 -0.458 0 C-N-CA 125.701 1.6 . . . . 0.0 107.179 -175.637 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 25' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER -75.1 -16.06 60.58 Favored 'General case' 0 N--CA 1.467 0.405 0 C-N-CA 125.765 1.626 . . . . 0.0 112.151 -174.164 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 26' ' ' LYS . . . . . . . . . . . . . 20.4 tttp -143.4 136.72 28.09 Favored 'General case' 0 N--CA 1.448 -0.554 0 N-CA-C 105.748 -1.945 . . . . 0.0 105.748 -174.679 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 27' ' ' ASN . . . . . . . . . . . . . 42.8 m-20 44.93 66.62 4.96 Favored Pre-proline 0 CA--C 1.547 0.839 0 C-N-CA 125.844 1.657 . . . . 0.0 110.862 178.895 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 28' ' ' PRO . . . . . . . . . . . . . 56.2 Cg_endo -65.87 173.82 6.48 Favored 'Trans proline' 0 C--N 1.346 0.413 0 C-N-CA 123.988 3.125 . . . . 0.0 112.751 -176.275 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 29' ' ' PRO . . . . . . . . . . . . . 70.3 Cg_endo -72.82 93.79 0.79 Allowed 'Trans proline' 0 N--CA 1.446 -1.272 0 N-CA-C 108.397 -1.424 . . . . 0.0 108.397 157.359 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 30' ' ' GLU . . . . . . . . . . . . . 0.2 OUTLIER -98.38 177.64 5.29 Favored 'General case' 0 C--N 1.327 -0.403 0 O-C-N 120.546 -1.346 . . . . 0.0 109.686 167.754 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 31' ' ' ILE . . . . . . . . . . . . . 9.0 tt -147.54 114.33 0.98 Allowed 'Isoleucine or valine' 0 N--CA 1.451 -0.378 0 N-CA-C 106.952 -1.499 . . . . 0.0 106.952 171.348 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 32' ' ' SER . . . . . . . . . . . . . 15.1 m -116.11 159.61 21.5 Favored 'General case' 0 C--O 1.238 0.477 0 N-CA-C 108.902 -0.777 . . . . 0.0 108.902 174.441 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 33' ' ' PHE . . . . . . . . . . . . . 29.0 m-85 -130.55 152.55 49.8 Favored 'General case' 0 N--CA 1.448 -0.555 0 N-CA-C 108.364 -0.976 . . . . 0.0 108.364 175.862 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 34' ' ' GLY . . . . . . . . . . . . . . . -117.98 -178.44 17.26 Favored Glycine 0 C--N 1.332 0.317 0 N-CA-C 109.568 -1.413 . . . . 0.0 109.568 171.13 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 35' ' ' GLU . . . . . . . . . . . . . 3.8 pt-20 -63.22 -26.17 68.67 Favored 'General case' 0 C--N 1.324 -0.513 0 C-N-CA 128.671 2.788 . . . . 0.0 112.527 -158.359 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 0.3 OUTLIER -85.2 13.44 6.35 Favored 'General case' 0 N--CA 1.437 -1.121 0 C-N-CA 129.296 3.038 . . . . 0.0 114.308 173.352 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 37' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER 60.8 14.78 5.38 Favored 'General case' 0 CA--C 1.55 0.946 0 C-N-CA 127.394 2.278 . . . . 0.0 112.522 -168.305 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 38' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -54.58 160.51 1.77 Allowed 'General case' 0 N--CA 1.467 0.416 0 O-C-N 119.912 -1.742 . . . . 0.0 110.623 177.658 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 39' ' ' ILE . . . . . . . . . . . . . 17.9 mt -132.12 120.7 44.53 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.514 0 N-CA-C 105.555 -2.017 . . . . 0.0 105.555 -177.546 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 40' ' ' SER . . . . . . . . . . . . . 17.3 m -129.18 89.1 2.8 Favored 'General case' 0 CA--C 1.535 0.378 0 C-N-CA 126.131 1.772 . . . . 0.0 108.607 -174.674 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 41' ' ' GLY . . . . . . . . . . . . . . . -135.61 -167.91 11.42 Favored Glycine 0 CA--C 1.538 1.487 0 C-N-CA 124.304 0.954 . . . . 0.0 110.95 -173.735 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 42' ' ' SER . . . . . . . . . . . . . 23.6 t -171.91 93.02 0.14 Allowed 'General case' 0 CA--C 1.535 0.379 0 C-N-CA 128.247 2.619 . . . . 0.0 108.525 177.497 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 43' ' ' MET . . . . . . . . . . . . . 2.6 mmt -63.74 -51.1 66.46 Favored 'General case' 0 C--O 1.231 0.107 0 N-CA-C 108.651 -0.87 . . . . 0.0 108.651 170.761 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 44' ' ' CYS . . . . . 1.302 ' SG ' ' SG ' ' A' ' 70' ' ' CYS . 48.9 t -148.79 -66.06 0.23 Allowed 'General case' 0 CA--C 1.514 -0.427 0 N-CA-C 108.182 -1.044 . . . . 0.0 108.182 169.023 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 45' ' ' ASN . . . . . . . . . . . . . 1.1 m-80 -75.93 17.36 0.33 Allowed 'General case' 0 CA--C 1.534 0.347 0 C-N-CA 127.835 2.454 . . . . 0.0 112.549 -172.612 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 46' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER 61.68 161.32 0.07 Allowed 'General case' 0 N--CA 1.463 0.207 0 C-N-CA 125.855 1.662 . . . . 0.0 111.545 -163.952 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 47' ' ' PHE . . . . . . . . . . . . . 35.0 p90 -158.81 159.78 35.5 Favored 'General case' 0 C--N 1.329 -0.308 0 N-CA-C 107.541 -1.281 . . . . 0.0 107.541 153.348 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 48' ' ' SER . . . . . . . . . . . . . 1.4 m -151.91 158.47 43.22 Favored 'General case' 0 C--O 1.237 0.427 0 N-CA-C 108.561 -0.903 . . . . 0.0 108.561 161.075 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 49' ' ' GLY . . . . . . . . . . . . . . . -177.76 166.68 37.12 Favored Glycine 0 CA--C 1.52 0.389 0 N-CA-C 110.136 -1.186 . . . . 0.0 110.136 179.578 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 50' ' ' GLU . . . . . . . . . . . . . 43.4 mt-10 -88.51 98.26 11.54 Favored 'General case' 0 N--CA 1.449 -0.488 0 N-CA-C 107.575 -1.268 . . . . 0.0 107.575 -176.832 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 51' ' ' GLY . . . . . . . . . . . . . . . -59.61 169.87 6.54 Favored Glycine 0 CA--C 1.531 1.083 0 CA-C-N 115.737 -0.665 . . . . 0.0 112.424 172.106 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 52' ' ' LYS . . . . . . . . . . . . . 35.6 ttpt -155.02 147.03 23.6 Favored 'General case' 0 C--O 1.235 0.327 0 O-C-N 121.549 -0.971 . . . . 0.0 111.142 169.606 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 53' ' ' LEU . . . . . . . . . . . . . 24.2 tp -134.77 139.73 45.37 Favored 'General case' 0 N--CA 1.453 -0.324 0 C-N-CA 127.575 2.35 . . . . 0.0 107.484 170.148 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 1.3 t -162.21 -14.77 0.04 OUTLIER 'General case' 0 CA--C 1.541 0.606 0 C-N-CA 125.574 1.55 . . . . 0.0 110.39 163.917 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 55' ' ' ASN . . . . . . . . . . . . . 43.9 m-20 -123.44 14.12 9.54 Favored 'General case' 0 CA--C 1.541 0.601 0 C-N-CA 124.761 1.224 . . . . 0.0 113.099 -170.407 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 56' ' ' GLY . . . . . . . . . . . . . . . 72.09 19.7 78.61 Favored Glycine 0 CA--C 1.533 1.183 0 CA-C-N 120.429 1.468 . . . . 0.0 112.672 -172.24 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 57' ' ' GLU . . . . . . . . . . . . . 19.7 tt0 -130.01 149.84 51.55 Favored 'General case' 0 CA--C 1.541 0.607 0 C-N-CA 125.187 1.395 . . . . 0.0 107.958 -176.726 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 58' ' ' LEU . . . . . . . . . . . . . 66.2 tp -114.72 124.74 52.57 Favored 'General case' 0 N--CA 1.465 0.291 0 CA-C-N 119.603 1.092 . . . . 0.0 109.066 177.516 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 59' ' ' THR . . . . . . . . . . . . . 11.8 p -123.01 159.47 28.32 Favored 'General case' 0 C--N 1.326 -0.42 0 C-N-CA 126.171 1.788 . . . . 0.0 110.15 169.531 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 60' ' ' ALA . . . . . . . . . . . . . . . -80.54 169.62 17.44 Favored 'General case' 0 N--CA 1.451 -0.423 0 C-N-CA 126.191 1.796 . . . . 0.0 113.468 162.532 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 61' ' ' LYS . . . . . . . . . . . . . 77.6 tttt -135.79 121.51 19.66 Favored 'General case' 0 N--CA 1.441 -0.876 0 N-CA-C 105.211 -2.144 . . . . 0.0 105.211 147.212 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 62' ' ' GLY . . . . . . . . . . . . . . . 104.41 -61.25 0.41 Allowed Glycine 0 CA--C 1.526 0.73 0 CA-C-O 118.575 -1.125 . . . . 0.0 113.775 160.569 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 63' ' ' LEU . . . . . . . . . . . . . 2.5 tp 44.85 87.79 0.02 OUTLIER 'General case' 0 CA--C 1.54 0.578 0 C-N-CA 128.305 2.642 . . . . 0.0 113.591 -175.499 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 64' ' ' ALA . . . . . . . . . . . . . . . -71.57 147.44 47.63 Favored 'General case' 0 C--N 1.33 -0.25 0 N-CA-C 107.094 -1.446 . . . . 0.0 107.094 162.05 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 65' ' ' MET . . . . . . . . . . . . . 63.9 mtp -147.06 -171.11 3.7 Favored 'General case' 0 CA--C 1.542 0.666 0 C-N-CA 126.806 2.042 . . . . 0.0 107.625 174.679 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 66' ' ' THR . . . . . . . . . . . . . 3.9 p -139.15 -168.82 2.52 Favored 'General case' 0 CA--C 1.546 0.812 0 C-N-CA 124.494 1.118 . . . . 0.0 109.847 176.785 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 67' ' ' ARG . . . . . . . . . . . . . 16.6 mmt85 -119.18 28.44 8.24 Favored 'General case' 0 N--CA 1.473 0.716 0 C-N-CA 127.322 2.249 . . . . 0.0 111.935 177.934 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 68' ' ' MET . . . . . . . . . . . . . 77.4 mtm -74.98 -169.7 0.96 Allowed 'General case' 0 CA--C 1.541 0.621 0 O-C-N 120.632 -1.293 . . . . 0.0 109.698 178.651 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 69' ' ' MET . . . . . . . . . . . . . 1.0 OUTLIER -149.63 176.68 10.44 Favored 'General case' 0 CA--C 1.522 -0.134 0 C-N-CA 125.531 1.532 . . . . 0.0 109.626 174.321 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 70' ' ' CYS . . . . . 1.302 ' SG ' ' SG ' ' A' ' 44' ' ' CYS . 75.9 m -133.8 15.38 3.96 Favored 'General case' 0 CA--C 1.537 0.461 0 C-N-CA 124.225 1.01 . . . . 0.0 111.658 179.986 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 71' ' ' ALA . . . . . . . . . . . . . . . 60.6 -25.75 0.04 OUTLIER 'General case' 0 CA--C 1.537 0.455 0 C-N-CA 130.184 3.394 . . . . 0.0 115.308 -171.212 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 72' ' ' ASN . . . . . . . . . . . . . 19.8 t30 -96.42 144.56 28.04 Favored Pre-proline 0 C--O 1.236 0.347 0 C-N-CA 124.116 0.967 . . . . 0.0 110.366 -176.552 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 73' ' ' PRO . . . . . . . . . . . . . 53.5 Cg_endo -73.72 -38.19 2.55 Favored 'Trans proline' 0 N--CA 1.46 -0.447 0 C-N-CA 122.044 1.829 . . . . 0.0 112.284 -174.6 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 74' ' ' GLN . . . . . . . . . . . . . 63.1 tt0 -52.48 -46.25 66.5 Favored 'General case' 0 C--O 1.224 -0.277 0 CA-C-N 118.973 0.806 . . . . 0.0 110.661 -178.378 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 75' ' ' LEU . . . . . . . . . . . . . 90.0 mt -66.12 -37.65 86.26 Favored 'General case' 0 CA--C 1.534 0.347 0 O-C-N 121.873 -0.517 . . . . 0.0 111.623 -179.557 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 76' ' ' ASN . . . . . . . . . . . . . 0.8 OUTLIER -76.05 -28.92 57.84 Favored 'General case' 0 N--CA 1.467 0.38 0 CA-C-N 118.936 0.789 . . . . 0.0 111.691 -178.483 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 77' ' ' GLU . . . . . . . . . . . . . 3.3 tp10 -65.75 -36.64 84.14 Favored 'General case' 0 CA--C 1.533 0.321 0 C-N-CA 125.047 1.339 . . . . 0.0 109.008 166.729 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 78' ' ' LEU . . . . . 0.408 ' HA ' ' HB ' ' A' ' 81' ' ' THR . 5.2 mp -70.63 -13.17 61.98 Favored 'General case' 0 N--CA 1.453 -0.298 0 O-C-N 121.121 -0.987 . . . . 0.0 113.55 -177.429 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 79' ' ' ASP . . . . . . . . . . . . . 13.4 t70 -52.99 -58.28 7.51 Favored 'General case' 0 C--O 1.231 0.12 0 C-N-CA 124.725 1.21 . . . . 0.0 110.696 163.273 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 80' ' ' ASN . . . . . . . . . . . . . 13.4 p30 -75.33 -35.7 61.15 Favored 'General case' 0 N--CA 1.444 -0.731 0 N-CA-C 109.605 -0.517 . . . . 0.0 109.605 -173.525 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 81' ' ' THR . . . . . 0.408 ' HB ' ' HA ' ' A' ' 78' ' ' LEU . 32.6 m -48.43 -53.15 18.86 Favored 'General case' 0 N--CA 1.447 -0.606 0 C-N-CA 125.29 1.436 . . . . 0.0 110.349 174.29 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 82' ' ' ILE . . . . . . . . . . . . . 8.9 tp -77.2 -38.31 27.15 Favored 'Isoleucine or valine' 0 C--N 1.341 0.231 0 CA-C-N 120.069 1.304 . . . . 0.0 111.586 -178.686 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 83' ' ' SER . . . . . . . . . . . . . 4.2 t -50.46 -50.96 51.0 Favored 'General case' 0 C--O 1.238 0.467 0 C-N-CA 123.679 0.791 . . . . 0.0 109.851 -179.904 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 84' ' ' GLU . . . . . . . . . . . . . 0.5 OUTLIER -67.41 -44.64 78.31 Favored 'General case' 0 N--CA 1.45 -0.444 0 C-N-CA 124.46 1.104 . . . . 0.0 112.006 -178.451 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 85' ' ' MET . . . . . . . . . . . . . 90.2 mtp -66.8 -23.41 66.05 Favored 'General case' 0 C--O 1.232 0.16 0 CA-C-O 121.864 0.84 . . . . 0.0 110.7 -166.667 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 86' ' ' LEU . . . . . . . . . . . . . 2.8 mm? -98.02 -31.42 12.16 Favored 'General case' 0 N--CA 1.446 -0.664 0 C-N-CA 125.301 1.44 . . . . 0.0 110.413 -177.814 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 87' ' ' LYS . . . . . . . . . . . . . 54.0 mttt -66.6 -49.91 64.77 Favored 'General case' 0 N--CA 1.439 -0.986 0 N-CA-C 107.438 -1.319 . . . . 0.0 107.438 179.16 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 88' ' ' GLU . . . . . . . . . . . . . 31.2 mt-10 -89.15 -8.44 53.68 Favored 'General case' 0 CA--C 1.532 0.265 0 N-CA-C 113.169 0.804 . . . . 0.0 113.169 -168.115 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 89' ' ' GLY . . . . . . . . . . . . . . . 83.54 138.91 3.63 Favored Glycine 0 C--N 1.337 0.588 0 C-N-CA 124.358 0.98 . . . . 0.0 112.423 175.45 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 90' ' ' ALA . . . . . . . . . . . . . . . -131.48 154.03 49.16 Favored 'General case' 0 CA--C 1.514 -0.426 0 N-CA-C 114.127 1.158 . . . . 0.0 114.127 -165.275 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 91' ' ' GLN . . . . . . . . . . . . . 9.0 mp0 -70.36 129.22 38.71 Favored 'General case' 0 N--CA 1.445 -0.709 0 N-CA-C 104.242 -2.503 . . . . 0.0 104.242 163.1 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 92' ' ' VAL . . . . . . . . . . . . . 3.3 p -128.6 77.32 0.55 Allowed 'Isoleucine or valine' 0 C--N 1.325 -0.489 0 N-CA-C 106.512 -1.662 . . . . 0.0 106.512 -177.135 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 93' ' ' ASP . . . . . . . . . . . . . 2.4 m-20 -72.32 147.65 46.12 Favored 'General case' 0 N--CA 1.448 -0.546 0 N-CA-C 107.206 -1.405 . . . . 0.0 107.206 172.537 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 94' ' ' LEU . . . . . . . . . . . . . 61.1 tp -142.07 102.73 4.18 Favored 'General case' 0 N--CA 1.448 -0.534 0 N-CA-C 107.909 -1.145 . . . . 0.0 107.909 171.283 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 95' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -70.67 179.48 2.58 Favored 'General case' 0 N--CA 1.442 -0.855 0 CA-C-N 114.771 -1.104 . . . . 0.0 108.825 168.486 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 96' ' ' ALA . . . . . . . . . . . . . . . -47.07 -33.01 4.53 Favored 'General case' 0 CA--C 1.535 0.401 0 C-N-CA 126.273 1.829 . . . . 0.0 115.173 -169.955 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 97' ' ' ASN . . . . . . . . . . . . . 0.0 OUTLIER -148.35 6.8 0.76 Allowed 'General case' 0 CA--C 1.537 0.445 0 C-N-CA 126.325 1.85 . . . . 0.0 110.69 -173.897 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 98' ' ' GLN . . . . . . . . . . . . . 24.7 tt0 -143.46 111.41 6.09 Favored 'General case' 0 CA--C 1.529 0.156 0 CA-C-N 119.566 1.076 . . . . 0.0 109.899 -164.9 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 99' ' ' LEU . . . . . . . . . . . . . 10.9 tp -66.79 147.37 53.35 Favored 'General case' 0 C--O 1.235 0.321 0 C-N-CA 125.63 1.572 . . . . 0.0 107.745 170.744 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 100' ' ' THR . . . . . . . . . . . . . 85.3 m -143.46 100.69 3.65 Favored 'General case' 0 C--N 1.326 -0.439 0 N-CA-C 106.638 -1.615 . . . . 0.0 106.638 169.506 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 101' ' ' LEU . . . . . . . . . . . . . 3.2 mm? -81.37 146.33 30.38 Favored 'General case' 0 CA--C 1.517 -0.303 0 N-CA-C 107.651 -1.241 . . . . 0.0 107.651 175.571 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 102' ' ' ALA . . . . . . . . . . . . . . . -143.46 152.03 41.04 Favored 'General case' 0 C--O 1.235 0.336 0 C-N-CA 123.679 0.792 . . . . 0.0 109.7 164.126 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 103' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -151.61 173.92 14.07 Favored 'General case' 0 C--N 1.326 -0.448 0 C-N-CA 126.93 2.092 . . . . 0.0 108.735 179.631 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 104' ' ' ALA . . . . . . . . . . . . . . . -49.85 -19.19 0.62 Allowed 'General case' 0 CA--C 1.536 0.419 0 N-CA-C 115.44 1.644 . . . . 0.0 115.44 164.392 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 105' ' ' LYS . . . . . . . . . . . . . 23.8 mmtt -87.95 -74.15 0.46 Allowed 'General case' 0 N--CA 1.455 -0.19 0 CA-C-N 119.775 1.171 . . . . 0.0 109.245 172.67 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 106' ' ' GLN . . . . . . . . . . . . . 13.4 mt-30 -150.34 179.76 7.86 Favored 'General case' 0 N--CA 1.462 0.151 0 C-N-CA 124.644 1.178 . . . . 0.0 109.835 -160.862 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 107' ' ' THR . . . . . . . . . . . . . 3.5 t -135.22 125.51 26.36 Favored 'General case' 0 CA--C 1.538 0.506 0 C-N-CA 124.587 1.155 . . . . 0.0 109.699 177.777 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 108' ' ' LEU . . . . . . . . . . . . . 8.5 mp -119.44 149.02 42.56 Favored 'General case' 0 C--O 1.234 0.245 0 C-N-CA 126.746 2.018 . . . . 0.0 109.337 -172.257 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 109' ' ' THR . . . . . . . . . . . . . 32.2 m -121.27 124.69 45.24 Favored 'General case' 0 N--CA 1.451 -0.419 0 N-CA-C 108.338 -0.986 . . . . 0.0 108.338 -173.022 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 110' ' ' TYR . . . . . . . . . . . . . 32.3 m-85 -124.39 163.86 20.88 Favored 'General case' 0 CA--C 1.518 -0.272 0 N-CA-C 109.482 -0.562 . . . . 0.0 109.482 -179.98 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 111' ' ' LYS . . . . . . . . . . . . . 0.5 OUTLIER -128.0 140.08 52.18 Favored 'General case' 0 CA--C 1.514 -0.405 0 CA-C-O 117.54 -1.219 . . . . 0.0 108.883 -171.734 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 112' ' ' LEU . . . . . . . . . . . . . 28.9 tp -71.85 47.01 0.13 Allowed 'General case' 0 CA--C 1.54 0.592 0 C-N-CA 127.386 2.275 . . . . 0.0 110.079 175.078 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 113' ' ' ALA . . . . . . . . . . . . . . . -78.96 82.32 5.15 Favored 'General case' 0 N--CA 1.446 -0.644 0 N-CA-C 106.489 -1.671 . . . . 0.0 106.489 166.225 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 114' ' ' ASP . . . . . . . . . . . . . 45.1 t0 -89.07 88.59 7.62 Favored 'General case' 0 CA--C 1.506 -0.73 0 N-CA-C 107.421 -1.325 . . . . 0.0 107.421 173.908 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 115' ' ' LEU . . . . . . . . . . . . . 23.1 mt -108.76 4.83 24.11 Favored 'General case' 0 C--N 1.323 -0.545 0 CA-C-N 113.634 -1.621 . . . . 0.0 110.94 -175.374 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 116' ' ' MET . . . . . . . . . . . . . 9.1 ttp -175.82 156.53 1.83 Allowed 'General case' 0 C--O 1.238 0.46 0 C-N-CA 125.069 1.348 . . . . 0.0 110.084 -175.388 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 117' ' ' ASN . . . . . . . . . . . . . 0.9 OUTLIER . . . . . 0 N--CA 1.469 0.523 0 O-C-N 121.411 -0.806 . . . . 0.0 110.961 171.168 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 C--O 1.237 0.424 0 N-CA-C 110.069 -0.345 . . . . 0.0 110.069 . . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 2' ' ' VAL . . . . . . . . . . . . . 7.3 p -55.63 142.89 9.54 Favored 'Isoleucine or valine' 0 N--CA 1.447 -0.59 0 C-N-CA 124.133 0.973 . . . . 0.0 109.331 175.377 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 3' ' ' THR . . . . . . . . . . . . . 0.8 OUTLIER -130.74 162.88 52.44 Favored Pre-proline 0 C--N 1.327 -0.403 0 C-N-CA 124.953 1.301 . . . . 0.0 109.196 -176.939 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 4' ' ' PRO . . . . . . . . . . . . . 30.7 Cg_endo -65.53 -34.52 42.25 Favored 'Trans proline' 0 N--CA 1.457 -0.636 0 C-N-CA 122.275 1.984 . . . . 0.0 111.731 -178.579 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 5' ' ' GLU . . . . . 0.421 ' C ' ' H ' ' A' ' 7' ' ' LEU . 55.1 tt0 -58.63 -55.13 39.02 Favored 'General case' 0 C--N 1.322 -0.61 0 C-N-CA 124.731 1.212 . . . . 0.0 110.656 -177.156 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 6' ' ' GLN . . . . . . . . . . . . . 21.3 pt20 -66.35 12.65 0.06 Allowed 'General case' 0 CA--C 1.541 0.635 0 C-N-CA 125.348 1.459 . . . . 0.0 113.793 177.829 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 7' ' ' LEU . . . . . 0.421 ' H ' ' C ' ' A' ' 5' ' ' GLU . 82.4 mt -124.46 -47.19 1.86 Allowed 'General case' 0 N--CA 1.454 -0.238 0 C-N-CA 126.378 1.871 . . . . 0.0 110.456 177.815 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 8' ' ' GLN . . . . . . . . . . . . 0.259 3.3 pt20 -56.34 -14.53 2.98 Favored 'General case' 0 N--CA 1.472 0.66 0 N-CA-C 114.874 1.435 . . . . 0.0 114.874 -176.361 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 9' ' ' HIS . . . . . . . . . . . . . 10.6 m-70 -124.92 16.64 8.58 Favored 'General case' 0 C--N 1.32 -0.685 0 C-N-CA 124.489 1.116 . . . . 0.0 111.274 -174.811 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 10' ' ' HIS . . . . . . . . . . . . . 97.8 m-70 -142.53 121.3 12.67 Favored 'General case' 0 CA--C 1.541 0.63 0 C-N-CA 125.711 1.604 . . . . 0.0 110.805 -179.879 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 11' ' ' ARG . . . . . . . . . . . . . 4.4 ptm85 -78.67 160.18 27.64 Favored 'General case' 0 N--CA 1.467 0.397 0 C-N-CA 124.853 1.261 . . . . 0.0 109.578 174.164 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 12' ' ' PHE . . . . . . . . . . . . . 34.2 m-85 -140.03 134.74 31.84 Favored 'General case' 0 C--N 1.329 -0.286 0 C-N-CA 123.926 0.891 . . . . 0.0 110.664 -179.171 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 13' ' ' VAL . . . . . . . . . . . . . 11.0 p -120.88 144.21 30.55 Favored 'Isoleucine or valine' 0 C--O 1.233 0.226 0 O-C-N 121.192 -0.942 . . . . 0.0 110.149 -179.213 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 14' ' ' LEU . . . . . . . . . . . . . 35.0 tp -79.42 86.56 5.11 Favored 'General case' 0 C--N 1.332 -0.193 0 C-N-CA 124.959 1.304 . . . . 0.0 110.598 -169.383 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 4.0 mm-40 -55.44 -42.3 74.02 Favored 'General case' 0 C--O 1.235 0.322 0 C-N-CA 124.527 1.131 . . . . 0.0 111.022 176.169 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 22.3 t -155.11 142.98 19.98 Favored 'General case' 0 N--CA 1.452 -0.369 0 CA-C-O 121.918 0.866 . . . . 0.0 110.962 174.571 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 17' ' ' VAL . . . . . . . . . . . . . 44.3 t -67.2 171.15 0.85 Allowed 'Isoleucine or valine' 0 C--O 1.24 0.594 0 N-CA-C 107.235 -1.394 . . . . 0.0 107.235 159.42 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 18' ' ' ASN . . . . . . . . . . . . . 0.2 OUTLIER -46.65 -44.47 18.44 Favored 'General case' 0 CA--C 1.528 0.129 0 C-N-CA 124.245 1.018 . . . . 0.0 111.503 170.888 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . -86.73 -58.57 1.9 Allowed Glycine 0 N--CA 1.446 -0.649 0 O-C-N 124.223 0.952 . . . . 0.0 110.988 -166.421 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 24.3 mttt -149.42 166.15 15.95 Favored Pre-proline 0 C--O 1.238 0.493 0 C-N-CA 126.286 1.834 . . . . 0.0 110.449 -173.178 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 21' ' ' PRO . . . . . . . . . . . . . 42.4 Cg_endo -56.11 171.27 0.86 Allowed 'Trans proline' 0 N--CA 1.455 -0.793 0 C-N-CA 122.082 1.854 . . . . 0.0 111.897 164.329 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 22' ' ' VAL . . . . . . . . . . . . . 4.1 p -128.37 147.15 32.94 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.341 0 C-N-CA 124.775 1.23 . . . . 0.0 108.415 -178.757 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 23' ' ' THR . . . . . . . . . . . . . 1.4 p -110.61 145.57 37.64 Favored 'General case' 0 N--CA 1.452 -0.358 0 C-N-CA 124.734 1.214 . . . . 0.0 109.38 179.172 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 24' ' ' SER . . . . . . . . . . . . . 23.3 t -150.27 137.91 19.88 Favored 'General case' 0 N--CA 1.437 -1.096 0 C-N-CA 127.5 2.32 . . . . 0.0 105.247 176.483 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 25' ' ' ASP . . . . . . . . . . . . . 37.4 t70 -49.74 -59.27 3.97 Favored 'General case' 0 C--N 1.32 -0.706 0 C-N-CA 124.098 0.959 . . . . 0.0 111.905 171.875 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 26' ' ' LYS . . . . . . . . . . . . . 11.2 tttt -153.47 -3.58 0.2 Allowed 'General case' 0 N--CA 1.47 0.542 0 N-CA-C 113.946 1.091 . . . . 0.0 113.946 -175.97 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 27' ' ' ASN . . . . . . . . . . . . . 43.4 m-80 -127.02 83.36 66.2 Favored Pre-proline 0 C--O 1.234 0.263 0 N-CA-C 107.543 -1.28 . . . . 0.0 107.543 -176.249 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 28' ' ' PRO . . . . . . . . . . . . . 49.2 Cg_endo -65.77 162.86 32.86 Favored 'Trans proline' 0 N--CA 1.453 -0.909 0 C-N-CA 121.817 1.678 . . . . 0.0 110.633 -176.559 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 29' ' ' PRO . . . . . . . . . . . . . 30.0 Cg_endo -65.29 84.8 0.2 Allowed 'Trans proline' 0 N--CA 1.449 -1.131 0 C-N-CA 122.437 2.091 . . . . 0.0 108.512 162.913 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 30' ' ' GLU . . . . . . . . . . . . . 11.6 pt-20 -105.49 162.21 13.67 Favored 'General case' 0 C--O 1.241 0.622 0 C-N-CA 124.337 1.055 . . . . 0.0 108.31 169.709 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 31' ' ' ILE . . . . . . . . . . . . . 20.2 tt -138.53 137.19 43.63 Favored 'Isoleucine or valine' 0 N--CA 1.447 -0.622 0 C-N-CA 127.606 2.363 . . . . 0.0 105.501 177.894 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 32' ' ' SER . . . . . . . . . . . . . 1.5 m -131.39 163.72 27.26 Favored 'General case' 0 N--CA 1.447 -0.622 0 N-CA-C 107.974 -1.121 . . . . 0.0 107.974 174.159 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 33' ' ' PHE . . . . . . . . . . . . . 35.3 m-85 -131.65 166.6 21.1 Favored 'General case' 0 N--CA 1.445 -0.679 0 N-CA-C 107.097 -1.446 . . . . 0.0 107.097 -179.698 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 34' ' ' GLY . . . . . . . . . . . . . . . 166.93 141.15 3.07 Favored Glycine 0 CA--C 1.503 -0.659 0 N-CA-C 108.208 -1.957 . . . . 0.0 108.208 -174.966 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 35' ' ' GLU . . . . . . . . . . . . . 90.8 mt-10 59.64 108.83 0.02 OUTLIER 'General case' 0 C--O 1.222 -0.348 0 C-N-CA 127.698 2.399 . . . . 0.0 110.675 -176.612 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 35.5 mtpt 61.48 12.31 4.33 Favored 'General case' 0 N--CA 1.473 0.701 0 N-CA-C 115.312 1.597 . . . . 0.0 115.312 169.486 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 37' ' ' MET . . . . . . . . . . . . . 13.5 mmm 58.06 49.84 10.97 Favored 'General case' 0 CA--C 1.537 0.479 0 C-N-CA 124.35 1.06 . . . . 0.0 112.488 -161.097 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 38' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -63.27 167.13 5.48 Favored 'General case' 0 N--CA 1.452 -0.346 0 O-C-N 120.624 -1.298 . . . . 0.0 109.279 150.017 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 39' ' ' ILE . . . . . . . . . . . . . 10.3 mt -132.61 133.46 59.53 Favored 'Isoleucine or valine' 0 C--O 1.238 0.477 0 C-N-CA 125.503 1.521 . . . . 0.0 107.214 -179.223 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 40' ' ' SER . . . . . . . . . . . . . 16.4 m -131.47 151.84 51.22 Favored 'General case' 0 C--N 1.33 -0.268 0 N-CA-C 106.887 -1.523 . . . . 0.0 106.887 156.361 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 41' ' ' GLY . . . . . . . . . . . . . . . -178.06 178.42 48.51 Favored Glycine 0 N--CA 1.446 -0.699 0 N-CA-C 109.767 -1.333 . . . . 0.0 109.767 174.158 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 42' ' ' SER . . . . . . . . . . . . . 6.1 p -151.95 84.53 1.28 Allowed 'General case' 0 N--CA 1.445 -0.687 0 N-CA-C 108.978 -0.749 . . . . 0.0 108.978 -169.673 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 43' ' ' MET . . . . . . . . . . . . . 17.5 mmm -60.81 -46.38 90.73 Favored 'General case' 0 C--N 1.341 0.228 0 N-CA-C 108.43 -0.952 . . . . 0.0 108.43 169.726 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 44' ' ' CYS . . . . . 1.282 ' SG ' ' SG ' ' A' ' 70' ' ' CYS . 2.2 t -159.84 -66.93 0.07 Allowed 'General case' 0 N--CA 1.433 -1.319 0 N-CA-C 105.14 -2.17 . . . . 0.0 105.14 165.559 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 45' ' ' ASN . . . . . . . . . . . . . 5.0 m-80 -74.63 10.96 1.14 Allowed 'General case' 0 N--CA 1.471 0.595 0 C-N-CA 125.633 1.573 . . . . 0.0 114.682 -166.89 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 46' ' ' ARG . . . . . . . . . . . . . 6.7 mmm-85 56.46 164.79 0.02 OUTLIER 'General case' 0 C--N 1.332 -0.195 0 C-N-CA 126.671 1.988 . . . . 0.0 112.695 -169.329 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 47' ' ' PHE . . . . . . . . . . . . . 53.0 p90 -167.05 165.21 15.84 Favored 'General case' 0 C--N 1.325 -0.496 0 C-N-CA 125.561 1.544 . . . . 0.0 107.727 178.403 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 48' ' ' SER . . . . . . . . . . . . . 0.5 OUTLIER -168.54 141.37 2.93 Favored 'General case' 0 C--N 1.329 -0.303 0 C-N-CA 125.611 1.564 . . . . 0.0 107.742 171.688 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 49' ' ' GLY . . . . . . . . . . . . . . . -152.94 163.33 30.44 Favored Glycine 0 CA--C 1.53 1.028 0 N-CA-C 111.019 -0.832 . . . . 0.0 111.019 175.21 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 50' ' ' GLU . . . . . . . . . . . . . 9.9 pt-20 -63.76 83.18 0.03 OUTLIER 'General case' 0 CA--C 1.538 0.504 0 C-N-CA 128.258 2.623 . . . . 0.0 110.038 172.432 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 51' ' ' GLY . . . . . . . . . . . . . . . -63.8 -76.79 0.26 Allowed Glycine 0 N--CA 1.466 0.635 0 O-C-N 121.386 -0.821 . . . . 0.0 113.355 -166.754 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 52' ' ' LYS . . . . . . . . . . . . . 3.4 ttpm? 57.33 126.94 0.0 OUTLIER 'General case' 0 C--N 1.331 -0.208 0 C-N-CA 130.631 3.573 . . . . 0.0 112.797 176.518 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 53' ' ' LEU . . . . . . . . . . . . . 32.4 tp -125.07 119.45 28.67 Favored 'General case' 0 N--CA 1.467 0.405 0 O-C-N 121.643 -0.661 . . . . 0.0 110.339 -174.341 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 10.0 t -145.1 -17.09 0.5 Allowed 'General case' 0 CA--C 1.539 0.551 0 C-N-CA 125.185 1.394 . . . . 0.0 110.692 178.703 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 55' ' ' ASN . . . . . . . . . . . . . 6.6 m-20 -129.3 6.65 5.33 Favored 'General case' 0 CA--C 1.536 0.416 0 CA-C-N 119.331 0.969 . . . . 0.0 112.275 -159.734 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 56' ' ' GLY . . . . . . . . . . . . . . . 75.06 4.66 73.25 Favored Glycine 0 CA--C 1.532 1.124 0 O-C-N 121.451 -0.781 . . . . 0.0 112.237 -165.792 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 57' ' ' GLU . . . . . . . . . . . . . 33.2 tt0 -121.03 131.24 54.16 Favored 'General case' 0 C--O 1.234 0.28 0 CA-C-N 118.443 1.121 . . . . 0.0 108.698 -169.052 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 58' ' ' LEU . . . . . . . . . . . . . 47.0 tp -116.65 98.64 6.64 Favored 'General case' 0 C--O 1.236 0.352 0 C-N-CA 124.814 1.246 . . . . 0.0 108.864 173.713 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 59' ' ' THR . . . . . . . . . . . . . 2.1 p -85.34 169.73 13.44 Favored 'General case' 0 C--N 1.327 -0.379 0 C-N-CA 123.961 0.904 . . . . 0.0 111.945 172.492 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 60' ' ' ALA . . . . . . . . . . . . . . . -142.94 103.76 4.22 Favored 'General case' 0 N--CA 1.455 -0.18 0 C-N-CA 125.995 1.718 . . . . 0.0 109.437 148.567 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 61' ' ' LYS . . . . . . . . . . . . . 45.5 tttt -69.23 -18.45 63.88 Favored 'General case' 0 CA--C 1.542 0.672 0 CA-C-O 118.892 -0.575 . . . . 0.0 111.988 173.598 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 62' ' ' GLY . . . . . . . . . . . . . . . -102.84 -83.85 1.75 Allowed Glycine 0 CA--C 1.526 0.73 0 C-N-CA 124.521 1.058 . . . . 0.0 110.764 176.382 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 63' ' ' LEU . . . . . . . . . . . . . 2.4 tp 65.03 79.06 0.26 Allowed 'General case' 0 N--CA 1.448 -0.546 0 C-N-CA 129.442 3.097 . . . . 0.0 114.379 -178.003 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 64' ' ' ALA . . . . . . . . . . . . . . . -70.09 92.65 0.76 Allowed 'General case' 0 CA--C 1.539 0.525 0 C-N-CA 125.121 1.368 . . . . 0.0 112.367 178.591 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 65' ' ' MET . . . . . . . . . . . . . 52.8 mtp -99.22 173.81 6.61 Favored 'General case' 0 N--CA 1.472 0.628 0 C-N-CA 124.649 1.18 . . . . 0.0 111.45 176.205 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 66' ' ' THR . . . . . . . . . . . . . 5.5 p -115.76 -164.84 0.98 Allowed 'General case' 0 CA--C 1.547 0.836 0 C-N-CA 124.725 1.21 . . . . 0.0 112.104 -178.429 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 67' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -141.26 31.53 1.73 Allowed 'General case' 0 N--CA 1.474 0.772 0 C-N-CA 126.449 1.9 . . . . 0.0 112.332 -173.265 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 68' ' ' MET . . . . . . . . . . . . . 76.6 mtm -76.71 179.97 5.72 Favored 'General case' 0 CA--C 1.545 0.785 0 C-N-CA 125.302 1.441 . . . . 0.0 109.969 173.079 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 69' ' ' MET . . . . . . . . . . . . . 1.5 mpp? -110.91 168.63 9.34 Favored 'General case' 0 C--O 1.237 0.417 0 C-N-CA 128.415 2.686 . . . . 0.0 109.702 172.915 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 70' ' ' CYS . . . . . 1.282 ' SG ' ' SG ' ' A' ' 44' ' ' CYS . 1.7 m -140.12 150.26 44.05 Favored 'General case' 0 N--CA 1.469 0.487 0 C-N-CA 125.161 1.384 . . . . 0.0 112.427 176.522 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 71' ' ' ALA . . . . . . . . . . . . . . . -70.29 -10.96 60.47 Favored 'General case' 0 CA--C 1.534 0.354 0 C-N-CA 126.039 1.736 . . . . 0.0 114.91 -174.443 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 72' ' ' ASN . . . . . . . . . . . . . 61.3 t30 -135.67 142.53 41.22 Favored Pre-proline 0 C--O 1.235 0.303 0 N-CA-C 105.756 -1.942 . . . . 0.0 105.756 177.716 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 73' ' ' PRO . . . . . . . . . . . . . 87.2 Cg_endo -84.56 -23.95 2.55 Favored 'Trans proline' 0 N--CA 1.458 -0.575 0 CA-C-N 120.536 1.227 . . . . 0.0 111.384 -163.862 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 74' ' ' GLN . . . . . . . . . . . . . 57.4 tt0 -60.06 -43.63 95.29 Favored 'General case' 0 N--CA 1.452 -0.332 0 C-N-CA 123.574 0.75 . . . . 0.0 109.004 175.311 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 75' ' ' LEU . . . . . . . . . . . . . 65.3 mt -59.25 -45.91 89.91 Favored 'General case' 0 C--N 1.341 0.199 0 CA-C-N 118.213 0.461 . . . . 0.0 110.309 178.726 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 76' ' ' ASN . . . . . . . . . . . . . 27.2 t-20 -64.83 -49.63 69.85 Favored 'General case' 0 C--O 1.222 -0.368 0 N-CA-C 108.892 -0.781 . . . . 0.0 108.892 -176.768 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 77' ' ' GLU . . . . . . . . . . . . . 8.4 tt0 -56.61 -34.5 67.29 Favored 'General case' 0 CA--C 1.537 0.471 0 C-N-CA 125.392 1.477 . . . . 0.0 112.754 -178.961 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 78' ' ' LEU . . . . . . . . . . . . . 3.5 mp -67.51 -14.01 62.56 Favored 'General case' 0 C--O 1.236 0.348 0 C-N-CA 125.056 1.343 . . . . 0.0 112.758 -179.574 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 79' ' ' ASP . . . . . . . . . . . . . 5.0 p-10 -60.23 -38.0 82.05 Favored 'General case' 0 CA--C 1.52 -0.196 0 CA-C-N 119.217 0.917 . . . . 0.0 111.531 176.355 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 80' ' ' ASN . . . . . . . . . . . . . 63.3 m-20 -77.26 -38.81 50.17 Favored 'General case' 0 N--CA 1.445 -0.675 0 CA-C-O 118.11 -0.948 . . . . 0.0 109.999 178.02 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 81' ' ' THR . . . . . . . . . . . . . 41.7 m -54.62 -52.76 61.22 Favored 'General case' 0 C--N 1.341 0.199 0 CA-C-N 118.983 0.81 . . . . 0.0 109.73 179.336 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 82' ' ' ILE . . . . . . . . . . . . . 9.6 tp -65.63 -36.89 78.69 Favored 'Isoleucine or valine' 0 CA--C 1.531 0.216 0 CA-C-N 118.842 0.746 . . . . 0.0 110.273 -175.182 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 83' ' ' SER . . . . . . . . . . . . . 10.8 t -58.11 -49.33 77.32 Favored 'General case' 0 C--O 1.234 0.269 0 CA-C-N 117.994 0.361 . . . . 0.0 110.897 174.819 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 84' ' ' GLU . . . . . . . . . . . . . 78.1 tt0 -78.18 -7.64 57.32 Favored 'General case' 0 C--N 1.327 -0.411 0 C-N-CA 126.593 1.957 . . . . 0.0 111.62 -175.557 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 85' ' ' MET . . . . . . . . . . . . . 81.5 mtp -90.28 -52.19 5.06 Favored 'General case' 0 CA--C 1.515 -0.371 0 CA-C-N 120.999 1.727 . . . . 0.0 110.373 167.243 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 86' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -66.47 -29.67 69.85 Favored 'General case' 0 N--CA 1.453 -0.293 0 CA-C-O 118.816 -0.612 . . . . 0.0 110.882 -169.387 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 87' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -58.84 -56.82 17.29 Favored 'General case' 0 N--CA 1.452 -0.357 0 CA-C-N 119.345 0.975 . . . . 0.0 112.405 -171.933 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 88' ' ' GLU . . . . . . . . . . . . . 81.1 mt-10 -73.39 -34.98 65.81 Favored 'General case' 0 C--N 1.331 -0.204 0 C-N-CA 123.137 0.575 . . . . 0.0 110.855 -175.327 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 89' ' ' GLY . . . . . . . . . . . . . . . 123.13 104.35 1.71 Allowed Glycine 0 C--N 1.333 0.365 0 N-CA-C 107.373 -2.291 . . . . 0.0 107.373 -176.108 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 90' ' ' ALA . . . . . . . . . . . . . . . -74.96 137.15 41.42 Favored 'General case' 0 N--CA 1.451 -0.424 0 N-CA-C 107.873 -1.158 . . . . 0.0 107.873 170.768 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 91' ' ' GLN . . . . . . . . . . . . . 17.9 mp0 -65.83 121.98 16.28 Favored 'General case' 0 N--CA 1.442 -0.844 0 N-CA-C 104.738 -2.319 . . . . 0.0 104.738 159.369 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 92' ' ' VAL . . . . . . . . . . . . . 25.2 t -107.33 119.91 57.76 Favored 'Isoleucine or valine' 0 N--CA 1.44 -0.968 0 N-CA-C 104.83 -2.285 . . . . 0.0 104.83 174.229 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 93' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -134.33 104.04 5.98 Favored 'General case' 0 N--CA 1.452 -0.338 0 N-CA-C 107.049 -1.463 . . . . 0.0 107.049 176.773 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 94' ' ' LEU . . . . . . . . . . . . . 27.1 tp -98.2 118.49 34.95 Favored 'General case' 0 CA--C 1.515 -0.39 0 N-CA-C 106.823 -1.547 . . . . 0.0 106.823 173.854 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 95' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -80.71 -165.4 0.88 Allowed 'General case' 0 C--N 1.323 -0.569 0 C-N-CA 124.429 1.091 . . . . 0.0 109.494 165.846 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 96' ' ' ALA . . . . . . . . . . . . . . . -47.74 -52.13 19.67 Favored 'General case' 0 CA--C 1.541 0.633 0 O-C-N 120.524 -1.36 . . . . 0.0 113.143 -179.887 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 97' ' ' ASN . . . . . . . . . . . . . 0.0 OUTLIER -135.26 8.52 3.43 Favored 'General case' 0 N--CA 1.478 0.961 0 N-CA-C 114.05 1.129 . . . . 0.0 114.05 -177.942 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 98' ' ' GLN . . . . . . . . . . . . . 18.4 tt0 -136.79 124.78 22.79 Favored 'General case' 0 N--CA 1.453 -0.294 0 O-C-N 121.233 -0.917 . . . . 0.0 109.371 -170.111 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 99' ' ' LEU . . . . . . . . . . . . . 1.0 OUTLIER -88.45 142.24 27.88 Favored 'General case' 0 N--CA 1.449 -0.515 0 C-N-CA 125.453 1.501 . . . . 0.0 109.229 175.521 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 100' ' ' THR . . . . . . . . . . . . . 79.3 m -122.99 115.55 22.07 Favored 'General case' 0 C--N 1.322 -0.622 0 N-CA-C 105.436 -2.061 . . . . 0.0 105.436 171.685 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 101' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -112.93 101.35 9.41 Favored 'General case' 0 CA--C 1.51 -0.585 0 C-N-CA 126.109 1.764 . . . . 0.0 107.153 -179.05 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 102' ' ' ALA . . . . . . . . . . . . . . . -117.69 152.49 35.12 Favored 'General case' 0 C--N 1.326 -0.444 0 C-N-CA 123.284 0.634 . . . . 0.0 109.59 -177.622 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 103' ' ' THR . . . . . . . . . . . . . 0.4 OUTLIER -159.09 176.12 12.66 Favored 'General case' 0 N--CA 1.44 -0.97 0 C-N-CA 126.481 1.912 . . . . 0.0 106.659 176.147 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 104' ' ' ALA . . . . . . . . . . . . . . . -62.58 -14.01 37.82 Favored 'General case' 0 CA--C 1.536 0.424 0 N-CA-C 113.338 0.866 . . . . 0.0 113.338 173.669 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 105' ' ' LYS . . . . . . . . . . . . . 12.6 tppt? -73.79 -75.76 0.14 Allowed 'General case' 0 N--CA 1.437 -1.084 0 C-N-CA 125.302 1.441 . . . . 0.0 107.461 176.154 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 106' ' ' GLN . . . . . . . . . . . . . 14.5 mt-30 -165.27 178.78 6.66 Favored 'General case' 0 CA--C 1.542 0.646 0 C-N-CA 128.605 2.762 . . . . 0.0 104.834 -169.213 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 107' ' ' THR . . . . . . . . . . . . . 4.6 t -131.42 141.85 49.92 Favored 'General case' 0 CA--C 1.539 0.547 0 C-N-CA 124.796 1.238 . . . . 0.0 110.237 -173.533 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 108' ' ' LEU . . . . . . . . . . . . . 8.9 mp -126.21 154.34 43.41 Favored 'General case' 0 C--O 1.234 0.265 0 C-N-CA 128.419 2.687 . . . . 0.0 108.596 -171.146 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 109' ' ' THR . . . . . . . . . . . . . 27.2 m -123.01 117.74 26.17 Favored 'General case' 0 N--CA 1.466 0.363 0 C-N-CA 123.409 0.684 . . . . 0.0 109.238 173.911 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 110' ' ' TYR . . . . . . . . . . . . . 73.9 m-85 -108.86 160.72 15.76 Favored 'General case' 0 CA--C 1.539 0.523 0 C-N-CA 123.461 0.704 . . . . 0.0 109.508 174.772 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 111' ' ' LYS . . . . . . . . . . . . . 2.1 tppt? -114.83 147.69 39.5 Favored 'General case' 0 N--CA 1.467 0.413 0 C-N-CA 124.603 1.161 . . . . 0.0 110.068 -178.944 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 112' ' ' LEU . . . . . . . . . . . . . 23.9 tp -73.43 38.33 0.09 Allowed 'General case' 0 CA--C 1.542 0.654 0 C-N-CA 127.379 2.272 . . . . 0.0 111.871 171.76 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 113' ' ' ALA . . . . . . . . . . . . . . . -77.05 88.06 3.56 Favored 'General case' 0 C--N 1.324 -0.535 0 O-C-N 119.234 -2.166 . . . . 0.0 109.453 -176.878 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 114' ' ' ASP . . . . . . . . . . . . 0.31 29.8 p-10 -105.3 55.99 0.69 Allowed 'General case' 0 N--CA 1.464 0.264 0 CA-C-O 123.712 1.72 . . . . 0.0 113.324 -173.134 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 115' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -64.29 4.64 0.33 Allowed 'General case' 0 CA--C 1.54 0.571 0 C-N-CA 129.331 3.052 . . . . 0.0 114.726 174.175 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 116' ' ' MET . . . . . . . . . . . . . 4.2 ppp? -78.6 -20.05 51.32 Favored 'General case' 0 C--N 1.325 -0.484 0 O-C-N 120.777 -1.202 . . . . 0.0 110.304 169.104 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 117' ' ' ASN . . . . . . . . . . . . . 3.9 p-10 . . . . . 0 N--CA 1.452 -0.348 0 N-CA-C 109.091 -0.707 . . . . 0.0 109.091 175.814 . . . . . . . . 0 0 . 1 . 017 nuclear orig full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 24.6 tpp . . . . . 0 C--O 1.24 0.597 0 N-CA-C 108.895 -0.78 . . . . 0.0 108.895 . . . . . . . . . 0 0 . 1 . 017 nuclear orig full ' A' A ' 2' ' ' VAL . . . . . . . . . . . . . 10.0 p -53.9 118.71 1.25 Allowed 'Isoleucine or valine' 0 N--CA 1.449 -0.485 0 C-N-CA 123.884 0.873 . . . . 0.0 109.128 -178.016 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 3' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -128.56 157.53 74.71 Favored Pre-proline 0 N--CA 1.449 -0.501 0 N-CA-C 109.287 -0.634 . . . . 0.0 109.287 -167.776 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 4' ' ' PRO . . . . . . . . . . . . . 21.7 Cg_endo -63.62 -48.45 5.66 Favored 'Trans proline' 0 N--CA 1.456 -0.691 0 C-N-CA 122.74 2.293 . . . . 0.0 111.787 -176.469 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 5' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER -68.17 -12.66 61.32 Favored 'General case' 0 C--N 1.325 -0.491 0 N-CA-C 113.722 1.008 . . . . 0.0 113.722 -173.007 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 6' ' ' GLN . . . . . . . . . . . . . 11.1 pt20 -93.85 15.21 17.18 Favored 'General case' 0 CA--C 1.54 0.566 0 N-CA-C 113.908 1.077 . . . . 0.0 113.908 167.442 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 7' ' ' LEU . . . . . 0.406 ' C ' ' H ' ' A' ' 9' ' ' HIS . 90.6 mt -129.88 -44.76 1.18 Allowed 'General case' 0 N--CA 1.469 0.508 0 C-N-CA 124.569 1.148 . . . . 0.0 111.949 -175.639 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 8' ' ' GLN . . . . . . . . . . . . . 1.5 mp0 -56.64 2.32 0.02 OUTLIER 'General case' 0 N--CA 1.472 0.671 0 N-CA-C 118.353 2.723 . . . . 0.0 118.353 -176.059 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 9' ' ' HIS . . . . . 0.406 ' H ' ' C ' ' A' ' 7' ' ' LEU . 5.7 m-70 -139.66 10.58 2.46 Favored 'General case' 0 C--N 1.319 -0.739 0 C-N-CA 127.946 2.498 . . . . 0.0 112.516 179.95 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 10' ' ' HIS . . . . . . . . . . . . . 27.8 m-70 -133.25 110.54 10.17 Favored 'General case' 0 N--CA 1.455 -0.214 0 C-N-CA 124.153 0.981 . . . . 0.0 108.687 -161.462 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 11' ' ' ARG . . . . . . . . . . . . . 20.7 ttt-85 -68.74 147.11 52.28 Favored 'General case' 0 N--CA 1.465 0.315 0 N-CA-C 108.444 -0.947 . . . . 0.0 108.444 172.915 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 12' ' ' PHE . . . . . . . . . . . . . 46.5 m-85 -127.83 161.07 29.87 Favored 'General case' 0 N--CA 1.45 -0.448 0 N-CA-C 107.648 -1.242 . . . . 0.0 107.648 165.502 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 13' ' ' VAL . . . . . . . . . . . . . 7.5 p -131.44 143.17 41.33 Favored 'Isoleucine or valine' 0 CA--C 1.512 -0.484 0 N-CA-C 108.188 -1.041 . . . . 0.0 108.188 172.045 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 14' ' ' LEU . . . . . . . . . . . . . 5.6 tt -70.04 110.19 4.96 Favored 'General case' 0 N--CA 1.441 -0.903 0 N-CA-C 107.874 -1.158 . . . . 0.0 107.874 179.977 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 15' ' ' GLU . . . . . 0.403 ' H ' ' HA ' ' A' ' 110' ' ' TYR . 3.1 tt0 -86.0 -42.05 14.33 Favored 'General case' 0 N--CA 1.438 -1.043 0 O-C-N 124.013 0.821 . . . . 0.0 110.217 -169.371 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 12.6 p -154.33 142.81 20.66 Favored 'General case' 0 N--CA 1.448 -0.555 0 CA-C-O 121.735 0.779 . . . . 0.0 109.834 168.369 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 17' ' ' VAL . . . . . . . . . . . . . 23.2 t -75.62 175.08 0.76 Allowed 'Isoleucine or valine' 0 CA--C 1.536 0.409 0 N-CA-C 107.028 -1.471 . . . . 0.0 107.028 168.401 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 18' ' ' ASN . . . . . . . . . . . . . 10.6 t30 -43.9 -51.6 7.44 Favored 'General case' 0 C--N 1.34 0.194 0 C-N-CA 124.533 1.133 . . . . 0.0 112.628 -171.554 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . -78.29 -66.21 1.77 Allowed Glycine 0 N--CA 1.444 -0.812 0 O-C-N 123.725 0.641 . . . . 0.0 111.609 176.28 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 0.8 OUTLIER -139.68 165.75 29.06 Favored Pre-proline 0 CA--C 1.532 0.259 0 CA-C-N 117.752 0.776 . . . . 0.0 112.917 -159.126 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 21' ' ' PRO . . . . . . . . . . . . . 56.5 Cg_endo -61.46 -176.9 0.19 Allowed 'Trans proline' 0 N--CA 1.457 -0.654 0 C-N-CA 124.094 3.196 . . . . 0.0 113.185 176.627 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 22' ' ' VAL . . . . . . . . . . . . . 81.6 t -120.86 155.36 24.36 Favored 'Isoleucine or valine' 0 N--CA 1.448 -0.544 0 C-N-CA 126.576 1.95 . . . . 0.0 109.208 -179.227 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 23' ' ' THR . . . . . . . . . . . . . 11.3 t -141.17 114.36 8.63 Favored 'General case' 0 C--O 1.235 0.292 0 CA-C-O 123.259 1.504 . . . . 0.0 111.844 168.169 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 24' ' ' SER . . . . . . . . . . . . . 39.1 t -158.18 94.91 1.33 Allowed 'General case' 0 C--N 1.319 -0.74 0 N-CA-C 105.017 -2.216 . . . . 0.0 105.017 172.433 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 25' ' ' ASP . . . . . . . . . . . . . 0.7 OUTLIER -80.06 38.97 0.42 Allowed 'General case' 0 N--CA 1.468 0.451 0 C-N-CA 125.467 1.507 . . . . 0.0 110.552 -176.297 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 26' ' ' LYS . . . . . . . . . . . . . 33.0 ttpt -151.28 -46.73 0.11 Allowed 'General case' 0 CA--C 1.508 -0.654 0 O-C-N 120.268 -1.52 . . . . 0.0 112.083 178.181 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 27' ' ' ASN . . . . . . . . . . . . . 0.0 OUTLIER -150.79 83.27 5.8 Favored Pre-proline 0 C--N 1.319 -0.739 0 N-CA-C 106.708 -1.59 . . . . 0.0 106.708 176.644 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 28' ' ' PRO . . . . . . . . . . . . . 75.2 Cg_endo -71.19 170.74 17.48 Favored 'Trans proline' 0 N--CA 1.454 -0.83 0 C-N-CA 122.171 1.914 . . . . 0.0 109.257 167.561 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 29' ' ' PRO . . . . . . . . . . . . . 37.6 Cg_endo -70.85 63.91 2.43 Favored 'Trans proline' 0 N--CA 1.457 -0.656 0 C-N-CA 124.065 3.177 . . . . 0.0 111.063 173.469 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 30' ' ' GLU . . . . . . . . . . . . . 2.4 pt-20 -78.66 168.82 19.2 Favored 'General case' 0 C--O 1.239 0.505 0 O-C-N 120.09 -1.631 . . . . 0.0 109.2 172.608 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 31' ' ' ILE . . . . . . . . . . . . . 14.4 tt -144.16 152.68 15.62 Favored 'Isoleucine or valine' 0 C--O 1.237 0.434 0 N-CA-C 107.641 -1.244 . . . . 0.0 107.641 -177.202 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 32' ' ' SER . . . . . . . . . . . . . 41.1 p -147.09 165.89 28.55 Favored 'General case' 0 N--CA 1.444 -0.747 0 CA-C-O 121.666 0.746 . . . . 0.0 109.372 178.154 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 33' ' ' PHE . . . . . . . . . . . . . 78.5 m-85 -146.13 125.67 13.27 Favored 'General case' 0 N--CA 1.445 -0.713 0 N-CA-C 105.623 -1.992 . . . . 0.0 105.623 -168.373 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 34' ' ' GLY . . . . . . . . . . . . . . . -156.19 167.13 33.31 Favored Glycine 0 CA--C 1.53 1.02 0 N-CA-C 109.631 -1.387 . . . . 0.0 109.631 160.729 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 35' ' ' GLU . . . . . . . . . . . . . 4.6 mt-10 56.54 89.63 0.04 OUTLIER 'General case' 0 N--CA 1.468 0.438 0 C-N-CA 126.945 2.098 . . . . 0.0 113.869 168.641 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 44.3 mtmt 74.14 32.35 1.03 Allowed 'General case' 0 N--CA 1.474 0.769 0 C-N-CA 127.472 2.309 . . . . 0.0 113.204 176.097 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 37' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER 59.03 33.86 23.21 Favored 'General case' 0 CA--C 1.54 0.585 0 C-N-CA 123.791 0.836 . . . . 0.0 110.21 -176.931 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 38' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -67.5 171.38 6.22 Favored 'General case' 0 N--CA 1.453 -0.278 0 O-C-N 120.902 -1.124 . . . . 0.0 111.115 170.535 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 39' ' ' ILE . . . . . . . . . . . . . 27.6 mt -137.33 109.34 6.72 Favored 'Isoleucine or valine' 0 C--O 1.235 0.325 0 N-CA-C 108.061 -1.089 . . . . 0.0 108.061 -176.452 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 40' ' ' SER . . . . . . . . . . . . . 34.7 m -90.1 137.93 31.94 Favored 'General case' 0 C--N 1.33 -0.246 0 C-N-CA 123.601 0.76 . . . . 0.0 109.027 158.642 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 41' ' ' GLY . . . . . . . . . . . . . . . -160.6 -179.33 35.29 Favored Glycine 0 CA--C 1.525 0.668 0 N-CA-C 110.254 -1.139 . . . . 0.0 110.254 165.257 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 42' ' ' SER . . . . . . . . . . . . . 1.8 p -160.34 92.78 1.0 Allowed 'General case' 0 N--CA 1.454 -0.24 0 CA-C-N 118.841 1.32 . . . . 0.0 111.254 174.439 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 43' ' ' MET . . . . . . . . . . . . . 9.2 mmt -64.73 -66.94 0.48 Allowed 'General case' 0 C--O 1.232 0.149 0 N-CA-C 109.498 -0.556 . . . . 0.0 109.498 175.316 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 44' ' ' CYS . . . . . 1.283 ' SG ' ' SG ' ' A' ' 70' ' ' CYS . 44.8 t -132.72 -59.83 0.89 Allowed 'General case' 0 N--CA 1.452 -0.358 0 N-CA-C 106.426 -1.694 . . . . 0.0 106.426 168.449 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 45' ' ' ASN . . . . . . . . . . . . . 4.8 m120 -80.34 27.56 0.34 Allowed 'General case' 0 C--N 1.328 -0.329 0 C-N-CA 128.665 2.786 . . . . 0.0 112.064 -165.453 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 46' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER 52.55 -166.19 0.06 Allowed 'General case' 0 C--N 1.327 -0.41 0 C-N-CA 124.769 1.228 . . . . 0.0 108.021 -157.275 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 47' ' ' PHE . . . . . . . . . . . . . 6.3 p90 -178.42 170.43 1.69 Allowed 'General case' 0 C--O 1.237 0.446 0 C-N-CA 129.19 2.996 . . . . 0.0 107.984 147.616 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 48' ' ' SER . . . . . . . . . . . . . 1.5 p -166.1 160.63 16.53 Favored 'General case' 0 C--N 1.322 -0.6 0 C-N-CA 126.192 1.797 . . . . 0.0 108.751 178.153 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 49' ' ' GLY . . . . . . . . . . . . . . . 177.83 163.1 28.98 Favored Glycine 0 C--N 1.332 0.337 0 N-CA-C 110.721 -0.951 . . . . 0.0 110.721 163.16 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 50' ' ' GLU . . . . . . . . . . . . . 11.1 pt-20 -68.52 100.31 1.09 Allowed 'General case' 0 N--CA 1.449 -0.493 0 CA-C-O 122.048 0.928 . . . . 0.0 108.721 173.525 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 51' ' ' GLY . . . . . . . . . . . . . . . -77.04 171.88 55.14 Favored Glycine 0 CA--C 1.529 0.945 0 C-N-CA 124.224 0.916 . . . . 0.0 111.912 171.421 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 52' ' ' LYS . . . . . . . . . . . . . 6.2 ttpm? -156.9 148.62 22.57 Favored 'General case' 0 N--CA 1.464 0.247 0 C-N-CA 124.916 1.287 . . . . 0.0 108.066 166.444 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 53' ' ' LEU . . . . . . . . . . . . . 50.7 tp -148.37 142.65 26.18 Favored 'General case' 0 C--N 1.338 0.069 0 C-N-CA 124.512 1.125 . . . . 0.0 109.141 174.655 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 23.1 t -156.21 -61.88 0.1 Allowed 'General case' 0 CA--C 1.535 0.393 0 C-N-CA 125.389 1.475 . . . . 0.0 107.792 173.599 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 55' ' ' ASN . . . . . . . . . . . . . 20.7 p-10 -65.46 -58.67 5.25 Favored 'General case' 0 N--CA 1.464 0.265 0 C-N-CA 125.711 1.604 . . . . 0.0 113.016 177.818 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 56' ' ' GLY . . . . . . . . . . . . . . . 150.96 14.16 0.08 OUTLIER Glycine 0 CA--C 1.529 0.944 0 C-N-CA 123.489 0.566 . . . . 0.0 111.911 -163.573 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 57' ' ' GLU . . . . . . . . . . . . . 26.8 tt0 -131.96 115.84 16.37 Favored 'General case' 0 CA--C 1.533 0.29 0 CA-C-N 118.185 0.992 . . . . 0.0 109.146 -175.654 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 58' ' ' LEU . . . . . . . . . . . . . 37.8 tp -93.13 102.4 14.71 Favored 'General case' 0 C--O 1.236 0.366 0 C-N-CA 127.291 2.237 . . . . 0.0 110.159 -177.503 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 59' ' ' THR . . . . . . . . . . . . . 18.2 p -94.68 163.59 13.31 Favored 'General case' 0 CA--C 1.533 0.313 0 C-N-CA 122.945 0.498 . . . . 0.0 110.036 168.122 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 60' ' ' ALA . . . . . . . . . . . . . . . -147.24 103.48 3.58 Favored 'General case' 0 C--N 1.342 0.273 0 C-N-CA 123.673 0.789 . . . . 0.0 111.218 155.465 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 61' ' ' LYS . . . . . . . . . . . . . 73.6 tttt -86.47 77.62 9.4 Favored 'General case' 0 N--CA 1.463 0.18 0 C-N-CA 124.496 1.118 . . . . 0.0 109.48 178.201 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 62' ' ' GLY . . . . . . . . . . . . . . . 148.01 80.44 0.03 OUTLIER Glycine 0 N--CA 1.464 0.526 0 N-CA-C 110.161 -1.176 . . . . 0.0 110.161 175.14 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 63' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -117.47 83.22 1.95 Allowed 'General case' 0 N--CA 1.439 -0.98 0 C-N-CA 124.294 1.038 . . . . 0.0 110.065 -159.609 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 64' ' ' ALA . . . . . . . . . . . . . . . -77.68 96.17 4.79 Favored 'General case' 0 C--O 1.244 0.777 0 C-N-CA 126.034 1.733 . . . . 0.0 112.134 179.756 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 65' ' ' MET . . . . . . . . . . . . 0.259 6.5 ptm -124.61 172.3 9.35 Favored 'General case' 0 CA--C 1.531 0.235 0 C-N-CA 123.706 0.803 . . . . 0.0 109.787 170.611 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 66' ' ' THR . . . . . . . . . . . . . 15.8 p -104.85 -165.09 1.1 Allowed 'General case' 0 C--N 1.326 -0.455 0 C-N-CA 124.371 1.068 . . . . 0.0 109.503 -162.25 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 67' ' ' ARG . . . . . . . . . . . . . 0.5 OUTLIER -133.5 26.03 4.09 Favored 'General case' 0 C--O 1.237 0.404 0 C-N-CA 125.416 1.486 . . . . 0.0 112.075 -178.181 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 68' ' ' MET . . . . . . . . . . . . . 18.2 ptm -73.26 -169.68 0.67 Allowed 'General case' 0 CA--C 1.536 0.436 0 C-N-CA 125.321 1.448 . . . . 0.0 110.467 172.693 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 69' ' ' MET . . . . . . . . . . . . . 0.8 OUTLIER -142.6 -179.16 6.14 Favored 'General case' 0 C--O 1.238 0.49 0 C-N-CA 127.157 2.183 . . . . 0.0 109.03 -179.715 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 70' ' ' CYS . . . . . 1.283 ' SG ' ' SG ' ' A' ' 44' ' ' CYS . 70.0 m -149.21 163.71 36.86 Favored 'General case' 0 N--CA 1.455 -0.194 0 C-N-CA 124.417 1.087 . . . . 0.0 111.157 -176.581 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 71' ' ' ALA . . . . . . . . . . . . . . . -69.65 11.9 0.23 Allowed 'General case' 0 CA--C 1.54 0.592 0 C-N-CA 126.377 1.871 . . . . 0.0 113.874 178.214 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 72' ' ' ASN . . . . . . . . . . . . . 13.7 t30 -147.3 143.72 18.53 Favored Pre-proline 0 C--O 1.235 0.305 0 O-C-N 120.667 -1.27 . . . . 0.0 108.598 179.991 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 73' ' ' PRO . . . . . . . . . . . . . 68.1 Cg_endo -75.63 -25.42 10.92 Favored 'Trans proline' 0 N--CA 1.459 -0.556 0 C-N-CA 122.055 1.837 . . . . 0.0 111.601 179.919 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 74' ' ' GLN . . . . . . . . . . . . . 54.1 tt0 -70.13 -48.53 57.1 Favored 'General case' 0 N--CA 1.451 -0.385 0 C-N-CA 124.129 0.971 . . . . 0.0 109.606 -179.341 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 75' ' ' LEU . . . . . . . . . . . . . 41.5 mt -54.71 -45.15 73.97 Favored 'General case' 0 N--CA 1.471 0.612 0 CA-C-N 118.873 0.761 . . . . 0.0 109.149 174.528 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 76' ' ' ASN . . . . . . . . . . . . . 15.0 t-20 -61.07 -39.62 90.58 Favored 'General case' 0 CA--C 1.535 0.366 0 C-N-CA 124.236 1.015 . . . . 0.0 111.166 -175.787 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 77' ' ' GLU . . . . . . . . . . . . . 5.8 tm-20 -81.45 -30.8 33.33 Favored 'General case' 0 N--CA 1.455 -0.221 0 C-N-CA 125.721 1.608 . . . . 0.0 113.349 -177.889 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 78' ' ' LEU . . . . . . . . . . . . . 9.2 mt -61.12 -25.92 67.32 Favored 'General case' 0 N--CA 1.466 0.341 0 C-N-CA 123.231 0.612 . . . . 0.0 112.393 -179.796 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 79' ' ' ASP . . . . . . . . . . . . . 4.2 t70 -47.64 -49.56 26.94 Favored 'General case' 0 CA--C 1.517 -0.295 0 C-N-CA 125.912 1.685 . . . . 0.0 111.416 165.632 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 80' ' ' ASN . . . . . . . . . . . . . 2.7 m120 -74.34 -36.55 63.65 Favored 'General case' 0 N--CA 1.448 -0.568 0 CA-C-O 118.364 -0.827 . . . . 0.0 109.714 -175.234 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 81' ' ' THR . . . . . . . . . . . . . 89.9 m -54.11 -63.06 1.27 Allowed 'General case' 0 C--N 1.344 0.357 0 N-CA-C 108.054 -1.091 . . . . 0.0 108.054 172.152 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 82' ' ' ILE . . . . . . . . . . . . . 10.9 tp -65.76 -39.05 83.7 Favored 'Isoleucine or valine' 0 N--CA 1.449 -0.506 0 CA-C-O 118.97 -0.538 . . . . 0.0 110.433 -165.643 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 83' ' ' SER . . . . . . . . . . . . . 8.6 t -61.55 -49.37 76.95 Favored 'General case' 0 N--CA 1.447 -0.592 0 N-CA-C 109.312 -0.625 . . . . 0.0 109.312 -177.842 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 84' ' ' GLU . . . . . . . . . . . . . 3.6 tp10 -67.55 -22.38 65.41 Favored 'General case' 0 CA--C 1.537 0.455 0 C-N-CA 123.738 0.815 . . . . 0.0 111.856 179.813 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 85' ' ' MET . . . . . . . . . . . . . 7.1 ptm -87.6 -41.3 13.53 Favored 'General case' 0 CA--C 1.515 -0.388 0 N-CA-C 106.236 -1.765 . . . . 0.0 106.236 -171.691 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 86' ' ' LEU . . . . . . . . . . . . . 2.3 mm? -67.56 -25.57 65.86 Favored 'General case' 0 N--CA 1.439 -1.011 0 C-N-CA 119.272 -0.971 . . . . 0.0 111.926 -173.043 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 87' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -64.87 -53.95 38.62 Favored 'General case' 0 N--CA 1.448 -0.56 0 CA-C-O 118.799 -0.62 . . . . 0.0 110.785 -175.09 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 88' ' ' GLU . . . . . . . . . . . . . 12.4 pt-20 -71.49 -41.76 68.91 Favored 'General case' 0 C--O 1.234 0.255 0 CA-C-O 118.876 -0.583 . . . . 0.0 112.41 -176.092 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 89' ' ' GLY . . . . . . . . . . . . . . . 126.53 93.96 0.89 Allowed Glycine 0 C--N 1.334 0.457 0 N-CA-C 108.879 -1.689 . . . . 0.0 108.879 -173.405 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 90' ' ' ALA . . . . . . . . . . . . . . . -69.4 136.79 52.14 Favored 'General case' 0 N--CA 1.447 -0.612 0 N-CA-C 108.818 -0.808 . . . . 0.0 108.818 176.805 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 91' ' ' GLN . . . . . . . . . . . . . 29.0 mm-40 -74.89 92.71 2.57 Favored 'General case' 0 N--CA 1.446 -0.64 0 N-CA-C 105.011 -2.218 . . . . 0.0 105.011 177.974 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 92' ' ' VAL . . . . . . . . . . . . . 7.5 p -86.67 132.13 33.08 Favored 'Isoleucine or valine' 0 N--CA 1.443 -0.78 0 N-CA-C 106.007 -1.849 . . . . 0.0 106.007 179.955 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 93' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -137.61 152.43 49.35 Favored 'General case' 0 C--N 1.323 -0.559 0 N-CA-C 106.489 -1.671 . . . . 0.0 106.489 167.334 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 94' ' ' LEU . . . . . . . . . . . . . 54.1 tp -132.69 100.51 4.96 Favored 'General case' 0 CA--C 1.514 -0.429 0 CA-C-O 121.7 0.762 . . . . 0.0 108.968 -179.463 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 95' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -64.18 169.47 4.47 Favored 'General case' 0 C--N 1.323 -0.547 0 CA-C-N 113.718 -1.583 . . . . 0.0 109.831 164.099 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 96' ' ' ALA . . . . . . . . . . . . . . . -44.67 -24.54 0.2 Allowed 'General case' 0 N--CA 1.469 0.499 0 C-N-CA 127.952 2.501 . . . . 0.0 116.95 -170.93 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 97' ' ' ASN . . . . . . . . . . . . . 0.0 OUTLIER -155.39 6.71 0.24 Allowed 'General case' 0 CA--C 1.542 0.653 0 C-N-CA 126.551 1.94 . . . . 0.0 111.09 170.299 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 98' ' ' GLN . . . . . . . . . . . . . 25.7 tt0 -127.69 110.44 12.66 Favored 'General case' 0 N--CA 1.469 0.498 0 C-N-CA 125.383 1.473 . . . . 0.0 110.643 -170.382 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 99' ' ' LEU . . . . . . . . . . . . . 11.1 tp -75.01 143.72 43.44 Favored 'General case' 0 C--N 1.321 -0.667 0 C-N-CA 127.573 2.349 . . . . 0.0 108.037 173.606 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 100' ' ' THR . . . . . . . . . . . . . 4.6 m -132.81 118.91 19.58 Favored 'General case' 0 C--N 1.327 -0.378 0 N-CA-C 106.669 -1.604 . . . . 0.0 106.669 175.342 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 101' ' ' LEU . . . . . . . . . . . . . 2.7 mm? -115.59 111.08 20.14 Favored 'General case' 0 CA--C 1.513 -0.459 0 N-CA-C 106.099 -1.815 . . . . 0.0 106.099 174.521 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 102' ' ' ALA . . . . . . . . . . . . . . . -106.15 158.08 17.09 Favored 'General case' 0 C--N 1.326 -0.421 0 N-CA-C 108.331 -0.989 . . . . 0.0 108.331 162.775 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 103' ' ' THR . . . . . . . . . . . . . 1.8 m -157.09 -179.28 8.05 Favored 'General case' 0 N--CA 1.436 -1.163 0 N-CA-C 105.596 -2.002 . . . . 0.0 105.596 171.853 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 104' ' ' ALA . . . . . . . . . . . . . . . -50.6 -39.01 48.8 Favored 'General case' 0 N--CA 1.451 -0.394 0 C-N-CA 122.683 0.393 . . . . 0.0 111.379 172.14 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 105' ' ' LYS . . . . . . . . . . . . . 4.5 tmtt? -61.69 -67.19 0.43 Allowed 'General case' 0 CA--C 1.532 0.279 0 N-CA-C 114.56 1.318 . . . . 0.0 114.56 -177.67 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 106' ' ' GLN . . . . . . . . . . . . . 8.9 pt20 -167.01 -173.45 2.35 Favored 'General case' 0 C--O 1.238 0.474 0 C-N-CA 126.477 1.911 . . . . 0.0 107.997 -178.993 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 107' ' ' THR . . . . . . . . . . . . . 14.8 t -118.47 140.26 50.15 Favored 'General case' 0 CA--C 1.534 0.345 0 C-N-CA 123.314 0.645 . . . . 0.0 109.869 174.008 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 108' ' ' LEU . . . . . . . . . . . . . 53.5 mt -125.11 138.15 54.17 Favored 'General case' 0 C--O 1.236 0.348 0 C-N-CA 127.726 2.41 . . . . 0.0 106.521 -178.513 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 109' ' ' THR . . . . . . . . . . . . . 31.5 m -112.38 144.96 40.94 Favored 'General case' 0 C--O 1.235 0.3 0 N-CA-C 107.793 -1.188 . . . . 0.0 107.793 179.992 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 110' ' ' TYR . . . . . 0.403 ' HA ' ' H ' ' A' ' 15' ' ' GLU . 34.4 m-85 -130.5 172.77 11.54 Favored 'General case' 0 C--O 1.233 0.209 0 C-N-CA 123.987 0.915 . . . . 0.0 111.158 -178.918 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 111' ' ' LYS . . . . . . . . . . . . . 8.8 tppt? -125.79 143.87 50.88 Favored 'General case' 0 CA--C 1.514 -0.414 0 C-N-CA 124.885 1.274 . . . . 0.0 109.679 173.202 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 112' ' ' LEU . . . . . . . . . . . . . 43.7 tp -74.07 51.91 0.43 Allowed 'General case' 0 CA--C 1.539 0.535 0 C-N-CA 125.999 1.72 . . . . 0.0 108.93 165.159 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 113' ' ' ALA . . . . . . . . . . . . . . . -85.32 91.27 8.13 Favored 'General case' 0 N--CA 1.451 -0.406 0 O-C-N 119.84 -1.788 . . . . 0.0 106.421 170.238 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 114' ' ' ASP . . . . . . . . . . . . . 43.5 t0 -94.25 75.67 3.98 Favored 'General case' 0 CA--C 1.513 -0.457 0 CA-C-O 123.664 1.697 . . . . 0.0 109.243 -178.59 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 115' ' ' LEU . . . . . . . . . . . . . 30.4 mt -94.85 26.44 3.58 Favored 'General case' 0 C--N 1.323 -0.582 0 CA-C-N 112.871 -1.968 . . . . 0.0 109.453 -174.297 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 116' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -56.18 132.65 51.06 Favored 'General case' 0 N--CA 1.454 -0.27 0 CA-C-O 121.056 0.455 . . . . 0.0 110.143 176.698 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 117' ' ' ASN . . . . . . . . . . . . . 18.4 p30 . . . . . 0 C--O 1.238 0.488 0 C-N-CA 124.805 1.242 . . . . 0.0 110.437 167.401 . . . . . . . . 0 0 . 1 . 018 nuclear orig full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 29.5 ttm . . . . . 0 N--CA 1.452 -0.355 0 CA-C-O 121.157 0.503 . . . . 0.0 109.877 . . . . . . . . . 0 0 . 1 . 018 nuclear orig full ' A' A ' 2' ' ' VAL . . . . . . . . . . . . . 7.7 p -50.18 151.73 0.6 Allowed 'Isoleucine or valine' 0 CA--C 1.536 0.419 0 C-N-CA 127.377 2.271 . . . . 0.0 111.838 173.238 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 3' ' ' THR . . . . . . . . . . . . . 20.6 p -134.95 165.05 39.62 Favored Pre-proline 0 CA--C 1.533 0.316 0 C-N-CA 123.382 0.673 . . . . 0.0 110.581 177.468 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 4' ' ' PRO . . . . . . . . . . . . . 9.7 Cg_endo -58.28 -36.33 97.81 Favored 'Trans proline' 0 C--O 1.235 0.343 0 C-N-CA 122.999 2.466 . . . . 0.0 113.452 175.828 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 5' ' ' GLU . . . . . . . . . . . . . 0.2 OUTLIER -61.18 -44.29 97.53 Favored 'General case' 0 CA--C 1.538 0.505 0 C-N-CA 124.198 0.999 . . . . 0.0 111.765 -174.947 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 6' ' ' GLN . . . . . . . . . . . . . 15.7 pt20 -75.14 18.94 0.17 Allowed 'General case' 0 CA--C 1.542 0.642 0 C-N-CA 125.306 1.442 . . . . 0.0 112.573 177.279 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 7' ' ' LEU . . . . . . . . . . . . . 81.4 mt -136.71 -51.35 0.68 Allowed 'General case' 0 N--CA 1.469 0.485 0 CA-C-N 119.843 1.202 . . . . 0.0 113.073 -174.12 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 8' ' ' GLN . . . . . . . . . . . . . 0.2 OUTLIER -44.04 -28.75 0.51 Allowed 'General case' 0 N--CA 1.473 0.679 0 N-CA-C 115.712 1.745 . . . . 0.0 115.712 -176.16 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 9' ' ' HIS . . . . . . . . . . . . . 79.5 m-70 -131.43 32.27 4.22 Favored 'General case' 0 C--O 1.238 0.489 0 C-N-CA 123.392 0.677 . . . . 0.0 111.82 -173.562 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 10' ' ' HIS . . . . . . . . . . . . . 98.4 m-70 -129.34 113.67 15.25 Favored 'General case' 0 N--CA 1.452 -0.339 0 C-N-CA 124.995 1.318 . . . . 0.0 109.634 176.537 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 11' ' ' ARG . . . . . . . . . . . . . 17.0 ttt180 -69.64 150.09 47.4 Favored 'General case' 0 C--O 1.233 0.214 0 N-CA-C 108.678 -0.86 . . . . 0.0 108.678 166.511 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 12' ' ' PHE . . . . . . . . . . . . . 99.0 m-85 -138.89 157.98 45.05 Favored 'General case' 0 CA--C 1.503 -0.84 0 CA-C-O 123.994 1.854 . . . . 0.0 108.655 171.018 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 13' ' ' VAL . . . . . . . . . . . . . 0.0 OUTLIER -126.7 131.36 71.24 Favored 'Isoleucine or valine' 0 C--N 1.311 -1.103 0 CA-C-N 113.008 -1.906 . . . . 0.0 106.09 -176.358 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 14' ' ' LEU . . . . . . . . . . . . . 26.5 tp -65.64 102.61 0.75 Allowed 'General case' 0 CA--C 1.515 -0.375 0 N-CA-C 107.629 -1.248 . . . . 0.0 107.629 175.963 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -86.2 -52.87 5.38 Favored 'General case' 0 N--CA 1.443 -0.822 0 N-CA-C 107.652 -1.24 . . . . 0.0 107.652 -172.188 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -138.15 123.95 19.95 Favored 'General case' 0 C--O 1.235 0.33 0 CA-C-O 121.573 0.701 . . . . 0.0 110.248 -173.9 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 17' ' ' VAL . . . . . . . . . . . . . 11.3 t -75.86 170.52 1.47 Allowed 'Isoleucine or valine' 0 C--O 1.237 0.437 0 N-CA-C 107.621 -1.252 . . . . 0.0 107.621 172.847 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 18' ' ' ASN . . . . . . . . . . . . . 0.3 OUTLIER -58.17 -20.57 42.0 Favored 'General case' 0 CA--C 1.536 0.424 0 CA-C-O 117.873 -1.06 . . . . 0.0 112.896 168.475 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . -106.85 -64.53 0.61 Allowed Glycine 0 C--N 1.341 0.856 0 C-N-CA 125.491 1.52 . . . . 0.0 111.887 -174.896 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 25.1 mmtm -136.04 164.45 43.04 Favored Pre-proline 0 N--CA 1.469 0.495 0 CA-C-N 118.814 1.307 . . . . 0.0 110.55 -176.86 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 21' ' ' PRO . . . . . . . . . . . . . 57.2 Cg_endo -66.4 153.38 78.25 Favored 'Trans proline' 0 CA--C 1.537 0.659 0 N-CA-C 108.605 -1.344 . . . . 0.0 108.605 159.632 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 22' ' ' VAL . . . . . . . . . . . . . 11.7 t -89.51 158.4 2.96 Favored 'Isoleucine or valine' 0 C--O 1.24 0.601 0 N-CA-C 108.961 -0.755 . . . . 0.0 108.961 176.563 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 23' ' ' THR . . . . . . . . . . . . . 3.1 m -130.7 124.38 31.4 Favored 'General case' 0 CA--C 1.532 0.259 0 C-N-CA 125.143 1.377 . . . . 0.0 107.954 178.453 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 24' ' ' SER . . . . . . . . . . . . . 5.4 m -153.6 136.08 15.07 Favored 'General case' 0 N--CA 1.452 -0.331 0 C-N-CA 127.46 2.304 . . . . 0.0 106.921 -167.595 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 25' ' ' ASP . . . . . . . . . . . . . 2.9 t70 -47.95 -84.06 0.01 OUTLIER 'General case' 0 N--CA 1.472 0.634 0 C-N-CA 127.281 2.232 . . . . 0.0 110.266 -179.752 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 26' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -135.62 -1.36 2.53 Favored 'General case' 0 CA--C 1.531 0.214 0 C-N-CA 125.484 1.514 . . . . 0.0 112.753 173.923 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 27' ' ' ASN . . . . . . . . . . . . . 60.6 m-80 -115.62 81.25 8.92 Favored Pre-proline 0 CA--C 1.532 0.286 0 C-N-CA 126.092 1.757 . . . . 0.0 107.426 -179.038 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 28' ' ' PRO . . . . . . . . . . . . . 19.0 Cg_endo -68.76 169.09 18.36 Favored 'Trans proline' 0 CA--C 1.534 0.506 0 C-N-CA 123.067 2.511 . . . . 0.0 113.659 177.093 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 29' ' ' PRO . . . . . . . . . . . . . 13.6 Cg_endo -62.43 109.91 0.96 Allowed 'Trans proline' 0 N--CA 1.449 -1.131 0 N-CA-C 107.226 -1.875 . . . . 0.0 107.226 145.763 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 30' ' ' GLU . . . . . . . . . . . . . 10.4 pt-20 -130.21 165.04 23.2 Favored 'General case' 0 C--N 1.318 -0.767 0 C-N-CA 127.996 2.519 . . . . 0.0 106.046 175.847 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 31' ' ' ILE . . . . . . . . . . . . . 20.3 tt -145.47 146.13 19.88 Favored 'Isoleucine or valine' 0 N--CA 1.447 -0.609 0 C-N-CA 125.556 1.542 . . . . 0.0 107.189 -177.401 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 32' ' ' SER . . . . . . . . . . . . . 27.5 p -133.07 172.85 12.09 Favored 'General case' 0 N--CA 1.441 -0.905 0 C-N-CA 126.022 1.729 . . . . 0.0 107.373 168.223 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 33' ' ' PHE . . . . . . . . . . . . . 98.8 m-85 -137.13 -173.22 3.4 Favored 'General case' 0 N--CA 1.448 -0.535 0 N-CA-C 107.919 -1.141 . . . . 0.0 107.919 -174.663 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 34' ' ' GLY . . . . . . . . . . . . . . . 176.42 -160.43 28.05 Favored Glycine 0 N--CA 1.451 -0.333 0 N-CA-C 109.385 -1.486 . . . . 0.0 109.385 170.545 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 35' ' ' GLU . . . . . . . . . . . . . 1.9 tt0 -52.95 154.25 2.98 Favored 'General case' 0 N--CA 1.448 -0.56 0 C-N-CA 125.016 1.326 . . . . 0.0 111.84 -167.894 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 11.7 mtpt 52.78 26.99 4.92 Favored 'General case' 0 CA--C 1.536 0.423 0 CA-C-O 117.956 -1.021 . . . . 0.0 112.195 -169.193 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 37' ' ' MET . . . . . . . . . . . . . 31.4 mmm 54.95 26.48 7.99 Favored 'General case' 0 CA--C 1.542 0.659 0 C-N-CA 124.823 1.249 . . . . 0.0 111.14 -174.95 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 38' ' ' MET . . . . . . . . . . . . . 25.3 mmm -56.0 155.69 6.09 Favored 'General case' 0 CA--C 1.519 -0.213 0 O-C-N 121.055 -1.028 . . . . 0.0 110.444 175.521 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 39' ' ' ILE . . . . . . . . . . . . . 10.4 mt -123.91 135.61 62.96 Favored 'Isoleucine or valine' 0 N--CA 1.449 -0.511 0 C-N-CA 124.793 1.237 . . . . 0.0 107.815 -175.073 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 40' ' ' SER . . . . . . . . . . . . . 66.6 m -131.04 121.09 24.42 Favored 'General case' 0 N--CA 1.45 -0.437 0 N-CA-C 106.495 -1.669 . . . . 0.0 106.495 169.233 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 41' ' ' GLY . . . . . . . . . . . . . . . -164.82 165.2 37.43 Favored Glycine 0 C--O 1.237 0.291 0 N-CA-C 108.994 -1.642 . . . . 0.0 108.994 179.331 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 42' ' ' SER . . . . . 0.461 ' HA ' ' HA ' ' A' ' 46' ' ' ARG . 92.0 p -157.56 108.41 2.26 Favored 'General case' 0 N--CA 1.444 -0.752 0 CA-C-N 117.596 0.698 . . . . 0.0 111.681 -176.667 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 43' ' ' MET . . . . . . . . . . . . . 7.2 mmt -87.4 -58.43 2.58 Favored 'General case' 0 N--CA 1.451 -0.401 0 C-N-CA 124.121 0.968 . . . . 0.0 109.322 -177.533 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 44' ' ' CYS . . . . . 1.301 ' SG ' ' SG ' ' A' ' 70' ' ' CYS . 43.6 t -155.29 -19.11 0.11 Allowed 'General case' 0 CA--C 1.535 0.379 0 N-CA-C 112.442 0.534 . . . . 0.0 112.442 -179.406 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 45' ' ' ASN . . . . . . . . . . . . . 2.8 m-80 -125.95 16.36 7.96 Favored 'General case' 0 N--CA 1.473 0.687 0 C-N-CA 125.997 1.719 . . . . 0.0 109.413 179.68 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 46' ' ' ARG . . . . . 0.461 ' HA ' ' HA ' ' A' ' 42' ' ' SER 0.376 6.0 ptt180 44.05 -172.48 0.01 OUTLIER 'General case' 0 CA--C 1.536 0.413 0 C-N-CA 127.469 2.308 . . . . 0.0 113.623 -161.956 . . . . . . . . 3 3 . 1 . 018 nuclear orig full ' A' A ' 47' ' ' PHE . . . . . . . . . . . . . 21.5 p90 -173.5 162.96 4.33 Favored 'General case' 0 N--CA 1.472 0.646 0 C-N-CA 125.672 1.589 . . . . 0.0 109.151 164.33 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 48' ' ' SER . . . . . . . . . . . . . 7.6 p -155.02 135.1 13.04 Favored 'General case' 0 N--CA 1.449 -0.512 0 C-N-CA 123.998 0.919 . . . . 0.0 108.649 178.134 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 49' ' ' GLY . . . . . . . . . . . . . . . -169.0 165.39 38.89 Favored Glycine 0 C--N 1.337 0.616 0 N-CA-C 110.014 -1.234 . . . . 0.0 110.014 171.519 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 50' ' ' GLU . . . . . . . . . . . . . 2.4 pt-20 -83.48 103.17 12.62 Favored 'General case' 0 N--CA 1.442 -0.867 0 CA-C-O 122.619 1.199 . . . . 0.0 108.796 178.588 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 51' ' ' GLY . . . . . . . . . . . . . . . -58.23 174.97 2.47 Favored Glycine 0 CA--C 1.539 1.559 0 CA-C-N 114.647 -1.16 . . . . 0.0 111.112 163.223 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 52' ' ' LYS . . . . . . . . . . . . . 29.8 ttpt -142.71 159.01 43.06 Favored 'General case' 0 C--N 1.329 -0.315 0 N-CA-C 106.006 -1.85 . . . . 0.0 106.006 156.651 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 53' ' ' LEU . . . . . . . . . . . . . 49.5 tp -148.08 95.29 2.45 Favored 'General case' 0 N--CA 1.447 -0.62 0 N-CA-C 107.195 -1.409 . . . . 0.0 107.195 170.23 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 2.4 t -137.58 6.37 2.73 Favored 'General case' 0 CA--C 1.533 0.3 0 CA-C-N 115.498 -0.773 . . . . 0.0 111.196 174.627 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 55' ' ' ASN . . . . . . . . . . . . . 7.9 p-10 -142.74 -21.15 0.66 Allowed 'General case' 0 C--O 1.222 -0.394 0 CA-C-O 117.672 -1.156 . . . . 0.0 114.035 175.725 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 56' ' ' GLY . . . . . . . . . . . . . . . 119.28 7.92 9.72 Favored Glycine 0 CA--C 1.529 0.943 0 CA-C-N 119.29 0.95 . . . . 0.0 112.945 -172.099 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 57' ' ' GLU . . . . . . . . . . . . . 41.3 tt0 -127.16 128.37 46.04 Favored 'General case' 0 C--O 1.235 0.303 0 CA-C-N 118.841 1.32 . . . . 0.0 108.299 -173.836 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 58' ' ' LEU . . . . . . . . . . . . . 52.5 tp -100.42 94.25 6.06 Favored 'General case' 0 CA--C 1.531 0.216 0 C-N-CA 125.628 1.571 . . . . 0.0 108.924 177.505 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 59' ' ' THR . . . . . . . . . . . . . 40.8 p -91.42 146.51 23.75 Favored 'General case' 0 C--O 1.235 0.327 0 N-CA-C 108.129 -1.063 . . . . 0.0 108.129 162.745 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 60' ' ' ALA . . . . . . . . . . . . . . . -140.93 102.37 4.25 Favored 'General case' 0 C--N 1.334 -0.1 0 C-N-CA 124.491 1.116 . . . . 0.0 108.392 166.998 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 61' ' ' LYS . . . . . . . . . . . . . 49.6 mttp -65.4 -60.88 2.49 Favored 'General case' 0 N--CA 1.442 -0.837 0 C-N-CA 124.545 1.138 . . . . 0.0 111.856 -171.148 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 62' ' ' GLY . . . . . . . . . . . . . . . -55.35 -59.93 9.66 Favored Glycine 0 C--O 1.227 -0.282 0 C-N-CA 125.047 1.308 . . . . 0.0 111.262 -165.388 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 63' ' ' LEU . . . . . . . . . . . . . 3.8 tp 49.17 60.86 3.46 Favored 'General case' 0 N--CA 1.445 -0.696 0 C-N-CA 127.646 2.379 . . . . 0.0 113.817 168.962 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 64' ' ' ALA . . . . . . . . . . . . . . . -78.88 135.06 36.9 Favored 'General case' 0 C--N 1.324 -0.525 0 CA-C-N 115.845 -0.616 . . . . 0.0 111.192 -178.004 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 65' ' ' MET . . . . . . . . . . . . . 66.4 mtp -133.57 -175.17 3.73 Favored 'General case' 0 CA--C 1.547 0.84 0 C-N-CA 124.985 1.314 . . . . 0.0 111.288 -172.874 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 66' ' ' THR . . . . . . . . . . . . . 30.0 p -107.78 -164.81 1.0 Allowed 'General case' 0 N--CA 1.47 0.565 0 C-N-CA 127.604 2.361 . . . . 0.0 110.887 177.807 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 67' ' ' ARG . . . . . . . . . . . . . 2.1 mpp_? -132.81 87.44 2.41 Favored 'General case' 0 C--O 1.232 0.15 0 C-N-CA 126.821 2.048 . . . . 0.0 107.215 173.187 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 68' ' ' MET . . . . . . . . . . . . . 10.0 mtm -139.43 162.44 35.03 Favored 'General case' 0 N--CA 1.467 0.418 0 C-N-CA 123.878 0.871 . . . . 0.0 113.061 -173.017 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 69' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -119.01 164.17 15.87 Favored 'General case' 0 C--O 1.235 0.302 0 C-N-CA 127.492 2.317 . . . . 0.0 106.991 171.953 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 70' ' ' CYS . . . . . 1.301 ' SG ' ' SG ' ' A' ' 44' ' ' CYS . 57.5 m -140.36 23.89 2.32 Favored 'General case' 0 N--CA 1.474 0.733 0 C-N-CA 124.033 0.933 . . . . 0.0 112.73 -175.149 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 71' ' ' ALA . . . . . . . . . . . . . . . 54.6 -1.29 0.02 OUTLIER 'General case' 0 CA--C 1.511 -0.534 0 N-CA-C 117.586 2.439 . . . . 0.0 117.586 -176.602 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 72' ' ' ASN . . . . . . . . . . . . . 0.0 OUTLIER -138.58 144.05 40.64 Favored Pre-proline 0 N--CA 1.441 -0.913 0 CA-C-N 118.833 0.742 . . . . 0.0 109.512 167.928 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 73' ' ' PRO . . . . . . . . . . . . . 74.5 Cg_endo -74.97 -20.64 16.73 Favored 'Trans proline' 0 N--CA 1.45 -1.086 0 C-N-CA 121.944 1.763 . . . . 0.0 111.853 -178.056 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 74' ' ' GLN . . . . . . . . . . . . . 39.4 tt0 -58.54 -45.82 88.1 Favored 'General case' 0 CA--C 1.531 0.248 0 CA-C-N 120.606 1.548 . . . . 0.0 110.607 -177.184 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 75' ' ' LEU . . . . . . . . . . . . . 83.4 mt -66.75 -41.51 87.68 Favored 'General case' 0 CA--C 1.522 -0.117 0 C-N-CA 123.843 0.857 . . . . 0.0 110.122 175.911 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 76' ' ' ASN . . . . . . . . . . . . . 3.0 t-20 -59.79 -45.33 92.65 Favored 'General case' 0 C--O 1.219 -0.505 0 C-N-CA 124.052 0.941 . . . . 0.0 110.294 -177.403 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 77' ' ' GLU . . . . . . . . . . . . . 29.7 mt-10 -56.46 -43.01 79.13 Favored 'General case' 0 N--CA 1.448 -0.542 0 C-N-CA 125.508 1.523 . . . . 0.0 111.02 175.43 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 78' ' ' LEU . . . . . . . . . . . . . 0.7 OUTLIER -61.08 -32.05 71.71 Favored 'General case' 0 C--N 1.339 0.121 0 CA-C-O 118.253 -0.879 . . . . 0.0 112.355 -177.808 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 79' ' ' ASP . . . . . . . . . . . . . 0.0 OUTLIER -54.26 -39.82 67.2 Favored 'General case' 0 CA--C 1.535 0.398 0 C-N-CA 124.127 0.971 . . . . 0.0 112.902 174.311 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 80' ' ' ASN . . . . . . . . . . . . . 6.9 p30 -87.29 -37.8 16.86 Favored 'General case' 0 CA--C 1.518 -0.272 0 CA-C-N 119.001 0.819 . . . . 0.0 109.849 175.834 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 81' ' ' THR . . . . . . . . . . . . . 32.7 m -53.24 -54.44 36.14 Favored 'General case' 0 N--CA 1.455 -0.186 0 O-C-N 123.856 0.723 . . . . 0.0 109.18 -174.513 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 82' ' ' ILE . . . . . . . . . . . . . 10.7 tp -64.54 -32.94 59.87 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.475 0 C-N-CA 122.824 0.45 . . . . 0.0 111.356 -176.968 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 83' ' ' SER . . . . . . . . . . . . . 36.4 p -64.08 -53.41 50.24 Favored 'General case' 0 N--CA 1.443 -0.775 0 N-CA-C 109.647 -0.501 . . . . 0.0 109.647 -171.35 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 84' ' ' GLU . . . . . . . . . . . . . 2.4 tp10 -62.72 -42.08 99.47 Favored 'General case' 0 N--CA 1.449 -0.502 0 C-N-CA 124.734 1.213 . . . . 0.0 109.261 -176.421 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 85' ' ' MET . . . . . . . . . . . . . 78.9 mtp -60.28 -41.41 93.29 Favored 'General case' 0 C--N 1.343 0.323 0 C-N-CA 123.778 0.831 . . . . 0.0 110.18 179.141 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 86' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -80.44 -19.35 46.32 Favored 'General case' 0 C--N 1.332 -0.19 0 O-C-N 121.436 -0.79 . . . . 0.0 112.096 -176.657 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 87' ' ' LYS . . . . . . . . . . . . . 2.4 mptm? -76.46 -55.4 5.57 Favored 'General case' 0 N--CA 1.447 -0.584 0 CA-C-O 118.198 -0.906 . . . . 0.0 109.537 169.622 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 88' ' ' GLU . . . . . . . . . . . . . 21.1 pt-20 -69.06 -24.66 64.19 Favored 'General case' 0 CA--C 1.535 0.368 0 CA-C-N 118.768 0.713 . . . . 0.0 111.376 -177.004 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 89' ' ' GLY . . . . . . . . . . . . . . . 106.57 99.14 2.6 Favored Glycine 0 C--N 1.337 0.591 0 N-CA-C 110.106 -1.198 . . . . 0.0 110.106 174.848 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 90' ' ' ALA . . . . . . . . . . . . . . . -74.1 133.67 42.86 Favored 'General case' 0 N--CA 1.446 -0.665 0 C-N-CA 123.075 0.55 . . . . 0.0 110.158 -175.68 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 91' ' ' GLN . . . . . . . . . . . . . 1.8 mp0 -73.04 125.2 27.08 Favored 'General case' 0 N--CA 1.452 -0.356 0 N-CA-C 105.447 -2.057 . . . . 0.0 105.447 170.403 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 92' ' ' VAL . . . . . . . . . . . . . 25.5 t -122.21 126.72 74.7 Favored 'Isoleucine or valine' 0 N--CA 1.446 -0.628 0 N-CA-C 107.743 -1.206 . . . . 0.0 107.743 -174.579 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 93' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -135.38 80.7 1.85 Allowed 'General case' 0 N--CA 1.451 -0.376 0 N-CA-C 106.767 -1.568 . . . . 0.0 106.767 177.679 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 94' ' ' LEU . . . . . . . . . . . . . 1.6 tm? -84.75 102.79 13.29 Favored 'General case' 0 CA--C 1.514 -0.432 0 N-CA-C 107.433 -1.321 . . . . 0.0 107.433 173.726 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 95' ' ' THR . . . . . . . . . . . . . 1.1 m -82.58 177.71 8.57 Favored 'General case' 0 C--N 1.322 -0.611 0 CA-C-N 114.064 -1.425 . . . . 0.0 108.244 178.45 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 96' ' ' ALA . . . . . . . . . . . . . . . -52.62 -20.17 2.86 Favored 'General case' 0 CA--C 1.539 0.554 0 N-CA-C 114.574 1.324 . . . . 0.0 114.574 -173.607 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 97' ' ' ASN . . . . . . . . . . . . . 17.4 p30 -146.62 -10.15 0.47 Allowed 'General case' 0 N--CA 1.467 0.419 0 N-CA-C 116.553 2.057 . . . . 0.0 116.553 160.388 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 98' ' ' GLN . . . . . . . . . . . . . 6.2 tt0 -112.9 128.96 56.61 Favored 'General case' 0 N--CA 1.47 0.549 0 CA-C-N 122.092 2.223 . . . . 0.0 111.356 -178.526 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 99' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -84.24 122.97 29.62 Favored 'General case' 0 C--O 1.235 0.299 0 C-N-CA 125.012 1.325 . . . . 0.0 107.768 170.293 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 100' ' ' THR . . . . . . . . . . . . . 5.1 m -110.18 127.82 55.14 Favored 'General case' 0 C--N 1.326 -0.444 0 N-CA-C 107.239 -1.393 . . . . 0.0 107.239 171.52 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 101' ' ' LEU . . . . . . . . . . . . . 2.7 mm? -114.49 143.12 45.46 Favored 'General case' 0 CA--C 1.514 -0.431 0 C-N-CA 125.464 1.506 . . . . 0.0 108.959 172.353 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 102' ' ' ALA . . . . . . . . . . . . . . . -144.8 159.62 42.59 Favored 'General case' 0 C--O 1.235 0.303 0 C-N-CA 124.936 1.295 . . . . 0.0 108.432 161.693 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 103' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -160.61 174.83 13.42 Favored 'General case' 0 N--CA 1.443 -0.781 0 C-N-CA 126.308 1.843 . . . . 0.0 108.014 170.416 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 104' ' ' ALA . . . . . . . . . . . . . . . -62.25 -28.72 69.91 Favored 'General case' 0 C--O 1.235 0.296 0 O-C-N 121.743 -0.598 . . . . 0.0 111.588 176.395 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 105' ' ' LYS . . . . . . . . . . . . . 8.9 mmtm -69.58 -84.77 0.03 OUTLIER 'General case' 0 N--CA 1.45 -0.434 0 C-N-CA 123.505 0.722 . . . . 0.0 109.769 167.014 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 106' ' ' GLN . . . . . . . . . . . . . 23.3 mt-30 -141.37 -169.83 2.95 Favored 'General case' 0 C--N 1.328 -0.362 0 C-N-CA 123.656 0.782 . . . . 0.0 109.364 -158.711 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 107' ' ' THR . . . . . . . . . . . . . 1.1 t -149.69 147.31 27.92 Favored 'General case' 0 N--CA 1.45 -0.455 0 N-CA-C 106.287 -1.746 . . . . 0.0 106.287 -168.773 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 108' ' ' LEU . . . . . . . . . . . . . 36.8 mt -144.87 160.74 40.81 Favored 'General case' 0 N--CA 1.465 0.324 0 N-CA-C 107.634 -1.247 . . . . 0.0 107.634 -177.503 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 109' ' ' THR . . . . . . . . . . . . . 63.6 m -133.0 133.91 43.76 Favored 'General case' 0 C--O 1.236 0.353 0 N-CA-C 107.609 -1.256 . . . . 0.0 107.609 169.649 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 110' ' ' TYR . . . . . . . . . . . . . 19.1 m-85 -118.32 178.86 4.29 Favored 'General case' 0 C--O 1.236 0.345 0 C-N-CA 124.231 1.013 . . . . 0.0 108.981 178.77 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 111' ' ' LYS . . . . . . . . . . . . . 1.0 OUTLIER -139.13 138.83 37.35 Favored 'General case' 0 N--CA 1.455 -0.215 0 CA-C-O 118.02 -0.99 . . . . 0.0 110.879 178.045 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 112' ' ' LEU . . . . . . . . . . . . . 22.5 tp -60.53 19.68 0.01 OUTLIER 'General case' 0 CA--C 1.544 0.718 0 C-N-CA 131.309 3.843 . . . . 0.0 114.839 175.643 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 113' ' ' ALA . . . . . . . . . . . . . . . -67.82 84.59 0.21 Allowed 'General case' 0 CA--C 1.541 0.609 0 O-C-N 120.233 -1.542 . . . . 0.0 111.082 179.91 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 114' ' ' ASP . . . . . . . . . . . . . 23.4 t0 -93.16 33.3 1.21 Allowed 'General case' 0 N--CA 1.47 0.541 0 CA-C-O 122.974 1.368 . . . . 0.0 110.791 -176.447 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 115' ' ' LEU . . . . . . . . . . . . . 26.2 mt 57.57 12.29 1.51 Allowed 'General case' 0 CA--C 1.544 0.717 0 C-N-CA 125.636 1.574 . . . . 0.0 112.975 -174.212 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 116' ' ' MET . . . . . . . . . . . . . 2.9 ttp -124.15 139.49 53.88 Favored 'General case' 0 N--CA 1.442 -0.83 0 C-N-CA 128.943 2.897 . . . . 0.0 103.875 163.962 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 117' ' ' ASN . . . . . . . . . . . . . 4.0 m120 . . . . . 0 C--O 1.234 0.265 0 CA-C-O 119.087 -0.482 . . . . 0.0 111.67 -171.644 . . . . . . . . 0 0 . 1 . 019 nuclear orig full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 C--O 1.237 0.429 0 N-CA-C 111.097 0.036 . . . . 0.0 111.097 . . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 2' ' ' VAL . . . . . 0.403 HG23 HE21 ' A' ' 6' ' ' GLN . 7.2 p -57.92 139.25 17.81 Favored 'Isoleucine or valine' 0 C--O 1.238 0.455 0 O-C-N 123.595 0.56 . . . . 0.0 110.063 175.834 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 3' ' ' THR . . . . . . . . . . . . . 0.8 OUTLIER -121.9 165.05 21.68 Favored Pre-proline 0 N--CA 1.448 -0.53 0 C-N-CA 124.01 0.924 . . . . 0.0 110.173 179.3 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 4' ' ' PRO . . . . . . . . . . . . . 18.3 Cg_endo -61.78 -50.63 4.99 Favored 'Trans proline' 0 N--CA 1.454 -0.832 0 C-N-CA 122.281 1.987 . . . . 0.0 111.133 174.338 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 5' ' ' GLU . . . . . . . . . . . . . 13.9 tt0 -55.01 -40.31 70.02 Favored 'General case' 0 CA--C 1.536 0.407 0 C-N-CA 124.244 1.018 . . . . 0.0 112.613 -168.513 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 6' ' ' GLN . . . . . 0.403 HE21 HG23 ' A' ' 2' ' ' VAL . 12.1 pt20 -73.14 14.65 0.28 Allowed 'General case' 0 CA--C 1.538 0.518 0 C-N-CA 125.433 1.493 . . . . 0.0 113.938 179.96 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 7' ' ' LEU . . . . . . . . . . . . . 88.6 mt -129.74 -46.29 1.16 Allowed 'General case' 0 C--N 1.34 0.168 0 C-N-CA 125.081 1.352 . . . . 0.0 110.478 -176.017 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 8' ' ' GLN . . . . . . . . . . . . . 2.3 mp0 -49.01 -15.34 0.1 Allowed 'General case' 0 N--CA 1.473 0.715 0 C-N-CA 127.078 2.151 . . . . 0.0 116.697 -178.944 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 9' ' ' HIS . . . . . . . . . . . . . 94.6 m-70 -130.23 13.5 5.62 Favored 'General case' 0 C--N 1.325 -0.473 0 C-N-CA 124.828 1.251 . . . . 0.0 112.492 -175.819 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 10' ' ' HIS . . . . . . . . . . . . . 46.9 m-70 -125.66 138.9 53.92 Favored 'General case' 0 C--O 1.238 0.462 0 C-N-CA 124.815 1.246 . . . . 0.0 107.987 -173.325 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 11' ' ' ARG . . . . . . . . . . . . . 21.6 ttt180 -95.0 146.7 24.07 Favored 'General case' 0 N--CA 1.465 0.279 0 C-N-CA 125.531 1.533 . . . . 0.0 109.754 174.277 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 12' ' ' PHE . . . . . . . . . . . . . 35.5 m-85 -134.26 156.14 48.93 Favored 'General case' 0 N--CA 1.441 -0.914 0 CA-C-O 123.675 1.702 . . . . 0.0 109.253 175.198 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 13' ' ' VAL . . . . . . . . . . . . . 0.0 OUTLIER -138.96 130.82 36.36 Favored 'Isoleucine or valine' 0 C--N 1.313 -1.002 0 CA-C-N 113.03 -1.895 . . . . 0.0 107.242 -172.713 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 14' ' ' LEU . . . . . . . . . . . . . 11.6 tp -64.86 102.72 0.62 Allowed 'General case' 0 N--CA 1.45 -0.475 0 N-CA-C 106.392 -1.707 . . . . 0.0 106.392 176.148 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 15' ' ' GLU . . . . . 0.488 ' HG3' ' HE2' ' A' ' 111' ' ' LYS . 1.3 tm-20 -85.33 -41.38 15.55 Favored 'General case' 0 N--CA 1.449 -0.495 0 N-CA-C 108.91 -0.774 . . . . 0.0 108.91 -173.826 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 5.8 p -151.92 142.71 22.91 Favored 'General case' 0 N--CA 1.442 -0.833 0 CA-C-O 122.442 1.115 . . . . 0.0 109.342 169.229 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 17' ' ' VAL . . . . . . . . . . . . . 2.2 t -70.22 175.86 0.57 Allowed 'Isoleucine or valine' 0 CA--C 1.54 0.582 0 N-CA-C 107.111 -1.44 . . . . 0.0 107.111 168.253 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 18' ' ' ASN . . . . . . . . . . . . . 0.6 OUTLIER -44.88 -24.01 0.18 Allowed 'General case' 0 CA--C 1.539 0.53 0 C-N-CA 127.473 2.309 . . . . 0.0 116.391 -172.467 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . -163.89 17.54 0.12 Allowed Glycine 0 CA--C 1.532 1.141 0 CA-C-O 118.356 -1.247 . . . . 0.0 113.413 170.512 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 40.9 mtmt -145.97 155.54 51.47 Favored Pre-proline 0 N--CA 1.469 0.523 0 CA-C-N 120.412 2.106 . . . . 0.0 109.519 -178.032 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 21' ' ' PRO . . . . . . . . . . . . . 80.9 Cg_endo -72.34 171.59 16.66 Favored 'Trans proline' 0 N--CA 1.45 -1.053 0 C-N-CA 122.118 1.879 . . . . 0.0 110.812 176.544 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 22' ' ' VAL . . . . . . . . . . . . . 3.8 p -120.1 165.37 15.58 Favored 'Isoleucine or valine' 0 CA--C 1.54 0.581 0 C-N-CA 124.349 1.059 . . . . 0.0 111.973 178.184 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 23' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -77.15 -175.8 3.78 Favored 'General case' 0 CA--C 1.545 0.778 0 C-N-CA 127.26 2.224 . . . . 0.0 112.503 -175.525 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 24' ' ' SER . . . . . . . . . . . . . 19.6 m 69.17 67.11 0.27 Allowed 'General case' 0 N--CA 1.452 -0.344 0 C-N-CA 128.995 2.918 . . . . 0.0 114.663 160.574 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 25' ' ' ASP . . . . . . . . . . . . . 6.5 m-20 -46.54 -38.9 10.03 Favored 'General case' 0 CA--C 1.538 0.483 0 C-N-CA 125.699 1.6 . . . . 0.0 113.308 176.324 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 26' ' ' LYS . . . . . . . . . . . . . 77.9 tttt -95.42 -17.9 21.15 Favored 'General case' 0 N--CA 1.466 0.335 0 O-C-N 120.874 -1.141 . . . . 0.0 112.501 -175.853 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 27' ' ' ASN . . . . . . . . . . . . . 4.1 p30 -150.44 69.62 8.83 Favored Pre-proline 0 CA--C 1.534 0.335 0 C-N-CA 124.136 0.974 . . . . 0.0 110.437 -177.015 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 28' ' ' PRO . . . . . . . . . . . . . 40.8 Cg_endo -65.38 162.49 33.38 Favored 'Trans proline' 0 N--CA 1.46 -0.5 0 C-N-CA 122.126 1.884 . . . . 0.0 111.279 -176.802 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 29' ' ' PRO . . . . . . . . . . . . . 18.6 Cg_endo -62.52 87.02 0.11 Allowed 'Trans proline' 0 N--CA 1.453 -0.873 0 C-N-CA 123.562 2.842 . . . . 0.0 109.416 160.211 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 30' ' ' GLU . . . . . . . . . . . . . 1.1 pt-20 -97.23 158.74 15.3 Favored 'General case' 0 N--CA 1.447 -0.576 0 C-N-CA 124.765 1.226 . . . . 0.0 108.292 173.504 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 31' ' ' ILE . . . . . . . . . . . . . 16.4 tt -139.06 137.09 42.36 Favored 'Isoleucine or valine' 0 N--CA 1.443 -0.777 0 N-CA-C 105.456 -2.053 . . . . 0.0 105.456 179.558 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 32' ' ' SER . . . . . . . . . . . . . 68.7 p -136.46 160.12 39.72 Favored 'General case' 0 C--N 1.321 -0.663 0 N-CA-C 106.804 -1.554 . . . . 0.0 106.804 170.151 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 33' ' ' PHE . . . . . . . . . . . . . 58.1 m-85 -118.38 164.67 14.89 Favored 'General case' 0 C--N 1.326 -0.445 0 N-CA-C 108.088 -1.078 . . . . 0.0 108.088 179.462 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 34' ' ' GLY . . . . . . . . . . . . . . . 167.91 142.4 3.47 Favored Glycine 0 N--CA 1.448 -0.542 0 N-CA-C 109.017 -1.633 . . . . 0.0 109.017 177.305 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 35' ' ' GLU . . . . . . . . . . . . . 0.3 OUTLIER 57.28 116.01 0.01 OUTLIER 'General case' 0 CA--C 1.537 0.461 0 C-N-CA 129.264 3.026 . . . . 0.0 114.481 168.947 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 8.6 mtmm 59.08 18.31 6.27 Favored 'General case' 0 N--CA 1.473 0.694 0 O-C-N 120.453 -1.404 . . . . 0.0 113.057 -173.091 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 37' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER 58.85 35.73 24.35 Favored 'General case' 0 CA--C 1.535 0.398 0 C-N-CA 124.843 1.257 . . . . 0.0 110.242 -174.163 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 38' ' ' MET . . . . . . . . . . . . . 9.2 mtp -69.05 164.49 22.32 Favored 'General case' 0 N--CA 1.45 -0.428 0 O-C-N 121.469 -0.77 . . . . 0.0 110.307 167.947 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 39' ' ' ILE . . . . . . . . . . . . . 9.3 mt -122.59 139.93 47.94 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.439 0 C-N-CA 126.485 1.914 . . . . 0.0 106.92 179.115 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 40' ' ' SER . . . . . . . . . . . . . 73.1 m -124.14 149.16 46.58 Favored 'General case' 0 N--CA 1.454 -0.239 0 C-N-CA 125.604 1.562 . . . . 0.0 108.364 163.223 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 41' ' ' GLY . . . . . . . . . . . . . . . 172.84 -178.8 44.69 Favored Glycine 0 CA--C 1.523 0.592 0 N-CA-C 109.221 -1.552 . . . . 0.0 109.221 172.199 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 42' ' ' SER . . . . . . . . . . . . . 40.4 t -142.0 154.61 45.14 Favored 'General case' 0 N--CA 1.449 -0.496 0 N-CA-C 107.303 -1.369 . . . . 0.0 107.303 162.569 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 43' ' ' MET . . . . . . . . . . . . . 14.9 mmt -107.03 -53.01 2.67 Favored 'General case' 0 N--CA 1.454 -0.247 0 N-CA-C 107.43 -1.322 . . . . 0.0 107.43 159.211 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 44' ' ' CYS . . . . . 1.298 ' SG ' ' SG ' ' A' ' 70' ' ' CYS . 12.7 t -151.06 -50.57 0.12 Allowed 'General case' 0 CA--C 1.534 0.338 0 N-CA-C 107.114 -1.439 . . . . 0.0 107.114 176.738 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 45' ' ' ASN . . . . . . . . . . . . . 14.1 m-80 -88.39 16.06 6.94 Favored 'General case' 0 CA--C 1.518 -0.25 0 C-N-CA 125.276 1.43 . . . . 0.0 113.967 -175.837 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 46' ' ' ARG . . . . . . . . . . . . . 3.9 mmt180 58.23 172.26 0.06 Allowed 'General case' 0 N--CA 1.465 0.277 0 C-N-CA 123.86 0.864 . . . . 0.0 110.459 -168.775 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 47' ' ' PHE . . . . . . . . . . . . . 48.7 p90 -163.59 172.35 14.47 Favored 'General case' 0 C--O 1.241 0.618 0 C-N-CA 123.841 0.856 . . . . 0.0 109.712 161.232 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 48' ' ' SER . . . . . . . . . . . . . 1.7 p -173.93 143.99 0.99 Allowed 'General case' 0 N--CA 1.449 -0.518 0 C-N-CA 124.898 1.279 . . . . 0.0 108.863 177.205 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 49' ' ' GLY . . . . . . . . . . . . . . . -176.91 169.83 42.35 Favored Glycine 0 CA--C 1.524 0.628 0 O-C-N 121.25 -0.906 . . . . 0.0 112.455 172.776 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 50' ' ' GLU . . . . . . . . . . . . . 17.3 mt-10 -72.31 94.83 1.64 Allowed 'General case' 0 N--CA 1.461 0.092 0 C-N-CA 124.922 1.289 . . . . 0.0 108.257 171.851 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 51' ' ' GLY . . . . . . . . . . . . . . . -58.98 -65.91 3.16 Favored Glycine 0 C--O 1.226 -0.385 0 C-N-CA 125.818 1.675 . . . . 0.0 113.193 -177.555 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 52' ' ' LYS . . . . . . . . . . . . . 2.5 ttmp? 70.57 138.48 0.04 OUTLIER 'General case' 0 C--N 1.326 -0.443 0 C-N-CA 128.041 2.537 . . . . 0.0 112.655 178.018 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 53' ' ' LEU . . . . . . . . . . . . . 24.8 tp -147.09 102.55 3.52 Favored 'General case' 0 C--O 1.236 0.347 0 C-N-CA 123.637 0.775 . . . . 0.0 109.801 179.734 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 2.0 t -153.09 19.48 0.57 Allowed 'General case' 0 CA--C 1.54 0.574 0 C-N-CA 123.775 0.83 . . . . 0.0 111.658 176.525 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 55' ' ' ASN . . . . . . . . . . . . . 11.9 p30 -146.03 3.69 0.94 Allowed 'General case' 0 N--CA 1.47 0.55 0 N-CA-C 113.847 1.055 . . . . 0.0 113.847 164.985 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 56' ' ' GLY . . . . . . . . . . . . . . . 95.68 16.14 40.51 Favored Glycine 0 CA--C 1.527 0.814 0 CA-C-N 119.495 1.043 . . . . 0.0 112.511 -175.695 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 57' ' ' GLU . . . . . . . . . . . . . 23.6 tt0 -136.04 156.67 48.38 Favored 'General case' 0 CA--C 1.537 0.472 0 C-N-CA 124.426 1.09 . . . . 0.0 108.331 -174.618 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 58' ' ' LEU . . . . . . . . . . . . . 38.9 tp -129.62 97.22 4.46 Favored 'General case' 0 CA--C 1.541 0.597 0 C-N-CA 125.182 1.393 . . . . 0.0 110.502 -173.109 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 59' ' ' THR . . . . . . . . . . . . . 2.7 p -113.07 104.99 12.93 Favored 'General case' 0 N--CA 1.474 0.746 0 C-N-CA 127.575 2.35 . . . . 0.0 112.203 -175.448 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 60' ' ' ALA . . . . . . . . . . . . . . . -72.73 126.05 28.97 Favored 'General case' 0 C--O 1.233 0.201 0 O-C-N 122.119 -0.363 . . . . 0.0 110.917 176.583 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 61' ' ' LYS . . . . . . . . . . . . . 16.2 ttpt -77.96 46.25 0.57 Allowed 'General case' 0 CA--C 1.543 0.692 0 C-N-CA 124.909 1.284 . . . . 0.0 113.68 -177.866 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 62' ' ' GLY . . . . . . . . . . . . . . . 134.33 -21.95 3.8 Favored Glycine 0 N--CA 1.474 1.207 0 O-C-N 120.708 -1.245 . . . . 0.0 114.84 170.732 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 63' ' ' LEU . . . . . . . . . . . . . 1.6 tp 44.89 80.06 0.04 OUTLIER 'General case' 0 CA--C 1.546 0.816 0 C-N-CA 128.008 2.523 . . . . 0.0 114.424 169.143 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 64' ' ' ALA . . . . . . . . . . . . . . . -65.18 100.03 0.42 Allowed 'General case' 0 CA--C 1.545 0.765 0 C-N-CA 127.166 2.187 . . . . 0.0 114.056 -175.132 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 65' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -108.55 175.3 5.51 Favored 'General case' 0 N--CA 1.484 1.263 0 C-N-CA 125.11 1.364 . . . . 0.0 111.433 -173.02 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 66' ' ' THR . . . . . . . . . . . . . 17.0 p -118.12 -165.65 1.13 Allowed 'General case' 0 N--CA 1.478 0.926 0 C-N-CA 126.146 1.778 . . . . 0.0 111.462 -177.618 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 67' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -142.79 75.99 1.51 Allowed 'General case' 0 N--CA 1.474 0.733 0 C-N-CA 125.463 1.505 . . . . 0.0 109.559 177.897 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 68' ' ' MET . . . . . . . . . . . . . 51.5 mtm -126.12 164.72 20.29 Favored 'General case' 0 C--N 1.326 -0.434 0 C-N-CA 129.592 3.157 . . . . 0.0 108.604 -179.423 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 69' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -113.63 163.32 15.12 Favored 'General case' 0 N--CA 1.449 -0.523 0 C-N-CA 126.246 1.819 . . . . 0.0 107.016 173.302 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 70' ' ' CYS . . . . . 1.298 ' SG ' ' SG ' ' A' ' 44' ' ' CYS . 0.5 OUTLIER -121.89 -6.94 9.01 Favored 'General case' 0 C--N 1.323 -0.548 0 C-N-CA 126.284 1.833 . . . . 0.0 114.276 -170.081 . . . . . . . . 3 3 . 1 . 019 nuclear orig full ' A' A ' 71' ' ' ALA . . . . . . . . . . . . . . . 61.17 4.2 0.84 Allowed 'General case' 0 CA--C 1.538 0.503 0 C-N-CA 125.361 1.464 . . . . 0.0 114.597 -172.403 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 72' ' ' ASN . . . . . . . . . . . . . 25.0 t30 -132.61 142.5 45.08 Favored Pre-proline 0 N--CA 1.472 0.641 0 CA-C-N 120.67 1.577 . . . . 0.0 108.575 160.457 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 73' ' ' PRO . . . . . . . . . . . . . 70.0 Cg_endo -79.25 -29.36 3.17 Favored 'Trans proline' 0 C--N 1.346 0.401 0 C-N-CA 122.124 1.883 . . . . 0.0 112.179 -169.986 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 74' ' ' GLN . . . . . . . . . . . . . 31.8 tt0 -60.52 -39.63 88.53 Favored 'General case' 0 C--O 1.221 -0.42 0 CA-C-N 116.691 -0.231 . . . . 0.0 110.419 -179.751 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 75' ' ' LEU . . . . . . . . . . . . . 69.5 mt -66.84 -37.73 85.03 Favored 'General case' 0 N--CA 1.467 0.399 0 O-C-N 121.834 -0.541 . . . . 0.0 109.895 174.328 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 76' ' ' ASN . . . . . . . . . . . . . 2.2 t-20 -64.52 -46.37 83.19 Favored 'General case' 0 C--O 1.22 -0.491 0 C-N-CA 125.182 1.393 . . . . 0.0 111.45 -177.663 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 77' ' ' GLU . . . . . . . . . . . . . 8.2 pt-20 -71.3 -30.2 65.95 Favored 'General case' 0 N--CA 1.468 0.455 0 CA-C-N 119.564 1.074 . . . . 0.0 111.935 177.237 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 78' ' ' LEU . . . . . . . . . . . . . 1.0 OUTLIER -61.09 -35.94 78.35 Favored 'General case' 0 C--N 1.329 -0.308 0 C-N-CA 124.13 0.972 . . . . 0.0 109.346 177.388 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 79' ' ' ASP . . . . . . . . . . . . . 0.0 OUTLIER -59.12 -29.03 67.09 Favored 'General case' 0 N--CA 1.463 0.188 0 C-N-CA 124.074 0.95 . . . . 0.0 112.489 173.603 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 80' ' ' ASN . . . . . . . . . . . . . 10.9 t30 -97.68 -20.04 17.87 Favored 'General case' 0 N--CA 1.452 -0.37 0 C-N-CA 124.082 0.953 . . . . 0.0 111.366 -178.842 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 81' ' ' THR . . . . . . . . . . . . . 20.4 m -69.8 -57.95 4.48 Favored 'General case' 0 N--CA 1.448 -0.545 0 N-CA-C 107.051 -1.462 . . . . 0.0 107.051 172.208 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 82' ' ' ILE . . . . . . . . . . . . . 8.9 tp -66.74 -39.91 84.81 Favored 'Isoleucine or valine' 0 N--CA 1.454 -0.269 0 C-N-CA 124.058 0.943 . . . . 0.0 111.333 -170.264 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 83' ' ' SER . . . . . . . . . . . . . 43.3 p -50.15 -49.23 52.78 Favored 'General case' 0 C--O 1.236 0.389 0 C-N-CA 124.542 1.137 . . . . 0.0 110.621 -176.141 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 84' ' ' GLU . . . . . . . . . . . . . 0.9 OUTLIER -70.94 -40.29 72.13 Favored 'General case' 0 N--CA 1.447 -0.582 0 CA-C-O 117.386 -1.293 . . . . 0.0 112.108 178.919 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 85' ' ' MET . . . . . . . . . . . . . 91.8 mtp -58.81 -41.37 86.61 Favored 'General case' 0 C--N 1.347 0.472 0 CA-C-N 120.94 1.7 . . . . 0.0 109.117 -176.279 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 86' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -77.56 -27.77 51.58 Favored 'General case' 0 C--O 1.232 0.179 0 C-N-CA 123.899 0.88 . . . . 0.0 112.043 -175.859 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 87' ' ' LYS . . . . . . . . . . . . . 64.5 mttt -76.34 -52.0 10.82 Favored 'General case' 0 N--CA 1.446 -0.672 0 N-CA-C 108.601 -0.888 . . . . 0.0 108.601 176.765 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 88' ' ' GLU . . . . . . . . . . . . . 18.0 mm-40 -51.19 -51.34 54.69 Favored 'General case' 0 CA--C 1.527 0.072 0 C-N-CA 125.242 1.417 . . . . 0.0 109.511 176.641 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 89' ' ' GLY . . . . . . . . . . . . . . . 106.67 133.16 7.28 Favored Glycine 0 C--N 1.335 0.523 0 N-CA-C 107.677 -2.169 . . . . 0.0 107.677 -166.653 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 90' ' ' ALA . . . . . . . . . . . . . . . -138.19 142.72 40.02 Favored 'General case' 0 CA--C 1.516 -0.35 0 C-N-CA 123.708 0.803 . . . . 0.0 109.695 -168.333 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 91' ' ' GLN . . . . . . . . . . . . . 6.0 mp0 -72.31 129.15 37.74 Favored 'General case' 0 N--CA 1.444 -0.775 0 N-CA-C 105.206 -2.146 . . . . 0.0 105.206 -177.098 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 92' ' ' VAL . . . . . . . . . . . . . 7.5 p -122.14 127.35 75.23 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.325 0 N-CA-C 106.947 -1.501 . . . . 0.0 106.947 -175.9 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 93' ' ' ASP . . . . . . . . . . . . . 0.8 OUTLIER -142.76 94.54 2.65 Favored 'General case' 0 C--O 1.234 0.253 0 N-CA-C 107.822 -1.177 . . . . 0.0 107.822 -173.452 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 94' ' ' LEU . . . . . . . . . . . . . 0.9 OUTLIER -99.45 102.65 14.28 Favored 'General case' 0 CA--C 1.515 -0.371 0 N-CA-C 107.069 -1.456 . . . . 0.0 107.069 176.043 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 95' ' ' THR . . . . . . . . . . . . . 5.8 t -78.02 -168.81 1.36 Allowed 'General case' 0 CA--C 1.536 0.407 0 O-C-N 125.043 1.465 . . . . 0.0 107.9 178.975 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 96' ' ' ALA . . . . . . . . . . . . . . . -53.15 -23.29 7.87 Favored 'General case' 0 CA--C 1.541 0.599 0 N-CA-C 114.041 1.126 . . . . 0.0 114.041 -175.075 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 97' ' ' ASN . . . . . . . . . . . . . 30.2 p30 -158.19 6.35 0.13 Allowed 'General case' 0 N--CA 1.473 0.697 0 N-CA-C 116.247 1.943 . . . . 0.0 116.247 164.757 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 98' ' ' GLN . . . . . . . . . . . . . 3.2 tt0 -121.6 130.53 53.56 Favored 'General case' 0 N--CA 1.471 0.6 0 CA-C-N 121.216 1.826 . . . . 0.0 110.743 -176.766 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 99' ' ' LEU . . . . . . . . . . . . . 14.5 tp -83.77 138.84 33.06 Favored 'General case' 0 C--O 1.232 0.168 0 O-C-N 121.523 -0.736 . . . . 0.0 110.145 171.768 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 100' ' ' THR . . . . . . . . . . . . . 28.8 m -120.74 120.14 34.78 Favored 'General case' 0 N--CA 1.448 -0.556 0 N-CA-C 105.773 -1.936 . . . . 0.0 105.773 159.433 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 101' ' ' LEU . . . . . . . . . . . . . 3.2 mm? -96.77 138.59 34.1 Favored 'General case' 0 CA--C 1.505 -0.753 0 N-CA-C 106.661 -1.607 . . . . 0.0 106.661 149.376 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 102' ' ' ALA . . . . . . . . . . . . . . . -131.98 154.04 49.72 Favored 'General case' 0 C--N 1.327 -0.411 0 N-CA-C 107.319 -1.363 . . . . 0.0 107.319 165.529 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 103' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -162.94 172.2 15.44 Favored 'General case' 0 N--CA 1.442 -0.845 0 C-N-CA 127.815 2.446 . . . . 0.0 107.891 176.274 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 104' ' ' ALA . . . . . . . . . . . . . . . -53.47 -29.97 38.52 Favored 'General case' 0 CA--C 1.537 0.471 0 C-N-CA 124.16 0.984 . . . . 0.0 113.103 174.94 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 105' ' ' LYS . . . . . . . . . . . . . 53.2 mmtt -70.7 -72.39 0.21 Allowed 'General case' 0 C--O 1.232 0.138 0 C-N-CA 123.61 0.764 . . . . 0.0 111.815 175.143 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 106' ' ' GLN . . . . . . . . . . . . . 2.6 pt20 -154.57 -168.48 2.93 Favored 'General case' 0 C--O 1.232 0.168 0 C-N-CA 123.49 0.716 . . . . 0.0 110.169 -178.983 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 107' ' ' THR . . . . . . . . . . . . . 7.2 t -130.64 152.91 49.49 Favored 'General case' 0 N--CA 1.446 -0.637 0 C-N-CA 126.284 1.834 . . . . 0.0 107.583 176.264 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 108' ' ' LEU . . . . . . . . . . . . . 3.5 mm? -121.63 166.29 14.47 Favored 'General case' 0 C--O 1.237 0.442 0 C-N-CA 125.193 1.397 . . . . 0.0 109.995 174.179 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 109' ' ' THR . . . . . . . . . . . . . 9.4 m -130.96 106.6 8.52 Favored 'General case' 0 N--CA 1.448 -0.565 0 N-CA-C 107.94 -1.133 . . . . 0.0 107.94 166.225 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 110' ' ' TYR . . . . . . . . . . . . . 49.6 m-85 -98.96 165.26 11.84 Favored 'General case' 0 C--O 1.235 0.308 0 N-CA-C 108.946 -0.761 . . . . 0.0 108.946 172.668 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 111' ' ' LYS . . . . . 0.488 ' HE2' ' HG3' ' A' ' 15' ' ' GLU . 5.0 tppt? -122.39 146.18 47.58 Favored 'General case' 0 C--O 1.226 -0.134 0 C-N-CA 124.249 1.02 . . . . 0.0 110.144 178.932 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 112' ' ' LEU . . . . . . . . . . . . . 26.1 tp -69.65 17.82 0.05 OUTLIER 'General case' 0 CA--C 1.546 0.795 0 C-N-CA 128.813 2.845 . . . . 0.0 113.519 -177.736 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 113' ' ' ALA . . . . . . . . . . . . . . . -60.54 90.19 0.02 OUTLIER 'General case' 0 CA--C 1.534 0.361 0 C-N-CA 126.023 1.729 . . . . 0.0 111.794 -168.397 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 114' ' ' ASP . . . . . 0.473 ' C ' ' H ' ' A' ' 116' ' ' MET . 27.2 t0 -87.35 45.44 1.27 Allowed 'General case' 0 CA--C 1.51 -0.592 0 CA-C-O 122.901 1.334 . . . . 0.0 111.494 -168.864 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 115' ' ' LEU . . . . . . . . . . . . . 2.8 mt -76.62 5.45 7.47 Favored 'General case' 0 CA--C 1.54 0.56 0 CA-C-N 115.358 -0.837 . . . . 0.0 109.963 -173.746 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 116' ' ' MET . . . . . 0.473 ' H ' ' C ' ' A' ' 114' ' ' ASP . 6.5 tpt 65.27 124.42 0.02 OUTLIER 'General case' 0 CA--C 1.537 0.472 0 C-N-CA 130.203 3.401 . . . . 0.0 111.887 -176.439 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 117' ' ' ASN . . . . . 0.455 ' H ' ' HE2' ' A' ' 116' ' ' MET . 76.0 m-20 . . . . . 0 C--O 1.24 0.597 0 C-N-CA 126.485 1.914 . . . . 0.0 111.661 -172.556 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 9.6 ttt . . . . . 0 C--O 1.234 0.252 0 N-CA-C 109.506 -0.553 . . . . 0.0 109.506 . . . . . . . . . 0 0 . 1 . 001 nuclear build core ' A' A ' 2' ' ' VAL . . . . . . . . . . . . . 74.9 t -59.69 137.3 22.3 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.448 0 N-CA-C 108.382 -0.97 . . . . 0.0 108.382 173.403 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 3' ' ' THR . . . . . . . . . . . . . 0.1 OUTLIER -124.75 162.38 43.32 Favored Pre-proline 0 CA--C 1.537 0.444 0 C-N-CA 122.494 0.318 . . . . 0.0 110.98 177.107 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 4' ' ' PRO . . . . . . . . . . . . . 9.2 Cg_endo -71.22 -41.74 2.38 Favored 'Trans proline' 0 CA--C 1.532 0.41 0 C-N-CA 122.833 2.356 . . . . 0.0 112.58 -179.312 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 5' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -61.01 -44.59 97.19 Favored 'General case' 0 C--N 1.325 -0.48 0 C-N-CA 124.231 1.012 . . . . 0.0 110.576 -173.516 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 6' ' ' GLN . . . . . . . . . . . . . 3.7 pt20 -65.5 12.63 0.05 OUTLIER 'General case' 0 CA--C 1.541 0.612 0 C-N-CA 125.803 1.641 . . . . 0.0 114.678 175.135 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 7' ' ' LEU . . . . . . . . . . . . . 77.0 mt -130.97 -45.57 1.03 Allowed 'General case' 0 C--O 1.225 -0.187 0 C-N-CA 125.488 1.515 . . . . 0.0 110.354 -177.34 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 8' ' ' GLN . . . . . . . . . . . . . 19.3 mt-30 -62.12 -3.08 1.12 Allowed 'General case' 0 N--CA 1.469 0.487 0 N-CA-C 115.534 1.679 . . . . 0.0 115.534 -171.956 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 9' ' ' HIS . . . . . . . . . . . . . 97.7 m-70 -135.41 13.68 3.49 Favored 'General case' 0 C--N 1.326 -0.414 0 C-N-CA 125.181 1.393 . . . . 0.0 111.488 177.128 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 10' ' ' HIS . . . . . . . . . . . . . 94.7 m-70 -131.13 108.21 9.58 Favored 'General case' 0 N--CA 1.451 -0.404 0 C-N-CA 124.753 1.221 . . . . 0.0 109.353 -172.119 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 11' ' ' ARG . . . . . . . . . . . . . 9.5 ptt180 -74.83 163.34 27.77 Favored 'General case' 0 C--O 1.235 0.311 0 N-CA-C 108.976 -0.75 . . . . 0.0 108.976 174.617 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 12' ' ' PHE . . . . . . . . . . . . . 46.7 m-85 -139.19 146.8 40.98 Favored 'General case' 0 N--CA 1.448 -0.568 0 N-CA-C 108.416 -0.957 . . . . 0.0 108.416 173.137 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 13' ' ' VAL . . . . . 0.482 ' HA ' ' HA ' ' A' ' 30' ' ' GLU . 7.2 p -112.3 137.17 46.11 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.478 0 O-C-N 121.267 -0.895 . . . . 0.0 109.686 178.622 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 14' ' ' LEU . . . . . . . . . . . . . 26.7 tp -64.22 121.97 15.51 Favored 'General case' 0 N--CA 1.466 0.375 0 N-CA-C 107.254 -1.387 . . . . 0.0 107.254 178.669 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 1.6 tm-20 -105.63 -50.22 3.25 Favored 'General case' 0 C--N 1.326 -0.454 0 N-CA-C 108.134 -1.061 . . . . 0.0 108.134 -174.429 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 5.3 p -146.11 124.23 12.16 Favored 'General case' 0 N--CA 1.446 -0.663 0 CA-C-O 121.995 0.902 . . . . 0.0 110.713 179.833 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 17' ' ' VAL . . . . . . . . . . . . . 2.4 t -64.93 160.04 3.57 Favored 'Isoleucine or valine' 0 C--O 1.239 0.531 0 N-CA-C 107.137 -1.431 . . . . 0.0 107.137 161.776 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 18' ' ' ASN . . . . . . . . . . . . . 1.5 t30 -44.97 -43.31 8.97 Favored 'General case' 0 CA--C 1.53 0.203 0 C-N-CA 123.77 0.828 . . . . 0.0 111.864 165.115 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . -90.43 -33.67 8.49 Favored Glycine 0 CA--C 1.526 0.756 0 CA-C-O 117.686 -1.619 . . . . 0.0 114.389 -170.235 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 10.5 mttt -161.67 165.7 15.93 Favored Pre-proline 0 N--CA 1.469 0.496 0 CA-C-N 119.806 1.803 . . . . 0.0 110.321 -174.357 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 21' ' ' PRO . . . . . . . . . . . . . 97.0 Cg_endo -64.01 -179.96 0.94 Allowed 'Trans proline' 0 CA--C 1.537 0.639 0 C-N-CA 122.614 2.209 . . . . 0.0 110.953 163.121 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 22' ' ' VAL . . . . . . . . . . . . . 3.8 t -130.1 145.37 35.74 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.426 0 N-CA-C 107.909 -1.145 . . . . 0.0 107.909 169.837 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 23' ' ' THR . . . . . . . . . . . . . 0.1 OUTLIER -143.65 111.79 6.24 Favored 'General case' 0 C--O 1.233 0.213 0 C-N-CA 124.877 1.271 . . . . 0.0 108.273 178.107 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 24' ' ' SER . . . . . . . . . . . . . 2.9 m -134.16 45.12 2.64 Favored 'General case' 0 CA--C 1.535 0.378 0 CA-C-N 118.668 0.667 . . . . 0.0 112.244 -163.989 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 25' ' ' ASP . . . . . . . . . . . . . 1.0 OUTLIER 65.14 -81.17 0.03 OUTLIER 'General case' 0 N--CA 1.463 0.178 0 C-N-CA 128.695 2.798 . . . . 0.0 110.171 172.27 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 26' ' ' LYS . . . . . . . . . . . . . 21.3 ttpp -143.63 5.23 1.38 Allowed 'General case' 0 CA--C 1.535 0.373 0 C-N-CA 124.653 1.181 . . . . 0.0 112.008 171.085 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 27' ' ' ASN . . . . . . . . . . . . . 70.0 m-80 -122.41 70.05 33.32 Favored Pre-proline 0 C--O 1.233 0.202 0 C-N-CA 125.514 1.525 . . . . 0.0 108.158 -174.238 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 28' ' ' PRO . . . . . . . . . . . . . 93.0 Cg_endo -72.91 160.68 45.46 Favored 'Trans proline' 0 N--CA 1.454 -0.811 0 C-N-CA 121.986 1.791 . . . . 0.0 111.214 -178.623 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 29' ' ' PRO . . . . . . . . . . . . . 39.6 Cg_endo -68.17 64.84 1.04 Allowed 'Trans proline' 0 N--CA 1.458 -0.568 0 C-N-CA 123.864 3.043 . . . . 0.0 111.392 164.022 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 30' ' ' GLU . . . . . 0.482 ' HA ' ' HA ' ' A' ' 13' ' ' VAL . 14.7 pt-20 -72.71 170.07 15.33 Favored 'General case' 0 N--CA 1.446 -0.635 0 O-C-N 120.316 -1.49 . . . . 0.0 109.408 166.705 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 31' ' ' ILE . . . . . . . . . . . . . 20.0 tt -141.77 149.26 20.05 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.483 0 N-CA-C 106.983 -1.488 . . . . 0.0 106.983 178.475 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 32' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER -134.75 164.35 27.74 Favored 'General case' 0 N--CA 1.442 -0.829 0 CA-C-O 122.856 1.312 . . . . 0.0 109.083 172.929 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 33' ' ' PHE . . . . . . . . . . . . . 95.2 m-85 -133.02 167.13 20.85 Favored 'General case' 0 C--N 1.323 -0.58 0 CA-C-N 113.74 -1.573 . . . . 0.0 107.609 -177.233 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 34' ' ' GLY . . . . . . . . . . . . . . . -166.47 -170.69 31.7 Favored Glycine 0 N--CA 1.447 -0.615 0 N-CA-C 110.007 -1.237 . . . . 0.0 110.007 172.354 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 35' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -44.31 149.15 0.39 Allowed 'General case' 0 C--O 1.234 0.282 0 C-N-CA 126.707 2.003 . . . . 0.0 111.383 -173.261 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 32.7 mmtm 65.01 15.66 10.12 Favored 'General case' 0 CA--C 1.536 0.43 0 C-N-CA 125.574 1.549 . . . . 0.0 111.727 -170.919 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 37' ' ' MET . . . . . . . . . . . . . 11.5 mmm 59.7 20.97 9.68 Favored 'General case' 0 CA--C 1.54 0.576 0 C-N-CA 126.12 1.768 . . . . 0.0 113.272 -171.839 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 38' ' ' MET . . . . . . . . . . . . . 0.8 OUTLIER -61.19 160.01 11.1 Favored 'General case' 0 N--CA 1.452 -0.328 0 O-C-N 121.171 -0.956 . . . . 0.0 112.011 178.911 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 39' ' ' ILE . . . . . . . . . . . . . 10.4 mt -131.7 138.45 52.85 Favored 'Isoleucine or valine' 0 C--O 1.236 0.375 0 C-N-CA 124.851 1.26 . . . . 0.0 108.625 -168.473 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 40' ' ' SER . . . . . . . . . . . . . 13.7 m -135.89 132.83 37.03 Favored 'General case' 0 CA--C 1.531 0.232 0 N-CA-C 106.389 -1.708 . . . . 0.0 106.389 166.47 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 41' ' ' GLY . . . . . . . . . . . . . . . -157.91 172.35 35.08 Favored Glycine 0 C--N 1.334 0.439 0 CA-C-N 119.109 0.868 . . . . 0.0 111.49 -177.965 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 42' ' ' SER . . . . . . . . . . . . . 15.1 p -149.57 72.17 1.13 Allowed 'General case' 0 N--CA 1.452 -0.336 0 O-C-N 121.861 -0.788 . . . . 0.0 112.068 -165.283 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 43' ' ' MET . . . . . . . . . . . . . 6.3 mmt -66.48 -58.42 5.28 Favored 'General case' 0 CA--C 1.537 0.445 0 N-CA-C 109.315 -0.624 . . . . 0.0 109.315 178.207 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 44' ' ' CYS . . . . . 1.293 ' SG ' ' SG ' ' A' ' 70' ' ' CYS . 3.8 t -145.4 -57.32 0.32 Allowed 'General case' 0 N--CA 1.462 0.17 0 N-CA-C 107.128 -1.434 . . . . 0.0 107.128 161.247 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 45' ' ' ASN . . . . . . . . . . . . . 16.1 m-80 -74.42 7.17 3.06 Favored 'General case' 0 C--N 1.331 -0.211 0 C-N-CA 127.363 2.265 . . . . 0.0 113.267 -171.327 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 46' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER 57.9 150.1 0.01 OUTLIER 'General case' 0 C--O 1.225 -0.2 0 C-N-CA 126.831 2.052 . . . . 0.0 112.23 -166.115 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 47' ' ' PHE . . . . . . . . . . . . . 38.4 p90 -146.02 170.14 17.24 Favored 'General case' 0 N--CA 1.445 -0.706 0 CA-C-O 122.63 1.205 . . . . 0.0 109.392 167.963 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 48' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -161.66 161.9 29.71 Favored 'General case' 0 C--N 1.324 -0.531 0 C-N-CA 126.032 1.733 . . . . 0.0 106.83 174.996 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 49' ' ' GLY . . . . . . . . . . . . . . . 174.15 168.04 34.49 Favored Glycine 0 CA--C 1.523 0.591 0 CA-C-N 119.364 0.984 . . . . 0.0 111.976 166.178 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 50' ' ' GLU . . . . . . . . . . . . . 31.1 mt-10 -80.2 94.93 6.14 Favored 'General case' 0 C--O 1.236 0.368 0 C-N-CA 123.514 0.726 . . . . 0.0 109.874 -178.964 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 51' ' ' GLY . . . . . . . . . . . . . . . -69.71 173.37 37.79 Favored Glycine 0 CA--C 1.528 0.857 0 CA-C-O 122.797 1.221 . . . . 0.0 113.135 174.147 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 52' ' ' LYS . . . . . . . . . . . . . 1.4 ttmp? -151.63 154.28 36.09 Favored 'General case' 0 N--CA 1.454 -0.268 0 C-N-CA 126.205 1.802 . . . . 0.0 107.635 -179.66 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 53' ' ' LEU . . . . . . . . . . . . . 1.5 tm? -149.44 117.73 6.44 Favored 'General case' 0 N--CA 1.453 -0.29 0 N-CA-C 106.247 -1.76 . . . . 0.0 106.247 169.231 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 1.3 t -144.06 -26.15 0.54 Allowed 'General case' 0 CA--C 1.535 0.392 0 C-N-CA 124.431 1.092 . . . . 0.0 112.126 -179.341 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 55' ' ' ASN . . . . . . . . . . . . . 0.5 OUTLIER -140.19 -10.75 1.11 Allowed 'General case' 0 N--CA 1.473 0.678 0 CA-C-N 119.924 1.238 . . . . 0.0 113.489 177.246 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 56' ' ' GLY . . . . . . . . . . . . . . . 126.3 6.23 5.82 Favored Glycine 0 CA--C 1.532 1.095 0 O-C-N 121.242 -0.911 . . . . 0.0 112.069 -173.063 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 57' ' ' GLU . . . . . . . . . . . . . 28.1 tt0 -114.26 113.71 24.98 Favored 'General case' 0 C--O 1.237 0.426 0 C-N-CA 125.419 1.488 . . . . 0.0 108.387 -169.535 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 58' ' ' LEU . . . . . . . . . . . . . 47.6 tp -94.36 97.4 10.18 Favored 'General case' 0 CA--C 1.533 0.305 0 C-N-CA 122.878 0.471 . . . . 0.0 110.439 175.354 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 59' ' ' THR . . . . . . . . . . . . . 6.4 p -99.29 139.01 35.57 Favored 'General case' 0 C--O 1.237 0.422 0 C-N-CA 124.171 0.988 . . . . 0.0 110.057 168.66 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 60' ' ' ALA . . . . . . . . . . . . . . . -94.34 108.73 20.62 Favored 'General case' 0 C--O 1.234 0.253 0 C-N-CA 124.799 1.239 . . . . 0.0 109.594 171.523 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 61' ' ' LYS . . . . . . . . . . . . . 11.0 tttt -75.36 72.0 2.37 Favored 'General case' 0 C--O 1.235 0.338 0 C-N-CA 124.916 1.286 . . . . 0.0 108.786 170.06 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 62' ' ' GLY . . . . . . . . . . . . . . . 102.86 104.47 2.86 Favored Glycine 0 N--CA 1.451 -0.349 0 N-CA-C 107.721 -2.152 . . . . 0.0 107.721 -174.433 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 63' ' ' LEU . . . . . . . . . . . . . 1.8 tp -90.42 161.79 15.4 Favored 'General case' 0 N--CA 1.447 -0.619 0 N-CA-C 108.506 -0.924 . . . . 0.0 108.506 160.352 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 64' ' ' ALA . . . . . . . . . . . . . . . -153.8 144.14 22.26 Favored 'General case' 0 C--O 1.235 0.299 0 C-N-CA 124.363 1.065 . . . . 0.0 109.858 165.848 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 65' ' ' MET . . . . . . . . . . . . . 8.5 mtt -145.48 169.31 18.6 Favored 'General case' 0 N--CA 1.472 0.628 0 C-N-CA 127.014 2.126 . . . . 0.0 111.752 -172.313 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 66' ' ' THR . . . . . . . . . . . . . 6.7 p -105.33 -172.37 2.08 Favored 'General case' 0 CA--C 1.544 0.748 0 C-N-CA 124.781 1.232 . . . . 0.0 110.78 177.003 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 67' ' ' ARG . . . . . . . . . . . . . 64.9 mtm-85 -121.48 76.14 1.23 Allowed 'General case' 0 N--CA 1.47 0.571 0 C-N-CA 124.728 1.211 . . . . 0.0 109.604 169.943 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 68' ' ' MET . . . . . . . . . . . . . 78.6 mtm -102.79 178.33 4.6 Favored 'General case' 0 CA--C 1.533 0.322 0 C-N-CA 124.924 1.29 . . . . 0.0 110.81 171.95 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 69' ' ' MET . . . . . . . . . . . . . 0.4 OUTLIER -137.24 171.7 14.09 Favored 'General case' 0 C--O 1.237 0.434 0 C-N-CA 127.058 2.143 . . . . 0.0 105.233 166.54 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 70' ' ' CYS . . . . . 1.293 ' SG ' ' SG ' ' A' ' 44' ' ' CYS . 97.0 m -141.51 9.03 2.01 Favored 'General case' 0 C--N 1.328 -0.327 0 N-CA-C 115.251 1.574 . . . . 0.0 115.251 -168.438 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 71' ' ' ALA . . . . . . . . . . . . . . . 62.19 2.23 0.8 Allowed 'General case' 0 CA--C 1.536 0.43 0 C-N-CA 126.72 2.008 . . . . 0.0 115.037 179.088 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 72' ' ' ASN . . . . . . . . . . . . . 0.1 OUTLIER -121.83 157.12 58.2 Favored Pre-proline 0 N--CA 1.476 0.867 0 N-CA-C 106.53 -1.655 . . . . 0.0 106.53 156.368 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 73' ' ' PRO . . . . . . . . . . . . . 64.7 Cg_endo -77.38 -41.85 0.32 Allowed 'Trans proline' 0 N--CA 1.459 -0.519 0 C-N-CA 122.236 1.957 . . . . 0.0 111.817 -178.487 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 74' ' ' GLN . . . . . . . . . . . . . 40.1 tt0 -47.52 -60.57 2.44 Favored 'General case' 0 CA--C 1.532 0.271 0 C-N-CA 126.972 2.109 . . . . 0.0 110.609 -173.959 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 75' ' ' LEU . . . . . . . . . . . . . 82.4 mt -55.44 -40.65 71.81 Favored 'General case' 0 CA--C 1.536 0.42 0 C-N-CA 125.126 1.37 . . . . 0.0 110.537 -177.786 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 76' ' ' ASN . . . . . . . . . . . . . 23.7 t-20 -75.14 -19.93 59.64 Favored 'General case' 0 N--CA 1.467 0.384 0 C-N-CA 125.309 1.444 . . . . 0.0 112.379 -176.05 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 77' ' ' GLU . . . . . . . . . . . . . 0.3 OUTLIER -92.48 -31.35 15.28 Favored 'General case' 0 CA--C 1.535 0.376 0 C-N-CA 124.501 1.12 . . . . 0.0 111.821 174.338 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 78' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -61.21 -25.48 67.08 Favored 'General case' 0 CA--C 1.534 0.347 0 C-N-CA 126.503 1.921 . . . . 0.0 111.787 -176.982 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 79' ' ' ASP . . . . . . . . . . . . . 20.2 m-20 -56.58 -43.44 80.03 Favored 'General case' 0 C--O 1.237 0.395 0 C-N-CA 125.549 1.54 . . . . 0.0 111.254 170.959 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 80' ' ' ASN . . . . . . . . . . . . . 49.1 m-20 -72.85 -32.07 65.21 Favored 'General case' 0 N--CA 1.453 -0.294 0 C-N-CA 119.288 -0.965 . . . . 0.0 110.261 -177.193 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 81' ' ' THR . . . . . . . . . . . . . 0.9 OUTLIER -58.04 -54.1 50.79 Favored 'General case' 0 N--CA 1.452 -0.367 0 CA-C-N 118.835 0.743 . . . . 0.0 110.264 172.567 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 82' ' ' ILE . . . . . . . . . . . . . 7.3 tp -65.06 -36.46 77.86 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.277 0 C-N-CA 119.77 -0.772 . . . . 0.0 110.143 -175.321 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 83' ' ' SER . . . . . . . . . . . . . 6.4 m -56.61 -51.62 67.96 Favored 'General case' 0 N--CA 1.449 -0.525 0 C-N-CA 122.974 0.51 . . . . 0.0 111.474 176.681 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 84' ' ' GLU . . . . . . . . . . . . . 3.3 mm-40 -56.75 -54.92 40.71 Favored 'General case' 0 N--CA 1.452 -0.355 0 C-N-CA 126.059 1.744 . . . . 0.0 110.083 176.414 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 85' ' ' MET . . . . . . . . . . . . . 87.8 mtp -60.95 -41.66 96.72 Favored 'General case' 0 C--N 1.341 0.233 0 CA-C-O 121.863 0.839 . . . . 0.0 108.762 -169.721 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 86' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -77.35 -20.57 54.64 Favored 'General case' 0 C--N 1.331 -0.223 0 O-C-N 121.361 -0.837 . . . . 0.0 112.407 -177.289 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 87' ' ' LYS . . . . . . . . . . . . . 5.4 tttm -72.66 -54.77 8.12 Favored 'General case' 0 N--CA 1.452 -0.364 0 N-CA-C 108.195 -1.039 . . . . 0.0 108.195 170.304 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 88' ' ' GLU . . . . . . . . . . . . . 15.4 pt-20 -73.95 -33.87 64.07 Favored 'General case' 0 CA--C 1.534 0.362 0 CA-C-O 118.667 -0.682 . . . . 0.0 111.918 -168.433 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 89' ' ' GLY . . . . . . . . . . . . . . . 120.33 87.4 1.01 Allowed Glycine 0 C--N 1.335 0.519 0 N-CA-C 108.616 -1.794 . . . . 0.0 108.616 178.509 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 90' ' ' ALA . . . . . 0.697 ' HB1' HD12 ' A' ' 101' ' ' LEU . . . -69.07 119.3 13.15 Favored 'General case' 0 N--CA 1.443 -0.823 0 N-CA-C 107.535 -1.283 . . . . 0.0 107.535 -173.26 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 91' ' ' GLN . . . . . . . . . . . . . 58.9 mm-40 -79.76 116.02 19.69 Favored 'General case' 0 N--CA 1.447 -0.579 0 N-CA-C 105.48 -2.044 . . . . 0.0 105.48 -177.083 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 92' ' ' VAL . . . . . . . . . . . . . 24.2 t -103.55 108.69 25.06 Favored 'Isoleucine or valine' 0 N--CA 1.448 -0.536 0 C-N-CA 127.422 2.289 . . . . 0.0 109.201 -168.787 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 93' ' ' ASP . . . . . . . . . . . . . 5.1 t0 -107.54 68.59 0.72 Allowed 'General case' 0 C--O 1.238 0.489 0 C-N-CA 126.508 1.923 . . . . 0.0 109.051 174.674 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 94' ' ' LEU . . . . . . . . . . . . . 1.7 tm? -75.55 109.93 9.52 Favored 'General case' 0 N--CA 1.452 -0.327 0 N-CA-C 106.882 -1.525 . . . . 0.0 106.882 168.944 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 95' ' ' THR . . . . . . . . . . . . . 7.7 t -89.52 -163.74 1.05 Allowed 'General case' 0 C--N 1.326 -0.42 0 C-N-CA 125.539 1.536 . . . . 0.0 108.387 175.766 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 96' ' ' ALA . . . . . . . . . . . . . . . -44.76 -40.87 6.41 Favored 'General case' 0 CA--C 1.54 0.584 0 C-N-CA 124.609 1.164 . . . . 0.0 113.791 -174.357 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 97' ' ' ASN . . . . . . . . . . . . . 6.2 p30 -162.91 14.52 0.07 Allowed 'General case' 0 N--CA 1.47 0.536 0 C-N-CA 124.681 1.193 . . . . 0.0 113.207 -173.752 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 98' ' ' GLN . . . . . . . . . . . . . 6.0 tt0 -128.83 130.42 46.91 Favored 'General case' 0 C--N 1.333 -0.143 0 N-CA-C 106.555 -1.646 . . . . 0.0 106.555 174.913 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 99' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -81.3 136.13 35.75 Favored 'General case' 0 C--N 1.327 -0.409 0 N-CA-C 107.17 -1.418 . . . . 0.0 107.17 169.465 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 100' ' ' THR . . . . . . . . . . . . . 0.3 OUTLIER -128.84 137.91 51.75 Favored 'General case' 0 N--CA 1.45 -0.456 0 N-CA-C 106.12 -1.807 . . . . 0.0 106.12 165.228 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 101' ' ' LEU . . . . . 0.697 HD12 ' HB1' ' A' ' 90' ' ' ALA . 4.5 mm? -106.63 157.33 17.77 Favored 'General case' 0 N--CA 1.449 -0.502 0 N-CA-C 107.861 -1.163 . . . . 0.0 107.861 164.753 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 102' ' ' ALA . . . . . . . . . . . . . . . -155.31 109.47 2.89 Favored 'General case' 0 C--N 1.329 -0.283 0 N-CA-C 108.321 -0.992 . . . . 0.0 108.321 159.06 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 103' ' ' THR . . . . . . . . . . . . . 0.5 OUTLIER -121.37 -172.66 2.46 Favored 'General case' 0 C--O 1.238 0.476 0 N-CA-C 108.608 -0.886 . . . . 0.0 108.608 -175.687 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 104' ' ' ALA . . . . . . . . . . . . . . . -53.09 -44.17 67.35 Favored 'General case' 0 N--CA 1.454 -0.26 0 O-C-N 121.102 -0.998 . . . . 0.0 110.202 168.728 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 105' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -59.57 -66.7 0.47 Allowed 'General case' 0 C--O 1.234 0.265 0 N-CA-C 113.277 0.843 . . . . 0.0 113.277 -173.758 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 106' ' ' GLN . . . . . . . . . . . . . 2.2 pt20 -166.22 -172.77 2.36 Favored 'General case' 0 CA--C 1.535 0.393 0 C-N-CA 127.114 2.165 . . . . 0.0 108.139 178.76 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 107' ' ' THR . . . . . . . . . . . . . 4.5 t -100.2 157.45 16.57 Favored 'General case' 0 C--O 1.24 0.57 0 C-N-CA 125.441 1.497 . . . . 0.0 108.186 163.267 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 108' ' ' LEU . . . . . . . . . . . . . 76.6 mt -146.95 141.56 26.62 Favored 'General case' 0 C--N 1.332 -0.173 0 C-N-CA 127.071 2.148 . . . . 0.0 105.968 176.757 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 109' ' ' THR . . . . . . . . . . . . . 27.9 m -130.14 126.5 37.67 Favored 'General case' 0 C--O 1.237 0.411 0 N-CA-C 107.959 -1.126 . . . . 0.0 107.959 -174.147 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 110' ' ' TYR . . . . . . . . . . . . . 12.4 m-85 -124.43 158.58 32.43 Favored 'General case' 0 CA--C 1.531 0.237 0 C-N-CA 124.215 1.006 . . . . 0.0 109.375 -176.04 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 111' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -108.75 145.32 35.31 Favored 'General case' 0 CA--C 1.516 -0.362 0 C-N-CA 124.14 0.976 . . . . 0.0 109.905 -178.931 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 112' ' ' LEU . . . . . . . . . . . . . 25.7 tp -75.61 58.56 1.07 Allowed 'General case' 0 CA--C 1.54 0.582 0 C-N-CA 124.816 1.246 . . . . 0.0 108.515 166.917 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 113' ' ' ALA . . . . . . . . . . . . . . . -78.94 64.5 3.89 Favored 'General case' 0 CA--C 1.529 0.163 0 O-C-N 120.534 -1.354 . . . . 0.0 108.102 170.66 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 114' ' ' ASP . . . . . . . . . . . . . 25.2 t0 . . . . . 0 N--CA 1.465 0.316 0 CA-C-O 122.04 0.924 . . . . 0.0 113.322 -161.526 . . . . . . . . 0 0 . 1 . 002 nuclear build core ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 48.5 ttp . . . . . 0 N--CA 1.454 -0.239 0 N-CA-C 109.253 -0.647 . . . . 0.0 109.253 . . . . . . . . . 0 0 . 1 . 002 nuclear build core ' A' A ' 2' ' ' VAL . . . . . . . . . . . . . 12.2 p -58.07 142.8 13.3 Favored 'Isoleucine or valine' 0 C--O 1.241 0.649 0 C-N-CA 124.197 0.999 . . . . 0.0 111.336 177.126 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 3' ' ' THR . . . . . 0.458 ' HB ' ' HD2' ' A' ' 4' ' ' PRO . 51.8 p -126.65 165.67 26.92 Favored Pre-proline 0 CA--C 1.535 0.371 0 C-N-CA 124.54 1.136 . . . . 0.0 110.223 179.467 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 4' ' ' PRO . . . . . 0.458 ' HD2' ' HB ' ' A' ' 3' ' ' THR . 45.2 Cg_endo -69.91 -34.45 14.05 Favored 'Trans proline' 0 CA--C 1.533 0.445 0 C-N-CA 122.672 2.248 . . . . 0.0 113.662 175.893 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 5' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -49.18 -59.97 3.2 Favored 'General case' 0 N--CA 1.477 0.88 0 C-N-CA 125.747 1.619 . . . . 0.0 110.121 -179.964 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 6' ' ' GLN . . . . . . . . . . . . . 8.8 pt20 -64.32 14.83 0.02 OUTLIER 'General case' 0 CA--C 1.542 0.64 0 C-N-CA 127.957 2.503 . . . . 0.0 114.789 176.946 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 7' ' ' LEU . . . . . . . . . . . . . 95.5 mt -132.77 -48.74 0.88 Allowed 'General case' 0 CA--C 1.518 -0.259 0 C-N-CA 124.758 1.223 . . . . 0.0 110.633 -175.734 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 8' ' ' GLN . . . . . . . . . . . . . 40.5 mt-30 -56.83 -5.76 0.27 Allowed 'General case' 0 CA--C 1.536 0.429 0 C-N-CA 126.024 1.73 . . . . 0.0 114.699 -175.725 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 9' ' ' HIS . . . . . . . . . . . . . 95.9 m-70 -125.11 0.63 7.87 Favored 'General case' 0 CA--C 1.532 0.27 0 CA-C-O 118.022 -0.99 . . . . 0.0 113.486 178.534 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 10' ' ' HIS . . . . . . . . . . . . . 98.2 m-70 -120.91 126.59 50.4 Favored 'General case' 0 C--O 1.234 0.253 0 CA-C-N 119.595 1.088 . . . . 0.0 111.919 -170.29 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 11' ' ' ARG . . . . . . . . . . . . . 32.8 ttt180 -70.4 154.38 41.96 Favored 'General case' 0 C--N 1.331 -0.212 0 C-N-CA 124.884 1.274 . . . . 0.0 109.06 162.929 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 12' ' ' PHE . . . . . . . . . . . . . 41.4 m-85 -130.83 165.83 22.15 Favored 'General case' 0 N--CA 1.444 -0.76 0 C-N-CA 125.727 1.611 . . . . 0.0 107.982 164.581 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 13' ' ' VAL . . . . . 0.501 ' HA ' ' HA ' ' A' ' 30' ' ' GLU . 7.3 p -128.86 145.83 35.11 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.436 0 O-C-N 120.924 -1.11 . . . . 0.0 108.562 174.495 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 14' ' ' LEU . . . . . . . . . . . . . 4.9 tp -77.86 86.93 4.08 Favored 'General case' 0 C--O 1.233 0.23 0 N-CA-C 107.452 -1.314 . . . . 0.0 107.452 176.838 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 15' ' ' GLU . . . . . 0.404 ' HG2' ' HE2' ' A' ' 111' ' ' LYS . 17.7 tp10 -70.49 -49.86 43.97 Favored 'General case' 0 C--N 1.323 -0.546 0 CA-C-N 115.718 -0.674 . . . . 0.0 109.455 -176.465 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 63.2 p -147.51 136.2 21.92 Favored 'General case' 0 N--CA 1.446 -0.642 0 CA-C-O 122.363 1.078 . . . . 0.0 111.386 176.408 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 17' ' ' VAL . . . . . . . . . . . . . 3.2 t -77.68 169.04 1.81 Allowed 'Isoleucine or valine' 0 C--O 1.238 0.486 0 C-N-CA 125.71 1.604 . . . . 0.0 107.355 174.324 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 18' ' ' ASN . . . . . . . . . . . . . 0.5 OUTLIER -51.23 -34.68 33.25 Favored 'General case' 0 CA--C 1.534 0.329 0 C-N-CA 123.469 0.707 . . . . 0.0 112.205 165.063 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . -93.01 -45.35 3.61 Favored Glycine 0 CA--C 1.527 0.788 0 CA-C-O 118.395 -1.225 . . . . 0.0 113.875 -170.892 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 13.9 mttt -160.28 166.09 16.39 Favored Pre-proline 0 N--CA 1.469 0.488 0 C-N-CA 126.145 1.778 . . . . 0.0 109.819 -173.261 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 21' ' ' PRO . . . . . . . . . . . . . 91.1 Cg_endo -63.5 -178.78 0.54 Allowed 'Trans proline' 0 CA--C 1.542 0.893 0 C-N-CA 122.718 2.279 . . . . 0.0 111.358 163.477 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 22' ' ' VAL . . . . . . . . . . . . . 4.0 t -131.59 154.74 40.93 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.377 0 C-N-CA 124.107 0.963 . . . . 0.0 108.445 172.881 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 23' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -148.63 112.91 5.25 Favored 'General case' 0 C--O 1.234 0.27 0 N-CA-C 105.791 -1.929 . . . . 0.0 105.791 170.832 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 24' ' ' SER . . . . . . . . . . . . . 15.3 m -121.33 48.94 1.58 Allowed 'General case' 0 N--CA 1.469 0.497 0 CA-C-N 119.505 1.048 . . . . 0.0 108.348 174.769 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 25' ' ' ASP . . . . . . . . . . . . . 38.4 t0 51.35 -83.77 0.01 OUTLIER 'General case' 0 N--CA 1.453 -0.308 0 C-N-CA 128.671 2.788 . . . . 0.0 110.852 -169.787 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 26' ' ' LYS . . . . . . . . . . . . . 32.6 tttm -130.5 -4.71 4.23 Favored 'General case' 0 CA--C 1.537 0.465 0 C-N-CA 125.698 1.599 . . . . 0.0 111.214 -172.121 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 27' ' ' ASN . . . . . . . . . . . . . 6.2 p30 -118.8 58.38 3.68 Favored Pre-proline 0 CA--C 1.545 0.753 0 C-N-CA 126.26 1.824 . . . . 0.0 112.885 177.735 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 28' ' ' PRO . . . . . . . . . . . . . 54.1 Cg_endo -71.09 168.07 24.3 Favored 'Trans proline' 0 CA--C 1.548 1.215 0 C-N-CA 123.72 2.947 . . . . 0.0 112.627 -176.6 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 29' ' ' PRO . . . . . . . . . . . . . 20.6 Cg_endo -73.2 63.71 4.3 Favored 'Trans proline' 0 C--N 1.355 0.873 0 C-N-CA 123.59 2.86 . . . . 0.0 113.525 179.067 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 30' ' ' GLU . . . . . 0.501 ' HA ' ' HA ' ' A' ' 13' ' ' VAL . 8.7 pt-20 -72.15 169.44 16.09 Favored 'General case' 0 CA--C 1.537 0.469 0 O-C-N 120.228 -1.545 . . . . 0.0 111.638 175.148 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 31' ' ' ILE . . . . . . . . . . . . . 16.6 tt -143.46 146.46 21.27 Favored 'Isoleucine or valine' 0 CA--C 1.529 0.166 0 N-CA-C 107.909 -1.145 . . . . 0.0 107.909 -179.39 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 32' ' ' SER . . . . . . . . . . . . . 14.7 p -137.48 157.26 46.94 Favored 'General case' 0 C--O 1.237 0.441 0 O-C-N 120.962 -1.086 . . . . 0.0 109.669 170.986 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 33' ' ' PHE . . . . . . . . . . . . . 86.5 m-85 -121.99 155.92 34.56 Favored 'General case' 0 N--CA 1.442 -0.857 0 N-CA-C 107.207 -1.405 . . . . 0.0 107.207 177.681 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 34' ' ' GLY . . . . . . . . . . . . . . . -149.87 -165.12 12.24 Favored Glycine 0 CA--C 1.516 0.12 0 N-CA-C 109.271 -1.532 . . . . 0.0 109.271 177.189 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 35' ' ' GLU . . . . . . . . . . . . . 0.2 OUTLIER -44.1 154.57 0.11 Allowed 'General case' 0 C--O 1.235 0.337 0 C-N-CA 126.745 2.018 . . . . 0.0 111.577 177.774 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 37.8 mtpt 55.92 13.92 1.24 Allowed 'General case' 0 CA--C 1.532 0.275 0 C-N-CA 124.778 1.231 . . . . 0.0 112.311 -171.659 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 37' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER 59.36 25.99 14.78 Favored 'General case' 0 CA--C 1.542 0.653 0 C-N-CA 124.872 1.269 . . . . 0.0 110.903 -175.135 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 38' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -61.86 164.54 6.27 Favored 'General case' 0 N--CA 1.444 -0.748 0 O-C-N 120.449 -1.407 . . . . 0.0 111.575 173.015 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 39' ' ' ILE . . . . . . . . . . . . . 10.6 mt -134.05 139.26 48.72 Favored 'Isoleucine or valine' 0 C--O 1.238 0.455 0 N-CA-C 106.732 -1.581 . . . . 0.0 106.732 -172.108 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 40' ' ' SER . . . . . . . . . . . . . 58.8 m -136.29 152.82 51.1 Favored 'General case' 0 C--O 1.234 0.266 0 N-CA-C 109.591 -0.522 . . . . 0.0 109.591 156.067 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 41' ' ' GLY . . . . . . . . . . . . . . . -164.98 -175.26 35.55 Favored Glycine 0 CA--C 1.527 0.835 0 C-N-CA 124.645 1.117 . . . . 0.0 110.323 172.532 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 42' ' ' SER . . . . . . . . . . . . . 22.1 p -151.27 87.43 1.39 Allowed 'General case' 0 N--CA 1.445 -0.713 0 C-N-CA 124.69 1.196 . . . . 0.0 110.02 177.737 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 43' ' ' MET . . . . . . . . . . . . . 6.2 mmt -61.11 -66.95 0.45 Allowed 'General case' 0 C--N 1.341 0.236 0 N-CA-C 108.455 -0.942 . . . . 0.0 108.455 169.601 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 44' ' ' CYS . . . . . 1.288 ' SG ' ' SG ' ' A' ' 70' ' ' CYS . 17.1 t -138.01 -57.04 0.67 Allowed 'General case' 0 N--CA 1.447 -0.586 0 N-CA-C 106.446 -1.687 . . . . 0.0 106.446 164.571 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 45' ' ' ASN . . . . . . . . . . . . . 5.8 m-80 -76.68 8.28 3.78 Favored 'General case' 0 N--CA 1.464 0.259 0 C-N-CA 127.4 2.28 . . . . 0.0 115.854 -168.394 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 46' ' ' ARG . . . . . . . . . . . . . 8.7 mtm180 53.37 160.24 0.01 OUTLIER 'General case' 0 CA--C 1.52 -0.176 0 C-N-CA 126.78 2.032 . . . . 0.0 112.362 -155.936 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 47' ' ' PHE . . . . . . . . . . . . . 48.8 p90 -159.32 153.1 23.01 Favored 'General case' 0 C--N 1.321 -0.657 0 CA-C-N 113.653 -1.612 . . . . 0.0 107.672 164.83 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 48' ' ' SER . . . . . . . . . . . . . 3.3 m -154.26 156.93 37.93 Favored 'General case' 0 N--CA 1.444 -0.754 0 C-N-CA 125.696 1.598 . . . . 0.0 106.823 176.391 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 49' ' ' GLY . . . . . . . . . . . . . . . 174.57 163.86 28.5 Favored Glycine 0 N--CA 1.448 -0.543 0 N-CA-C 111.193 -0.763 . . . . 0.0 111.193 167.994 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 50' ' ' GLU . . . . . . . . . . . . . 34.0 tt0 -64.66 100.12 0.36 Allowed 'General case' 0 N--CA 1.445 -0.685 0 C-N-CA 125.437 1.495 . . . . 0.0 108.985 171.985 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 51' ' ' GLY . . . . . . . . . . . . . . . -72.18 177.45 39.25 Favored Glycine 0 CA--C 1.527 0.79 0 N-CA-C 111.483 -0.647 . . . . 0.0 111.483 161.027 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 52' ' ' LYS . . . . . . . . . . . . . 16.6 tttp -162.77 151.24 14.38 Favored 'General case' 0 N--CA 1.455 -0.201 0 N-CA-C 106.985 -1.487 . . . . 0.0 106.985 171.281 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 53' ' ' LEU . . . . . . . . . . . . . 42.7 tp -146.9 119.36 8.45 Favored 'General case' 0 CA--C 1.517 -0.299 0 N-CA-C 107.436 -1.32 . . . . 0.0 107.436 173.808 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 2.1 t -157.64 14.63 0.23 Allowed 'General case' 0 CA--C 1.541 0.608 0 C-N-CA 123.158 0.583 . . . . 0.0 110.768 166.945 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 55' ' ' ASN . . . . . . . . . . . . . 18.2 p-10 -154.87 26.68 0.43 Allowed 'General case' 0 CA--C 1.537 0.446 0 C-N-CA 125.178 1.391 . . . . 0.0 111.528 -169.743 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 56' ' ' GLY . . . . . . . . . . . . . . . 63.62 17.08 59.69 Favored Glycine 0 CA--C 1.531 1.044 0 O-C-N 121.609 -0.682 . . . . 0.0 113.62 -179.605 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 57' ' ' GLU . . . . . . . . . . . . . 33.9 tt0 -129.74 151.12 50.67 Favored 'General case' 0 N--CA 1.451 -0.394 0 C-N-CA 125.633 1.573 . . . . 0.0 107.271 -174.24 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 58' ' ' LEU . . . . . . . . . . . . . 59.0 tp -131.6 107.91 9.17 Favored 'General case' 0 N--CA 1.455 -0.203 0 C-N-CA 125.717 1.607 . . . . 0.0 108.012 175.932 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 59' ' ' THR . . . . . . . . . . . . . 4.5 p -107.57 160.01 16.01 Favored 'General case' 0 CA--C 1.536 0.416 0 C-N-CA 125.726 1.611 . . . . 0.0 110.171 176.594 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 60' ' ' ALA . . . . . . . . . . . . . . . -110.14 102.37 11.08 Favored 'General case' 0 C--O 1.234 0.27 0 C-N-CA 124.851 1.26 . . . . 0.0 111.713 168.569 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 61' ' ' LYS . . . . . . . . . . . . . 0.3 OUTLIER -79.23 5.4 12.35 Favored 'General case' 0 CA--C 1.539 0.526 0 N-CA-C 112.755 0.65 . . . . 0.0 112.755 168.639 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 62' ' ' GLY . . . . . . . . . . . . . . . -167.91 48.68 0.24 Allowed Glycine 0 C--N 1.331 0.303 0 CA-C-N 121.384 1.902 . . . . 0.0 111.487 -177.567 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 63' ' ' LEU . . . . . . . . . . . . . 0.9 OUTLIER -61.29 140.03 58.05 Favored 'General case' 0 N--CA 1.45 -0.457 0 N-CA-C 108.351 -0.981 . . . . 0.0 108.351 171.438 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 64' ' ' ALA . . . . . . . . . . . . . . . -144.12 134.81 24.96 Favored 'General case' 0 N--CA 1.454 -0.25 0 N-CA-C 109.024 -0.732 . . . . 0.0 109.024 171.457 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 65' ' ' MET . . . . . . . . . . . . . 68.4 mtp -139.98 179.49 6.58 Favored 'General case' 0 C--O 1.24 0.604 0 C-N-CA 124.656 1.182 . . . . 0.0 110.094 -170.179 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 66' ' ' THR . . . . . . . . . . . . 0.282 3.3 p -120.4 -163.04 0.98 Allowed 'General case' 0 CA--C 1.551 0.992 0 C-N-CA 125.508 1.523 . . . . 0.0 112.671 -176.306 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 67' ' ' ARG . . . . . . . . . . . . . 17.7 mmt180 -130.15 62.25 1.57 Allowed 'General case' 0 N--CA 1.475 0.813 0 C-N-CA 126.6 1.96 . . . . 0.0 111.715 173.741 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 68' ' ' MET . . . . . . . . . . . . . 77.2 mtm -99.53 171.53 7.87 Favored 'General case' 0 N--CA 1.468 0.429 0 C-N-CA 125.837 1.655 . . . . 0.0 111.684 172.901 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 69' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -129.28 161.81 29.36 Favored 'General case' 0 C--O 1.237 0.402 0 C-N-CA 127.627 2.371 . . . . 0.0 108.489 -176.42 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 70' ' ' CYS . . . . . 1.288 ' SG ' ' SG ' ' A' ' 44' ' ' CYS . 66.2 m -145.74 13.08 1.32 Allowed 'General case' 0 N--CA 1.474 0.773 0 N-CA-C 116.585 2.069 . . . . 0.0 116.585 -170.125 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 71' ' ' ALA . . . . . . . . . . . . . . . 68.39 -28.04 0.15 Allowed 'General case' 0 N--CA 1.473 0.697 0 C-N-CA 127.741 2.416 . . . . 0.0 116.182 166.301 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 72' ' ' ASN . . . . . . . . . . . . . 1.1 t-20 -88.73 163.42 35.52 Favored Pre-proline 0 C--O 1.24 0.564 0 C-N-CA 127.235 2.214 . . . . 0.0 105.844 159.634 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 73' ' ' PRO . . . . . . . . . . . . . 24.6 Cg_endo -92.55 -19.68 0.6 Allowed 'Trans proline' 0 N--CA 1.451 -0.98 0 C-N-CA 121.596 1.531 . . . . 0.0 110.951 169.917 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 74' ' ' GLN . . . . . . . . . . . . . 63.3 tt0 -52.65 -62.62 1.53 Allowed 'General case' 0 C--N 1.343 0.312 0 C-N-CA 125.135 1.374 . . . . 0.0 110.586 -176.657 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 75' ' ' LEU . . . . . . . . . . . . . 19.9 mt -62.93 -28.0 69.76 Favored 'General case' 0 CA--C 1.538 0.481 0 C-N-CA 122.959 0.504 . . . . 0.0 110.451 -173.45 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 76' ' ' ASN . . . . . . . . . . . . . 2.0 t-20 -72.52 -34.64 67.73 Favored 'General case' 0 CA--C 1.532 0.27 0 C-N-CA 126.284 1.834 . . . . 0.0 111.811 -179.867 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 77' ' ' GLU . . . . . . . . . . . . . 1.1 mm-40 -78.99 -30.96 44.67 Favored 'General case' 0 C--O 1.234 0.24 0 C-N-CA 123.757 0.823 . . . . 0.0 110.694 172.451 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 78' ' ' LEU . . . . . . . . . . . . . 3.0 mp -62.68 -35.63 80.3 Favored 'General case' 0 N--CA 1.456 -0.155 0 C-N-CA 124.778 1.231 . . . . 0.0 110.442 -179.688 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 79' ' ' ASP . . . . . . . . . . . . . 74.2 m-20 -53.17 -47.55 68.7 Favored 'General case' 0 CA--C 1.517 -0.312 0 C-N-CA 124.207 1.003 . . . . 0.0 110.699 171.514 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 80' ' ' ASN . . . . . . . . . . . . . 37.4 m-20 -78.16 -35.08 49.26 Favored 'General case' 0 N--CA 1.452 -0.328 0 N-CA-C 108.801 -0.815 . . . . 0.0 108.801 -171.482 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 81' ' ' THR . . . . . . . . . . . . . 12.8 m -58.41 -56.22 24.88 Favored 'General case' 0 N--CA 1.445 -0.719 0 C-N-CA 123.814 0.846 . . . . 0.0 109.701 172.316 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 82' ' ' ILE . . . . . . . . . . . . . 10.2 tp -65.25 -34.35 69.91 Favored 'Isoleucine or valine' 0 C--N 1.34 0.195 0 CA-C-N 120.093 1.315 . . . . 0.0 110.905 -174.089 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 83' ' ' SER . . . . . . . . . . . . . 11.2 t -62.35 -54.25 43.13 Favored 'General case' 0 N--CA 1.446 -0.649 0 N-CA-C 109.249 -0.648 . . . . 0.0 109.249 -179.0 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 84' ' ' GLU . . . . . . . . . . . . . 4.5 mm-40 -57.56 -44.83 85.57 Favored 'General case' 0 N--CA 1.449 -0.484 0 C-N-CA 124.864 1.266 . . . . 0.0 110.127 174.99 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 85' ' ' MET . . . . . . . . . . . . . 95.4 mtp -73.02 -1.1 15.85 Favored 'General case' 0 CA--C 1.518 -0.284 0 CA-C-N 119.175 0.898 . . . . 0.0 112.665 -173.86 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 86' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -112.73 -16.19 12.82 Favored 'General case' 0 C--N 1.327 -0.398 0 CA-C-N 119.686 1.13 . . . . 0.0 110.786 170.941 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 87' ' ' LYS . . . . . . . . . . . . . 1.8 mptp? -79.3 -26.84 42.21 Favored 'General case' 0 N--CA 1.453 -0.286 0 CA-C-O 117.861 -1.066 . . . . 0.0 112.385 -173.578 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 88' ' ' GLU . . . . . . . . . . . . . 22.7 pt-20 -110.23 0.77 18.29 Favored 'General case' 0 CA--C 1.54 0.573 0 C-N-CA 124.977 1.311 . . . . 0.0 113.476 -170.778 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 89' ' ' GLY . . . . . . . . . . . . . . . 86.04 99.78 0.75 Allowed Glycine 0 C--N 1.338 0.679 0 C-N-CA 126.862 2.173 . . . . 0.0 110.256 -173.276 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 90' ' ' ALA . . . . . . . . . . . . . . . -71.87 139.68 48.95 Favored 'General case' 0 N--CA 1.465 0.309 0 N-CA-C 107.591 -1.263 . . . . 0.0 107.591 164.988 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 91' ' ' GLN . . . . . . . . . . . . . 78.1 mm-40 -74.17 145.89 43.87 Favored 'General case' 0 N--CA 1.445 -0.677 0 N-CA-C 105.771 -1.937 . . . . 0.0 105.771 158.359 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 92' ' ' VAL . . . . . . . . . . . . . 7.9 p -135.02 124.51 43.19 Favored 'Isoleucine or valine' 0 N--CA 1.449 -0.476 0 N-CA-C 106.645 -1.613 . . . . 0.0 106.645 -172.346 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 93' ' ' ASP . . . . . . . . . . . . . 4.1 m-20 -142.21 85.97 1.94 Allowed 'General case' 0 C--O 1.232 0.169 0 N-CA-C 107.893 -1.151 . . . . 0.0 107.893 -174.098 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 94' ' ' LEU . . . . . . . . . . . . . 42.7 tp -77.9 111.08 13.38 Favored 'General case' 0 N--CA 1.461 0.118 0 N-CA-C 107.474 -1.306 . . . . 0.0 107.474 169.891 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 95' ' ' THR . . . . . . . . . . . . . 8.9 t -77.73 -176.38 4.34 Favored 'General case' 0 CA--C 1.535 0.402 0 N-CA-C 109.292 -0.633 . . . . 0.0 109.292 165.258 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 96' ' ' ALA . . . . . . . . . . . . . . . -44.17 -41.1 5.49 Favored 'General case' 0 CA--C 1.532 0.27 0 C-N-CA 126.58 1.952 . . . . 0.0 113.053 -171.999 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 97' ' ' ASN . . . . . . . . . . . . . 12.9 p30 -161.41 70.25 0.35 Allowed 'General case' 0 N--CA 1.449 -0.516 0 C-N-CA 124.474 1.11 . . . . 0.0 108.174 168.532 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 98' ' ' GLN . . . . . . . . . . . . . 0.3 OUTLIER -170.25 135.31 1.28 Allowed 'General case' 0 N--CA 1.472 0.654 0 C-N-CA 125.836 1.654 . . . . 0.0 107.501 157.582 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 99' ' ' LEU . . . . . 0.699 HD22 ' CD2' ' A' ' 101' ' ' LEU . 0.5 OUTLIER -85.5 112.13 20.63 Favored 'General case' 0 N--CA 1.451 -0.383 0 C-N-CA 123.681 0.792 . . . . 0.0 109.736 174.775 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' A' A ' 100' ' ' THR . . . . . . . . . . . . . 53.4 m -89.42 115.66 27.03 Favored 'General case' 0 C--N 1.324 -0.504 0 N-CA-C 106.338 -1.727 . . . . 0.0 106.338 166.751 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 101' ' ' LEU . . . . . 0.699 ' CD2' HD22 ' A' ' 99' ' ' LEU . 1.7 mm? -109.7 141.67 41.95 Favored 'General case' 0 CA--C 1.507 -0.7 0 C-N-CA 124.656 1.182 . . . . 0.0 108.661 171.892 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 102' ' ' ALA . . . . . . . . . . . . . . . -145.0 143.55 30.56 Favored 'General case' 0 C--O 1.234 0.277 0 O-C-N 124.504 1.128 . . . . 0.0 110.351 178.573 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 103' ' ' THR . . . . . . . . . . . . . 0.6 OUTLIER -158.65 171.84 19.37 Favored 'General case' 0 N--CA 1.443 -0.818 0 C-N-CA 126.868 2.067 . . . . 0.0 108.278 174.35 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 104' ' ' ALA . . . . . . . . . . . . . . . -58.24 -35.39 71.65 Favored 'General case' 0 CA--C 1.533 0.326 0 O-C-N 121.34 -0.85 . . . . 0.0 111.275 178.117 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 105' ' ' LYS . . . . . . . . . . . . . 1.4 mmpt? -55.76 -72.58 0.07 Allowed 'General case' 0 CA--C 1.534 0.337 0 CA-C-O 118.424 -0.798 . . . . 0.0 113.005 170.992 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 106' ' ' GLN . . . . . . . . . . . . . 3.0 pt20 -159.8 -165.12 1.45 Allowed 'General case' 0 CA--C 1.536 0.41 0 C-N-CA 124.215 1.006 . . . . 0.0 110.129 -174.301 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 107' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -134.26 134.22 41.7 Favored 'General case' 0 CA--C 1.537 0.449 0 C-N-CA 126.564 1.945 . . . . 0.0 106.445 -179.5 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 108' ' ' LEU . . . . . . . . . . . . . 3.8 mm? -112.14 156.65 21.93 Favored 'General case' 0 C--O 1.235 0.315 0 C-N-CA 124.867 1.267 . . . . 0.0 109.065 174.585 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 109' ' ' THR . . . . . . . . . . . . . 3.3 m -127.52 87.77 2.68 Favored 'General case' 0 C--O 1.237 0.408 0 N-CA-C 105.946 -1.872 . . . . 0.0 105.946 -177.097 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 110' ' ' TYR . . . . . . . . . . . . . 91.4 m-85 -91.54 139.01 31.12 Favored 'General case' 0 CA--C 1.531 0.217 0 N-CA-C 109.42 -0.585 . . . . 0.0 109.42 -175.344 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 111' ' ' LYS . . . . . 0.404 ' HE2' ' HG2' ' A' ' 15' ' ' GLU . 2.5 tppt? -94.61 141.69 28.32 Favored 'General case' 0 N--CA 1.464 0.234 0 C-N-CA 123.733 0.813 . . . . 0.0 108.894 -178.47 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 112' ' ' LEU . . . . . . . . . . . . . 19.8 tp -75.07 49.67 0.45 Allowed 'General case' 0 CA--C 1.544 0.713 0 C-N-CA 126.572 1.949 . . . . 0.0 110.078 173.48 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 113' ' ' ALA . . . . . . . . . . . . . . . -84.25 78.46 9.78 Favored 'General case' 0 C--O 1.234 0.261 0 O-C-N 119.771 -1.83 . . . . 0.0 108.709 177.366 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 114' ' ' ASP . . . . . . . . . . . . . 1.9 p-10 . . . . . 0 C--N 1.328 -0.341 0 C-N-CA 124.098 0.959 . . . . 0.0 113.231 -170.759 . . . . . . . . 0 0 . 1 . 003 nuclear build core ' A' A ' 1' ' ' MET . . . . . 0.413 ' O ' HG12 ' A' ' 2' ' ' VAL . 0.0 OUTLIER . . . . . 0 C--O 1.234 0.239 0 N-CA-C 114.106 1.15 . . . . 0.0 114.106 . . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 2' ' ' VAL . . . . . 0.413 HG12 ' O ' ' A' ' 1' ' ' MET 0.267 10.0 p 54.68 165.7 0.0 OUTLIER 'Isoleucine or valine' 0 CA--C 1.547 0.857 0 C-N-CA 129.588 3.155 . . . . 0.0 111.705 -170.223 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' A' A ' 3' ' ' THR . . . . . . . . . . . . . 25.3 p -130.01 155.77 80.14 Favored Pre-proline 0 CA--C 1.533 0.307 0 O-C-N 119.628 -1.92 . . . . 0.0 109.774 170.942 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 4' ' ' PRO . . . . . . . . . . . . . 58.2 Cg_endo -62.28 -33.11 81.66 Favored 'Trans proline' 0 C--N 1.345 0.386 0 C-N-CA 124.139 3.226 . . . . 0.0 112.221 178.217 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 5' ' ' GLU . . . . . . . . . . . . . 11.8 tt0 -51.68 -36.29 45.89 Favored 'General case' 0 C--N 1.318 -0.778 0 C-N-CA 125.2 1.4 . . . . 0.0 112.197 171.343 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 6' ' ' GLN . . . . . . . . . . . . . 26.4 mt-30 -73.04 10.67 0.86 Allowed 'General case' 0 CA--C 1.545 0.783 0 C-N-CA 123.7 0.8 . . . . 0.0 112.265 173.725 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 7' ' ' LEU . . . . . 0.52 HD22 ' CE2' ' A' ' 33' ' ' PHE . 97.7 mt -136.54 -50.61 0.68 Allowed 'General case' 0 C--O 1.223 -0.335 0 C-N-CA 125.103 1.361 . . . . 0.0 112.56 -172.503 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 8' ' ' GLN . . . . . . . . . . . . . 1.8 mt-30 -53.01 -8.32 0.1 Allowed 'General case' 0 N--CA 1.481 1.106 0 C-N-CA 126.163 1.785 . . . . 0.0 115.748 -174.993 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 9' ' ' HIS . . . . . . . . . . . . . 98.1 m-70 -131.09 7.14 4.63 Favored 'General case' 0 CA--C 1.537 0.48 0 C-N-CA 125.017 1.327 . . . . 0.0 112.763 177.581 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 10' ' ' HIS . . . . . . . . . . . . . 95.1 m-70 -130.57 116.8 18.64 Favored 'General case' 0 C--O 1.233 0.212 0 C-N-CA 125.247 1.419 . . . . 0.0 110.464 -169.537 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 11' ' ' ARG . . . . . . . . . . . . . 32.3 ttm-85 -70.15 155.12 41.08 Favored 'General case' 0 CA--C 1.518 -0.263 0 C-N-CA 124.406 1.082 . . . . 0.0 108.64 169.656 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 12' ' ' PHE . . . . . . . . . . . . . 74.9 m-85 -139.06 153.87 48.12 Favored 'General case' 0 CA--C 1.501 -0.923 0 CA-C-O 122.732 1.253 . . . . 0.0 109.233 163.809 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 13' ' ' VAL . . . . . . . . . . . . . 0.0 OUTLIER -130.3 135.13 61.37 Favored 'Isoleucine or valine' 0 CA--C 1.494 -1.187 0 CA-C-N 113.286 -1.779 . . . . 0.0 114.99 -173.81 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 14' ' ' LEU . . . . . . . . . . . . . 2.2 tt -65.09 110.84 2.65 Favored 'General case' 0 CA--C 1.497 -1.091 0 O-C-N 126.135 2.147 . . . . 0.0 109.135 -173.144 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 0.9 OUTLIER -94.3 -52.46 4.34 Favored 'General case' 0 N--CA 1.426 -1.665 0 O-C-N 125.576 1.797 . . . . 0.0 108.446 -168.913 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 16' ' ' SER . . . . . 0.448 ' HA ' ' HA ' ' A' ' 21' ' ' PRO . 87.1 p -139.94 150.41 44.5 Favored 'General case' 0 N--CA 1.444 -0.738 0 CA-C-N 115.523 -0.762 . . . . 0.0 110.569 166.536 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 17' ' ' VAL . . . . . 0.55 HG12 ' H ' ' A' ' 18' ' ' ASN . 2.7 t -83.8 178.35 0.55 Allowed 'Isoleucine or valine' 0 N--CA 1.443 -0.779 0 N-CA-C 107.251 -1.389 . . . . 0.0 107.251 176.334 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 18' ' ' ASN . . . . . 0.55 ' H ' HG12 ' A' ' 17' ' ' VAL . 0.0 OUTLIER -50.44 -28.65 8.63 Favored 'General case' 0 N--CA 1.464 0.273 0 N-CA-C 114.633 1.346 . . . . 0.0 114.633 -178.812 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . -104.31 -76.96 1.13 Allowed Glycine 0 N--CA 1.445 -0.712 0 N-CA-C 109.652 -1.379 . . . . 0.0 109.652 171.167 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 16.3 mttt -125.07 165.73 24.28 Favored Pre-proline 0 N--CA 1.466 0.345 0 C-N-CA 124.702 1.201 . . . . 0.0 112.318 -167.473 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 21' ' ' PRO . . . . . 0.448 ' HA ' ' HA ' ' A' ' 16' ' ' SER . 56.1 Cg_endo -61.8 167.85 9.59 Favored 'Trans proline' 0 N--CA 1.458 -0.617 0 C-N-CA 123.607 2.871 . . . . 0.0 113.142 170.126 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 22' ' ' VAL . . . . . . . . . . . . . 7.9 p -141.1 157.47 22.52 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.357 0 C-N-CA 127.733 2.413 . . . . 0.0 105.731 -178.419 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 23' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -145.89 91.82 2.13 Favored 'General case' 0 C--O 1.236 0.38 0 N-CA-C 108.571 -0.9 . . . . 0.0 108.571 176.539 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 24' ' ' SER . . . . . . . . . . . . . 61.1 m -77.64 49.2 0.73 Allowed 'General case' 0 CA--C 1.533 0.29 0 C-N-CA 125.284 1.434 . . . . 0.0 110.271 178.467 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 25' ' ' ASP . . . . . . . . . . . . . 0.7 OUTLIER 56.8 -84.46 0.02 OUTLIER 'General case' 0 CA--C 1.514 -0.408 0 C-N-CA 127.728 2.411 . . . . 0.0 110.536 -169.602 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 26' ' ' LYS . . . . . . . . . . . . . 35.5 tttt -142.74 3.91 1.47 Allowed 'General case' 0 C--N 1.325 -0.483 0 C-N-CA 127.957 2.503 . . . . 0.0 110.29 -168.342 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 27' ' ' ASN . . . . . . . . . . . . . 70.6 m-80 -122.05 62.98 15.77 Favored Pre-proline 0 N--CA 1.453 -0.281 0 C-N-CA 127.156 2.182 . . . . 0.0 107.207 -173.165 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 28' ' ' PRO . . . . . . . . . . . . . 65.7 Cg_endo -64.54 159.14 46.06 Favored 'Trans proline' 0 C--O 1.24 0.622 0 C-N-CA 122.615 2.21 . . . . 0.0 110.864 -172.657 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 29' ' ' PRO . . . . . . . . . . . . . 28.0 Cg_endo -71.99 63.99 3.31 Favored 'Trans proline' 0 N--CA 1.456 -0.682 0 C-N-CA 122.829 2.352 . . . . 0.0 110.048 166.818 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 30' ' ' GLU . . . . . . . . . . . . . 1.6 pt-20 -72.09 166.23 22.71 Favored 'General case' 0 CA--C 1.542 0.664 0 N-CA-C 108.31 -0.996 . . . . 0.0 108.31 177.439 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 31' ' ' ILE . . . . . . . . . . . . . 10.6 tt -138.31 150.66 24.45 Favored 'Isoleucine or valine' 0 N--CA 1.445 -0.711 0 N-CA-C 105.627 -1.99 . . . . 0.0 105.627 172.789 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 32' ' ' SER . . . . . . . . . . . . . 78.0 p -144.97 174.3 11.14 Favored 'General case' 0 N--CA 1.432 -1.359 0 CA-C-O 122.691 1.234 . . . . 0.0 108.907 165.919 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 33' ' ' PHE . . . . . 0.52 ' CE2' HD22 ' A' ' 7' ' ' LEU . 77.0 m-85 -136.31 164.43 28.11 Favored 'General case' 0 N--CA 1.434 -1.246 0 N-CA-C 106.372 -1.714 . . . . 0.0 106.372 -173.371 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 34' ' ' GLY . . . . . . . . . . . . . . . 165.08 -168.83 39.42 Favored Glycine 0 N--CA 1.445 -0.765 0 N-CA-C 110.073 -1.211 . . . . 0.0 110.073 176.918 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 35' ' ' GLU . . . . . . . . . . . . . 3.4 mt-10 63.69 -86.14 0.02 OUTLIER 'General case' 0 C--N 1.331 -0.202 0 C-N-CA 125.813 1.645 . . . . 0.0 110.064 -178.396 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 29.7 mtpt -154.42 72.31 0.86 Allowed 'General case' 0 N--CA 1.44 -0.965 0 C-N-CA 126.926 2.09 . . . . 0.0 110.67 -176.277 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 37' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER 55.72 26.68 9.69 Favored 'General case' 0 CA--C 1.539 0.543 0 C-N-CA 123.998 0.919 . . . . 0.0 109.428 -178.036 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 38' ' ' MET . . . . . . . . . . . . . 10.4 mtp -73.82 164.89 26.04 Favored 'General case' 0 N--CA 1.448 -0.557 0 N-CA-C 108.246 -1.02 . . . . 0.0 108.246 172.279 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 39' ' ' ILE . . . . . . . . . . . . . 34.1 mt -135.93 134.4 50.85 Favored 'Isoleucine or valine' 0 C--O 1.235 0.323 0 N-CA-C 108.163 -1.051 . . . . 0.0 108.163 -178.428 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 40' ' ' SER . . . . . . . . . . . . . 34.5 t -142.02 144.83 33.83 Favored 'General case' 0 CA--C 1.536 0.405 0 C-N-CA 125.051 1.34 . . . . 0.0 108.824 177.377 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 41' ' ' GLY . . . . . . . . . . . . . . . -177.64 -176.35 45.6 Favored Glycine 0 CA--C 1.528 0.845 0 N-CA-C 111.333 -0.707 . . . . 0.0 111.333 177.98 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 42' ' ' SER . . . . . . . . . . . . . 34.0 p -143.81 80.3 1.65 Allowed 'General case' 0 CA--C 1.538 0.497 0 C-N-CA 123.007 0.523 . . . . 0.0 111.829 -171.89 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 43' ' ' MET . . . . . . . . . . . . . 3.1 mmt -63.79 -59.75 4.16 Favored 'General case' 0 N--CA 1.472 0.662 0 O-C-N 121.107 -0.996 . . . . 0.0 109.918 173.76 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 44' ' ' CYS . . . . . 1.288 ' SG ' ' SG ' ' A' ' 70' ' ' CYS . 41.9 t -129.06 -66.0 0.84 Allowed 'General case' 0 N--CA 1.451 -0.383 0 N-CA-C 108.156 -1.053 . . . . 0.0 108.156 151.298 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 45' ' ' ASN . . . . . . . . . . . . . 0.6 OUTLIER -87.84 19.78 3.36 Favored 'General case' 0 C--N 1.33 -0.259 0 N-CA-C 114.215 1.191 . . . . 0.0 114.215 -152.242 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 46' ' ' ARG . . . . . . . . . . . . . 17.4 mmm-85 57.46 162.74 0.03 OUTLIER 'General case' 0 CA--C 1.52 -0.178 0 C-N-CA 128.823 2.849 . . . . 0.0 112.025 -158.385 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 47' ' ' PHE . . . . . . . . . . . . . 53.9 p90 -158.28 162.4 37.77 Favored 'General case' 0 C--O 1.242 0.678 0 C-N-CA 125.513 1.525 . . . . 0.0 107.163 172.361 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 48' ' ' SER . . . . . . . . . . . . . 2.5 p -167.87 142.24 3.55 Favored 'General case' 0 C--O 1.236 0.381 0 C-N-CA 123.747 0.819 . . . . 0.0 109.073 -178.01 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 49' ' ' GLY . . . . . . . . . . . . . . . -171.12 169.63 42.62 Favored Glycine 0 C--N 1.337 0.633 0 CA-C-N 119.979 1.263 . . . . 0.0 110.648 -177.661 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 50' ' ' GLU . . . . . . . . . . . . . 36.7 mt-10 -83.01 102.55 11.83 Favored 'General case' 0 N--CA 1.446 -0.632 0 N-CA-C 106.412 -1.699 . . . . 0.0 106.412 177.767 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 51' ' ' GLY . . . . . . . . . . . . . . . -64.16 167.08 27.8 Favored Glycine 0 CA--C 1.528 0.85 0 CA-C-O 122.705 1.169 . . . . 0.0 112.859 165.312 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 52' ' ' LYS . . . . . . . . . . . . . 60.6 tttm -152.97 140.36 19.62 Favored 'General case' 0 C--N 1.331 -0.232 0 N-CA-C 105.543 -2.021 . . . . 0.0 105.543 164.538 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 53' ' ' LEU . . . . . . . . . . . . . 15.2 tp -142.37 133.23 25.65 Favored 'General case' 0 CA--C 1.52 -0.173 0 C-N-CA 123.968 0.907 . . . . 0.0 108.745 179.09 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER -149.52 -38.62 0.15 Allowed 'General case' 0 CA--C 1.541 0.616 0 C-N-CA 125.54 1.536 . . . . 0.0 110.144 177.489 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 55' ' ' ASN . . . . . . . . . . . . . 2.6 t30 -124.38 7.0 8.36 Favored 'General case' 0 N--CA 1.471 0.583 0 N-CA-C 115.49 1.663 . . . . 0.0 115.49 -157.115 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 56' ' ' GLY . . . . . . . . . . . . . . . 90.22 13.16 60.67 Favored Glycine 0 N--CA 1.468 0.769 0 O-C-N 121.185 -0.947 . . . . 0.0 112.148 -166.013 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 57' ' ' GLU . . . . . . . . . . . . . 42.3 tt0 -130.16 144.4 51.34 Favored 'General case' 0 N--CA 1.446 -0.663 0 C-N-CA 124.652 1.181 . . . . 0.0 109.036 179.326 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 58' ' ' LEU . . . . . 0.435 ' HB2' HG21 ' A' ' 92' ' ' VAL . 5.1 tp -127.99 159.11 36.02 Favored 'General case' 0 N--CA 1.447 -0.618 0 C-N-CA 126.376 1.87 . . . . 0.0 108.788 178.878 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 59' ' ' THR . . . . . . . . . . . . . 0.7 OUTLIER -141.61 174.98 10.05 Favored 'General case' 0 C--N 1.321 -0.649 0 C-N-CA 125.936 1.695 . . . . 0.0 106.988 171.201 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 60' ' ' ALA . . . . . . . . . . . . . . . -134.39 99.91 4.51 Favored 'General case' 0 CA--C 1.516 -0.337 0 N-CA-C 108.043 -1.095 . . . . 0.0 108.043 160.085 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 61' ' ' LYS . . . . . 0.423 ' HE2' ' N ' ' A' ' 62' ' ' GLY . 0.2 OUTLIER -55.74 123.19 13.32 Favored 'General case' 0 C--O 1.234 0.27 0 N-CA-C 107.06 -1.459 . . . . 0.0 107.06 172.017 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' A' A ' 62' ' ' GLY . . . . . 0.423 ' N ' ' HE2' ' A' ' 61' ' ' LYS . . . 96.23 -59.67 1.37 Allowed Glycine 0 CA--C 1.525 0.664 0 C-N-CA 124.981 1.276 . . . . 0.0 111.586 166.109 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 63' ' ' LEU . . . . . 0.439 HD22 ' HA ' ' A' ' 83' ' ' SER . 0.5 OUTLIER 47.07 90.69 0.02 OUTLIER 'General case' 0 CA--C 1.537 0.447 0 C-N-CA 129.187 2.995 . . . . 0.0 114.425 -178.003 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' A' A ' 64' ' ' ALA . . . . . . . . . . . . . . . -88.48 104.53 16.89 Favored 'General case' 0 C--O 1.237 0.411 0 C-N-CA 124.126 0.97 . . . . 0.0 111.026 -178.462 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 65' ' ' MET . . . . . . . . . . . . . 54.8 mtp -97.48 176.47 5.85 Favored 'General case' 0 N--CA 1.471 0.599 0 C-N-CA 123.622 0.769 . . . . 0.0 110.188 172.487 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 66' ' ' THR . . . . . . . . . . . . 0.348 1.5 p -113.77 -164.92 0.96 Allowed 'General case' 0 CA--C 1.556 1.193 0 C-N-CA 124.101 0.96 . . . . 0.0 110.171 178.214 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 67' ' ' ARG . . . . . . . . . . . . . 16.2 mtt180 -136.52 30.94 2.86 Favored 'General case' 0 N--CA 1.489 1.476 0 CA-C-N 120.816 1.644 . . . . 0.0 114.429 -170.808 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 68' ' ' MET . . . . . . . . . . . . . 44.1 mtm -77.81 176.71 8.8 Favored 'General case' 0 CA--C 1.537 0.471 0 O-C-N 120.265 -1.522 . . . . 0.0 111.206 176.646 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 69' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -86.01 170.17 12.52 Favored 'General case' 0 C--O 1.243 0.758 0 C-N-CA 128.693 2.797 . . . . 0.0 108.479 165.842 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 70' ' ' CYS . . . . . 1.288 ' SG ' ' SG ' ' A' ' 44' ' ' CYS . 0.1 OUTLIER -110.02 -177.86 3.37 Favored 'General case' 0 N--CA 1.454 -0.267 0 C-N-CA 125.847 1.659 . . . . 0.0 112.83 -177.869 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' A' A ' 71' ' ' ALA . . . . . . . . . . . . . . . -104.24 -12.45 16.65 Favored 'General case' 0 N--CA 1.466 0.328 0 N-CA-C 112.163 0.431 . . . . 0.0 112.163 165.5 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 72' ' ' ASN . . . . . . . . . . . . . 52.7 t30 -156.07 143.12 13.64 Favored Pre-proline 0 N--CA 1.466 0.357 0 N-CA-C 107.503 -1.295 . . . . 0.0 107.503 -174.353 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 73' ' ' PRO . . . . . . . . . . . . . 38.9 Cg_endo -75.67 -33.52 3.9 Favored 'Trans proline' 0 C--N 1.345 0.342 0 C-N-CA 121.736 1.624 . . . . 0.0 111.447 -167.627 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 74' ' ' GLN . . . . . . . . . . . . . 20.7 tt0 -57.92 -32.91 68.23 Favored 'General case' 0 CA--C 1.535 0.377 0 C-N-CA 124.638 1.175 . . . . 0.0 112.065 177.952 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 75' ' ' LEU . . . . . 0.52 ' HB2' ' SG ' ' A' ' 70' ' ' CYS . 82.3 mt -70.03 -43.34 71.5 Favored 'General case' 0 N--CA 1.465 0.301 0 O-C-N 121.83 -0.544 . . . . 0.0 110.129 172.648 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 76' ' ' ASN . . . . . . . . . . . . . 3.3 t-20 -68.24 -8.02 35.59 Favored 'General case' 0 CA--C 1.532 0.278 0 C-N-CA 125.681 1.592 . . . . 0.0 112.017 -178.913 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 77' ' ' GLU . . . . . . . . . . . . . 32.8 tt0 -102.46 -48.13 4.25 Favored 'General case' 0 N--CA 1.45 -0.459 0 C-N-CA 127.227 2.211 . . . . 0.0 109.295 178.39 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 78' ' ' LEU . . . . . 0.469 HD21 HG13 ' A' ' 17' ' ' VAL . 0.9 OUTLIER -58.02 -25.04 60.61 Favored 'General case' 0 N--CA 1.468 0.443 0 C-N-CA 124.083 0.953 . . . . 0.0 112.762 171.095 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' A' A ' 79' ' ' ASP . . . . . . . . . . . . . 13.4 t70 -46.0 -54.98 7.47 Favored 'General case' 0 N--CA 1.443 -0.777 0 C-N-CA 126.464 1.906 . . . . 0.0 111.236 166.952 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 80' ' ' ASN . . . . . . . . . . . . . 76.8 m-20 -78.77 -34.44 45.62 Favored 'General case' 0 N--CA 1.453 -0.312 0 CA-C-O 118.743 -0.646 . . . . 0.0 109.499 -174.093 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 81' ' ' THR . . . . . . . . . . . . . 13.7 m -49.72 -59.32 3.92 Favored 'General case' 0 CA--C 1.535 0.391 0 C-N-CA 123.898 0.879 . . . . 0.0 110.334 171.088 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 82' ' ' ILE . . . . . . . . . . . . . 7.8 tp -63.49 -35.79 73.82 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.393 0 CA-C-N 119.608 1.095 . . . . 0.0 110.667 -174.291 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 83' ' ' SER . . . . . 0.439 ' HA ' HD22 ' A' ' 63' ' ' LEU . 0.5 OUTLIER -66.78 -12.56 59.29 Favored 'General case' 0 C--O 1.234 0.277 0 C-N-CA 127.345 2.258 . . . . 0.0 113.939 179.128 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' A' A ' 84' ' ' GLU . . . . . . . . . . . . . 89.3 tt0 -114.79 -22.47 9.65 Favored 'General case' 0 C--N 1.324 -0.512 0 C-N-CA 124.888 1.275 . . . . 0.0 111.351 179.902 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 85' ' ' MET . . . . . . . . . . . . . 87.9 mtp -73.04 -55.17 6.88 Favored 'General case' 0 C--O 1.23 0.056 0 CA-C-O 122.682 1.23 . . . . 0.0 108.81 178.375 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 86' ' ' LEU . . . . . . . . . . . . . 1.4 mm? -73.92 -17.56 61.01 Favored 'General case' 0 N--CA 1.454 -0.233 0 C-N-CA 124.979 1.312 . . . . 0.0 111.654 -167.791 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 87' ' ' LYS . . . . . . . . . . . . . 25.1 tttt -72.14 -48.79 41.02 Favored 'General case' 0 N--CA 1.447 -0.603 0 C-N-CA 124.201 1.0 . . . . 0.0 109.156 177.667 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 88' ' ' GLU . . . . . . . . . . . . . 1.9 mm-40 -69.84 -62.9 1.2 Allowed 'General case' 0 N--CA 1.448 -0.548 0 O-C-N 124.254 0.971 . . . . 0.0 108.426 -178.806 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 89' ' ' GLY . . . . . . . . . . . . . . . 144.72 110.27 0.69 Allowed Glycine 0 C--N 1.336 0.557 0 N-CA-C 109.179 -1.568 . . . . 0.0 109.179 -176.276 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 90' ' ' ALA . . . . . . . . . . . . . . . -91.45 142.99 27.08 Favored 'General case' 0 C--N 1.333 -0.119 0 C-N-CA 124.061 0.945 . . . . 0.0 109.06 -178.807 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 91' ' ' GLN . . . . . . . . . . . . . 6.8 mm-40 -74.49 142.33 44.85 Favored 'General case' 0 N--CA 1.443 -0.824 0 N-CA-C 105.752 -1.944 . . . . 0.0 105.752 161.098 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 92' ' ' VAL . . . . . 0.435 HG21 ' HB2' ' A' ' 58' ' ' LEU . 26.6 t -137.45 107.71 5.17 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.491 0 N-CA-C 105.068 -2.197 . . . . 0.0 105.068 -170.761 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 93' ' ' ASP . . . . . . . . . . . . . 2.1 t0 -127.19 97.61 4.99 Favored 'General case' 0 N--CA 1.448 -0.527 0 N-CA-C 108.085 -1.08 . . . . 0.0 108.085 -157.148 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 94' ' ' LEU . . . . . . . . . . . . . 55.9 tp -98.24 104.15 16.16 Favored 'General case' 0 CA--C 1.511 -0.535 0 CA-C-O 122.046 0.927 . . . . 0.0 109.247 -175.045 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 95' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -65.67 174.19 2.43 Favored 'General case' 0 C--N 1.319 -0.726 0 CA-C-N 113.633 -1.621 . . . . 0.0 109.569 167.605 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 96' ' ' ALA . . . . . . . . . . . . . . . -48.51 -33.24 9.18 Favored 'General case' 0 CA--C 1.539 0.55 0 O-C-N 120.826 -1.172 . . . . 0.0 113.856 -172.565 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 97' ' ' ASN . . . . . . . . . . . . . 23.8 p30 -151.41 17.94 0.73 Allowed 'General case' 0 CA--C 1.539 0.526 0 C-N-CA 125.145 1.378 . . . . 0.0 113.559 172.324 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 98' ' ' GLN . . . . . . . . . . . . . 21.5 tt0 -137.32 121.04 17.39 Favored 'General case' 0 N--CA 1.461 0.119 0 O-C-N 120.821 -1.174 . . . . 0.0 110.654 177.323 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 99' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -69.19 140.86 54.62 Favored 'General case' 0 N--CA 1.451 -0.408 0 C-N-CA 126.019 1.728 . . . . 0.0 109.183 169.479 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 100' ' ' THR . . . . . . . . . . . . . 2.5 m -133.65 130.65 38.55 Favored 'General case' 0 C--N 1.323 -0.567 0 N-CA-C 106.795 -1.558 . . . . 0.0 106.795 167.789 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 101' ' ' LEU . . . . . . . . . . . . . 2.6 mp -108.97 158.67 17.48 Favored 'General case' 0 CA--C 1.509 -0.609 0 C-N-CA 125.209 1.404 . . . . 0.0 110.458 174.856 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 102' ' ' ALA . . . . . . . . . . . . . . . -152.18 158.56 43.07 Favored 'General case' 0 C--N 1.327 -0.385 0 C-N-CA 124.559 1.144 . . . . 0.0 108.228 164.558 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 103' ' ' THR . . . . . 0.425 HG22 ' H ' ' A' ' 104' ' ' ALA . 1.3 m -157.24 -172.08 3.87 Favored 'General case' 0 N--CA 1.441 -0.916 0 C-N-CA 127.484 2.314 . . . . 0.0 105.659 167.141 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 104' ' ' ALA . . . . . 0.425 ' H ' HG22 ' A' ' 103' ' ' THR . . . -62.3 -35.48 79.17 Favored 'General case' 0 C--N 1.34 0.196 0 CA-C-N 119.918 1.235 . . . . 0.0 111.536 168.623 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 105' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -59.74 -79.83 0.03 OUTLIER 'General case' 0 C--N 1.339 0.123 0 C-N-CA 123.59 0.756 . . . . 0.0 110.712 -178.03 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 106' ' ' GLN . . . . . . . . . . . . . 84.6 mt-30 -151.53 -176.88 5.78 Favored 'General case' 0 CA--C 1.536 0.424 0 C-N-CA 125.89 1.676 . . . . 0.0 107.301 -169.672 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 107' ' ' THR . . . . . . . . . . . . . 0.1 OUTLIER -138.56 134.47 33.9 Favored 'General case' 0 N--CA 1.453 -0.314 0 C-N-CA 125.943 1.697 . . . . 0.0 106.571 -177.222 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 108' ' ' LEU . . . . . . . . . . . . . 1.5 mm? -125.75 158.48 34.81 Favored 'General case' 0 C--O 1.233 0.197 0 C-N-CA 124.345 1.058 . . . . 0.0 108.401 179.413 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 109' ' ' THR . . . . . . . . . . . . . 27.8 m -122.63 137.52 54.88 Favored 'General case' 0 C--O 1.236 0.356 0 N-CA-C 107.797 -1.186 . . . . 0.0 107.797 177.086 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 110' ' ' TYR . . . . . . . . . . . . . 4.4 m-85 -135.92 145.19 46.0 Favored 'General case' 0 CA--C 1.535 0.395 0 C-N-CA 124.107 0.963 . . . . 0.0 111.761 -178.815 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 111' ' ' LYS . . . . . . . . . . . . . 4.1 tppt? -90.23 150.78 21.82 Favored 'General case' 0 N--CA 1.474 0.764 0 O-C-N 120.82 -1.175 . . . . 0.0 110.806 -179.367 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 112' ' ' LEU . . . . . . . . . . . . . 35.7 tp -74.6 46.47 0.28 Allowed 'General case' 0 CA--C 1.541 0.626 0 C-N-CA 124.792 1.237 . . . . 0.0 109.881 158.653 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 113' ' ' ALA . . . . . . . . . . . . . . . -84.02 102.34 12.42 Favored 'General case' 0 N--CA 1.444 -0.775 0 N-CA-C 104.383 -2.451 . . . . 0.0 104.383 162.147 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 114' ' ' ASP . . . . . . . . . . . . . 57.2 t0 . . . . . 0 CA--C 1.516 -0.331 0 CA-C-O 122.287 1.041 . . . . 0.0 109.495 170.278 . . . . . . . . 0 0 . 1 . 004 nuclear build core ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 10.0 tpt . . . . . 0 C--O 1.235 0.326 0 N-CA-C 107.325 -1.361 . . . . 0.0 107.325 . . . . . . . . . 0 0 . 1 . 004 nuclear build core ' A' A ' 2' ' ' VAL . . . . . . . . . . . . . 2.3 p -59.87 144.56 12.7 Favored 'Isoleucine or valine' 0 C--O 1.234 0.243 0 N-CA-C 108.399 -0.963 . . . . 0.0 108.399 170.227 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 3' ' ' THR . . . . . . . . . . . . . 0.6 OUTLIER -110.42 153.83 43.27 Favored Pre-proline 0 N--CA 1.445 -0.723 0 C-N-CA 123.163 0.585 . . . . 0.0 110.756 172.521 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 4' ' ' PRO . . . . . . . . . . . . . 52.7 Cg_endo -64.95 -33.73 50.66 Favored 'Trans proline' 0 N--CA 1.461 -0.386 0 C-N-CA 123.825 3.017 . . . . 0.0 111.91 -179.263 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 5' ' ' GLU . . . . . . . . . . . . . 65.3 tt0 -49.77 -35.32 22.08 Favored 'General case' 0 CA--C 1.549 0.928 0 C-N-CA 124.216 1.006 . . . . 0.0 111.647 169.759 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 6' ' ' GLN . . . . . . . . . . . . . 48.8 mt-30 -72.46 5.62 2.87 Favored 'General case' 0 CA--C 1.539 0.543 0 O-C-N 120.955 -1.091 . . . . 0.0 112.886 176.08 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 7' ' ' LEU . . . . . . . . . . . . . 93.6 mt -131.52 -54.91 1.02 Allowed 'General case' 0 C--O 1.225 -0.229 0 C-N-CA 125.533 1.533 . . . . 0.0 110.368 -171.615 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 8' ' ' GLN . . . . . . . . . . . . . 4.9 mt-30 -55.41 -6.72 0.19 Allowed 'General case' 0 N--CA 1.479 0.992 0 C-N-CA 127.686 2.394 . . . . 0.0 115.736 -172.815 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 9' ' ' HIS . . . . . . . . . . . . . 76.1 m-70 -139.38 30.31 2.16 Favored 'General case' 0 CA--C 1.54 0.558 0 C-N-CA 125.428 1.491 . . . . 0.0 111.491 178.394 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 10' ' ' HIS . . . . . . . . . . . . . 94.4 m-70 -140.87 142.18 34.55 Favored 'General case' 0 CA--C 1.534 0.344 0 C-N-CA 124.636 1.174 . . . . 0.0 110.917 176.891 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 11' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -88.5 149.03 23.85 Favored 'General case' 0 N--CA 1.463 0.19 0 C-N-CA 124.452 1.101 . . . . 0.0 108.824 167.669 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 12' ' ' PHE . . . . . . . . . . . . . 82.9 m-85 -139.91 154.57 47.27 Favored 'General case' 0 CA--C 1.494 -1.176 0 CA-C-O 122.525 1.155 . . . . 0.0 108.841 169.712 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 13' ' ' VAL . . . . . 0.461 ' CG2' ' HB3' ' A' ' 113' ' ' ALA . 0.0 OUTLIER -127.84 139.46 51.84 Favored 'Isoleucine or valine' 0 N--CA 1.434 -1.242 0 CA-C-N 113.983 -1.462 . . . . 0.0 107.059 -174.103 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' A' A ' 14' ' ' LEU . . . . . . . . . . . . . 19.1 tp -73.11 97.52 2.39 Favored 'General case' 0 N--CA 1.453 -0.321 0 N-CA-C 106.97 -1.493 . . . . 0.0 106.97 174.463 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 2.9 mm-40 -64.04 -54.88 27.28 Favored 'General case' 0 N--CA 1.451 -0.415 0 N-CA-C 108.434 -0.95 . . . . 0.0 108.434 176.962 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 10.1 m -156.14 153.24 28.99 Favored 'General case' 0 N--CA 1.451 -0.425 0 CA-C-O 121.927 0.87 . . . . 0.0 110.85 -174.011 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 17' ' ' VAL . . . . . . . . . . . . . 1.9 t -111.03 169.24 4.04 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.317 0 C-N-CA 126.097 1.759 . . . . 0.0 107.108 -171.832 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 18' ' ' ASN . . . . . . . . . . . . . 1.7 p-10 -57.32 -2.38 0.11 Allowed 'General case' 0 CA--C 1.54 0.578 0 N-CA-C 116.494 2.035 . . . . 0.0 116.494 179.949 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . -146.67 -2.64 0.55 Allowed Glycine 0 CA--C 1.527 0.793 0 CA-C-N 120.496 1.498 . . . . 0.0 115.8 -178.312 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 10.9 pttm 179.67 162.24 0.81 Allowed Pre-proline 0 N--CA 1.469 0.495 0 CA-C-N 119.952 1.876 . . . . 0.0 109.71 175.245 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 21' ' ' PRO . . . . . . . . . . . . . 55.3 Cg_endo -67.94 179.48 2.74 Favored 'Trans proline' 0 N--CA 1.459 -0.541 0 C-N-CA 123.753 2.969 . . . . 0.0 110.775 170.551 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 22' ' ' VAL . . . . . . . . . . . . . 90.1 t -110.15 153.5 11.91 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.384 0 N-CA-C 109.804 -0.443 . . . . 0.0 109.804 169.638 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 23' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -129.89 105.08 7.76 Favored 'General case' 0 CA--C 1.534 0.345 0 C-N-CA 126.548 1.939 . . . . 0.0 107.515 174.424 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 24' ' ' SER . . . . . . . . . . . . . 10.3 t -163.36 94.01 0.79 Allowed 'General case' 0 C--O 1.234 0.244 0 N-CA-C 108.55 -0.907 . . . . 0.0 108.55 168.633 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 25' ' ' ASP . . . . . . . . . . . . . 11.5 m-20 -79.24 -6.31 56.35 Favored 'General case' 0 CA--C 1.535 0.377 0 O-C-N 121.793 -0.567 . . . . 0.0 111.149 -172.748 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 26' ' ' LYS . . . . . . . . . . . . . 13.6 tttp -116.69 -32.88 5.02 Favored 'General case' 0 N--CA 1.471 0.59 0 CA-C-N 119.621 1.1 . . . . 0.0 113.225 -179.091 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 27' ' ' ASN . . . . . . . . . . . . . 1.4 p30 -138.3 77.41 35.68 Favored Pre-proline 0 C--N 1.323 -0.546 0 C-N-CA 123.848 0.859 . . . . 0.0 109.944 175.157 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 28' ' ' PRO . . . . . . . . . . . . . 70.6 Cg_endo -64.3 155.56 64.86 Favored 'Trans proline' 0 N--CA 1.455 -0.791 0 C-N-CA 121.689 1.592 . . . . 0.0 110.052 174.176 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 29' ' ' PRO . . . . . . . . . . . . . 18.1 Cg_endo -69.24 74.92 1.02 Allowed 'Trans proline' 0 N--CA 1.453 -0.883 0 C-N-CA 123.008 2.472 . . . . 0.0 108.505 159.606 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 30' ' ' GLU . . . . . 0.439 ' HA ' ' HA ' ' A' ' 13' ' ' VAL . 0.1 OUTLIER -87.86 163.98 16.12 Favored 'General case' 0 N--CA 1.446 -0.669 0 N-CA-C 108.391 -0.966 . . . . 0.0 108.391 168.445 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' A' A ' 31' ' ' ILE . . . . . . . . . . . . . 19.1 tt -130.69 142.4 43.76 Favored 'Isoleucine or valine' 0 N--CA 1.437 -1.082 0 C-N-CA 126.79 2.036 . . . . 0.0 105.534 172.658 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 32' ' ' SER . . . . . . . . . . . . . 19.9 m -138.65 163.91 30.87 Favored 'General case' 0 N--CA 1.443 -0.815 0 N-CA-C 106.294 -1.743 . . . . 0.0 106.294 171.347 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 33' ' ' PHE . . . . . . . . . . . . . 96.6 m-85 -144.64 143.28 30.68 Favored 'General case' 0 N--CA 1.439 -0.998 0 N-CA-C 106.043 -1.836 . . . . 0.0 106.043 -167.421 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 34' ' ' GLY . . . . . . . . . . . . . . . -166.39 152.22 21.11 Favored Glycine 0 CA--C 1.518 0.263 0 N-CA-C 109.746 -1.342 . . . . 0.0 109.746 160.958 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 35' ' ' GLU . . . . . . . . . . . . . 3.0 pt-20 44.94 145.93 0.0 OUTLIER 'General case' 0 C--O 1.219 -0.508 1 C-N-CA 134.756 5.222 . . . . 0.0 113.556 -171.864 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 52.8 mtpt 51.19 17.38 0.47 Allowed 'General case' 0 N--CA 1.475 0.818 0 O-C-N 120.002 -1.687 . . . . 0.0 114.852 170.387 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 37' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER 62.57 26.74 15.87 Favored 'General case' 0 CA--C 1.544 0.731 0 CA-C-N 120.432 1.469 . . . . 0.0 113.515 -167.837 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 38' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -63.01 158.75 18.63 Favored 'General case' 0 C--N 1.34 0.185 0 O-C-N 119.702 -1.873 . . . . 0.0 110.326 173.589 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 39' ' ' ILE . . . . . . . . . . . . . 37.8 mt -134.2 129.3 53.48 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.493 0 N-CA-C 107.261 -1.385 . . . . 0.0 107.261 -167.32 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 40' ' ' SER . . . . . . . . . . . . . 22.5 m -131.32 114.07 14.56 Favored 'General case' 0 N--CA 1.454 -0.251 0 C-N-CA 124.86 1.264 . . . . 0.0 107.928 176.181 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 41' ' ' GLY . . . . . . . . . . . . . . . -154.09 178.94 30.68 Favored Glycine 0 CA--C 1.523 0.576 0 N-CA-C 110.311 -1.116 . . . . 0.0 110.311 -179.226 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 42' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -161.47 92.86 0.91 Allowed 'General case' 0 N--CA 1.451 -0.376 0 O-C-N 121.302 -1.117 . . . . 0.0 108.961 -176.19 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 43' ' ' MET . . . . . . . . . . . . . 34.1 mmm -69.89 -53.0 19.97 Favored 'General case' 0 C--O 1.224 -0.238 0 N-CA-C 108.649 -0.871 . . . . 0.0 108.649 174.92 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 44' ' ' CYS . . . . . 1.287 ' SG ' ' SG ' ' A' ' 70' ' ' CYS . 11.6 t -152.79 -61.74 0.15 Allowed 'General case' 0 CA--C 1.517 -0.304 0 N-CA-C 107.959 -1.126 . . . . 0.0 107.959 176.336 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 45' ' ' ASN . . . . . . . . . . . . . 13.7 m120 -75.25 14.02 0.63 Allowed 'General case' 0 CA--C 1.536 0.41 0 C-N-CA 125.213 1.405 . . . . 0.0 113.109 -174.242 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 46' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER 53.35 169.15 0.02 OUTLIER 'General case' 0 N--CA 1.468 0.454 0 C-N-CA 127.278 2.231 . . . . 0.0 112.073 -157.675 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 47' ' ' PHE . . . . . . . . . . . . . 33.8 p90 -161.81 172.97 15.25 Favored 'General case' 0 C--O 1.24 0.579 0 C-N-CA 124.357 1.063 . . . . 0.0 110.922 164.162 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 48' ' ' SER . . . . . . . . . . . . . 1.7 p -179.89 150.07 0.37 Allowed 'General case' 0 N--CA 1.444 -0.733 0 C-N-CA 126.871 2.068 . . . . 0.0 109.086 178.142 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 49' ' ' GLY . . . . . . . . . . . . . . . 179.71 166.02 34.67 Favored Glycine 0 CA--C 1.525 0.697 0 N-CA-C 110.446 -1.062 . . . . 0.0 110.446 172.486 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 50' ' ' GLU . . . . . . . . . . . . . 19.2 mt-10 -80.17 97.26 6.83 Favored 'General case' 0 C--N 1.332 -0.18 0 C-N-CA 123.967 0.907 . . . . 0.0 108.97 176.451 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 51' ' ' GLY . . . . . . . . . . . . . . . -63.15 177.71 6.71 Favored Glycine 0 CA--C 1.53 0.983 0 C-N-CA 123.976 0.798 . . . . 0.0 112.263 163.689 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 52' ' ' LYS . . . . . . . . . . . . . 78.6 tttt -156.16 159.75 39.28 Favored 'General case' 0 CA--C 1.536 0.413 0 C-N-CA 125.026 1.33 . . . . 0.0 107.949 166.028 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 53' ' ' LEU . . . . . . . . . . . . . 18.6 tp -156.51 90.15 1.15 Allowed 'General case' 0 N--CA 1.466 0.337 0 C-N-CA 124.681 1.193 . . . . 0.0 109.127 175.306 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 16.3 t -139.53 35.46 2.03 Favored 'General case' 0 CA--C 1.534 0.363 0 C-N-CA 124.449 1.1 . . . . 0.0 108.726 -178.119 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 55' ' ' ASN . . . . . . . . . . . . . 3.7 p30 -165.11 -80.5 0.03 OUTLIER 'General case' 0 N--CA 1.452 -0.347 0 C-N-CA 127.597 2.359 . . . . 0.0 105.676 -167.549 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 56' ' ' GLY . . . . . . . . . . . . . . . 163.11 15.66 0.03 OUTLIER Glycine 0 CA--C 1.534 1.224 0 C-N-CA 128.966 3.174 . . . . 0.0 109.686 -173.124 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 57' ' ' GLU . . . . . . . . . . . . . 51.1 tt0 -135.33 131.57 36.58 Favored 'General case' 0 C--N 1.343 0.293 0 N-CA-C 108.026 -1.101 . . . . 0.0 108.026 -166.869 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 58' ' ' LEU . . . . . . . . . . . . . 65.5 tp -111.35 90.31 3.3 Favored 'General case' 0 CA--C 1.533 0.307 0 C-N-CA 126.692 1.997 . . . . 0.0 108.929 -177.102 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 59' ' ' THR . . . . . . . . . . . . . 17.7 p -95.37 131.36 41.58 Favored 'General case' 0 C--O 1.236 0.387 0 C-N-CA 124.29 1.036 . . . . 0.0 108.59 171.244 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 60' ' ' ALA . . . . . . . . . . . . . . . -76.87 137.34 39.1 Favored 'General case' 0 N--CA 1.454 -0.252 0 N-CA-C 108.742 -0.836 . . . . 0.0 108.742 167.27 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 61' ' ' LYS . . . . . . . . . . . . . 72.9 tttt -66.59 -22.86 66.13 Favored 'General case' 0 C--N 1.329 -0.304 0 O-C-N 121.913 -0.492 . . . . 0.0 112.003 172.622 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 62' ' ' GLY . . . . . . . . . . . . . . . 168.93 111.89 0.25 Allowed Glycine 0 C--N 1.332 0.316 0 N-CA-C 107.989 -2.044 . . . . 0.0 107.989 -178.523 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 63' ' ' LEU . . . . . 0.432 HD22 ' HA ' ' A' ' 83' ' ' SER . 0.3 OUTLIER -77.75 112.81 14.98 Favored 'General case' 0 N--CA 1.454 -0.239 0 N-CA-C 107.621 -1.251 . . . . 0.0 107.621 175.735 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' A' A ' 64' ' ' ALA . . . . . . . . . . . . . . . -90.31 90.77 8.21 Favored 'General case' 0 C--N 1.326 -0.456 0 C-N-CA 124.802 1.241 . . . . 0.0 111.25 168.408 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 65' ' ' MET . . . . . . . . . . . . . 51.7 mtp -94.58 -179.73 4.98 Favored 'General case' 0 CA--C 1.539 0.54 0 O-C-N 120.842 -1.161 . . . . 0.0 109.314 179.513 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 66' ' ' THR . . . . . . . . . . . . . 16.9 p -121.32 -164.51 1.14 Allowed 'General case' 0 CA--C 1.54 0.571 0 O-C-N 120.973 -1.08 . . . . 0.0 109.683 -172.211 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 67' ' ' ARG . . . . . . . . . . . . . 10.9 mmm180 -128.13 51.2 1.99 Allowed 'General case' 0 CA--C 1.542 0.645 0 C-N-CA 125.929 1.692 . . . . 0.0 109.732 -176.049 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 68' ' ' MET . . . . . . . . . . . . . 19.6 ptp -113.17 -176.44 2.9 Favored 'General case' 0 CA--C 1.54 0.563 0 C-N-CA 127.451 2.3 . . . . 0.0 111.292 -179.889 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 69' ' ' MET . . . . . . . . . . . . . 0.4 OUTLIER -140.9 175.67 9.43 Favored 'General case' 0 C--O 1.235 0.308 0 C-N-CA 126.717 2.007 . . . . 0.0 108.905 -178.942 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 70' ' ' CYS . . . . . 1.287 ' SG ' ' SG ' ' A' ' 44' ' ' CYS . 1.1 p -140.33 152.97 46.26 Favored 'General case' 0 C--N 1.33 -0.254 0 C-N-CA 126.544 1.938 . . . . 0.0 109.633 -168.179 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 71' ' ' ALA . . . . . . . . . . . . . . . -79.44 6.63 9.74 Favored 'General case' 0 CA--C 1.534 0.329 0 C-N-CA 124.747 1.219 . . . . 0.0 113.963 -178.202 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 72' ' ' ASN . . . . . . . . . . . . . 24.8 t30 -135.79 143.34 44.19 Favored Pre-proline 0 C--O 1.233 0.192 0 CA-C-N 119.885 1.221 . . . . 0.0 108.023 172.427 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 73' ' ' PRO . . . . . . . . . . . . . 36.7 Cg_endo -75.56 -34.94 3.03 Favored 'Trans proline' 0 N--CA 1.463 -0.314 0 C-N-CA 122.103 1.869 . . . . 0.0 113.071 -169.888 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 74' ' ' GLN . . . . . . . . . . . . . 34.8 tt0 -60.35 -37.34 80.39 Favored 'General case' 0 CA--C 1.537 0.475 0 C-N-CA 123.746 0.818 . . . . 0.0 110.61 175.788 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 75' ' ' LEU . . . . . . . . . . . . . 91.1 mt -59.09 -41.24 87.58 Favored 'General case' 0 N--CA 1.467 0.384 0 CA-C-N 119.421 1.01 . . . . 0.0 109.407 176.461 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 76' ' ' ASN . . . . . . . . . . . . . 0.1 OUTLIER -68.1 -22.11 64.92 Favored 'General case' 0 N--CA 1.466 0.366 0 C-N-CA 124.204 1.002 . . . . 0.0 111.683 -179.661 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 77' ' ' GLU . . . . . . . . . . . . . 1.6 mt-10 -80.36 -41.39 24.82 Favored 'General case' 0 CA--C 1.53 0.187 0 C-N-CA 123.704 0.802 . . . . 0.0 110.51 173.001 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 78' ' ' LEU . . . . . . . . . . . . . 27.5 mt -62.76 -13.01 27.92 Favored 'General case' 0 N--CA 1.464 0.258 0 C-N-CA 124.839 1.256 . . . . 0.0 113.204 -174.098 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 79' ' ' ASP . . . . . . . . . . . . . 4.6 t70 -44.59 -58.58 2.93 Favored 'General case' 0 C--O 1.232 0.135 0 C-N-CA 125.309 1.444 . . . . 0.0 111.18 162.653 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 80' ' ' ASN . . . . . . . . . . . . . 0.7 OUTLIER -68.7 -37.44 79.54 Favored 'General case' 0 CA--C 1.516 -0.36 0 C-N-CA 120.394 -0.522 . . . . 0.0 109.882 -175.469 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 81' ' ' THR . . . . . . . . . . . . . 7.1 m -58.5 -52.97 63.41 Favored 'General case' 0 N--CA 1.447 -0.625 0 N-CA-C 108.689 -0.856 . . . . 0.0 108.689 -175.958 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 82' ' ' ILE . . . . . . . . . . . . . 11.1 tp -68.85 -39.48 80.05 Favored 'Isoleucine or valine' 0 N--CA 1.456 -0.128 0 CA-C-N 119.107 0.867 . . . . 0.0 111.062 -177.319 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 83' ' ' SER . . . . . 0.432 ' HA ' HD22 ' A' ' 63' ' ' LEU . 5.4 t -60.42 -53.02 62.61 Favored 'General case' 0 N--CA 1.451 -0.378 0 N-CA-C 108.915 -0.772 . . . . 0.0 108.915 -175.138 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 84' ' ' GLU . . . . . . . . . . . . . 5.9 mm-40 -61.03 -44.79 96.87 Favored 'General case' 0 N--CA 1.446 -0.671 0 C-N-CA 124.835 1.254 . . . . 0.0 111.142 179.8 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 85' ' ' MET . . . . . . . . . . . . . 90.8 mtp -66.98 -17.51 64.95 Favored 'General case' 0 N--CA 1.451 -0.41 0 CA-C-N 118.023 0.374 . . . . 0.0 110.798 -175.269 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 86' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -105.79 -25.43 12.19 Favored 'General case' 0 N--CA 1.456 -0.137 0 C-N-CA 124.12 0.968 . . . . 0.0 111.754 -177.309 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 87' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -72.81 -55.38 6.79 Favored 'General case' 0 CA--C 1.518 -0.256 0 N-CA-C 108.466 -0.939 . . . . 0.0 108.466 172.456 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 88' ' ' GLU . . . . . . . . . . . . . 54.9 mt-10 -72.72 -28.13 62.47 Favored 'General case' 0 CA--C 1.53 0.184 0 C-N-CA 119.315 -0.954 . . . . 0.0 112.244 -170.788 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 89' ' ' GLY . . . . . . . . . . . . . . . 120.37 95.56 1.51 Allowed Glycine 0 C--N 1.338 0.681 0 C-N-CA 124.361 0.982 . . . . 0.0 110.685 173.996 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 90' ' ' ALA . . . . . . . . . . . . . . . -62.51 134.21 56.07 Favored 'General case' 0 N--CA 1.451 -0.392 0 CA-C-O 118.12 -0.943 . . . . 0.0 108.508 177.286 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 91' ' ' GLN . . . . . . . . . . . . . 11.6 mm-40 -73.87 140.94 46.05 Favored 'General case' 0 C--O 1.239 0.52 0 N-CA-C 104.801 -2.296 . . . . 0.0 104.801 154.998 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 92' ' ' VAL . . . . . . . . . . . . . 7.2 p -132.73 120.3 41.14 Favored 'Isoleucine or valine' 0 N--CA 1.448 -0.546 0 N-CA-C 105.522 -2.029 . . . . 0.0 105.522 -174.134 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 93' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -142.13 90.14 2.23 Favored 'General case' 0 C--N 1.332 -0.184 0 N-CA-C 107.284 -1.376 . . . . 0.0 107.284 -171.23 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 94' ' ' LEU . . . . . . . . . . . . . 1.1 tm? -97.79 110.36 22.94 Favored 'General case' 0 N--CA 1.464 0.252 0 N-CA-C 107.254 -1.387 . . . . 0.0 107.254 -179.29 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 95' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -76.91 -164.68 0.46 Allowed 'General case' 0 CA--C 1.542 0.669 0 C-N-CA 125.162 1.385 . . . . 0.0 109.278 175.313 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 96' ' ' ALA . . . . . . . . . . . . . . . -62.28 -7.25 4.0 Favored 'General case' 0 CA--C 1.541 0.624 0 O-C-N 119.864 -1.772 . . . . 0.0 115.266 -178.106 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 97' ' ' ASN . . . . . . . . . . . . . 2.0 p30 -173.9 4.49 0.01 OUTLIER 'General case' 0 N--CA 1.476 0.844 0 C-N-CA 125.904 1.681 . . . . 0.0 114.521 169.882 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 98' ' ' GLN . . . . . . . . . . . . . 8.6 tt0 -120.28 132.56 55.37 Favored 'General case' 0 N--CA 1.472 0.634 0 CA-C-N 121.011 1.732 . . . . 0.0 108.976 -178.877 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 99' ' ' LEU . . . . . 0.49 HD22 ' CD2' ' A' ' 101' ' ' LEU . 0.4 OUTLIER -98.91 116.25 30.72 Favored 'General case' 0 C--O 1.233 0.231 0 C-N-CA 124.529 1.132 . . . . 0.0 109.385 176.694 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' A' A ' 100' ' ' THR . . . . . . . . . . . . . 26.7 m -93.27 117.66 30.34 Favored 'General case' 0 C--N 1.322 -0.601 0 C-N-CA 125.386 1.474 . . . . 0.0 107.381 170.363 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 101' ' ' LEU . . . . . 0.49 ' CD2' HD22 ' A' ' 99' ' ' LEU . 3.2 mm? -111.19 120.32 41.9 Favored 'General case' 0 N--CA 1.464 0.239 0 N-CA-C 106.803 -1.554 . . . . 0.0 106.803 166.678 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 102' ' ' ALA . . . . . . . . . . . . . . . -123.82 145.9 48.74 Favored 'General case' 0 N--CA 1.467 0.378 0 C-N-CA 124.676 1.19 . . . . 0.0 109.37 169.375 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 103' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -150.99 174.51 13.06 Favored 'General case' 0 N--CA 1.448 -0.53 0 C-N-CA 125.063 1.345 . . . . 0.0 109.796 178.125 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 104' ' ' ALA . . . . . . . . . . . . . . . -51.34 -29.51 15.46 Favored 'General case' 0 CA--C 1.537 0.467 0 C-N-CA 124.948 1.299 . . . . 0.0 113.032 171.846 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 105' ' ' LYS . . . . . . . . . . . . . 3.7 mtpt -80.93 -73.67 0.36 Allowed 'General case' 0 C--N 1.342 0.258 0 O-C-N 121.343 -0.848 . . . . 0.0 110.721 173.95 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 106' ' ' GLN . . . . . . . . . . . . . 29.1 mt-30 -144.26 177.56 8.52 Favored 'General case' 0 C--N 1.329 -0.325 0 C-N-CA 124.103 0.961 . . . . 0.0 108.6 -156.692 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 107' ' ' THR . . . . . . . . . . . . . 1.0 OUTLIER -130.42 142.31 50.51 Favored 'General case' 0 CA--C 1.531 0.222 0 N-CA-C 108.132 -1.062 . . . . 0.0 108.132 170.332 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 108' ' ' LEU . . . . . . . . . . . . . 6.4 mp -126.61 161.89 27.0 Favored 'General case' 0 N--CA 1.447 -0.609 0 C-N-CA 127.657 2.383 . . . . 0.0 108.488 -179.357 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 109' ' ' THR . . . . . . . . . . . . . 1.3 m -131.51 110.06 10.71 Favored 'General case' 0 C--O 1.238 0.46 0 N-CA-C 108.07 -1.085 . . . . 0.0 108.07 174.732 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 110' ' ' TYR . . . . . . . . . . . . . 37.0 m-85 -98.15 163.98 12.51 Favored 'General case' 0 C--O 1.235 0.29 0 N-CA-C 109.143 -0.688 . . . . 0.0 109.143 174.093 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 111' ' ' LYS . . . . . . . . . . . . . 0.7 OUTLIER -131.05 137.61 49.23 Favored 'General case' 0 CA--C 1.521 -0.138 0 C-N-CA 125.371 1.468 . . . . 0.0 109.347 -173.898 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 112' ' ' LEU . . . . . . . . . . . . . 25.6 tp -67.84 62.84 0.08 Allowed 'General case' 0 CA--C 1.542 0.66 0 C-N-CA 128.309 2.644 . . . . 0.0 110.382 168.527 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 113' ' ' ALA . . . . . 0.461 ' HB3' ' CG2' ' A' ' 13' ' ' VAL . . . -88.46 79.75 7.58 Favored 'General case' 0 CA--C 1.528 0.134 0 N-CA-C 105.909 -1.886 . . . . 0.0 105.909 165.018 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 114' ' ' ASP . . . . . . . . . . . . . 23.4 t0 . . . . . 0 CA--C 1.538 0.489 0 C-N-CA 125.324 1.45 . . . . 0.0 112.163 -167.807 . . . . . . . . 0 0 . 1 . 005 nuclear build core ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 22.5 ttm . . . . . 0 C--O 1.237 0.424 0 N-CA-C 109.086 -0.709 . . . . 0.0 109.086 . . . . . . . . . 0 0 . 1 . 005 nuclear build core ' A' A ' 2' ' ' VAL . . . . . 0.405 HG23 ' HB3' ' A' ' 94' ' ' LEU . 11.3 p -67.47 146.21 13.24 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.419 0 N-CA-C 109.517 -0.549 . . . . 0.0 109.517 177.794 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 3' ' ' THR . . . . . . . . . . . . . 6.1 p -135.34 162.57 56.6 Favored Pre-proline 0 CA--C 1.53 0.205 0 O-C-N 121.99 -0.444 . . . . 0.0 110.989 -173.977 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 4' ' ' PRO . . . . . . . . . . . . . 6.2 Cg_endo -59.68 -51.0 6.76 Favored 'Trans proline' 0 N--CA 1.454 -0.814 0 C-N-CA 122.059 1.839 . . . . 0.0 112.886 175.141 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 5' ' ' GLU . . . . . . . . . . . . . 6.5 mt-10 -58.73 -28.51 65.92 Favored 'General case' 0 CA--C 1.534 0.363 0 N-CA-C 113.74 1.015 . . . . 0.0 113.74 -170.747 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 6' ' ' GLN . . . . . . . . . . . . . 17.5 pt20 -79.89 9.08 5.72 Favored 'General case' 0 CA--C 1.533 0.31 0 N-CA-C 113.622 0.971 . . . . 0.0 113.622 175.939 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 7' ' ' LEU . . . . . . . . . . . . . 78.5 mt -127.17 -50.06 1.43 Allowed 'General case' 0 CA--C 1.52 -0.188 0 CA-C-N 119.272 0.942 . . . . 0.0 109.971 -170.322 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 8' ' ' GLN . . . . . . . . . . . . . 2.2 mp0 -55.38 -17.04 4.2 Favored 'General case' 0 N--CA 1.47 0.538 0 N-CA-C 114.985 1.476 . . . . 0.0 114.985 -175.977 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 9' ' ' HIS . . . . . . . . . . . . . 5.8 m170 -124.65 8.11 8.24 Favored 'General case' 0 CA--C 1.54 0.582 0 C-N-CA 124.234 1.014 . . . . 0.0 110.849 -172.582 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 10' ' ' HIS . . . . . . . . . . . . . 73.7 m-70 -131.75 108.68 9.63 Favored 'General case' 0 CA--C 1.533 0.299 0 C-N-CA 125.465 1.506 . . . . 0.0 109.454 -168.564 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 11' ' ' ARG . . . . . . . . . . . . . 1.5 ttt85 -65.61 154.37 38.95 Favored 'General case' 0 N--CA 1.465 0.276 0 C-N-CA 123.156 0.582 . . . . 0.0 110.674 176.676 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 12' ' ' PHE . . . . . . . . . . . . . 59.4 m-85 -131.87 158.0 42.5 Favored 'General case' 0 N--CA 1.447 -0.594 0 C-N-CA 124.47 1.108 . . . . 0.0 109.731 167.882 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 13' ' ' VAL . . . . . 0.485 ' HA ' ' HA ' ' A' ' 30' ' ' GLU . 7.6 p -129.44 136.52 59.14 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.373 0 N-CA-C 108.876 -0.787 . . . . 0.0 108.876 171.128 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 14' ' ' LEU . . . . . . . . . . . . . 20.2 tp -71.26 85.78 0.78 Allowed 'General case' 0 C--O 1.232 0.162 0 N-CA-C 106.784 -1.561 . . . . 0.0 106.784 176.654 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 2.7 mm-40 -67.9 -47.26 69.3 Favored 'General case' 0 C--N 1.325 -0.48 0 C-N-CA 124.098 0.959 . . . . 0.0 109.277 179.059 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 69.8 m -154.08 140.86 19.08 Favored 'General case' 0 N--CA 1.452 -0.35 0 O-C-N 121.139 -0.976 . . . . 0.0 112.184 -176.762 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 17' ' ' VAL . . . . . . . . . . . . . 85.8 t -98.98 171.12 1.31 Allowed 'Isoleucine or valine' 0 C--N 1.328 -0.328 0 C-N-CA 125.952 1.701 . . . . 0.0 108.601 -174.082 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 18' ' ' ASN . . . . . . . . . . . . . 1.3 t30 -44.36 -49.98 9.33 Favored 'General case' 0 C--N 1.337 0.059 0 C-N-CA 125.81 1.644 . . . . 0.0 112.02 -178.551 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . -79.65 -69.14 1.42 Allowed Glycine 0 CA--C 1.526 0.725 0 O-C-N 123.856 0.722 . . . . 0.0 111.459 177.269 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 30.2 mttm -136.72 165.68 33.3 Favored Pre-proline 0 CA--C 1.529 0.142 0 C-N-CA 125.728 1.611 . . . . 0.0 111.035 -164.273 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 21' ' ' PRO . . . . . . . . . . . . . 91.9 Cg_endo -67.37 176.41 4.85 Favored 'Trans proline' 0 N--CA 1.454 -0.852 0 C-N-CA 121.596 1.53 . . . . 0.0 110.045 162.728 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 22' ' ' VAL . . . . . . . . . . . . . 7.7 p -131.47 162.31 39.6 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.513 0 C-N-CA 124.834 1.254 . . . . 0.0 108.336 177.429 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 23' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -141.9 142.46 33.06 Favored 'General case' 0 CA--C 1.535 0.392 0 CA-C-N 119.008 0.822 . . . . 0.0 108.794 172.568 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 24' ' ' SER . . . . . . . . . . . . . 16.2 m -146.06 35.25 1.0 Allowed 'General case' 0 CA--C 1.537 0.448 0 C-N-CA 125.64 1.576 . . . . 0.0 110.483 -175.647 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 25' ' ' ASP . . . . . . . . . . . . . 18.0 m-20 53.13 52.68 13.24 Favored 'General case' 0 N--CA 1.47 0.563 0 C-N-CA 125.088 1.355 . . . . 0.0 110.801 -179.715 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 26' ' ' LYS . . . . . . . . . . . . . 5.0 tmtt? 64.71 9.24 5.05 Favored 'General case' 0 N--CA 1.45 -0.437 0 C-N-CA 124.456 1.102 . . . . 0.0 112.406 178.227 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 27' ' ' ASN . . . . . . . . . . . . . 73.3 m-20 -113.55 58.4 0.74 Allowed Pre-proline 0 CA--C 1.542 0.664 0 C-N-CA 125.151 1.38 . . . . 0.0 110.428 172.524 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 28' ' ' PRO . . . . . . . . . . . . . 23.2 Cg_endo -76.76 171.66 17.6 Favored 'Trans proline' 0 CA--C 1.543 0.936 0 C-N-CA 124.502 3.468 . . . . 0.0 113.457 -166.84 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 29' ' ' PRO . . . . . . . . . . . . . 19.5 Cg_endo -66.02 64.91 0.45 Allowed 'Trans proline' 0 C--N 1.357 0.978 0 C-N-CA 124.974 3.783 . . . . 0.0 111.811 170.984 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 30' ' ' GLU . . . . . 0.485 ' HA ' ' HA ' ' A' ' 13' ' ' VAL . 1.9 pt-20 -70.15 164.54 23.97 Favored 'General case' 0 C--O 1.239 0.525 0 O-C-N 120.222 -1.549 . . . . 0.0 109.339 172.28 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 31' ' ' ILE . . . . . . . . . . . . . 12.9 tt -139.94 147.63 23.57 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.474 0 CA-C-O 122.336 1.065 . . . . 0.0 108.492 176.935 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 32' ' ' SER . . . . . . . . . . . . . 5.0 p -138.75 154.29 48.52 Favored 'General case' 0 N--CA 1.443 -0.775 0 N-CA-C 107.064 -1.458 . . . . 0.0 107.064 -179.276 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 33' ' ' PHE . . . . . . . . . . . . . 91.7 m-85 -126.37 168.38 14.25 Favored 'General case' 0 N--CA 1.446 -0.638 0 N-CA-C 106.84 -1.541 . . . . 0.0 106.84 178.03 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 34' ' ' GLY . . . . . . . . . . . . . . . 157.85 170.49 22.69 Favored Glycine 0 CA--C 1.522 0.524 0 N-CA-C 109.197 -1.561 . . . . 0.0 109.197 -178.284 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 35' ' ' GLU . . . . . . . . . . . . . 25.1 mt-10 43.57 88.38 0.01 OUTLIER 'General case' 0 N--CA 1.467 0.406 0 C-N-CA 126.796 2.038 . . . . 0.0 113.38 163.647 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 29.3 mttm 69.67 24.42 5.49 Favored 'General case' 0 N--CA 1.466 0.369 0 C-N-CA 125.429 1.492 . . . . 0.0 112.609 -177.224 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 37' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER 64.98 21.66 12.34 Favored 'General case' 0 CA--C 1.542 0.673 0 CA-C-N 120.178 1.353 . . . . 0.0 109.878 -177.828 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 38' ' ' MET . . . . . . . . . . . . . 14.9 mtp -62.42 157.49 19.92 Favored 'General case' 0 N--CA 1.45 -0.445 0 O-C-N 120.959 -1.088 . . . . 0.0 110.006 171.406 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 39' ' ' ILE . . . . . . . . . . . . . 7.3 mt -119.26 131.22 72.56 Favored 'Isoleucine or valine' 0 N--CA 1.447 -0.587 0 C-N-CA 125.443 1.497 . . . . 0.0 107.2 -177.988 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 40' ' ' SER . . . . . . . . . . . . . 55.5 m -129.0 116.02 18.69 Favored 'General case' 0 N--CA 1.452 -0.363 0 C-N-CA 126.377 1.871 . . . . 0.0 107.182 178.78 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 41' ' ' GLY . . . . . . . . . . . . . . . -167.75 179.47 41.09 Favored Glycine 0 CA--C 1.526 0.738 0 N-CA-C 109.631 -1.388 . . . . 0.0 109.631 -179.395 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 42' ' ' SER . . . . . . . . . . . . . 1.0 OUTLIER -154.54 103.28 2.46 Favored 'General case' 0 N--CA 1.453 -0.283 0 O-C-N 121.989 -0.712 . . . . 0.0 109.257 -176.605 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 43' ' ' MET . . . . . . . . . . . . . 6.9 mmt -71.25 -43.55 67.02 Favored 'General case' 0 C--O 1.223 -0.335 0 N-CA-C 108.998 -0.741 . . . . 0.0 108.998 175.248 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 44' ' ' CYS . . . . . 1.275 ' SG ' ' SG ' ' A' ' 70' ' ' CYS . 38.7 t -153.84 -75.32 0.12 Allowed 'General case' 0 N--CA 1.453 -0.284 0 N-CA-C 104.61 -2.367 . . . . 0.0 104.61 172.878 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 45' ' ' ASN . . . . . . . . . . . . . 2.7 m120 -78.48 17.66 0.64 Allowed 'General case' 0 C--N 1.329 -0.3 0 C-N-CA 126.463 1.905 . . . . 0.0 112.494 -163.703 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 46' ' ' ARG . . . . . . . . . . . . . 3.9 mmm180 55.48 158.94 0.01 OUTLIER 'General case' 0 N--CA 1.465 0.299 0 C-N-CA 128.248 2.619 . . . . 0.0 112.631 -161.744 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 47' ' ' PHE . . . . . . . . . . . . . 47.3 p90 -152.69 171.74 17.73 Favored 'General case' 0 N--CA 1.448 -0.556 0 C-N-CA 125.352 1.461 . . . . 0.0 108.199 165.835 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 48' ' ' SER . . . . . . . . . . . . . 7.0 p -163.6 158.87 21.12 Favored 'General case' 0 N--CA 1.444 -0.765 0 N-CA-C 107.031 -1.47 . . . . 0.0 107.031 176.258 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 49' ' ' GLY . . . . . . . . . . . . . . . 173.62 169.17 35.64 Favored Glycine 0 C--N 1.34 0.756 0 CA-C-N 119.951 1.251 . . . . 0.0 112.265 164.7 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 50' ' ' GLU . . . . . . . . . . . . . 23.1 mt-10 -72.84 96.8 2.13 Favored 'General case' 0 C--O 1.239 0.503 0 C-N-CA 125.395 1.478 . . . . 0.0 108.884 171.607 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 51' ' ' GLY . . . . . . . . . . . . . . . -71.97 176.55 40.03 Favored Glycine 0 CA--C 1.527 0.818 0 CA-C-N 115.414 -0.812 . . . . 0.0 111.255 156.965 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 52' ' ' LYS . . . . . . . . . . . . . 29.9 ttpt -167.25 150.33 6.31 Favored 'General case' 0 CA--C 1.529 0.15 0 C-N-CA 126.21 1.804 . . . . 0.0 107.605 179.688 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 53' ' ' LEU . . . . . . . . . . . . . 46.7 tp -155.26 120.53 4.93 Favored 'General case' 0 C--O 1.232 0.142 0 C-N-CA 123.667 0.787 . . . . 0.0 109.345 177.132 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 1.2 t -162.21 39.56 0.12 Allowed 'General case' 0 CA--C 1.538 0.507 0 C-N-CA 123.639 0.776 . . . . 0.0 108.992 174.176 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 55' ' ' ASN . . . . . . . . . . . . . 15.8 p-10 -174.01 -51.4 0.01 OUTLIER 'General case' 0 N--CA 1.462 0.162 0 C-N-CA 124.779 1.232 . . . . 0.0 111.372 -161.497 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 56' ' ' GLY . . . . . . . . . . . . . . . 131.57 10.18 2.42 Favored Glycine 0 CA--C 1.529 0.91 0 C-N-CA 125.102 1.334 . . . . 0.0 113.128 -176.694 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 57' ' ' GLU . . . . . . . . . . . . . 51.7 tt0 -132.05 134.89 46.04 Favored 'General case' 0 C--O 1.233 0.233 0 CA-C-N 118.657 1.228 . . . . 0.0 109.118 -175.019 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 58' ' ' LEU . . . . . . . . . . . . . 38.1 tp -115.71 82.19 1.72 Allowed 'General case' 0 CA--C 1.535 0.393 0 C-N-CA 126.221 1.809 . . . . 0.0 110.685 -171.928 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 59' ' ' THR . . . . . . . . . . . . . 16.9 p -82.45 141.23 32.89 Favored 'General case' 0 C--O 1.237 0.427 0 O-C-N 121.445 -0.784 . . . . 0.0 110.931 177.366 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 60' ' ' ALA . . . . . 0.463 ' HB2' ' HB3' ' A' ' 86' ' ' LEU . . . -89.87 117.05 28.41 Favored 'General case' 0 CA--C 1.517 -0.309 0 C-N-CA 125.011 1.325 . . . . 0.0 110.584 173.604 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 61' ' ' LYS . . . . . . . . . . . . . 16.2 tttt -67.11 -9.47 40.03 Favored 'General case' 0 CA--C 1.543 0.683 0 N-CA-C 113.453 0.908 . . . . 0.0 113.453 176.05 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 62' ' ' GLY . . . . . . . . . . . . . . . 159.25 116.08 0.43 Allowed Glycine 0 CA--C 1.523 0.535 0 N-CA-C 108.606 -1.798 . . . . 0.0 108.606 179.597 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 63' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -97.59 108.54 21.28 Favored 'General case' 0 N--CA 1.452 -0.367 0 C-N-CA 124.227 1.011 . . . . 0.0 110.396 -173.07 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 64' ' ' ALA . . . . . . . . . . . . . . . -96.18 108.71 21.2 Favored 'General case' 0 C--N 1.324 -0.517 0 CA-C-N 115.634 -0.712 . . . . 0.0 110.114 -177.083 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 65' ' ' MET . . . . . . . . . . . . . 50.4 mtp -111.43 -178.72 3.52 Favored 'General case' 0 C--O 1.241 0.61 0 C-N-CA 126.091 1.756 . . . . 0.0 109.972 -174.588 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 66' ' ' THR . . . . . . . . . . . . . 10.1 p -122.6 -175.25 3.1 Favored 'General case' 0 CA--C 1.537 0.444 0 C-N-CA 123.625 0.77 . . . . 0.0 112.94 178.937 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 67' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -124.68 74.05 1.31 Allowed 'General case' 0 C--O 1.237 0.418 0 C-N-CA 126.727 2.011 . . . . 0.0 110.044 -174.622 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 68' ' ' MET . . . . . . . . . . . . . 2.0 ptt? -142.93 158.37 43.67 Favored 'General case' 0 N--CA 1.452 -0.343 0 C-N-CA 124.638 1.175 . . . . 0.0 111.694 172.824 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 69' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -104.92 134.67 47.65 Favored 'General case' 0 N--CA 1.448 -0.566 0 C-N-CA 127.388 2.275 . . . . 0.0 109.234 179.827 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 70' ' ' CYS . . . . . 1.275 ' SG ' ' SG ' ' A' ' 44' ' ' CYS . 60.0 m -100.05 -6.72 25.97 Favored 'General case' 0 N--CA 1.467 0.408 0 C-N-CA 125.611 1.564 . . . . 0.0 114.499 -173.489 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 71' ' ' ALA . . . . . . . . . . . . . . . 67.81 -45.04 0.49 Allowed 'General case' 0 C--O 1.234 0.248 0 C-N-CA 127.324 2.25 . . . . 0.0 113.936 -168.29 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 72' ' ' ASN . . . . . 0.68 ' HB3' HD22 ' A' ' 75' ' ' LEU . 43.4 t30 -68.38 142.71 94.81 Favored Pre-proline 0 C--O 1.234 0.26 0 CA-C-O 117.503 -1.237 . . . . 0.0 108.697 -177.598 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 73' ' ' PRO . . . . . . . . . . . . . 44.3 Cg_endo -78.92 -41.32 0.24 Allowed 'Trans proline' 0 N--CA 1.455 -0.756 0 C-N-CA 121.957 1.772 . . . . 0.0 110.999 178.414 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 74' ' ' GLN . . . . . . . . . . . . . 23.7 tt0 -61.58 -44.98 96.02 Favored 'General case' 0 CA--C 1.534 0.358 0 C-N-CA 123.126 0.57 . . . . 0.0 110.76 -169.506 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 75' ' ' LEU . . . . . 0.68 HD22 ' HB3' ' A' ' 72' ' ' ASN . 0.0 OUTLIER -52.31 -52.65 51.78 Favored 'General case' 0 N--CA 1.447 -0.605 0 C-N-CA 125.139 1.376 . . . . 0.0 110.583 169.543 . . . . . . . . 3 3 . 1 . 005 nuclear build core ' A' A ' 76' ' ' ASN . . . . . . . . . . . . . 1.2 m-20 -71.18 -0.89 10.8 Favored 'General case' 0 N--CA 1.47 0.53 0 C-N-CA 126.657 1.983 . . . . 0.0 113.144 -174.767 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 77' ' ' GLU . . . . . . . . . . . . . 3.3 mm-40 -101.93 -40.31 6.95 Favored 'General case' 0 C--O 1.235 0.328 0 C-N-CA 126.214 1.806 . . . . 0.0 109.708 171.075 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 78' ' ' LEU . . . . . . . . . . . . . 4.9 mp -67.49 -24.24 65.56 Favored 'General case' 0 N--CA 1.456 -0.167 0 C-N-CA 125.589 1.556 . . . . 0.0 112.103 -178.58 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 79' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -58.24 -34.35 70.35 Favored 'General case' 0 C--O 1.232 0.171 0 C-N-CA 123.4 0.68 . . . . 0.0 111.695 175.233 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 80' ' ' ASN . . . . . . . . . . . . . 91.1 m-20 -87.17 -36.41 18.05 Favored 'General case' 0 CA--C 1.512 -0.496 0 CA-C-O 117.893 -1.051 . . . . 0.0 109.862 177.753 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 81' ' ' THR . . . . . . . . . . . . . 3.8 m -52.38 -55.33 22.41 Favored 'General case' 0 CA--C 1.531 0.246 0 CA-C-N 118.646 0.657 . . . . 0.0 109.985 174.657 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 82' ' ' ILE . . . . . . . . . . . . . 9.8 tp -66.56 -37.61 79.93 Favored 'Isoleucine or valine' 0 N--CA 1.454 -0.27 0 C-N-CA 119.808 -0.757 . . . . 0.0 111.361 -174.382 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 83' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER -59.75 -49.55 77.29 Favored 'General case' 0 N--CA 1.443 -0.802 0 N-CA-C 109.283 -0.636 . . . . 0.0 109.283 179.495 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 84' ' ' GLU . . . . . . . . . . . . . 36.8 tt0 -66.41 -46.31 76.99 Favored 'General case' 0 N--CA 1.449 -0.5 0 C-N-CA 125.065 1.346 . . . . 0.0 111.219 -176.725 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 85' ' ' MET . . . . . . . . . . . . . 85.0 mtp -58.21 -52.26 66.31 Favored 'General case' 0 C--N 1.342 0.265 0 C-N-CA 124.413 1.085 . . . . 0.0 109.318 -177.766 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 86' ' ' LEU . . . . . 0.463 ' HB3' ' HB2' ' A' ' 60' ' ' ALA . 0.1 OUTLIER -75.27 -22.97 57.39 Favored 'General case' 0 N--CA 1.453 -0.311 0 CA-C-N 115.906 -0.588 . . . . 0.0 111.329 -171.41 . . . . . . . . 3 3 . 1 . 005 nuclear build core ' A' A ' 87' ' ' LYS . . . . . . . . . . . . . 9.5 mttt -67.14 -47.05 72.26 Favored 'General case' 0 N--CA 1.456 -0.172 0 N-CA-C 108.164 -1.05 . . . . 0.0 108.164 -178.797 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 88' ' ' GLU . . . . . . . . . . . . . 69.5 mt-10 -72.07 -51.45 21.54 Favored 'General case' 0 N--CA 1.454 -0.255 0 O-C-N 123.738 0.649 . . . . 0.0 110.077 177.567 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 89' ' ' GLY . . . . . . . . . . . . . . . 134.26 97.57 0.59 Allowed Glycine 0 C--N 1.337 0.597 0 N-CA-C 108.509 -1.836 . . . . 0.0 108.509 -169.732 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 90' ' ' ALA . . . . . . . . . . . . . . . -74.11 130.72 40.34 Favored 'General case' 0 N--CA 1.451 -0.387 0 N-CA-C 107.423 -1.325 . . . . 0.0 107.423 171.813 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 91' ' ' GLN . . . . . . . . . . . . . 82.1 mm-40 -62.64 130.91 47.14 Favored 'General case' 0 N--CA 1.442 -0.833 0 N-CA-C 106.109 -1.812 . . . . 0.0 106.109 159.239 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 92' ' ' VAL . . . . . . . . . . . . . 4.2 p -118.27 124.67 73.46 Favored 'Isoleucine or valine' 0 N--CA 1.44 -0.927 0 N-CA-C 104.069 -2.567 . . . . 0.0 104.069 -179.008 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 93' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -138.69 138.48 37.78 Favored 'General case' 0 N--CA 1.444 -0.739 0 N-CA-C 106.316 -1.735 . . . . 0.0 106.316 173.37 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 94' ' ' LEU . . . . . 0.556 ' HB2' HD12 ' A' ' 99' ' ' LEU . 10.8 tp -133.23 116.22 15.93 Favored 'General case' 0 N--CA 1.445 -0.687 0 N-CA-C 106.543 -1.651 . . . . 0.0 106.543 -178.923 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 95' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -82.59 -164.62 0.87 Allowed 'General case' 0 C--N 1.322 -0.619 0 CA-C-N 114.417 -1.265 . . . . 0.0 110.112 172.62 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 96' ' ' ALA . . . . . . . . . . . . . . . -49.59 -40.82 40.12 Favored 'General case' 0 CA--C 1.538 0.501 0 C-N-CA 124.611 1.164 . . . . 0.0 113.079 -178.004 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 97' ' ' ASN . . . . . . . . . . . . . 42.8 p30 -156.38 23.47 0.35 Allowed 'General case' 0 CA--C 1.541 0.63 0 N-CA-C 113.683 0.994 . . . . 0.0 113.683 -178.876 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 98' ' ' GLN . . . . . . . . . . . . . 13.7 tt0 -137.11 122.79 19.83 Favored 'General case' 0 N--CA 1.467 0.381 0 C-N-CA 124.45 1.1 . . . . 0.0 108.568 -177.735 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 99' ' ' LEU . . . . . 0.556 HD12 ' HB2' ' A' ' 94' ' ' LEU . 3.7 tp -82.38 130.81 35.19 Favored 'General case' 0 C--O 1.235 0.306 0 N-CA-C 107.709 -1.219 . . . . 0.0 107.709 170.723 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 100' ' ' THR . . . . . . . . . . . . . 5.0 m -117.73 114.32 23.15 Favored 'General case' 0 C--N 1.325 -0.471 0 C-N-CA 126.506 1.923 . . . . 0.0 106.743 171.371 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 101' ' ' LEU . . . . . . . . . . . . . 0.7 OUTLIER -115.54 123.82 49.47 Favored 'General case' 0 CA--C 1.505 -0.777 0 N-CA-C 106.832 -1.544 . . . . 0.0 106.832 -179.073 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 102' ' ' ALA . . . . . . . . . . . . . . . -139.14 158.48 44.1 Favored 'General case' 0 C--N 1.325 -0.488 0 C-N-CA 123.655 0.782 . . . . 0.0 108.97 178.577 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 103' ' ' THR . . . . . . . . . . . . . 0.6 OUTLIER -154.61 -179.95 8.47 Favored 'General case' 0 N--CA 1.443 -0.815 0 C-N-CA 126.438 1.895 . . . . 0.0 106.214 176.838 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 104' ' ' ALA . . . . . . . . . . . . . . . -60.53 -26.24 66.72 Favored 'General case' 0 C--O 1.236 0.363 0 O-C-N 120.992 -1.067 . . . . 0.0 112.284 174.613 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 105' ' ' LYS . . . . . . . . . . . . . 13.0 mmtt -77.63 -71.7 0.4 Allowed 'General case' 0 CA--C 1.512 -0.504 0 O-C-N 121.962 -0.461 . . . . 0.0 111.048 -179.992 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 106' ' ' GLN . . . . . . . . . . . . . 1.4 tt0 -154.07 -169.87 3.38 Favored 'General case' 0 N--CA 1.45 -0.446 0 N-CA-C 109.719 -0.475 . . . . 0.0 109.719 -166.435 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 107' ' ' THR . . . . . . . . . . . . . 10.0 t -143.74 164.13 31.35 Favored 'General case' 0 C--O 1.24 0.601 0 C-N-CA 123.431 0.692 . . . . 0.0 110.281 -173.682 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 108' ' ' LEU . . . . . . . . . . . . . 75.6 mt -150.05 134.05 16.99 Favored 'General case' 0 CA--C 1.536 0.434 0 C-N-CA 128.399 2.679 . . . . 0.0 106.123 -170.688 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 109' ' ' THR . . . . . . . . . . . . . 82.6 m -115.21 116.21 27.97 Favored 'General case' 0 C--O 1.237 0.398 0 N-CA-C 107.022 -1.473 . . . . 0.0 107.022 174.721 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 110' ' ' TYR . . . . . . . . . . . . . 21.7 m-85 -106.99 168.57 9.11 Favored 'General case' 0 C--O 1.237 0.424 0 CA-C-O 121.637 0.732 . . . . 0.0 109.811 176.652 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 111' ' ' LYS . . . . . . . . . . . . . 0.9 OUTLIER -130.03 143.71 50.94 Favored 'General case' 0 CA--C 1.519 -0.225 0 C-N-CA 126.013 1.725 . . . . 0.0 108.343 -170.847 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 112' ' ' LEU . . . . . . . . . . . . . 21.2 tp -70.71 60.63 0.23 Allowed 'General case' 0 CA--C 1.54 0.581 0 C-N-CA 126.222 1.809 . . . . 0.0 111.575 171.152 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 113' ' ' ALA . . . . . . . . . . . . . . . -88.04 103.34 15.63 Favored 'General case' 0 N--CA 1.453 -0.303 0 N-CA-C 105.297 -2.112 . . . . 0.0 105.297 163.251 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 114' ' ' ASP . . . . . . . . . . . . . 46.5 t0 . . . . . 0 C--N 1.33 -0.241 0 CA-C-O 122.918 1.342 . . . . 0.0 109.39 174.357 . . . . . . . . 0 0 . 1 . 006 nuclear build core ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 21.1 ttm . . . . . 0 N--CA 1.455 -0.181 0 N-CA-C 108.321 -0.992 . . . . 0.0 108.321 . . . . . . . . . 0 0 . 1 . 006 nuclear build core ' A' A ' 2' ' ' VAL . . . . . 0.555 HG11 ' O ' ' A' ' 92' ' ' VAL . 8.2 p -57.64 142.3 13.51 Favored 'Isoleucine or valine' 0 CA--C 1.542 0.648 0 CA-C-N 115.951 -0.568 . . . . 0.0 110.251 173.237 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 3' ' ' THR . . . . . . . . . . . . . 21.5 p -123.03 163.9 30.61 Favored Pre-proline 0 C--O 1.226 -0.153 0 O-C-N 121.353 -0.842 . . . . 0.0 109.956 172.724 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 4' ' ' PRO . . . . . . . . . . . . . 31.1 Cg_endo -63.89 -36.63 49.05 Favored 'Trans proline' 0 N--CA 1.461 -0.427 0 C-N-CA 122.227 1.951 . . . . 0.0 112.183 174.377 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 5' ' ' GLU . . . . . . . . . . . . . 13.3 tt0 -57.27 -56.67 18.84 Favored 'General case' 0 CA--C 1.534 0.333 0 C-N-CA 123.524 0.729 . . . . 0.0 111.25 -172.721 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 6' ' ' GLN . . . . . . . . . . . . . 4.2 pt20 -64.05 18.3 0.01 OUTLIER 'General case' 0 CA--C 1.543 0.691 0 C-N-CA 128.174 2.59 . . . . 0.0 114.252 178.877 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 7' ' ' LEU . . . . . . . . . . . . . 72.9 mt -134.95 -50.3 0.76 Allowed 'General case' 0 N--CA 1.453 -0.313 0 C-N-CA 126.272 1.829 . . . . 0.0 109.58 -176.649 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 8' ' ' GLN . . . . . . . . . . . . . 5.4 mt-30 -57.65 -21.31 39.17 Favored 'General case' 0 N--CA 1.472 0.652 0 N-CA-C 114.114 1.153 . . . . 0.0 114.114 -177.182 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 9' ' ' HIS . . . . . . . . . . . . . 8.3 m170 -110.76 11.46 22.57 Favored 'General case' 0 CA--C 1.537 0.475 0 C-N-CA 123.421 0.688 . . . . 0.0 111.218 -179.916 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 10' ' ' HIS . . . . . . . . . . . . . 50.8 m80 -136.33 112.25 9.57 Favored 'General case' 0 CA--C 1.535 0.39 0 C-N-CA 124.686 1.195 . . . . 0.0 109.223 -165.754 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 11' ' ' ARG . . . . . . . . . . . . . 4.6 ttt85 -69.11 152.61 44.95 Favored 'General case' 0 N--CA 1.466 0.351 0 O-C-N 121.304 -0.873 . . . . 0.0 108.961 172.159 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 12' ' ' PHE . . . . . . . . . . . . . 21.3 m-85 -139.11 156.6 47.03 Favored 'General case' 0 CA--C 1.512 -0.513 0 N-CA-C 108.387 -0.968 . . . . 0.0 108.387 173.676 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 13' ' ' VAL . . . . . 0.688 ' CG1' ' HB3' ' A' ' 113' ' ' ALA . 1.8 p -140.5 128.68 24.59 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.583 0 N-CA-C 113.135 0.791 . . . . 0.0 113.135 -179.339 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 14' ' ' LEU . . . . . . . . . . . . . 6.4 tt -57.32 119.91 7.25 Favored 'General case' 0 CA--C 1.508 -0.666 0 N-CA-C 107.512 -1.292 . . . . 0.0 107.512 178.055 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 15' ' ' GLU . . . . . 0.456 ' HG3' ' HE2' ' A' ' 111' ' ' LYS . 0.1 OUTLIER -106.12 -45.23 4.38 Favored 'General case' 0 N--CA 1.439 -0.978 0 CA-C-N 115.092 -0.958 . . . . 0.0 108.996 -173.229 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -143.56 152.18 41.11 Favored 'General case' 0 N--CA 1.443 -0.79 0 CA-C-O 121.972 0.891 . . . . 0.0 111.406 174.242 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 17' ' ' VAL . . . . . . . . . . . . . 10.5 t -76.93 175.68 0.73 Allowed 'Isoleucine or valine' 0 C--O 1.242 0.673 0 N-CA-C 106.871 -1.529 . . . . 0.0 106.871 173.1 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 18' ' ' ASN . . . . . . . . . . . . . 0.2 OUTLIER -44.79 -34.49 2.32 Favored 'General case' 0 CA--C 1.535 0.374 0 C-N-CA 126.773 2.029 . . . . 0.0 113.103 169.6 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . -115.3 -54.31 0.38 Allowed Glycine 0 CA--C 1.525 0.687 0 CA-C-O 118.937 -0.924 . . . . 0.0 113.339 -168.198 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 12.9 mttm -134.07 160.76 67.3 Favored Pre-proline 0 N--CA 1.466 0.331 0 CA-C-N 118.694 1.247 . . . . 0.0 111.702 178.08 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 21' ' ' PRO . . . . . . . . . . . . . 59.8 Cg_endo -67.06 160.72 46.0 Favored 'Trans proline' 0 N--CA 1.45 -1.029 0 C-N-CA 122.012 1.808 . . . . 0.0 110.321 162.468 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 22' ' ' VAL . . . . . . . . . . . . . 13.3 p -139.74 165.52 22.16 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.41 0 C-N-CA 124.536 1.134 . . . . 0.0 109.166 -179.265 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 23' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -130.07 157.98 40.89 Favored 'General case' 0 C--O 1.235 0.338 0 CA-C-O 121.528 0.68 . . . . 0.0 111.465 -179.166 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 24' ' ' SER . . . . . 0.422 ' HB3' ' HA ' ' A' ' 28' ' ' PRO . 32.2 t -150.9 47.88 0.85 Allowed 'General case' 0 CA--C 1.536 0.435 0 C-N-CA 126.462 1.905 . . . . 0.0 106.624 -178.397 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 25' ' ' ASP . . . . . . . . . . . . . 32.6 m-20 44.54 54.59 6.33 Favored 'General case' 0 N--CA 1.469 0.506 0 C-N-CA 126.044 1.737 . . . . 0.0 112.466 -176.391 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 26' ' ' LYS . . . . . . . . . . . . . 7.1 tmtm? 69.99 -2.57 2.01 Favored 'General case' 0 N--CA 1.471 0.605 0 O-C-N 120.91 -1.119 . . . . 0.0 112.664 176.619 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 27' ' ' ASN . . . . . . . . . . . . . 82.5 m-20 -113.43 71.03 1.56 Allowed Pre-proline 0 CA--C 1.537 0.471 0 C-N-CA 125.761 1.624 . . . . 0.0 107.471 175.455 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 28' ' ' PRO . . . . . 0.422 ' HA ' ' HB3' ' A' ' 24' ' ' SER . 60.2 Cg_endo -67.99 170.35 14.48 Favored 'Trans proline' 0 C--N 1.349 0.6 0 C-N-CA 124.664 3.576 . . . . 0.0 113.412 -173.335 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 29' ' ' PRO . . . . . 0.479 ' HB3' ' HA ' ' A' ' 43' ' ' MET . 12.2 Cg_endo -61.46 69.49 0.1 OUTLIER 'Trans proline' 0 CA--C 1.544 1.013 0 C-N-CA 125.167 3.911 . . . . 0.0 112.042 164.569 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 30' ' ' GLU . . . . . . . . . . . . . 11.7 pt-20 -95.74 168.95 10.35 Favored 'General case' 0 C--N 1.327 -0.379 0 O-C-N 119.768 -1.833 . . . . 0.0 111.105 177.512 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 31' ' ' ILE . . . . . 0.418 HD11 ' CG2' ' A' ' 39' ' ' ILE . 14.4 tt -147.64 165.62 5.83 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.399 0 C-N-CA 124.392 1.077 . . . . 0.0 108.307 -168.854 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 32' ' ' SER . . . . . . . . . . . . . 5.9 p -145.92 161.67 39.53 Favored 'General case' 0 N--CA 1.443 -0.824 0 N-CA-C 107.985 -1.117 . . . . 0.0 107.985 165.884 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 33' ' ' PHE . . . . . . . . . . . . . 84.6 m-85 -127.57 167.43 16.35 Favored 'General case' 0 N--CA 1.442 -0.874 0 N-CA-C 106.619 -1.623 . . . . 0.0 106.619 175.357 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 34' ' ' GLY . . . . . . . . . . . . . . . 165.57 -167.28 38.92 Favored Glycine 0 N--CA 1.447 -0.596 0 N-CA-C 105.815 -2.914 . . . . 0.0 105.815 -177.189 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 35' ' ' GLU . . . . . . . . . . . . . 37.7 mt-10 44.38 72.51 0.19 Allowed 'General case' 0 C--N 1.33 -0.242 0 C-N-CA 124.952 1.301 . . . . 0.0 112.41 161.658 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 24.9 mtmt 60.33 28.31 17.92 Favored 'General case' 0 CA--C 1.541 0.633 0 CA-C-N 115.182 -0.917 . . . . 0.0 112.224 174.635 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 37' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER 75.23 15.92 2.81 Favored 'General case' 0 N--CA 1.469 0.521 0 C-N-CA 128.152 2.581 . . . . 0.0 112.649 -175.867 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 38' ' ' MET . . . . . . . . . . . . . 19.6 mtp -55.92 147.44 19.48 Favored 'General case' 0 C--O 1.237 0.395 0 O-C-N 120.697 -1.252 . . . . 0.0 110.664 167.451 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 39' ' ' ILE . . . . . 0.418 ' CG2' HD11 ' A' ' 31' ' ' ILE . 7.5 mt -108.61 135.47 47.33 Favored 'Isoleucine or valine' 0 N--CA 1.447 -0.588 0 N-CA-C 107.158 -1.423 . . . . 0.0 107.158 -177.428 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 40' ' ' SER . . . . . . . . . . . . . 4.4 m -136.18 135.57 39.27 Favored 'General case' 0 N--CA 1.452 -0.36 0 N-CA-C 107.584 -1.265 . . . . 0.0 107.584 171.757 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 41' ' ' GLY . . . . . . . . . . . . . . . -178.08 -175.46 45.25 Favored Glycine 0 C--O 1.237 0.325 0 CA-C-N 119.179 0.9 . . . . 0.0 111.114 -178.474 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 42' ' ' SER . . . . . . . . . . . . . 15.7 t -143.54 167.62 21.79 Favored 'General case' 0 N--CA 1.444 -0.75 0 N-CA-C 108.197 -1.038 . . . . 0.0 108.197 165.548 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 43' ' ' MET . . . . . 0.479 ' HA ' ' HB3' ' A' ' 29' ' ' PRO . 36.4 mmm -126.79 -45.33 1.61 Allowed 'General case' 0 N--CA 1.447 -0.614 0 N-CA-C 107.86 -1.163 . . . . 0.0 107.86 162.014 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 44' ' ' CYS . . . . . 1.283 ' SG ' ' SG ' ' A' ' 70' ' ' CYS . 41.6 t -149.16 -51.21 0.15 Allowed 'General case' 0 CA--C 1.542 0.664 0 C-N-CA 126.112 1.765 . . . . 0.0 108.009 167.706 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 45' ' ' ASN . . . . . . . . . . . . . 8.0 m-80 -88.95 10.34 21.74 Favored 'General case' 0 N--CA 1.467 0.4 0 N-CA-C 115.898 1.814 . . . . 0.0 115.898 -174.203 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 46' ' ' ARG . . . . . . . . . . . . . 0.4 OUTLIER 60.99 164.78 0.08 Allowed 'General case' 0 N--CA 1.474 0.774 0 C-N-CA 125.809 1.644 . . . . 0.0 111.661 -169.737 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 47' ' ' PHE . . . . . . . . . . . . . 51.6 p90 -162.76 169.09 20.5 Favored 'General case' 0 C--O 1.238 0.492 0 C-N-CA 124.954 1.301 . . . . 0.0 108.887 167.852 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 48' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -157.23 162.21 39.25 Favored 'General case' 0 CA--C 1.541 0.608 0 C-N-CA 124.656 1.182 . . . . 0.0 108.673 164.731 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 49' ' ' GLY . . . . . . . . . . . . . . . -179.1 167.96 38.45 Favored Glycine 0 CA--C 1.532 1.109 0 CA-C-N 120.572 1.533 . . . . 0.0 113.156 171.104 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 50' ' ' GLU . . . . . . . . . . . . . 40.4 mt-10 -68.81 95.35 0.67 Allowed 'General case' 0 CA--C 1.534 0.329 0 C-N-CA 125.013 1.325 . . . . 0.0 110.193 170.473 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 51' ' ' GLY . . . . . . . . . . . . . . . -76.85 165.01 53.4 Favored Glycine 0 CA--C 1.529 0.951 0 N-CA-C 110.296 -1.122 . . . . 0.0 110.296 161.242 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 52' ' ' LYS . . . . . . . . . . . . . 62.3 tttt -168.85 137.01 2.03 Favored 'General case' 0 CA--C 1.517 -0.289 0 C-N-CA 126.833 2.053 . . . . 0.0 106.036 174.837 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 53' ' ' LEU . . . . . 0.464 HD12 ' N ' ' A' ' 54' ' ' SER . 16.1 tp -130.77 128.96 41.81 Favored 'General case' 0 CA--C 1.517 -0.316 0 CA-C-O 122.317 1.055 . . . . 0.0 110.391 -177.441 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 54' ' ' SER . . . . . 0.464 ' N ' HD12 ' A' ' 53' ' ' LEU . 21.1 t -144.94 -37.18 0.29 Allowed 'General case' 0 N--CA 1.443 -0.796 0 C-N-CA 125.433 1.493 . . . . 0.0 109.903 174.729 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 55' ' ' ASN . . . . . . . . . . . . . 65.9 t30 -121.64 23.23 10.31 Favored 'General case' 0 CA--C 1.538 0.502 0 C-N-CA 124.175 0.99 . . . . 0.0 113.647 -164.66 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 56' ' ' GLY . . . . . . . . . . . . . . . 78.03 5.28 86.9 Favored Glycine 0 CA--C 1.532 1.095 0 O-C-N 120.606 -1.309 . . . . 0.0 113.512 -176.089 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 57' ' ' GLU . . . . . . . . . . . . . 40.3 tt0 -123.67 148.6 46.36 Favored 'General case' 0 C--O 1.237 0.399 0 CA-C-N 118.612 1.206 . . . . 0.0 108.589 -174.13 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 58' ' ' LEU . . . . . . . . . . . . . 8.4 tp -132.51 138.83 47.67 Favored 'General case' 0 C--N 1.33 -0.251 0 C-N-CA 125.364 1.466 . . . . 0.0 110.54 178.421 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 59' ' ' THR . . . . . . . . . . . . . 1.6 p -125.82 167.11 15.66 Favored 'General case' 0 C--O 1.237 0.429 0 C-N-CA 125.76 1.624 . . . . 0.0 111.17 -176.66 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 60' ' ' ALA . . . . . . . . . . . . . . . -139.45 107.32 5.67 Favored 'General case' 0 CA--C 1.53 0.18 0 C-N-CA 125.505 1.522 . . . . 0.0 111.706 168.381 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 61' ' ' LYS . . . . . . . . . . . . . 24.7 tttt -72.55 77.23 1.07 Allowed 'General case' 0 CA--C 1.542 0.636 0 C-N-CA 124.027 0.931 . . . . 0.0 111.027 178.273 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 62' ' ' GLY . . . . . . . . . . . . . . . 124.29 -65.29 0.54 Allowed Glycine 0 N--CA 1.466 0.674 0 C-N-CA 125.68 1.61 . . . . 0.0 111.397 172.801 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 63' ' ' LEU . . . . . . . . . . . . . 6.0 tt 65.51 103.39 0.04 OUTLIER 'General case' 0 CA--C 1.535 0.4 0 C-N-CA 128.578 2.751 . . . . 0.0 114.243 174.003 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 64' ' ' ALA . . . . . . . . . . . . . . . -84.22 97.48 9.42 Favored 'General case' 0 CA--C 1.533 0.32 0 C-N-CA 126.759 2.024 . . . . 0.0 112.635 -169.693 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 65' ' ' MET . . . . . . . . . . . . . 3.0 mtt -98.2 -179.66 4.45 Favored 'General case' 0 CA--C 1.543 0.675 0 C-N-CA 124.684 1.194 . . . . 0.0 111.127 176.064 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 66' ' ' THR . . . . . . . . . . . . . 9.2 p -118.2 -163.89 0.98 Allowed 'General case' 0 CA--C 1.552 1.028 0 C-N-CA 125.989 1.715 . . . . 0.0 111.822 -179.744 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 67' ' ' ARG . . . . . . . . . . . . . 28.9 mmt180 -133.21 49.12 2.33 Favored 'General case' 0 CA--C 1.553 1.089 0 C-N-CA 126.296 1.838 . . . . 0.0 111.474 172.985 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 68' ' ' MET . . . . . . . . . . . . . 59.4 mtm -84.12 -175.0 5.59 Favored 'General case' 0 CA--C 1.544 0.743 0 C-N-CA 128.113 2.565 . . . . 0.0 110.612 167.942 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 69' ' ' MET . . . . . . . . . . . . . 1.4 pmm? -151.01 173.83 13.86 Favored 'General case' 0 N--CA 1.466 0.341 0 C-N-CA 126.255 1.822 . . . . 0.0 111.449 171.058 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 70' ' ' CYS . . . . . 1.283 ' SG ' ' SG ' ' A' ' 44' ' ' CYS . 86.0 m -141.36 148.05 39.04 Favored 'General case' 0 C--O 1.234 0.263 0 CA-C-O 122.041 0.924 . . . . 0.0 112.028 -169.74 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 71' ' ' ALA . . . . . . . . . . . . . . . -71.9 26.92 0.05 OUTLIER 'General case' 0 CA--C 1.543 0.705 0 C-N-CA 128.374 2.669 . . . . 0.0 112.265 175.927 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 72' ' ' ASN . . . . . . . . . . . . . 53.3 t-20 -146.96 141.38 15.92 Favored Pre-proline 0 CA--C 1.535 0.4 0 N-CA-C 103.859 -2.645 . . . . 0.0 103.859 156.114 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 73' ' ' PRO . . . . . . . . . . . . . 56.1 Cg_endo -83.94 -26.84 1.79 Allowed 'Trans proline' 0 N--CA 1.465 -0.158 0 C-N-CA 122.271 1.981 . . . . 0.0 111.759 -176.968 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 74' ' ' GLN . . . . . . . . . . . . . 11.2 tt0 -63.14 -26.18 68.7 Favored 'General case' 0 CA--C 1.538 0.508 0 O-C-N 121.669 -0.645 . . . . 0.0 110.852 179.807 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 75' ' ' LEU . . . . . . . . . . . . . 62.1 mt -69.45 -32.14 70.9 Favored 'General case' 0 N--CA 1.47 0.542 0 C-N-CA 123.71 0.804 . . . . 0.0 111.728 173.121 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 76' ' ' ASN . . . . . . . . . . . . . 2.1 t-20 -79.79 -20.87 45.17 Favored 'General case' 0 CA--C 1.531 0.237 0 C-N-CA 124.177 0.991 . . . . 0.0 111.261 -177.555 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 77' ' ' GLU . . . . . . . . . . . . . 4.3 mm-40 -78.49 -34.08 47.76 Favored 'General case' 0 CA--C 1.536 0.41 0 C-N-CA 123.944 0.898 . . . . 0.0 110.114 169.591 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 78' ' ' LEU . . . . . 0.417 HD12 ' HE2' ' A' ' 43' ' ' MET . 0.9 OUTLIER -57.05 -24.83 56.66 Favored 'General case' 0 C--N 1.345 0.407 0 O-C-N 121.513 -0.742 . . . . 0.0 111.869 176.369 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' A' A ' 79' ' ' ASP . . . . . . . . . . . . . 69.3 m-20 -64.35 -27.32 68.94 Favored 'General case' 0 N--CA 1.454 -0.273 0 C-N-CA 122.977 0.511 . . . . 0.0 111.991 -176.708 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 80' ' ' ASN . . . . . . . . . . . . . 10.7 p30 -101.76 -29.82 11.66 Favored 'General case' 0 N--CA 1.437 -1.106 0 CA-C-O 116.613 -1.661 . . . . 0.0 111.77 174.961 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 81' ' ' THR . . . . . . . . . . . . . 25.2 m -44.94 -74.42 0.04 OUTLIER 'General case' 0 CA--C 1.535 0.403 0 CA-C-N 119.164 0.893 . . . . 0.0 108.82 161.818 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 82' ' ' ILE . . . . . . . . . . . . . 5.2 tp -66.62 -34.58 71.02 Favored 'Isoleucine or valine' 0 N--CA 1.455 -0.205 0 O-C-N 121.012 -1.055 . . . . 0.0 111.448 -167.589 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 83' ' ' SER . . . . . . . . . . . . . 4.3 m -61.91 -45.07 95.34 Favored 'General case' 0 N--CA 1.445 -0.701 0 O-C-N 122.155 -0.341 . . . . 0.0 110.646 -177.662 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 84' ' ' GLU . . . . . . . . . . . . . 31.9 tt0 -77.94 -34.51 51.16 Favored 'General case' 0 N--CA 1.446 -0.669 0 CA-C-O 118.03 -0.986 . . . . 0.0 110.173 -178.032 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 85' ' ' MET . . . . . . . . . . . . . 86.8 mtp -54.64 -48.64 72.03 Favored 'General case' 0 C--N 1.343 0.297 0 CA-C-O 121.956 0.884 . . . . 0.0 108.728 174.709 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 86' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -76.63 -26.62 55.11 Favored 'General case' 0 N--CA 1.45 -0.457 0 CA-C-O 118.612 -0.708 . . . . 0.0 111.566 -176.648 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 87' ' ' LYS . . . . . . . . . . . . . 31.5 mttt -70.89 -38.14 73.03 Favored 'General case' 0 CA--C 1.532 0.284 0 CA-C-N 119.94 1.245 . . . . 0.0 108.938 178.203 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 88' ' ' GLU . . . . . . . . . . . . . 31.8 mm-40 -66.47 -63.79 1.0 Allowed 'General case' 0 CA--C 1.532 0.283 0 C-N-CA 125.274 1.43 . . . . 0.0 109.494 173.168 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 89' ' ' GLY . . . . . . . . . . . . . . . 135.55 99.22 0.58 Allowed Glycine 0 C--N 1.335 0.523 0 N-CA-C 107.517 -2.233 . . . . 0.0 107.517 -161.873 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 90' ' ' ALA . . . . . . . . . . . . . . . -90.47 139.88 30.26 Favored 'General case' 0 N--CA 1.455 -0.221 0 N-CA-C 108.996 -0.742 . . . . 0.0 108.996 -179.327 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 91' ' ' GLN . . . . . . . . . . . . . 41.9 mm-40 -78.63 134.99 37.11 Favored 'General case' 0 N--CA 1.442 -0.865 0 N-CA-C 106.075 -1.824 . . . . 0.0 106.075 174.916 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 92' ' ' VAL . . . . . 0.555 ' O ' HG11 ' A' ' 2' ' ' VAL . 24.2 t -130.14 98.0 3.6 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.476 0 C-N-CA 127.444 2.297 . . . . 0.0 106.144 -167.133 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 93' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -116.71 94.19 4.51 Favored 'General case' 0 C--O 1.235 0.335 0 CA-C-O 121.225 0.536 . . . . 0.0 110.317 -175.736 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 94' ' ' LEU . . . . . . . . . . . . . 1.5 tm? -93.2 106.66 18.6 Favored 'General case' 0 C--O 1.233 0.213 0 N-CA-C 108.479 -0.934 . . . . 0.0 108.479 174.856 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 95' ' ' THR . . . . . . . . . . . . . 5.8 t -85.55 -164.81 1.07 Allowed 'General case' 0 CA--C 1.543 0.69 0 C-N-CA 125.932 1.693 . . . . 0.0 108.724 171.108 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 96' ' ' ALA . . . . . . . . . . . . . . . -55.33 -22.74 20.38 Favored 'General case' 0 CA--C 1.545 0.775 0 N-CA-C 115.638 1.718 . . . . 0.0 115.638 -172.953 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 97' ' ' ASN . . . . . . . . . . . . . 0.0 OUTLIER -152.83 2.63 0.31 Allowed 'General case' 0 N--CA 1.477 0.922 0 CA-C-N 120.313 1.415 . . . . 0.0 113.941 176.395 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 98' ' ' GLN . . . . . . . . . . . . . 6.5 tt0 -140.14 136.37 33.44 Favored 'General case' 0 CA--C 1.53 0.211 0 O-C-N 120.423 -1.423 . . . . 0.0 109.525 -163.551 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 99' ' ' LEU . . . . . . . . . . . . . 20.2 tp -113.99 115.3 27.41 Favored 'General case' 0 N--CA 1.464 0.272 0 C-N-CA 126.84 2.056 . . . . 0.0 108.455 -172.468 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 100' ' ' THR . . . . . . . . . . . . . 0.9 OUTLIER -89.73 149.68 22.63 Favored 'General case' 0 CA--C 1.541 0.61 0 N-CA-C 104.787 -2.301 . . . . 0.0 104.787 177.044 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 101' ' ' LEU . . . . . . . . . . . . . 1.2 mm? -120.74 117.29 27.1 Favored 'General case' 0 N--CA 1.455 -0.189 0 C-N-CA 127.211 2.204 . . . . 0.0 106.583 163.125 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 102' ' ' ALA . . . . . . . . . . . . . . . -129.17 140.78 51.38 Favored 'General case' 0 N--CA 1.464 0.233 0 CA-C-N 119.406 1.003 . . . . 0.0 109.603 174.526 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 103' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -160.33 175.49 12.77 Favored 'General case' 0 N--CA 1.448 -0.554 0 C-N-CA 126.636 1.975 . . . . 0.0 108.336 171.599 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 104' ' ' ALA . . . . . . . . . . . . . . . -47.64 -36.34 10.82 Favored 'General case' 0 N--CA 1.453 -0.283 0 CA-C-O 117.549 -1.215 . . . . 0.0 112.855 173.391 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 105' ' ' LYS . . . . . 0.523 ' HE3' ' HA ' ' A' ' 105' ' ' LYS . 0.0 OUTLIER -55.98 -69.04 0.16 Allowed 'General case' 0 C--N 1.344 0.355 0 CA-C-N 120.004 1.274 . . . . 0.0 111.588 178.716 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' A' A ' 106' ' ' GLN . . . . . . . . . . . . . 10.2 pt20 -176.62 -164.95 0.12 Allowed 'General case' 0 C--N 1.329 -0.325 0 C-N-CA 127.303 2.241 . . . . 0.0 106.526 -174.69 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 107' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -135.42 138.9 43.7 Favored 'General case' 0 N--CA 1.443 -0.786 0 N-CA-C 107.663 -1.236 . . . . 0.0 107.663 -163.459 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 108' ' ' LEU . . . . . . . . . . . . . 1.1 mm? -133.58 162.84 30.81 Favored 'General case' 0 C--N 1.331 -0.226 0 C-N-CA 125.73 1.612 . . . . 0.0 107.401 174.039 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 109' ' ' THR . . . . . . . . . . . . . 81.1 m -139.64 116.7 11.07 Favored 'General case' 0 C--O 1.237 0.435 0 N-CA-C 108.307 -0.998 . . . . 0.0 108.307 174.746 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 110' ' ' TYR . . . . . . . . . . . . . 0.8 OUTLIER -94.68 157.04 16.14 Favored 'General case' 0 CA--C 1.536 0.409 0 C-N-CA 126.498 1.919 . . . . 0.0 109.012 177.731 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 111' ' ' LYS . . . . . 0.456 ' HE2' ' HG3' ' A' ' 15' ' ' GLU . 3.7 tppt? -102.02 150.69 22.98 Favored 'General case' 0 C--O 1.237 0.41 0 C-N-CA 126.795 2.038 . . . . 0.0 108.994 176.05 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 112' ' ' LEU . . . . . . . . . . . . . 44.4 tp -72.95 59.34 0.5 Allowed 'General case' 0 CA--C 1.54 0.58 0 C-N-CA 124.968 1.307 . . . . 0.0 108.649 158.967 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 113' ' ' ALA . . . . . 0.688 ' HB3' ' CG1' ' A' ' 13' ' ' VAL . . . -96.63 83.83 3.54 Favored 'General case' 0 C--N 1.328 -0.351 0 N-CA-C 106.112 -1.811 . . . . 0.0 106.112 164.97 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 114' ' ' ASP . . . . . . . . . . . . . 3.2 p-10 . . . . . 0 CA--C 1.53 0.183 0 C-N-CA 125.271 1.429 . . . . 0.0 111.886 -176.89 . . . . . . . . 0 0 . 1 . 007 nuclear build core ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 0.2 OUTLIER . . . . . 0 N--CA 1.451 -0.389 0 N-CA-C 109.099 -0.704 . . . . 0.0 109.099 . . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 2' ' ' VAL . . . . . . . . . . . . . 7.6 p -59.5 144.76 12.18 Favored 'Isoleucine or valine' 0 C--O 1.237 0.418 0 CA-C-O 120.879 0.371 . . . . 0.0 110.877 175.713 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 3' ' ' THR . . . . . . . . . . . . . 4.3 p -132.39 164.48 43.1 Favored Pre-proline 0 N--CA 1.453 -0.301 0 C-N-CA 124.508 1.123 . . . . 0.0 110.297 -178.064 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 4' ' ' PRO . . . . . . . . . . . . . 29.6 Cg_endo -66.15 -38.99 19.61 Favored 'Trans proline' 0 N--CA 1.462 -0.368 0 C-N-CA 122.559 2.173 . . . . 0.0 113.032 178.121 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 5' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -58.48 -47.48 83.92 Favored 'General case' 0 C--N 1.328 -0.353 0 C-N-CA 123.433 0.693 . . . . 0.0 110.907 -174.857 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 6' ' ' GLN . . . . . . . . . . . . . 3.8 pt20 -69.75 15.55 0.08 Allowed 'General case' 0 CA--C 1.541 0.603 0 C-N-CA 124.975 1.31 . . . . 0.0 114.048 176.161 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 7' ' ' LEU . . . . . . . . . . . . . 94.4 mt -130.3 -47.02 1.09 Allowed 'General case' 0 CA--C 1.529 0.17 0 C-N-CA 125.475 1.51 . . . . 0.0 110.882 -178.149 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 8' ' ' GLN . . . . . . . . . . . . . 7.1 mt-30 -60.77 -6.34 1.7 Allowed 'General case' 0 N--CA 1.479 1.012 0 N-CA-C 114.945 1.461 . . . . 0.0 114.945 -175.356 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 9' ' ' HIS . . . . . . . . . . . . . 10.7 m170 -126.94 13.29 7.32 Favored 'General case' 0 C--N 1.323 -0.554 0 C-N-CA 124.701 1.2 . . . . 0.0 111.359 -175.667 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 10' ' ' HIS . . . . . . . . . . . . . 73.8 m-70 -137.82 106.4 5.86 Favored 'General case' 0 CA--C 1.542 0.636 0 C-N-CA 124.466 1.107 . . . . 0.0 110.583 -161.341 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 11' ' ' ARG . . . . . . . . . . . . . 1.8 ttt180 -69.65 144.73 52.83 Favored 'General case' 0 N--CA 1.472 0.659 0 O-C-N 121.241 -0.912 . . . . 0.0 109.909 173.87 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 12' ' ' PHE . . . . . . . . . . . . . 39.4 m-85 -133.84 117.6 17.02 Favored 'General case' 0 N--CA 1.454 -0.26 0 C-N-CA 125.571 1.548 . . . . 0.0 107.709 177.584 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 13' ' ' VAL . . . . . 0.458 ' HA ' ' HA ' ' A' ' 30' ' ' GLU . 11.8 p -89.73 146.22 6.45 Favored 'Isoleucine or valine' 0 C--O 1.237 0.423 0 O-C-N 120.939 -1.101 . . . . 0.0 109.53 171.836 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 14' ' ' LEU . . . . . . . . . . . . . 25.0 tp -71.59 94.79 1.35 Allowed 'General case' 0 N--CA 1.453 -0.291 0 N-CA-C 107.572 -1.27 . . . . 0.0 107.572 173.078 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 4.3 mm-40 -61.89 -57.27 12.41 Favored 'General case' 0 N--CA 1.452 -0.327 0 N-CA-C 107.68 -1.23 . . . . 0.0 107.68 168.822 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 40.8 p -144.11 134.68 24.82 Favored 'General case' 0 N--CA 1.45 -0.457 0 N-CA-C 114.023 1.12 . . . . 0.0 114.023 -170.38 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 17' ' ' VAL . . . . . . . . . . . . . 65.9 t -72.52 165.07 3.16 Favored 'Isoleucine or valine' 0 C--O 1.24 0.577 0 N-CA-C 107.148 -1.427 . . . . 0.0 107.148 168.916 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 18' ' ' ASN . . . . . . . . . . . . . 0.0 OUTLIER -44.81 -39.56 5.4 Favored 'General case' 0 CA--C 1.534 0.33 0 C-N-CA 124.701 1.2 . . . . 0.0 112.185 174.776 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . -79.68 -81.11 0.76 Allowed Glycine 0 CA--C 1.526 0.734 0 C-N-CA 124.848 1.213 . . . . 0.0 110.609 177.565 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 37.7 mttt -141.99 166.29 22.46 Favored Pre-proline 0 CA--C 1.534 0.354 0 C-N-CA 127.057 2.143 . . . . 0.0 109.771 -173.517 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 21' ' ' PRO . . . . . . . . . . . . . 30.8 Cg_endo -58.14 168.54 3.54 Favored 'Trans proline' 0 N--CA 1.453 -0.865 0 C-N-CA 122.283 1.989 . . . . 0.0 113.042 172.58 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 22' ' ' VAL . . . . . . . . . . . . . 10.1 p -117.36 166.79 11.34 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.48 0 C-N-CA 127.31 2.244 . . . . 0.0 107.747 -179.45 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 23' ' ' THR . . . . . . . . . . . . . 39.7 m -131.14 156.35 45.42 Favored 'General case' 0 C--O 1.238 0.454 0 O-C-N 120.019 -1.676 . . . . 0.0 110.09 -177.772 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 24' ' ' SER . . . . . . . . . . . . . 1.7 p -154.98 136.15 13.94 Favored 'General case' 0 N--CA 1.435 -1.216 0 C-N-CA 125.806 1.642 . . . . 0.0 108.783 -162.379 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 25' ' ' ASP . . . . . . . . . . . . . 3.2 m-20 -71.14 63.33 0.33 Allowed 'General case' 0 C--N 1.32 -0.713 0 C-N-CA 124.936 1.295 . . . . 0.0 108.472 165.049 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 26' ' ' LYS . . . . . . . . . . . . . 31.0 tttp 62.79 4.9 1.57 Allowed 'General case' 0 CA--C 1.546 0.802 0 C-N-CA 124.329 1.052 . . . . 0.0 113.487 -179.554 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 27' ' ' ASN . . . . . . . . . . . . . 84.7 m-20 -127.2 76.54 76.26 Favored Pre-proline 0 C--O 1.239 0.525 0 C-N-CA 125.89 1.676 . . . . 0.0 108.306 -178.213 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 28' ' ' PRO . . . . . . . . . . . . . 85.4 Cg_endo -77.67 165.88 26.32 Favored 'Trans proline' 0 N--CA 1.461 -0.434 0 C-N-CA 124.078 3.186 . . . . 0.0 111.791 -176.42 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 29' ' ' PRO . . . . . . . . . . . . . 38.5 Cg_endo -66.89 83.41 0.32 Allowed 'Trans proline' 0 N--CA 1.452 -0.938 0 C-N-CA 122.789 2.326 . . . . 0.0 108.392 161.946 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 30' ' ' GLU . . . . . 0.458 ' HA ' ' HA ' ' A' ' 13' ' ' VAL . 12.9 pt-20 -91.67 163.73 13.99 Favored 'General case' 0 C--O 1.239 0.54 0 O-C-N 120.725 -1.235 . . . . 0.0 108.763 163.17 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 31' ' ' ILE . . . . . . . . . . . . . 12.1 tt -130.42 153.97 39.83 Favored 'Isoleucine or valine' 0 N--CA 1.449 -0.49 0 N-CA-C 106.06 -1.83 . . . . 0.0 106.06 171.806 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 32' ' ' SER . . . . . . . . . . . . . 3.6 t -144.86 172.46 13.0 Favored 'General case' 0 N--CA 1.445 -0.722 0 N-CA-C 107.074 -1.454 . . . . 0.0 107.074 167.765 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 33' ' ' PHE . . . . . . . . . . . . . 66.1 m-85 -136.12 163.07 31.19 Favored 'General case' 0 N--CA 1.445 -0.687 0 N-CA-C 107.027 -1.472 . . . . 0.0 107.027 -179.328 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 34' ' ' GLY . . . . . . . . . . . . . . . 167.54 113.95 0.29 Allowed Glycine 0 CA--C 1.495 -1.164 0 C-N-CA 118.226 -1.94 . . . . 0.0 114.639 172.263 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 35' ' ' GLU . . . . . . . . . . . . . 2.4 pt-20 77.12 140.57 0.07 Allowed 'General case' 0 N--CA 1.443 -0.787 1 C-N-CA 134.381 5.073 . . . . 0.0 106.845 -169.121 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 8.8 mtpm? 47.12 20.27 0.13 Allowed 'General case' 0 CA--C 1.544 0.733 0 N-CA-C 116.245 1.943 . . . . 0.0 116.245 176.167 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 37' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER 53.56 33.97 17.49 Favored 'General case' 0 C--N 1.331 -0.235 0 C-N-CA 126.418 1.887 . . . . 0.0 113.155 -167.964 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 38' ' ' MET . . . . . . . . . . . . . 0.1 OUTLIER -62.83 166.17 5.88 Favored 'General case' 0 N--CA 1.45 -0.451 0 N-CA-C 108.943 -0.762 . . . . 0.0 108.943 168.342 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 39' ' ' ILE . . . . . . . . . . . . . 9.1 mt -134.97 128.27 49.56 Favored 'Isoleucine or valine' 0 C--O 1.239 0.51 0 N-CA-C 107.471 -1.307 . . . . 0.0 107.471 -168.288 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 40' ' ' SER . . . . . . . . . . . . . 27.6 m -119.82 148.0 43.98 Favored 'General case' 0 CA--C 1.532 0.274 0 C-N-CA 124.735 1.214 . . . . 0.0 108.082 166.734 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 41' ' ' GLY . . . . . . . . . . . . . . . 173.23 178.61 43.34 Favored Glycine 0 CA--C 1.522 0.493 0 N-CA-C 109.725 -1.35 . . . . 0.0 109.725 -177.817 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 42' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -163.27 96.09 0.86 Allowed 'General case' 0 CA--C 1.536 0.418 0 O-C-N 121.942 -0.74 . . . . 0.0 110.863 -176.566 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 43' ' ' MET . . . . . . . . . . . . . 13.0 mmt -71.47 -68.73 0.43 Allowed 'General case' 0 N--CA 1.469 0.481 0 CA-C-N 118.456 0.571 . . . . 0.0 110.391 173.862 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 44' ' ' CYS . . . . . 1.286 ' SG ' ' SG ' ' A' ' 70' ' ' CYS . 45.6 t -135.59 -58.97 0.77 Allowed 'General case' 0 CA--C 1.527 0.089 0 N-CA-C 106.469 -1.678 . . . . 0.0 106.469 171.452 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 45' ' ' ASN . . . . . . . . . . . . . 25.7 m-20 -78.38 22.74 0.32 Allowed 'General case' 0 C--O 1.233 0.214 0 C-N-CA 126.811 2.044 . . . . 0.0 114.315 -175.118 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 46' ' ' ARG . . . . . . . . . . . . . 5.7 mpt_? 53.64 -173.85 0.04 OUTLIER 'General case' 0 C--O 1.225 -0.214 0 C-N-CA 124.028 0.931 . . . . 0.0 109.447 -163.737 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 47' ' ' PHE . . . . . . . . . . . . . 6.7 p90 -178.09 145.76 0.38 Allowed 'General case' 0 C--O 1.238 0.456 0 C-N-CA 126.399 1.88 . . . . 0.0 107.309 156.854 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 48' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -153.36 146.18 24.38 Favored 'General case' 0 C--N 1.324 -0.521 0 N-CA-C 107.749 -1.204 . . . . 0.0 107.749 177.23 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 49' ' ' GLY . . . . . . . . . . . . . . . -179.34 163.91 31.68 Favored Glycine 0 C--N 1.336 0.572 0 C-N-CA 120.398 -0.906 . . . . 0.0 112.615 179.133 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 50' ' ' GLU . . . . . . . . . . . . . 35.6 mt-10 -70.16 97.14 1.16 Allowed 'General case' 0 C--O 1.238 0.475 0 C-N-CA 124.809 1.244 . . . . 0.0 108.041 166.965 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 51' ' ' GLY . . . . . . . . . . . . . . . -72.08 175.58 41.97 Favored Glycine 0 CA--C 1.523 0.579 0 N-CA-C 110.416 -1.074 . . . . 0.0 110.416 155.888 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 52' ' ' LYS . . . . . . . . . . . . . 50.8 tttm -164.16 152.65 13.09 Favored 'General case' 0 C--N 1.332 -0.189 0 C-N-CA 125.795 1.638 . . . . 0.0 106.739 168.025 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 53' ' ' LEU . . . . . . . . . . . . . 46.2 tp -131.26 130.63 43.1 Favored 'General case' 0 C--O 1.232 0.179 0 C-N-CA 124.505 1.122 . . . . 0.0 109.169 170.813 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 40.1 t -139.37 -27.24 0.8 Allowed 'General case' 0 CA--C 1.535 0.399 0 C-N-CA 125.04 1.336 . . . . 0.0 111.292 177.832 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 55' ' ' ASN . . . . . . . . . . . . . 16.7 p-10 -146.41 17.96 1.34 Allowed 'General case' 0 CA--C 1.534 0.331 0 C-N-CA 124.486 1.114 . . . . 0.0 113.397 -153.319 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 56' ' ' GLY . . . . . . . . . . . . . . . 81.12 22.69 60.5 Favored Glycine 0 CA--C 1.525 0.692 0 CA-C-N 118.818 0.736 . . . . 0.0 112.958 -177.266 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 57' ' ' GLU . . . . . . . . . . . . . 35.8 tt0 -146.58 142.4 27.93 Favored 'General case' 0 C--O 1.237 0.425 0 C-N-CA 124.954 1.302 . . . . 0.0 109.183 -174.084 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 58' ' ' LEU . . . . . . . . . . . . . 57.9 tp -122.77 102.17 7.88 Favored 'General case' 0 CA--C 1.53 0.181 0 C-N-CA 127.115 2.166 . . . . 0.0 110.668 176.706 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 59' ' ' THR . . . . . . . . . . . . . 13.6 p -88.18 167.35 13.68 Favored 'General case' 0 CA--C 1.54 0.564 0 C-N-CA 124.611 1.164 . . . . 0.0 109.898 164.692 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 60' ' ' ALA . . . . . . . . . . . . . . . -132.23 107.54 8.65 Favored 'General case' 0 CA--C 1.528 0.131 0 C-N-CA 124.934 1.294 . . . . 0.0 109.574 163.069 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 61' ' ' LYS . . . . . . . . . . . . . 12.8 mttt -67.24 6.78 0.51 Allowed 'General case' 0 CA--C 1.54 0.585 0 N-CA-C 115.355 1.613 . . . . 0.0 115.355 -173.016 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 62' ' ' GLY . . . . . . . . . . . . . . . -150.35 -71.11 0.01 OUTLIER Glycine 0 CA--C 1.522 0.48 0 CA-C-N 120.818 1.645 . . . . 0.0 109.417 179.877 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 63' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER 60.55 89.75 0.07 Allowed 'General case' 0 N--CA 1.444 -0.728 0 C-N-CA 129.993 3.317 . . . . 0.0 113.261 179.304 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 64' ' ' ALA . . . . . . . . . . . . . . . -75.97 103.37 6.0 Favored 'General case' 0 C--O 1.236 0.393 0 C-N-CA 124.88 1.272 . . . . 0.0 111.239 -178.141 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 65' ' ' MET . . . . . . . . . . . . . 5.2 mtt -108.21 168.67 9.14 Favored 'General case' 0 N--CA 1.466 0.361 0 C-N-CA 124.0 0.92 . . . . 0.0 112.211 172.523 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 66' ' ' THR . . . . . . . . . . . . . 72.5 p -107.34 -163.96 0.94 Allowed 'General case' 0 CA--C 1.54 0.57 0 C-N-CA 126.392 1.877 . . . . 0.0 111.167 -176.474 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 67' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -141.01 84.26 1.92 Allowed 'General case' 0 N--CA 1.467 0.378 0 C-N-CA 124.282 1.033 . . . . 0.0 109.685 172.604 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 68' ' ' MET . . . . . . . . . . . . . 51.0 mtm -134.79 176.83 8.29 Favored 'General case' 0 C--N 1.324 -0.529 0 C-N-CA 129.566 3.147 . . . . 0.0 108.536 -178.641 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 69' ' ' MET . . . . . . . . . . . . . 1.6 pmm? -134.31 177.57 7.66 Favored 'General case' 0 N--CA 1.451 -0.392 0 C-N-CA 126.766 2.026 . . . . 0.0 109.872 170.114 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 70' ' ' CYS . . . . . 1.286 ' SG ' ' SG ' ' A' ' 44' ' ' CYS . 65.6 m -143.57 149.48 37.46 Favored 'General case' 0 C--N 1.33 -0.265 0 C-N-CA 126.37 1.868 . . . . 0.0 109.081 -170.037 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 71' ' ' ALA . . . . . . . . . . . . . . . -77.73 20.68 0.33 Allowed 'General case' 0 CA--C 1.539 0.524 0 N-CA-C 114.098 1.147 . . . . 0.0 114.098 -169.188 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 72' ' ' ASN . . . . . . . . . . . . . 21.8 t30 -147.22 142.26 16.73 Favored Pre-proline 0 C--O 1.236 0.393 0 N-CA-C 106.087 -1.82 . . . . 0.0 106.087 162.425 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 73' ' ' PRO . . . . . . . . . . . . . 30.4 Cg_endo -70.85 -21.98 27.71 Favored 'Trans proline' 0 C--N 1.346 0.399 0 C-N-CA 122.329 2.019 . . . . 0.0 112.621 -172.089 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 74' ' ' GLN . . . . . . . . . . . . . 39.0 tt0 -52.97 -38.3 62.04 Favored 'General case' 0 CA--C 1.534 0.332 0 C-N-CA 124.001 0.921 . . . . 0.0 111.581 -179.111 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 75' ' ' LEU . . . . . . . . . . . . . 32.5 mt -76.58 -31.37 57.46 Favored 'General case' 0 CA--C 1.533 0.312 0 C-N-CA 123.677 0.791 . . . . 0.0 111.732 -178.768 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 76' ' ' ASN . . . . . . . . . . . . . 3.2 t-20 -79.82 -14.34 58.75 Favored 'General case' 0 N--CA 1.469 0.52 0 C-N-CA 125.25 1.42 . . . . 0.0 110.991 179.975 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 77' ' ' GLU . . . . . . . . . . . . . 5.5 mm-40 -80.99 -44.83 17.53 Favored 'General case' 0 C--O 1.236 0.372 0 C-N-CA 126.265 1.826 . . . . 0.0 109.867 163.101 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 78' ' ' LEU . . . . . . . . . . . . . 23.9 mt -66.06 -36.21 82.61 Favored 'General case' 0 CA--C 1.51 -0.562 0 O-C-N 121.658 -0.651 . . . . 0.0 112.482 -171.822 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 79' ' ' ASP . . . . . . . . . . . . . 0.0 OUTLIER -61.65 -34.99 76.66 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-O 119.155 -0.45 . . . . 0.0 111.49 176.033 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 80' ' ' ASN . . . . . . . . . . . . . 11.2 t30 -75.61 -48.59 21.55 Favored 'General case' 0 N--CA 1.447 -0.591 0 N-CA-C 108.595 -0.891 . . . . 0.0 108.595 179.618 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 81' ' ' THR . . . . . . . . . . . . . 36.6 m -46.79 -59.8 2.82 Favored 'General case' 0 N--CA 1.449 -0.511 0 C-N-CA 125.175 1.39 . . . . 0.0 109.212 176.976 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 82' ' ' ILE . . . . . . . . . . . . . 4.6 tp -69.33 -34.77 64.25 Favored 'Isoleucine or valine' 0 C--O 1.237 0.407 0 O-C-N 121.615 -0.678 . . . . 0.0 111.914 -172.865 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 83' ' ' SER . . . . . . . . . . . . . 0.6 OUTLIER -58.94 -47.36 85.34 Favored 'General case' 0 N--CA 1.452 -0.365 0 N-CA-C 109.166 -0.679 . . . . 0.0 109.166 179.594 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 84' ' ' GLU . . . . . 0.443 ' OE1' ' HE2' ' A' ' 105' ' ' LYS . 16.8 tt0 -67.21 -42.8 83.51 Favored 'General case' 0 N--CA 1.447 -0.591 0 C-N-CA 124.453 1.101 . . . . 0.0 110.689 -179.163 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 85' ' ' MET . . . . . . . . . . . . . 48.4 mtp -59.66 -47.91 83.73 Favored 'General case' 0 C--N 1.343 0.317 0 CA-C-N 119.611 1.096 . . . . 0.0 110.115 -174.89 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 86' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -76.57 -20.3 56.96 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-O 118.824 -0.608 . . . . 0.0 112.114 -175.702 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 87' ' ' LYS . . . . . . . . . . . . . 3.3 tptt -71.93 -37.36 70.05 Favored 'General case' 0 N--CA 1.45 -0.43 0 N-CA-C 109.027 -0.731 . . . . 0.0 109.027 174.462 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 88' ' ' GLU . . . . . . . . . . . . . 89.2 mt-10 -89.24 -28.74 19.73 Favored 'General case' 0 C--O 1.233 0.218 0 CA-C-O 117.76 -1.114 . . . . 0.0 112.895 -173.106 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 89' ' ' GLY . . . . . . . . . . . . . . . 112.52 97.25 2.32 Favored Glycine 0 C--N 1.337 0.603 0 N-CA-C 109.483 -1.447 . . . . 0.0 109.483 -176.472 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 90' ' ' ALA . . . . . . . . . . . . . . . -78.89 128.86 33.88 Favored 'General case' 0 N--CA 1.449 -0.489 0 N-CA-C 108.02 -1.104 . . . . 0.0 108.02 174.514 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 91' ' ' GLN . . . . . . . . . . . . . 2.6 mp0 -62.8 140.65 58.78 Favored 'General case' 0 C--N 1.327 -0.402 0 N-CA-C 107.334 -1.358 . . . . 0.0 107.334 169.015 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 92' ' ' VAL . . . . . 0.464 ' HA ' HD22 ' A' ' 101' ' ' LEU . 25.4 t -126.45 114.6 38.85 Favored 'Isoleucine or valine' 0 N--CA 1.444 -0.753 0 C-N-CA 125.623 1.569 . . . . 0.0 108.14 -172.399 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 93' ' ' ASP . . . . . . . . . . . . . 14.4 m-20 -137.37 72.21 1.42 Allowed 'General case' 0 CA--C 1.538 0.486 0 C-N-CA 126.568 1.947 . . . . 0.0 106.709 -179.213 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 94' ' ' LEU . . . . . . . . . . . . . 0.9 OUTLIER -74.93 107.82 7.26 Favored 'General case' 0 N--CA 1.464 0.265 0 N-CA-C 106.694 -1.595 . . . . 0.0 106.694 168.311 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 95' ' ' THR . . . . . . . . . . . . . 2.2 t -71.93 -164.51 0.13 Allowed 'General case' 0 CA--C 1.54 0.564 0 C-N-CA 125.062 1.345 . . . . 0.0 108.313 172.127 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 96' ' ' ALA . . . . . . . . . . . . . . . -44.56 -49.26 10.2 Favored 'General case' 0 CA--C 1.543 0.68 0 O-C-N 121.26 -0.9 . . . . 0.0 112.725 -177.665 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 97' ' ' ASN . . . . . . . . . . . . . 31.3 p30 -157.66 28.44 0.28 Allowed 'General case' 0 CA--C 1.542 0.662 0 C-N-CA 125.707 1.603 . . . . 0.0 113.28 -174.529 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 98' ' ' GLN . . . . . . . . . . . . . 11.4 tt0 -137.72 121.91 18.05 Favored 'General case' 0 N--CA 1.466 0.329 0 C-N-CA 124.924 1.289 . . . . 0.0 107.953 173.822 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 99' ' ' LEU . . . . . . . . . . . . . 6.8 tp -69.43 123.63 21.77 Favored 'General case' 0 N--CA 1.451 -0.378 0 N-CA-C 105.793 -1.928 . . . . 0.0 105.793 172.666 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 100' ' ' THR . . . . . . . . . . . . . 3.7 m -121.64 113.82 20.29 Favored 'General case' 0 N--CA 1.452 -0.336 0 N-CA-C 105.698 -1.964 . . . . 0.0 105.698 172.478 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 101' ' ' LEU . . . . . 0.464 HD22 ' HA ' ' A' ' 92' ' ' VAL . 0.2 OUTLIER -121.01 150.76 40.64 Favored 'General case' 0 C--O 1.234 0.271 0 N-CA-C 107.345 -1.354 . . . . 0.0 107.345 -177.387 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' A' A ' 102' ' ' ALA . . . . . . . . . . . . . . . -144.86 161.37 39.47 Favored 'General case' 0 C--N 1.33 -0.277 0 C-N-CA 124.988 1.315 . . . . 0.0 108.595 172.745 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 103' ' ' THR . . . . . 0.452 HG22 ' H ' ' A' ' 104' ' ' ALA . 2.9 m -155.78 -168.14 2.7 Favored 'General case' 0 N--CA 1.446 -0.656 0 C-N-CA 127.404 2.282 . . . . 0.0 105.331 170.178 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 104' ' ' ALA . . . . . 0.452 ' H ' HG22 ' A' ' 103' ' ' THR . . . -57.42 -46.56 83.37 Favored 'General case' 0 CA--C 1.535 0.396 0 O-C-N 120.313 -1.492 . . . . 0.0 110.971 161.874 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 105' ' ' LYS . . . . . 0.443 ' HE2' ' OE1' ' A' ' 84' ' ' GLU . 3.3 tmtt? -49.61 -64.8 0.7 Allowed 'General case' 0 N--CA 1.465 0.298 0 C-N-CA 125.257 1.423 . . . . 0.0 113.056 -170.685 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 106' ' ' GLN . . . . . . . . . . . . . 3.5 pt20 -166.83 -167.78 1.02 Allowed 'General case' 0 CA--C 1.536 0.411 0 C-N-CA 126.092 1.757 . . . . 0.0 108.437 -175.838 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 107' ' ' THR . . . . . . . . . . . . . 0.5 OUTLIER -124.0 149.05 46.47 Favored 'General case' 0 CA--C 1.533 0.324 0 N-CA-C 107.504 -1.295 . . . . 0.0 107.504 168.672 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 108' ' ' LEU . . . . . . . . . . . . . 9.5 mp -120.35 157.16 29.84 Favored 'General case' 0 C--O 1.239 0.53 0 C-N-CA 126.362 1.865 . . . . 0.0 108.979 178.307 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 109' ' ' THR . . . . . . . . . . . . . 3.5 m -136.69 93.4 2.86 Favored 'General case' 0 C--O 1.238 0.479 0 N-CA-C 108.935 -0.765 . . . . 0.0 108.935 176.14 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 110' ' ' TYR . . . . . . . . . . . . . 34.5 m-85 -90.21 155.92 18.68 Favored 'General case' 0 CA--C 1.534 0.337 0 CA-C-O 121.168 0.509 . . . . 0.0 109.795 172.451 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 111' ' ' LYS . . . . . . . . . . . . . 0.3 OUTLIER -108.83 143.66 37.73 Favored 'General case' 0 CA--C 1.518 -0.271 0 C-N-CA 124.857 1.263 . . . . 0.0 108.145 178.426 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 112' ' ' LEU . . . . . . . . . . . . . 45.8 tp -70.45 68.17 0.36 Allowed 'General case' 0 CA--C 1.543 0.689 0 C-N-CA 125.155 1.382 . . . . 0.0 109.578 168.158 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 113' ' ' ALA . . . . . . . . . . . . . . . -100.26 75.24 1.8 Allowed 'General case' 0 N--CA 1.464 0.265 0 N-CA-C 106.571 -1.64 . . . . 0.0 106.571 -179.956 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 114' ' ' ASP . . . . . . . . . . . . . 42.6 t0 . . . . . 0 C--N 1.326 -0.414 0 CA-C-O 121.539 0.685 . . . . 0.0 110.802 -160.256 . . . . . . . . 0 0 . 1 . 008 nuclear build core ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 1.4 pmm? . . . . . 0 CA--C 1.536 0.427 0 N-CA-C 109.437 -0.579 . . . . 0.0 109.437 . . . . . . . . . 0 0 . 1 . 008 nuclear build core ' A' A ' 2' ' ' VAL . . . . . . . . . . . . . 6.7 p -72.34 153.37 7.74 Favored 'Isoleucine or valine' 0 C--O 1.236 0.357 0 N-CA-C 109.363 -0.606 . . . . 0.0 109.363 174.202 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 3' ' ' THR . . . . . . . . . . . . . 0.5 OUTLIER -132.79 159.15 73.74 Favored Pre-proline 0 CA--C 1.532 0.25 0 C-N-CA 124.053 0.941 . . . . 0.0 109.976 171.829 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 4' ' ' PRO . . . . . . . . . . . . . 55.4 Cg_endo -64.77 -34.28 50.63 Favored 'Trans proline' 0 C--N 1.345 0.358 0 C-N-CA 123.102 2.534 . . . . 0.0 111.341 -176.728 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 5' ' ' GLU . . . . . . . . . . . . . 19.2 tt0 -52.21 -55.31 21.94 Favored 'General case' 0 N--CA 1.449 -0.476 0 C-N-CA 125.471 1.508 . . . . 0.0 110.146 175.636 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 6' ' ' GLN . . . . . . . . . . . . . 11.8 pt20 -70.14 20.79 0.04 OUTLIER 'General case' 0 CA--C 1.543 0.694 0 N-CA-C 114.243 1.201 . . . . 0.0 114.243 176.039 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 7' ' ' LEU . . . . . . . . . . . . . 76.0 mt -129.54 -56.1 1.15 Allowed 'General case' 0 N--CA 1.461 0.119 0 C-N-CA 124.87 1.268 . . . . 0.0 110.922 178.435 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 8' ' ' GLN . . . . . . . . . . . . . 28.2 mt-30 -44.59 -8.73 0.01 OUTLIER 'General case' 0 N--CA 1.474 0.759 0 C-N-CA 129.257 3.023 . . . . 0.0 117.969 -178.159 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 9' ' ' HIS . . . . . . . . . . . . . 19.4 p80 -148.88 35.72 0.77 Allowed 'General case' 0 C--N 1.325 -0.473 0 C-N-CA 123.531 0.733 . . . . 0.0 112.276 177.651 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 10' ' ' HIS . . . . . . . . . . . . . 91.5 m-70 -130.86 165.1 23.77 Favored 'General case' 0 C--O 1.235 0.3 0 CA-C-O 121.626 0.727 . . . . 0.0 110.695 174.972 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 11' ' ' ARG . . . . . . . . . . . . . 60.3 ttt180 -128.94 139.46 52.1 Favored 'General case' 0 C--O 1.235 0.317 0 C-N-CA 126.252 1.821 . . . . 0.0 107.057 -173.606 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 12' ' ' PHE . . . . . . . . . . . . . 45.0 m-85 -137.43 112.28 8.93 Favored 'General case' 0 N--CA 1.441 -0.883 0 C-N-CA 125.181 1.392 . . . . 0.0 107.341 -164.684 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 13' ' ' VAL . . . . . . . . . . . . . 2.8 t -103.67 144.31 14.31 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.482 0 N-CA-C 106.709 -1.589 . . . . 0.0 106.709 -174.401 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 14' ' ' LEU . . . . . . . . . . . . . 11.5 tp -79.08 96.08 5.71 Favored 'General case' 0 N--CA 1.449 -0.494 0 N-CA-C 109.513 -0.551 . . . . 0.0 109.513 -169.834 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 1.4 mm-40 -76.3 -39.14 54.95 Favored 'General case' 0 N--CA 1.452 -0.344 0 CA-C-O 118.46 -0.781 . . . . 0.0 111.292 -170.943 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 2.6 t -156.03 156.73 34.92 Favored 'General case' 0 C--O 1.237 0.417 0 CA-C-N 119.721 1.146 . . . . 0.0 111.126 161.126 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 17' ' ' VAL . . . . . . . . . . . . . 21.3 t -86.3 171.66 1.12 Allowed 'Isoleucine or valine' 0 CA--C 1.534 0.331 0 C-N-CA 126.017 1.727 . . . . 0.0 107.504 172.519 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 18' ' ' ASN . . . . . . . . . . . . . 20.6 t30 -53.16 -35.59 59.95 Favored 'General case' 0 CA--C 1.53 0.195 0 C-N-CA 124.304 1.041 . . . . 0.0 112.494 166.393 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . -93.97 -54.16 1.67 Allowed Glycine 0 CA--C 1.525 0.659 0 C-N-CA 123.755 0.693 . . . . 0.0 112.806 -170.336 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 16.6 ptpt -160.0 163.83 21.45 Favored Pre-proline 0 N--CA 1.465 0.307 0 C-N-CA 125.665 1.586 . . . . 0.0 108.806 -174.723 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 21' ' ' PRO . . . . . . . . . . . . . 59.1 Cg_endo -70.93 171.21 16.2 Favored 'Trans proline' 0 N--CA 1.454 -0.815 0 CA-C-N 120.806 1.324 . . . . 0.0 110.973 170.67 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 22' ' ' VAL . . . . . . . . . . . . . 2.7 p -135.56 136.31 50.73 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.369 0 C-N-CA 126.552 1.941 . . . . 0.0 107.155 -178.155 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 23' ' ' THR . . . . . . . . . . . . . 0.8 OUTLIER -144.92 123.99 12.83 Favored 'General case' 0 C--O 1.238 0.459 0 N-CA-C 107.005 -1.48 . . . . 0.0 107.005 -175.398 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 24' ' ' SER . . . . . . . . . . . . . 14.7 m -123.26 41.25 3.52 Favored 'General case' 0 C--O 1.235 0.333 0 C-N-CA 124.957 1.303 . . . . 0.0 110.146 -163.958 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 25' ' ' ASP . . . . . . . . . . . . . 38.7 m-20 62.45 -78.46 0.03 OUTLIER 'General case' 0 C--O 1.234 0.254 0 C-N-CA 127.972 2.509 . . . . 0.0 108.582 -167.953 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 26' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -131.4 -8.58 3.72 Favored 'General case' 0 CA--C 1.523 -0.067 0 N-CA-C 115.684 1.735 . . . . 0.0 115.684 178.198 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 27' ' ' ASN . . . . . . . . . . . . . 13.2 m120 -115.41 75.91 4.92 Favored Pre-proline 0 N--CA 1.471 0.595 0 CA-C-N 120.167 1.349 . . . . 0.0 111.328 -175.624 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 28' ' ' PRO . . . . . . . . . . . . . 49.0 Cg_endo -66.53 162.41 36.93 Favored 'Trans proline' 0 CA--C 1.539 0.769 0 C-N-CA 123.392 2.728 . . . . 0.0 113.051 -177.611 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 29' ' ' PRO . . . . . . . . . . . . . 19.5 Cg_endo -66.04 64.85 0.45 Allowed 'Trans proline' 0 CA--C 1.54 0.802 0 C-N-CA 125.088 3.859 . . . . 0.0 113.443 170.833 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 30' ' ' GLU . . . . . . . . . . . . . 10.8 pt-20 -76.38 169.77 17.62 Favored 'General case' 0 CA--C 1.544 0.733 0 O-C-N 119.709 -1.869 . . . . 0.0 111.301 177.779 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 31' ' ' ILE . . . . . . . . . . . . . 16.8 tt -139.04 159.77 29.54 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.406 0 C-N-CA 127.212 2.205 . . . . 0.0 107.013 170.96 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 32' ' ' SER . . . . . . . . . . . . . 45.4 p -149.33 177.02 10.04 Favored 'General case' 0 N--CA 1.444 -0.773 0 C-N-CA 125.747 1.619 . . . . 0.0 107.345 167.453 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 33' ' ' PHE . . . . . . . . . . . . . 39.8 m-85 -134.65 148.8 50.45 Favored 'General case' 0 N--CA 1.447 -0.575 0 N-CA-C 106.458 -1.682 . . . . 0.0 106.458 175.284 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 34' ' ' GLY . . . . . . . . . . . . . . . -163.68 -176.23 35.4 Favored Glycine 0 N--CA 1.445 -0.749 0 N-CA-C 107.453 -2.259 . . . . 0.0 107.453 178.419 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 35' ' ' GLU . . . . . . . . . . . . 0.275 1.9 mt-10 47.36 -162.95 0.03 OUTLIER 'General case' 0 CA--C 1.538 0.506 0 C-N-CA 124.569 1.148 . . . . 0.0 110.083 -171.329 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 6.6 mmpt? -69.29 56.15 0.11 Allowed 'General case' 0 CA--C 1.546 0.791 0 O-C-N 119.207 -2.183 . . . . 0.0 112.644 -174.499 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 37' ' ' MET . . . . . . . . . . . . . 79.4 mmm 46.89 86.69 0.02 OUTLIER 'General case' 0 CA--C 1.539 0.549 0 C-N-CA 126.055 1.742 . . . . 0.0 110.401 -156.698 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 38' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -123.6 4.29 8.94 Favored 'General case' 0 N--CA 1.476 0.836 0 N-CA-C 114.062 1.134 . . . . 0.0 114.062 -175.489 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 39' ' ' ILE . . . . . . . . . . . . . 24.2 mt 46.92 133.47 0.0 OUTLIER 'Isoleucine or valine' 0 CA--C 1.539 0.555 1 C-N-CA 133.135 4.574 . . . . 0.0 111.963 179.888 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 40' ' ' SER . . . . . . . . . . . . . 8.3 m -140.2 101.95 4.26 Favored 'General case' 0 C--N 1.329 -0.31 0 O-C-N 120.163 -1.585 . . . . 0.0 107.227 178.792 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 41' ' ' GLY . . . . . . . . . . . . . . . -145.2 174.2 25.33 Favored Glycine 0 C--N 1.336 0.579 0 CA-C-N 118.841 0.746 . . . . 0.0 112.558 179.286 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 42' ' ' SER . . . . . . . . . . . . . 13.3 p -149.79 85.44 1.42 Allowed 'General case' 0 N--CA 1.451 -0.388 0 C-N-CA 123.108 0.563 . . . . 0.0 110.665 -178.635 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 43' ' ' MET . . . . . . . . . . . . . 3.4 mmt -59.52 -46.5 88.66 Favored 'General case' 0 N--CA 1.462 0.158 0 CA-C-O 122.081 0.943 . . . . 0.0 108.61 167.675 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 44' ' ' CYS . . . . . 1.305 ' SG ' ' SG ' ' A' ' 70' ' ' CYS . 36.5 t -149.32 -66.87 0.22 Allowed 'General case' 0 N--CA 1.442 -0.869 0 C-N-CA 125.178 1.391 . . . . 0.0 107.311 161.363 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 45' ' ' ASN . . . . . . . . . . . . . 3.0 m120 -87.23 22.42 2.11 Favored 'General case' 0 C--N 1.327 -0.387 0 C-N-CA 124.244 1.018 . . . . 0.0 111.884 -155.792 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 46' ' ' ARG . . . . . . . . . . . . . 7.0 mmm180 51.41 162.26 0.0 OUTLIER 'General case' 0 N--CA 1.465 0.291 0 C-N-CA 127.461 2.304 . . . . 0.0 113.09 -162.853 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 47' ' ' PHE . . . . . . . . . . . . . 49.6 p90 -163.64 163.74 24.26 Favored 'General case' 0 C--N 1.324 -0.521 0 C-N-CA 124.826 1.251 . . . . 0.0 109.521 170.03 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 48' ' ' SER . . . . . . . . . . . . . 6.2 m -158.79 165.66 33.75 Favored 'General case' 0 N--CA 1.44 -0.94 0 C-N-CA 126.866 2.066 . . . . 0.0 108.113 173.134 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 49' ' ' GLY . . . . . . . . . . . . . . . -178.59 167.71 38.32 Favored Glycine 0 CA--C 1.519 0.31 0 N-CA-C 110.354 -1.098 . . . . 0.0 110.354 166.981 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 50' ' ' GLU . . . . . . . . . . . . . 32.6 mt-10 -61.69 98.46 0.09 Allowed 'General case' 0 C--N 1.33 -0.253 0 N-CA-C 109.3 -0.629 . . . . 0.0 109.3 176.621 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 51' ' ' GLY . . . . . . . . . . . . . . . -60.14 -67.91 1.93 Allowed Glycine 0 C--N 1.335 0.475 0 O-C-N 124.485 1.116 . . . . 0.0 110.998 -176.94 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 52' ' ' LYS . . . . . . . . . . . . . 0.4 OUTLIER 64.49 164.27 0.14 Allowed 'General case' 0 N--CA 1.453 -0.282 0 C-N-CA 125.173 1.389 . . . . 0.0 109.187 -166.73 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 53' ' ' LEU . . . . . . . . . . . . . 5.9 tp -164.58 111.08 1.02 Allowed 'General case' 0 N--CA 1.45 -0.435 0 N-CA-C 107.429 -1.322 . . . . 0.0 107.429 164.065 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 1.4 t -148.95 -11.59 0.32 Allowed 'General case' 0 C--O 1.234 0.282 0 CA-C-O 117.561 -1.209 . . . . 0.0 112.701 178.087 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 55' ' ' ASN . . . . . . . . . . . . . 0.8 OUTLIER -156.96 46.87 0.42 Allowed 'General case' 0 CA--C 1.538 0.501 0 C-N-CA 124.897 1.279 . . . . 0.0 109.347 -170.201 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 56' ' ' GLY . . . . . . . . . . . . . . . 66.65 5.87 32.87 Favored Glycine 0 CA--C 1.533 1.192 0 N-CA-C 115.968 1.147 . . . . 0.0 115.968 170.425 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 57' ' ' GLU . . . . . . . . . . . . . 18.3 tt0 -132.6 110.61 10.56 Favored 'General case' 0 C--O 1.239 0.504 0 CA-C-N 118.579 1.189 . . . . 0.0 109.183 -164.633 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 58' ' ' LEU . . . . . . . . . . . . . 27.2 tp -89.69 104.44 17.0 Favored 'General case' 0 C--O 1.234 0.267 0 C-N-CA 126.364 1.866 . . . . 0.0 108.148 177.912 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 59' ' ' THR . . . . . . . . . . . . . 0.8 OUTLIER -91.72 168.91 11.14 Favored 'General case' 0 C--N 1.327 -0.393 0 CA-C-O 121.809 0.814 . . . . 0.0 110.302 169.706 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 60' ' ' ALA . . . . . . . . . . . . . . . -123.52 131.62 53.68 Favored 'General case' 0 N--CA 1.45 -0.426 0 N-CA-C 107.173 -1.417 . . . . 0.0 107.173 148.593 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 61' ' ' LYS . . . . . . . . . . . . . 24.3 ttmt -79.54 82.6 5.64 Favored 'General case' 0 N--CA 1.454 -0.24 0 N-CA-C 107.841 -1.17 . . . . 0.0 107.841 173.909 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 62' ' ' GLY . . . . . . . . . . . . . . . 103.99 -48.68 0.98 Allowed Glycine 0 CA--C 1.529 0.958 0 CA-C-O 118.827 -0.985 . . . . 0.0 113.044 174.402 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 63' ' ' LEU . . . . . . . . . . . . . 3.5 tp 64.88 106.29 0.03 OUTLIER 'General case' 0 N--CA 1.442 -0.86 0 C-N-CA 130.804 3.642 . . . . 0.0 113.777 -176.789 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 64' ' ' ALA . . . . . . . . . . . . . . . -77.69 146.25 36.13 Favored 'General case' 0 CA--C 1.533 0.291 0 N-CA-C 108.961 -0.755 . . . . 0.0 108.961 171.206 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 65' ' ' MET . . . . . . . . . . . . . 76.0 mtp -140.83 -164.91 1.83 Allowed 'General case' 0 CA--C 1.542 0.668 0 C-N-CA 126.58 1.952 . . . . 0.0 108.491 179.261 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 66' ' ' THR . . . . . . . . . . . . . 27.2 p -130.76 -165.89 1.62 Allowed 'General case' 0 N--CA 1.472 0.625 0 CA-C-N 120.062 1.301 . . . . 0.0 109.909 168.149 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 67' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -136.55 76.92 1.62 Allowed 'General case' 0 C--O 1.233 0.188 0 C-N-CA 126.167 1.787 . . . . 0.0 108.822 -179.199 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 68' ' ' MET . . . . . . . . . . . . . 15.3 ptp -124.51 158.23 33.41 Favored 'General case' 0 CA--C 1.533 0.323 0 C-N-CA 124.297 1.039 . . . . 0.0 111.97 -177.028 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 69' ' ' MET . . . . . . . . . . . . . 0.1 OUTLIER -73.97 162.31 29.18 Favored 'General case' 0 CA--C 1.533 0.305 0 C-N-CA 123.643 0.777 . . . . 0.0 109.424 171.432 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 70' ' ' CYS . . . . . 1.305 ' SG ' ' SG ' ' A' ' 44' ' ' CYS . 1.2 m -119.01 -179.53 3.85 Favored 'General case' 0 CA--C 1.537 0.476 0 C-N-CA 126.284 1.834 . . . . 0.0 108.692 161.551 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 71' ' ' ALA . . . . . . . . . . . . . . . -82.79 -26.6 31.65 Favored 'General case' 0 CA--C 1.535 0.393 0 C-N-CA 124.555 1.142 . . . . 0.0 111.615 166.012 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 72' ' ' ASN . . . . . . . . . . . . . 1.2 m-20 -119.97 152.67 54.43 Favored Pre-proline 0 N--CA 1.467 0.397 0 C-N-CA 123.962 0.905 . . . . 0.0 110.474 -172.167 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 73' ' ' PRO . . . . . . . . . . . . . 49.0 Cg_endo -70.39 -46.2 1.04 Allowed 'Trans proline' 0 N--CA 1.458 -0.585 0 C-N-CA 124.008 3.138 . . . . 0.0 111.198 173.146 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 74' ' ' GLN . . . . . . . . . . . . . 64.3 tt0 -51.31 -35.34 37.38 Favored 'General case' 0 C--O 1.221 -0.424 0 C-N-CA 123.569 0.748 . . . . 0.0 110.85 -174.172 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 75' ' ' LEU . . . . . 0.402 ' HB3' ' HB2' ' A' ' 44' ' ' CYS . 87.5 mt -66.33 -38.88 88.7 Favored 'General case' 0 CA--C 1.538 0.519 0 C-N-CA 123.686 0.794 . . . . 0.0 111.701 -177.373 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 76' ' ' ASN . . . . . . . . . . . . . 3.0 m-80 -79.07 -20.46 48.74 Favored 'General case' 0 N--CA 1.475 0.791 0 CA-C-N 119.506 1.048 . . . . 0.0 111.478 174.994 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 77' ' ' GLU . . . . . . . . . . . . . 0.7 OUTLIER -65.48 -38.18 89.02 Favored 'General case' 0 CA--C 1.545 0.766 0 O-C-N 121.056 -1.027 . . . . 0.0 109.48 164.918 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 78' ' ' LEU . . . . . . . . . . . . . 32.4 mt -80.34 -17.62 51.47 Favored 'General case' 0 N--CA 1.453 -0.3 0 CA-C-O 118.039 -0.982 . . . . 0.0 113.364 -174.847 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 79' ' ' ASP . . . . . . . . . . . . . 4.8 t70 -46.72 -57.52 4.76 Favored 'General case' 0 N--CA 1.469 0.476 0 C-N-CA 125.165 1.386 . . . . 0.0 109.406 162.511 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 80' ' ' ASN . . . . . . . . . . . . . 69.8 m-80 -74.48 -36.8 63.3 Favored 'General case' 0 N--CA 1.448 -0.544 0 CA-C-N 115.258 -0.883 . . . . 0.0 108.973 -171.818 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 81' ' ' THR . . . . . . . . . . . . . 28.0 m -54.49 -51.03 66.36 Favored 'General case' 0 CA--C 1.54 0.579 0 C-N-CA 124.052 0.941 . . . . 0.0 110.117 177.679 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 82' ' ' ILE . . . . . . . . . . . . . 7.0 tp -73.86 -33.27 36.7 Favored 'Isoleucine or valine' 0 C--N 1.345 0.385 0 CA-C-N 119.719 1.145 . . . . 0.0 111.015 -179.251 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 83' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -58.4 -53.24 60.58 Favored 'General case' 0 C--O 1.236 0.371 0 N-CA-C 108.832 -0.803 . . . . 0.0 108.832 178.713 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 84' ' ' GLU . . . . . . . . . . . . . 14.2 tp10 -75.6 -3.01 31.97 Favored 'General case' 0 CA--C 1.542 0.64 0 C-N-CA 124.873 1.269 . . . . 0.0 112.07 -174.667 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 85' ' ' MET . . . . . . . . . . . . . 84.7 mtp -107.45 -5.16 17.83 Favored 'General case' 0 CA--C 1.535 0.383 0 C-N-CA 124.338 1.055 . . . . 0.0 113.212 174.307 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 86' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -105.55 -22.86 12.9 Favored 'General case' 0 N--CA 1.475 0.802 0 CA-C-N 120.639 1.563 . . . . 0.0 111.628 173.818 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 87' ' ' LYS . . . . . . . . . . . . . 8.1 tttm -68.36 -44.6 74.88 Favored 'General case' 0 CA--C 1.543 0.707 0 N-CA-C 110.172 -0.307 . . . . 0.0 110.172 -169.035 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 88' ' ' GLU . . . . . . . . . . . . . 35.4 mt-10 -82.36 -14.67 54.89 Favored 'General case' 0 N--CA 1.468 0.425 0 C-N-CA 126.562 1.945 . . . . 0.0 112.265 177.581 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 89' ' ' GLY . . . . . . . . . . . . . . . 98.54 105.03 2.49 Favored Glycine 0 C--N 1.337 0.617 0 N-CA-C 110.572 -1.011 . . . . 0.0 110.572 -175.934 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 90' ' ' ALA . . . . . . . . . . . . . . . -74.16 138.08 43.58 Favored 'General case' 0 C--O 1.232 0.15 0 N-CA-C 108.596 -0.89 . . . . 0.0 108.596 171.57 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 91' ' ' GLN . . . . . . . . . . . . . 0.4 OUTLIER -64.81 129.05 38.3 Favored 'General case' 0 C--O 1.239 0.542 0 N-CA-C 105.231 -2.137 . . . . 0.0 105.231 161.039 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 92' ' ' VAL . . . . . . . . . . . . . 7.6 p -125.53 107.69 18.31 Favored 'Isoleucine or valine' 0 N--CA 1.447 -0.588 0 N-CA-C 106.762 -1.57 . . . . 0.0 106.762 -170.235 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 93' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -122.17 81.63 1.86 Allowed 'General case' 0 C--N 1.324 -0.521 0 N-CA-C 106.716 -1.587 . . . . 0.0 106.716 -179.213 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 94' ' ' LEU . . . . . . . . . . . . . 2.3 tm? -82.9 98.52 9.24 Favored 'General case' 0 CA--C 1.51 -0.572 0 N-CA-C 106.034 -1.839 . . . . 0.0 106.034 166.961 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 95' ' ' THR . . . . . . . . . . . . . 3.1 m -83.05 170.87 14.38 Favored 'General case' 0 C--N 1.316 -0.868 0 CA-C-N 112.195 -2.275 . . . . 0.0 106.182 172.501 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 96' ' ' ALA . . . . . . . . . . . . . . . -44.84 -32.63 1.64 Allowed 'General case' 0 CA--C 1.545 0.761 0 N-CA-C 116.395 1.998 . . . . 0.0 116.395 -160.877 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 97' ' ' ASN . . . . . . . . . . . . . 0.2 OUTLIER -141.11 9.69 2.12 Favored 'General case' 0 N--CA 1.472 0.665 0 CA-C-N 120.74 1.609 . . . . 0.0 113.035 173.16 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 98' ' ' GLN . . . . . . . . . . . . . 12.9 tt0 -143.5 129.79 19.87 Favored 'General case' 0 CA--C 1.52 -0.182 0 O-C-N 120.484 -1.385 . . . . 0.0 109.216 -169.874 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 99' ' ' LEU . . . . . 0.677 HD22 ' CD2' ' A' ' 101' ' ' LEU . 0.4 OUTLIER -91.34 123.12 34.54 Favored 'General case' 0 N--CA 1.444 -0.765 0 C-N-CA 125.298 1.439 . . . . 0.0 109.045 179.642 . . . . . . . . 3 3 . 1 . 008 nuclear build core ' A' A ' 100' ' ' THR . . . . . . . . . . . . . 79.7 m -98.87 115.87 29.82 Favored 'General case' 0 C--N 1.323 -0.584 0 C-N-CA 125.883 1.673 . . . . 0.0 106.495 165.83 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 101' ' ' LEU . . . . . 0.677 ' CD2' HD22 ' A' ' 99' ' ' LEU . 1.4 mm? -110.7 126.22 54.31 Favored 'General case' 0 CA--C 1.501 -0.924 0 N-CA-C 106.649 -1.612 . . . . 0.0 106.649 171.356 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 102' ' ' ALA . . . . . . . . . . . . . . . -138.02 153.21 49.4 Favored 'General case' 0 C--N 1.323 -0.545 0 O-C-N 124.396 1.06 . . . . 0.0 109.807 174.171 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 103' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -160.51 174.08 14.59 Favored 'General case' 0 N--CA 1.443 -0.78 0 C-N-CA 126.026 1.731 . . . . 0.0 108.04 177.526 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 104' ' ' ALA . . . . . . . . . . . . . . . -53.09 -34.6 57.35 Favored 'General case' 0 C--O 1.231 0.079 0 C-N-CA 123.662 0.785 . . . . 0.0 112.731 173.915 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 105' ' ' LYS . . . . . . . . . . . . . 1.6 mmpm? -62.84 -80.57 0.03 OUTLIER 'General case' 0 N--CA 1.455 -0.179 0 CA-C-N 118.545 0.611 . . . . 0.0 111.178 172.635 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 106' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -150.38 -172.73 4.25 Favored 'General case' 0 N--CA 1.453 -0.304 0 C-N-CA 125.812 1.645 . . . . 0.0 108.241 -164.523 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 107' ' ' THR . . . . . . . . . . . . . 15.3 t -144.36 145.78 32.16 Favored 'General case' 0 N--CA 1.451 -0.389 0 C-N-CA 124.826 1.25 . . . . 0.0 108.303 -174.895 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 108' ' ' LEU . . . . . . . . . . . . . 4.2 mp -134.4 162.16 32.99 Favored 'General case' 0 N--CA 1.449 -0.491 0 C-N-CA 128.018 2.527 . . . . 0.0 108.725 -165.788 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 109' ' ' THR . . . . . . . . . . . . . 57.8 m -133.66 110.3 9.77 Favored 'General case' 0 C--N 1.329 -0.315 0 N-CA-C 107.744 -1.206 . . . . 0.0 107.744 171.455 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 110' ' ' TYR . . . . . . . . . . . . . 95.2 m-85 -98.93 161.4 13.65 Favored 'General case' 0 N--CA 1.453 -0.301 0 N-CA-C 108.608 -0.886 . . . . 0.0 108.608 167.787 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 111' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -123.06 133.36 54.32 Favored 'General case' 0 CA--C 1.517 -0.316 0 CA-C-O 117.964 -1.017 . . . . 0.0 108.338 -175.614 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 112' ' ' LEU . . . . . . . . . . . . . 28.0 tp -58.8 103.47 0.17 Allowed 'General case' 0 C--O 1.232 0.175 0 N-CA-C 107.018 -1.475 . . . . 0.0 107.018 167.567 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 113' ' ' ALA . . . . . . . . . . . . . . . -147.17 77.03 1.44 Allowed 'General case' 0 C--N 1.33 -0.275 0 N-CA-C 107.267 -1.383 . . . . 0.0 107.267 -175.577 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 114' ' ' ASP . . . . . . . . . . . . 0.251 56.9 p30 . . . . . 0 C--N 1.331 -0.199 0 CA-C-O 124.205 1.955 . . . . 0.0 112.02 -173.927 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 11.6 ttp . . . . . 0 CA--C 1.534 0.346 0 N-CA-C 113.226 0.825 . . . . 0.0 113.226 . . . . . . . . . 0 0 . 1 . 009 nuclear build core ' A' A ' 2' ' ' VAL . . . . . 0.432 HG22 HD11 ' A' ' 7' ' ' LEU . 7.1 p 42.96 66.85 0.12 Allowed 'Isoleucine or valine' 0 C--N 1.334 -0.109 0 C-N-CA 124.744 1.218 . . . . 0.0 111.233 145.581 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 3' ' ' THR . . . . . . . . . . . . . 71.5 p -79.86 161.72 65.12 Favored Pre-proline 0 C--N 1.328 -0.363 0 C-N-CA 118.034 -1.466 . . . . 0.0 108.976 -167.599 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 4' ' ' PRO . . . . . . . . . . . . . 15.7 Cg_endo -54.37 -42.3 68.94 Favored 'Trans proline' 0 CA--C 1.532 0.411 0 C-N-CA 122.236 1.957 . . . . 0.0 112.644 175.066 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 5' ' ' GLU . . . . . . . . . . . . . 1.2 tm-20 -51.13 -60.61 2.91 Favored 'General case' 0 C--N 1.329 -0.322 0 C-N-CA 126.068 1.747 . . . . 0.0 111.539 -175.951 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 6' ' ' GLN . . . . . . . . . . . . . 18.1 pt20 -66.03 15.42 0.03 OUTLIER 'General case' 0 CA--C 1.54 0.558 0 C-N-CA 127.333 2.253 . . . . 0.0 114.242 -177.711 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 7' ' ' LEU . . . . . 0.432 HD11 HG22 ' A' ' 2' ' ' VAL . 67.3 mt -133.93 -48.03 0.8 Allowed 'General case' 0 CA--C 1.522 -0.115 0 C-N-CA 125.345 1.458 . . . . 0.0 111.254 -172.57 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 8' ' ' GLN . . . . . . . . . . . . . 17.5 mt-30 -57.74 -4.1 0.26 Allowed 'General case' 0 CA--C 1.543 0.701 0 N-CA-C 115.681 1.734 . . . . 0.0 115.681 -179.54 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 9' ' ' HIS . . . . . . . . . . . . . 9.4 m-70 -133.26 15.4 4.15 Favored 'General case' 0 CA--C 1.538 0.511 0 C-N-CA 124.569 1.148 . . . . 0.0 112.624 174.333 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 10' ' ' HIS . . . . . . . . . . . . . 63.8 m-70 -130.55 109.99 11.09 Favored 'General case' 0 CA--C 1.539 0.554 0 C-N-CA 125.136 1.374 . . . . 0.0 109.885 -169.118 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 11' ' ' ARG . . . . . . . . . . . . . 32.3 ttt180 -68.64 150.69 47.66 Favored 'General case' 0 N--CA 1.474 0.732 0 C-N-CA 125.231 1.412 . . . . 0.0 110.765 175.127 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 12' ' ' PHE . . . . . . . . . . . . . 23.0 m-85 -136.48 157.55 46.52 Favored 'General case' 0 N--CA 1.451 -0.411 0 CA-C-O 121.693 0.758 . . . . 0.0 109.3 169.351 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 13' ' ' VAL . . . . . . . . . . . . . 11.4 p -132.97 150.59 33.04 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.336 0 O-C-N 120.992 -1.068 . . . . 0.0 109.958 175.754 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 14' ' ' LEU . . . . . . . . . . . . . 30.6 tp -80.1 97.57 6.91 Favored 'General case' 0 N--CA 1.454 -0.258 0 N-CA-C 108.001 -1.111 . . . . 0.0 108.001 177.53 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 3.1 mm-40 -68.24 -55.96 10.38 Favored 'General case' 0 C--N 1.323 -0.546 0 C-N-CA 125.184 1.393 . . . . 0.0 109.584 172.737 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 6.1 p -148.56 164.53 33.96 Favored 'General case' 0 N--CA 1.449 -0.478 0 CA-C-O 122.445 1.117 . . . . 0.0 110.219 -175.75 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 17' ' ' VAL . . . . . 0.463 HG12 ' H ' ' A' ' 18' ' ' ASN . 1.7 t -109.78 -164.64 0.21 Allowed 'Isoleucine or valine' 0 N--CA 1.445 -0.681 0 N-CA-C 104.892 -2.262 . . . . 0.0 104.892 -172.07 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 18' ' ' ASN . . . . . 0.463 ' H ' HG12 ' A' ' 17' ' ' VAL . 2.0 p-10 -44.47 -38.48 4.12 Favored 'General case' 0 CA--C 1.538 0.482 0 C-N-CA 126.902 2.081 . . . . 0.0 113.485 -171.465 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . -141.78 -44.89 0.06 OUTLIER Glycine 0 CA--C 1.523 0.543 0 C-N-CA 125.22 1.39 . . . . 0.0 110.539 169.616 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 0.5 OUTLIER -81.14 158.07 70.2 Favored Pre-proline 0 CA--C 1.534 0.336 0 C-N-CA 123.857 0.863 . . . . 0.0 111.472 -170.11 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 21' ' ' PRO . . . . . . . . . . . . . 80.2 Cg_endo -79.21 172.58 14.52 Favored 'Trans proline' 0 N--CA 1.457 -0.655 0 C-N-CA 123.223 2.615 . . . . 0.0 110.954 178.803 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 22' ' ' VAL . . . . . . . . . . . . . 88.7 t -94.81 157.17 3.08 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.422 0 N-CA-C 107.691 -1.226 . . . . 0.0 107.691 162.938 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 23' ' ' THR . . . . . . . . . . . . . 7.5 p -134.58 87.83 2.39 Favored 'General case' 0 N--CA 1.444 -0.75 0 N-CA-C 107.35 -1.352 . . . . 0.0 107.35 166.513 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 24' ' ' SER . . . . . 0.458 ' HB3' ' HA ' ' A' ' 28' ' ' PRO . 0.6 OUTLIER -159.89 135.19 8.16 Favored 'General case' 0 N--CA 1.447 -0.612 0 N-CA-C 105.669 -1.975 . . . . 0.0 105.669 172.234 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' A' A ' 25' ' ' ASP . . . . . . . . . . . . . 54.9 t0 -136.41 -42.18 0.63 Allowed 'General case' 0 C--N 1.324 -0.523 0 C-N-CA 126.678 1.991 . . . . 0.0 108.959 -174.086 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 26' ' ' LYS . . . . . . . . . . . . . 17.9 pttt -48.45 -45.98 37.25 Favored 'General case' 0 CA--C 1.516 -0.349 0 C-N-CA 125.496 1.518 . . . . 0.0 111.797 177.79 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 27' ' ' ASN . . . . . . . . . . . . . 0.2 OUTLIER -162.14 87.07 1.49 Allowed Pre-proline 0 C--N 1.325 -0.486 0 C-N-CA 130.022 3.329 . . . . 0.0 107.443 174.319 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 28' ' ' PRO . . . . . 0.458 ' HA ' ' HB3' ' A' ' 24' ' ' SER . 17.0 Cg_endo -60.03 162.2 17.1 Favored 'Trans proline' 0 C--N 1.349 0.583 0 C-N-CA 122.972 2.448 . . . . 0.0 113.737 177.154 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 29' ' ' PRO . . . . . . . . . . . . . 17.9 Cg_endo -60.69 103.15 0.21 Allowed 'Trans proline' 0 N--CA 1.445 -1.359 0 C-N-CA 122.104 1.869 . . . . 0.0 108.401 152.388 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 30' ' ' GLU . . . . . . . . . . . . . 20.2 pt-20 -126.11 170.27 11.94 Favored 'General case' 0 C--N 1.323 -0.584 0 C-N-CA 125.578 1.551 . . . . 0.0 109.708 -179.905 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 31' ' ' ILE . . . . . 0.501 HD11 ' CG2' ' A' ' 39' ' ' ILE . 15.7 tt -141.15 157.02 22.24 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.412 0 N-CA-C 107.883 -1.154 . . . . 0.0 107.883 177.66 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 32' ' ' SER . . . . . . . . . . . . . 8.2 t -149.84 171.92 15.99 Favored 'General case' 0 C--N 1.323 -0.572 0 N-CA-C 106.64 -1.615 . . . . 0.0 106.64 166.2 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 33' ' ' PHE . . . . . . . . . . . . . 67.5 m-85 -141.07 168.21 20.34 Favored 'General case' 0 N--CA 1.447 -0.583 0 C-N-CA 124.004 0.921 . . . . 0.0 109.415 -173.895 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 34' ' ' GLY . . . . . . . . . . . . . . . -168.6 -165.0 25.26 Favored Glycine 0 C--N 1.332 0.345 0 C-N-CA 125.549 1.547 . . . . 0.0 109.332 168.092 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 35' ' ' GLU . . . . . . . . . . . . . 1.1 tm-20 -47.33 156.89 0.23 Allowed 'General case' 0 C--N 1.326 -0.445 0 C-N-CA 126.961 2.104 . . . . 0.0 112.96 -171.222 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 29.6 mtmm 52.59 26.52 4.39 Favored 'General case' 0 CA--C 1.531 0.221 0 C-N-CA 124.606 1.162 . . . . 0.0 112.015 -164.193 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 37' ' ' MET . . . . . . . . . . . . . 10.4 mmm 56.91 26.45 11.73 Favored 'General case' 0 CA--C 1.54 0.594 0 C-N-CA 124.3 1.04 . . . . 0.0 109.885 178.873 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 38' ' ' MET . . . . . . . . . . . . . 19.0 mtp -54.67 151.47 8.15 Favored 'General case' 0 N--CA 1.45 -0.437 0 C-N-CA 123.798 0.839 . . . . 0.0 110.113 176.473 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 39' ' ' ILE . . . . . 0.501 ' CG2' HD11 ' A' ' 31' ' ' ILE . 9.8 mt -134.13 116.22 22.5 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.465 0 N-CA-C 105.101 -2.185 . . . . 0.0 105.101 -176.664 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 40' ' ' SER . . . . . . . . . . . . . 66.8 m -141.7 119.63 11.96 Favored 'General case' 0 C--N 1.328 -0.33 0 N-CA-C 108.418 -0.956 . . . . 0.0 108.418 -172.479 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 41' ' ' GLY . . . . . . . . . . . . . . . -156.84 -165.36 14.73 Favored Glycine 0 CA--C 1.525 0.663 0 C-N-CA 124.42 1.009 . . . . 0.0 111.565 -171.111 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 42' ' ' SER . . . . . . . . . . . . . 28.7 t -157.43 123.37 4.74 Favored 'General case' 0 CA--C 1.511 -0.524 0 O-C-N 121.808 -0.819 . . . . 0.0 108.942 165.792 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 43' ' ' MET . . . . . . . . . . . . . 5.1 mmm -86.65 -43.15 12.86 Favored 'General case' 0 N--CA 1.45 -0.448 0 O-C-N 124.15 0.906 . . . . 0.0 111.18 160.142 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 44' ' ' CYS . . . . . 1.28 ' SG ' ' SG ' ' A' ' 70' ' ' CYS . 54.0 t -157.15 -71.23 0.1 Allowed 'General case' 0 CA--C 1.534 0.346 0 N-CA-C 107.413 -1.329 . . . . 0.0 107.413 177.907 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 45' ' ' ASN . . . . . . . . . . . . . 33.2 m-80 -77.66 26.81 0.17 Allowed 'General case' 0 N--CA 1.472 0.653 0 C-N-CA 127.488 2.315 . . . . 0.0 113.19 -179.054 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 46' ' ' ARG . . . . . . . . . . . . . 34.3 mtp85 53.08 -170.15 0.04 OUTLIER 'General case' 0 C--N 1.332 -0.194 0 C-N-CA 125.972 1.709 . . . . 0.0 108.973 -169.51 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 47' ' ' PHE . . . . . . . . . . . . . 29.6 p90 -178.99 153.11 0.6 Allowed 'General case' 0 C--O 1.238 0.493 0 C-N-CA 126.764 2.025 . . . . 0.0 108.516 160.753 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 48' ' ' SER . . . . . . . . . . . . . 6.3 p -163.93 143.13 7.85 Favored 'General case' 0 N--CA 1.449 -0.518 0 CA-C-O 117.695 -1.145 . . . . 0.0 110.669 179.184 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 49' ' ' GLY . . . . . . . . . . . . . . . -177.6 163.66 32.26 Favored Glycine 0 C--N 1.337 0.614 0 CA-C-N 119.647 1.112 . . . . 0.0 110.864 177.541 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 50' ' ' GLU . . . . . . . . . . . . . 38.1 mt-10 -75.84 100.45 4.78 Favored 'General case' 0 C--O 1.235 0.315 0 N-CA-C 109.241 -0.651 . . . . 0.0 109.241 173.902 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 51' ' ' GLY . . . . . . . . . . . . . . . -66.17 166.81 36.66 Favored Glycine 0 CA--C 1.529 0.921 0 CA-C-O 121.87 0.706 . . . . 0.0 112.343 170.199 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 52' ' ' LYS . . . . . . . . . . . . . 0.5 OUTLIER -132.71 143.16 49.43 Favored 'General case' 0 C--N 1.328 -0.356 0 C-N-CA 126.422 1.889 . . . . 0.0 107.301 165.982 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 53' ' ' LEU . . . . . . . . . . . . . 32.8 tp -156.66 151.77 26.3 Favored 'General case' 0 C--O 1.235 0.292 0 C-N-CA 126.286 1.834 . . . . 0.0 107.508 176.144 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 11.7 t -161.66 -24.26 0.05 Allowed 'General case' 0 CA--C 1.538 0.5 0 C-N-CA 124.818 1.247 . . . . 0.0 111.424 173.72 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 55' ' ' ASN . . . . . . . . . . . . . 17.8 p-10 -153.71 28.53 0.48 Allowed 'General case' 0 CA--C 1.54 0.562 0 C-N-CA 126.332 1.853 . . . . 0.0 112.304 -148.367 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 56' ' ' GLY . . . . . . . . . . . . . . . 71.89 27.12 71.2 Favored Glycine 0 CA--C 1.534 1.221 0 O-C-N 120.918 -1.114 . . . . 0.0 112.271 -177.721 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 57' ' ' GLU . . . . . . . . . . . . . 29.8 tt0 -135.02 142.83 46.5 Favored 'General case' 0 CA--C 1.533 0.303 0 N-CA-C 107.929 -1.138 . . . . 0.0 107.929 173.403 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 58' ' ' LEU . . . . . . . . . . . . . 31.7 tp -134.33 101.66 5.08 Favored 'General case' 0 C--O 1.234 0.287 0 C-N-CA 125.805 1.642 . . . . 0.0 109.403 -172.467 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 59' ' ' THR . . . . . . . . . . . . . 4.4 p -106.02 145.22 31.65 Favored 'General case' 0 C--N 1.328 -0.342 0 C-N-CA 124.345 1.058 . . . . 0.0 109.854 175.213 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 60' ' ' ALA . . . . . . . . . . . . . . . -95.41 130.06 42.34 Favored 'General case' 0 CA--C 1.531 0.225 0 C-N-CA 124.548 1.139 . . . . 0.0 110.202 169.781 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 61' ' ' LYS . . . . . . . . . . . . . 18.4 tttt -79.8 -15.23 57.85 Favored 'General case' 0 N--CA 1.473 0.684 0 N-CA-C 113.852 1.056 . . . . 0.0 113.852 177.853 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 62' ' ' GLY . . . . . . . . . . . . . . . 169.75 123.64 0.69 Allowed Glycine 0 C--N 1.332 0.33 0 N-CA-C 108.579 -1.808 . . . . 0.0 108.579 -178.86 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 63' ' ' LEU . . . . . . . . . . . . . 0.9 OUTLIER -128.26 94.24 3.85 Favored 'General case' 0 N--CA 1.45 -0.45 0 C-N-CA 124.769 1.228 . . . . 0.0 110.599 -151.971 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 64' ' ' ALA . . . . . . . . . . . . . . . -78.74 109.39 12.93 Favored 'General case' 0 C--O 1.236 0.361 0 C-N-CA 124.136 0.975 . . . . 0.0 111.601 -172.018 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 65' ' ' MET . . . . . . . . . . . . . 67.3 mtp -120.63 159.62 24.92 Favored 'General case' 0 CA--C 1.537 0.459 0 C-N-CA 124.24 1.016 . . . . 0.0 110.217 176.993 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 66' ' ' THR . . . . . . . . . . . . . 28.3 p -100.09 -164.89 1.16 Allowed 'General case' 0 CA--C 1.543 0.704 0 C-N-CA 125.444 1.498 . . . . 0.0 111.953 -169.379 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 67' ' ' ARG . . . . . . . . . . . . . 5.7 mmm180 -133.36 68.3 1.5 Allowed 'General case' 0 N--CA 1.471 0.597 0 C-N-CA 125.467 1.507 . . . . 0.0 109.968 -178.855 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 68' ' ' MET . . . . . . . . . . . . . 27.2 ptm -133.53 -172.22 2.91 Favored 'General case' 0 CA--C 1.538 0.506 0 C-N-CA 127.147 2.179 . . . . 0.0 110.369 -175.307 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 69' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -138.69 176.87 8.32 Favored 'General case' 0 C--O 1.236 0.35 0 C-N-CA 125.575 1.55 . . . . 0.0 110.061 -173.815 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 70' ' ' CYS . . . . . 1.28 ' SG ' ' SG ' ' A' ' 44' ' ' CYS . 60.2 m -138.05 4.88 2.53 Favored 'General case' 0 CA--C 1.54 0.582 0 N-CA-C 114.409 1.263 . . . . 0.0 114.409 -175.392 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 71' ' ' ALA . . . . . . . . . . . . . . . 58.61 3.98 0.33 Allowed 'General case' 0 N--CA 1.472 0.665 0 C-N-CA 125.743 1.617 . . . . 0.0 113.983 -177.057 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 72' ' ' ASN . . . . . . . . . . . . . 43.3 t-20 -143.19 142.05 20.75 Favored Pre-proline 0 C--O 1.238 0.498 0 N-CA-C 106.684 -1.599 . . . . 0.0 106.684 172.645 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 73' ' ' PRO . . . . . . . . . . . . . 37.3 Cg_endo -78.71 -27.65 4.77 Favored 'Trans proline' 0 C--O 1.221 -0.363 0 C-N-CA 121.564 1.509 . . . . 0.0 113.041 -169.189 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 74' ' ' GLN . . . . . . . . . . . . . 41.0 tt0 -51.43 -46.44 62.96 Favored 'General case' 0 N--CA 1.47 0.569 0 CA-C-N 119.501 1.046 . . . . 0.0 111.486 -177.435 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 75' ' ' LEU . . . . . . . . . . . . . 49.9 mt -70.02 -36.83 75.38 Favored 'General case' 0 C--N 1.329 -0.309 0 C-N-CA 124.914 1.286 . . . . 0.0 110.906 -178.286 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 76' ' ' ASN . . . . . . . . . . . . . 1.0 OUTLIER -78.9 2.11 21.28 Favored 'General case' 0 CA--C 1.541 0.599 0 C-N-CA 127.179 2.191 . . . . 0.0 112.325 178.046 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 77' ' ' GLU . . . . . . . . . . . . . 1.5 mm-40 -109.47 -39.82 5.06 Favored 'General case' 0 C--N 1.331 -0.212 0 C-N-CA 127.421 2.288 . . . . 0.0 108.338 173.819 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 78' ' ' LEU . . . . . . . . . . . . . 55.8 mt -56.29 -27.4 55.31 Favored 'General case' 0 C--N 1.343 0.319 0 C-N-CA 122.881 0.472 . . . . 0.0 110.653 168.285 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 79' ' ' ASP . . . . . . . . . . . . . 0.0 OUTLIER -63.76 -13.57 44.95 Favored 'General case' 0 CA--C 1.539 0.541 0 C-N-CA 126.3 1.84 . . . . 0.0 112.653 177.369 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 80' ' ' ASN . . . . . . . . . . . . . 67.8 m-20 -105.54 -44.84 4.59 Favored 'General case' 0 N--CA 1.465 0.277 0 C-N-CA 124.478 1.111 . . . . 0.0 109.962 169.452 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 81' ' ' THR . . . . . . . . . . . . . 85.9 m -44.59 -70.16 0.11 Allowed 'General case' 0 CA--C 1.535 0.38 0 C-N-CA 125.836 1.654 . . . . 0.0 111.273 -179.143 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 82' ' ' ILE . . . . . . . . . . . . . 8.2 tp -72.37 -29.72 32.5 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.347 0 O-C-N 121.428 -0.795 . . . . 0.0 111.088 -167.072 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 83' ' ' SER . . . . . . . . . . . . . 30.0 t -52.68 -60.09 3.67 Favored 'General case' 0 C--O 1.236 0.38 0 C-N-CA 124.735 1.214 . . . . 0.0 109.409 171.096 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 84' ' ' GLU . . . . . . . . . . . . . 30.8 tp10 -67.97 -39.03 83.42 Favored 'General case' 0 N--CA 1.449 -0.482 0 CA-C-O 118.209 -0.901 . . . . 0.0 110.875 -173.216 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 85' ' ' MET . . . . . . . . . . . . . 78.6 mtp -60.58 -42.78 97.4 Favored 'General case' 0 N--CA 1.464 0.275 0 CA-C-O 122.402 1.096 . . . . 0.0 109.309 -176.136 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 86' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -75.95 -23.71 55.4 Favored 'General case' 0 C--N 1.33 -0.257 0 C-N-CA 124.262 1.025 . . . . 0.0 111.722 -178.643 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 87' ' ' LYS . . . . . . . . . . . . . 3.0 tppt? -75.96 -52.29 10.58 Favored 'General case' 0 N--CA 1.441 -0.886 0 C-N-CA 124.589 1.156 . . . . 0.0 109.188 177.847 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 88' ' ' GLU . . . . . . . . . . . . . 17.3 pt-20 -64.95 -38.78 92.1 Favored 'General case' 0 CA--C 1.539 0.546 0 CA-C-O 118.927 -0.559 . . . . 0.0 110.536 178.124 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 89' ' ' GLY . . . . . . . . . . . . . . . 120.15 105.75 2.08 Favored Glycine 0 C--N 1.339 0.746 0 C-N-CA 126.743 2.116 . . . . 0.0 108.732 173.161 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 90' ' ' ALA . . . . . 0.426 ' HB1' HD13 ' A' ' 101' ' ' LEU . . . -77.18 133.29 38.97 Favored 'General case' 0 N--CA 1.448 -0.541 0 CA-C-O 118.457 -0.783 . . . . 0.0 109.566 -176.072 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 91' ' ' GLN . . . . . . . . . . . . . 59.1 mm-40 -65.21 139.2 58.63 Favored 'General case' 0 C--O 1.239 0.503 0 N-CA-C 105.099 -2.185 . . . . 0.0 105.099 152.533 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 92' ' ' VAL . . . . . . . . . . . . . 10.4 p -135.78 134.48 51.25 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.56 0 N-CA-C 106.154 -1.795 . . . . 0.0 106.154 -176.448 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 93' ' ' ASP . . . . . . . . . . . . . 0.7 OUTLIER -142.09 91.88 2.38 Favored 'General case' 0 N--CA 1.452 -0.373 0 N-CA-C 107.911 -1.144 . . . . 0.0 107.911 -170.442 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 94' ' ' LEU . . . . . 0.403 ' H ' ' HB ' ' A' ' 2' ' ' VAL . 0.4 OUTLIER -96.91 109.49 22.2 Favored 'General case' 0 C--O 1.235 0.31 0 N-CA-C 106.922 -1.51 . . . . 0.0 106.922 174.395 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' A' A ' 95' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -70.13 -163.77 0.07 Allowed 'General case' 0 CA--C 1.542 0.664 0 N-CA-C 108.173 -1.047 . . . . 0.0 108.173 166.139 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 96' ' ' ALA . . . . . . . . . . . . . . . -56.97 -27.86 61.73 Favored 'General case' 0 CA--C 1.536 0.437 0 O-C-N 119.291 -2.131 . . . . 0.0 113.138 -178.616 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 97' ' ' ASN . . . . . . . . . . . . . 28.4 p30 -167.41 18.69 0.03 OUTLIER 'General case' 0 CA--C 1.539 0.538 0 C-N-CA 124.072 0.949 . . . . 0.0 112.705 -168.766 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 98' ' ' GLN . . . . . . . . . . . . . 2.3 tt0 -130.93 124.35 30.88 Favored 'General case' 0 N--CA 1.47 0.527 0 CA-C-N 120.297 1.408 . . . . 0.0 107.724 169.997 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 99' ' ' LEU . . . . . 0.433 ' HB3' ' HB2' ' A' ' 110' ' ' TYR . 15.3 tp -86.13 139.89 30.69 Favored 'General case' 0 C--O 1.233 0.185 0 C-N-CA 124.238 1.015 . . . . 0.0 109.519 170.109 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 100' ' ' THR . . . . . . . . . . . . . 15.8 m -123.38 126.17 46.34 Favored 'General case' 0 C--N 1.322 -0.592 0 C-N-CA 126.308 1.843 . . . . 0.0 107.127 171.346 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 101' ' ' LEU . . . . . 0.426 HD13 ' HB1' ' A' ' 90' ' ' ALA . 0.7 OUTLIER -114.23 135.45 54.04 Favored 'General case' 0 C--N 1.334 -0.071 0 C-N-CA 127.502 2.321 . . . . 0.0 106.04 167.9 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' A' A ' 102' ' ' ALA . . . . . . . . . . . . . . . -157.23 82.5 0.92 Allowed 'General case' 0 CA--C 1.536 0.417 0 CA-C-N 120.057 1.299 . . . . 0.0 111.325 178.852 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 103' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -98.87 171.01 8.34 Favored 'General case' 0 C--O 1.236 0.374 0 C-N-CA 125.947 1.699 . . . . 0.0 110.392 179.867 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 104' ' ' ALA . . . . . . . . . . . . . . . -56.16 -28.14 56.93 Favored 'General case' 0 C--O 1.233 0.213 0 CA-C-O 118.466 -0.778 . . . . 0.0 112.239 176.705 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 105' ' ' LYS . . . . . . . . . . . . . 32.8 mmtt -58.81 -80.5 0.02 OUTLIER 'General case' 0 CA--C 1.531 0.24 0 CA-C-N 119.244 0.929 . . . . 0.0 110.927 165.345 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 106' ' ' GLN . . . . . . . . . . . . . 7.1 mt-30 -157.0 -170.36 3.26 Favored 'General case' 0 CA--C 1.536 0.428 0 C-N-CA 125.098 1.359 . . . . 0.0 109.803 -173.136 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 107' ' ' THR . . . . . . . . . . . . . 3.4 t -130.32 140.4 50.64 Favored 'General case' 0 CA--C 1.537 0.444 0 C-N-CA 126.376 1.87 . . . . 0.0 108.29 -174.949 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 108' ' ' LEU . . . . . . . . . . . . . 4.8 mp -134.09 153.16 51.99 Favored 'General case' 0 C--O 1.235 0.325 0 C-N-CA 130.097 3.359 . . . . 0.0 108.461 -172.665 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 109' ' ' THR . . . . . . . . . . . . . 7.1 m -138.6 96.97 3.25 Favored 'General case' 0 CA--C 1.539 0.534 0 N-CA-C 109.419 -0.586 . . . . 0.0 109.419 -175.771 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 110' ' ' TYR . . . . . 0.433 ' HB2' ' HB3' ' A' ' 99' ' ' LEU . 66.9 m-85 -99.08 155.83 17.25 Favored 'General case' 0 N--CA 1.464 0.259 0 C-N-CA 124.056 0.943 . . . . 0.0 110.712 -175.244 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 111' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -114.5 145.21 42.19 Favored 'General case' 0 C--N 1.331 -0.199 0 C-N-CA 125.703 1.601 . . . . 0.0 108.758 -171.487 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 112' ' ' LEU . . . . . . . . . . . . . 54.4 tp -75.62 60.98 1.29 Allowed 'General case' 0 CA--C 1.534 0.36 0 C-N-CA 127.957 2.503 . . . . 0.0 108.396 175.558 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 113' ' ' ALA . . . . . . . . . . . . . . . -93.31 94.69 8.89 Favored 'General case' 0 N--CA 1.448 -0.544 0 N-CA-C 106.189 -1.782 . . . . 0.0 106.189 177.299 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 114' ' ' ASP . . . . . . . . . . . . . 37.9 t0 . . . . . 0 CA--C 1.515 -0.39 0 CA-C-O 121.62 0.724 . . . . 0.0 110.993 -178.927 . . . . . . . . 0 0 . 1 . 010 nuclear build core ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 4.4 ptm . . . . . 0 CA--C 1.535 0.391 0 CA-C-O 121.471 0.653 . . . . 0.0 111.065 . . . . . . . . . 0 0 . 1 . 010 nuclear build core ' A' A ' 2' ' ' VAL . . . . . . . . . . . . . 14.6 p -61.92 155.24 4.73 Favored 'Isoleucine or valine' 0 CA--C 1.54 0.561 0 C-N-CA 125.622 1.569 . . . . 0.0 111.127 175.575 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 3' ' ' THR . . . . . 0.41 ' HB ' ' HD2' ' A' ' 4' ' ' PRO . 31.5 p -124.45 163.8 34.26 Favored Pre-proline 0 CA--C 1.535 0.368 0 C-N-CA 124.292 1.037 . . . . 0.0 108.64 173.269 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 4' ' ' PRO . . . . . 0.41 ' HD2' ' HB ' ' A' ' 3' ' ' THR . 57.9 Cg_endo -67.38 -34.8 25.7 Favored 'Trans proline' 0 N--CA 1.459 -0.5 0 C-N-CA 121.524 1.483 . . . . 0.0 111.046 170.066 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 5' ' ' GLU . . . . . . . . . . . . . 28.6 tt0 -56.14 -54.64 42.69 Favored 'General case' 0 C--N 1.328 -0.338 0 C-N-CA 125.005 1.322 . . . . 0.0 109.992 -174.918 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 6' ' ' GLN . . . . . . . . . . . . . 7.8 pt20 -63.87 6.4 0.17 Allowed 'General case' 0 CA--C 1.536 0.412 0 C-N-CA 125.318 1.447 . . . . 0.0 114.314 -179.48 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 7' ' ' LEU . . . . . 0.631 HD21 HD22 ' A' ' 94' ' ' LEU . 95.4 mt -123.77 -50.91 1.83 Allowed 'General case' 0 N--CA 1.451 -0.416 0 C-N-CA 125.895 1.678 . . . . 0.0 110.02 -177.763 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 8' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -61.37 -6.22 2.13 Favored 'General case' 0 N--CA 1.468 0.471 0 N-CA-C 113.967 1.099 . . . . 0.0 113.967 -169.794 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 9' ' ' HIS . . . . . . . . . . . . . 0.8 OUTLIER -124.6 9.68 8.38 Favored 'General case' 0 CA--C 1.543 0.705 0 C-N-CA 127.078 2.151 . . . . 0.0 110.301 -171.002 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 10' ' ' HIS . . . . . . . . . . . . . 94.5 m-70 -132.99 154.97 49.99 Favored 'General case' 0 C--O 1.236 0.389 0 CA-C-N 119.438 1.017 . . . . 0.0 111.614 -175.771 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 11' ' ' ARG . . . . . . . . . . . . . 63.4 ttt180 -96.9 147.03 24.38 Favored 'General case' 0 CA--C 1.513 -0.445 0 C-N-CA 124.525 1.13 . . . . 0.0 108.694 173.821 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 12' ' ' PHE . . . . . . . . . . . . . 60.2 m-85 -126.24 161.4 27.84 Favored 'General case' 0 N--CA 1.45 -0.468 0 N-CA-C 108.953 -0.758 . . . . 0.0 108.953 165.487 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 13' ' ' VAL . . . . . . . . . . . . . 8.8 p -129.6 155.48 41.36 Favored 'Isoleucine or valine' 0 CA--C 1.545 0.782 0 C-N-CA 125.333 1.453 . . . . 0.0 109.797 166.889 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 14' ' ' LEU . . . . . 0.53 ' HG ' HG21 ' A' ' 22' ' ' VAL . 1.3 tp -85.75 100.61 12.14 Favored 'General case' 0 N--CA 1.47 0.527 0 C-N-CA 125.519 1.528 . . . . 0.0 108.909 -175.673 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 4.9 tm-20 -88.45 -36.21 16.62 Favored 'General case' 0 CA--C 1.534 0.329 0 C-N-CA 122.653 0.381 . . . . 0.0 110.056 -174.006 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -152.12 146.26 25.36 Favored 'General case' 0 C--O 1.234 0.247 0 CA-C-O 122.656 1.217 . . . . 0.0 109.97 -177.907 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 17' ' ' VAL . . . . . 0.629 HG12 ' H ' ' A' ' 18' ' ' ASN . 3.0 t -79.65 -164.64 0.07 OUTLIER 'Isoleucine or valine' 0 CA--C 1.546 0.807 0 C-N-CA 126.071 1.748 . . . . 0.0 107.597 172.095 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 18' ' ' ASN . . . . . 0.629 ' H ' HG12 ' A' ' 17' ' ' VAL . 40.3 t30 -51.83 -9.54 0.09 Allowed 'General case' 0 CA--C 1.547 0.853 0 C-N-CA 127.731 2.413 . . . . 0.0 115.648 170.207 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . 156.9 32.2 0.02 OUTLIER Glycine 0 CA--C 1.524 0.594 0 O-C-N 120.92 -1.113 . . . . 0.0 112.373 -179.122 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 26.0 mttp -150.73 156.02 35.95 Favored Pre-proline 0 C--O 1.236 0.387 0 C-N-CA 126.975 2.11 . . . . 0.0 108.05 176.18 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 21' ' ' PRO . . . . . . . . . . . . . 72.7 Cg_endo -86.06 172.5 7.39 Favored 'Trans proline' 0 N--CA 1.448 -1.195 0 C-N-CA 122.212 1.942 . . . . 0.0 111.426 -179.498 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 22' ' ' VAL . . . . . 0.53 HG21 ' HG ' ' A' ' 14' ' ' LEU . 54.4 t -115.18 127.39 72.76 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.342 0 C-N-CA 125.192 1.397 . . . . 0.0 109.449 -166.76 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 23' ' ' THR . . . . . . . . . . . . . 2.5 p -105.61 95.71 6.0 Favored 'General case' 0 CA--C 1.534 0.351 0 C-N-CA 125.219 1.407 . . . . 0.0 111.506 -167.637 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 24' ' ' SER . . . . . . . . . . . . . 34.7 t -163.4 135.34 5.06 Favored 'General case' 0 N--CA 1.449 -0.476 0 N-CA-C 108.069 -1.086 . . . . 0.0 108.069 172.714 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 25' ' ' ASP . . . . . . . . . . . . . 13.6 m-20 -107.26 -3.47 19.72 Favored 'General case' 0 N--CA 1.472 0.666 0 C-N-CA 124.567 1.147 . . . . 0.0 112.111 166.478 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 26' ' ' LYS . . . . . . . . . . . . . 92.2 mttt -142.97 129.5 20.15 Favored 'General case' 0 C--N 1.345 0.376 0 O-C-N 120.162 -1.586 . . . . 0.0 110.04 -176.667 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 27' ' ' ASN . . . . . . . . . . . . . 2.4 m-80 45.53 68.07 3.67 Favored Pre-proline 0 CA--C 1.535 0.382 0 C-N-CA 125.634 1.574 . . . . 0.0 109.443 -179.979 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 28' ' ' PRO . . . . . . . . . . . . . 18.0 Cg_endo -63.79 172.76 5.41 Favored 'Trans proline' 0 C--O 1.236 0.387 0 C-N-CA 123.314 2.676 . . . . 0.0 112.37 -173.361 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 29' ' ' PRO . . . . . . . . . . . . . 42.2 Cg_endo -74.05 62.71 5.03 Favored 'Trans proline' 0 N--CA 1.454 -0.826 0 C-N-CA 121.333 1.355 . . . . 0.0 110.435 166.497 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 30' ' ' GLU . . . . . . . . . . . . . 0.3 OUTLIER -81.37 169.85 16.72 Favored 'General case' 0 CA--C 1.536 0.42 0 O-C-N 120.581 -1.325 . . . . 0.0 108.897 174.812 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 31' ' ' ILE . . . . . . . . . . . . . 7.5 tt -146.17 105.86 0.66 Allowed 'Isoleucine or valine' 0 N--CA 1.452 -0.328 0 N-CA-C 105.665 -1.976 . . . . 0.0 105.665 169.6 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 32' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER -80.45 129.66 34.65 Favored 'General case' 0 N--CA 1.445 -0.706 0 N-CA-C 106.604 -1.628 . . . . 0.0 106.604 160.17 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 33' ' ' PHE . . . . . . . . . . . . . 59.7 m-85 -93.42 156.44 16.77 Favored 'General case' 0 C--O 1.239 0.512 0 N-CA-C 106.803 -1.554 . . . . 0.0 106.803 158.673 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 34' ' ' GLY . . . . . . . . . . . . . . . -167.53 122.34 1.03 Allowed Glycine 0 C--O 1.219 -0.803 0 CA-C-O 117.107 -1.941 . . . . 0.0 109.713 -177.221 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 35' ' ' GLU . . . . . . . . . . . . . 1.8 tm-20 70.24 114.46 0.05 OUTLIER 'General case' 0 CA--C 1.542 0.659 0 CA-C-N 120.341 2.071 . . . . 0.0 111.436 178.986 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 44.9 mtmt 63.91 -50.21 0.26 Allowed 'General case' 0 N--CA 1.477 0.913 0 C-N-CA 130.578 3.551 . . . . 0.0 116.478 176.751 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 37' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER 171.27 8.18 0.0 OUTLIER 'General case' 0 CA--C 1.543 0.676 1 C-N-CA 132.347 4.259 . . . . 0.0 111.342 177.173 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' A' A ' 38' ' ' MET . . . . . . . . . . . . . 65.5 mmm -57.02 157.32 5.92 Favored 'General case' 0 N--CA 1.473 0.683 0 CA-C-N 120.667 1.576 . . . . 0.0 111.596 -169.478 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 39' ' ' ILE . . . . . . . . . . . . . 52.9 mt -124.57 124.91 69.23 Favored 'Isoleucine or valine' 0 C--O 1.235 0.327 0 C-N-CA 126.641 1.976 . . . . 0.0 106.662 -166.687 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 40' ' ' SER . . . . . . . . . . . . . 59.8 p -138.21 123.39 19.23 Favored 'General case' 0 C--O 1.241 0.635 0 C-N-CA 125.309 1.444 . . . . 0.0 108.334 177.554 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 41' ' ' GLY . . . . . . . . . . . . . . . -171.93 178.44 44.16 Favored Glycine 0 CA--C 1.529 0.926 0 CA-C-N 119.974 1.261 . . . . 0.0 112.959 -173.677 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 42' ' ' SER . . . . . . . . . . . . . 20.6 t -154.47 109.98 3.15 Favored 'General case' 0 C--O 1.236 0.393 0 O-C-N 121.622 -0.929 . . . . 0.0 109.859 169.012 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 43' ' ' MET . . . . . . . . . . . . . 15.3 mmt -65.91 -64.58 0.83 Allowed 'General case' 0 N--CA 1.455 -0.185 0 N-CA-C 106.998 -1.482 . . . . 0.0 106.998 159.597 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 44' ' ' CYS . . . . . 1.296 ' SG ' ' SG ' ' A' ' 70' ' ' CYS . 19.7 t -146.37 -61.99 0.31 Allowed 'General case' 0 N--CA 1.454 -0.253 0 N-CA-C 108.807 -0.812 . . . . 0.0 108.807 -178.245 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 45' ' ' ASN . . . . . . . . . . . . . 2.9 m120 -77.24 15.95 0.66 Allowed 'General case' 0 CA--C 1.544 0.738 0 C-N-CA 125.731 1.612 . . . . 0.0 113.139 -175.371 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 46' ' ' ARG . . . . . . . . . . . . . 1.2 mtt180 56.94 164.93 0.03 OUTLIER 'General case' 0 N--CA 1.472 0.644 0 C-N-CA 126.765 2.026 . . . . 0.0 113.164 -156.421 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 47' ' ' PHE . . . . . . . . . . . . . 39.1 p90 -160.65 166.04 29.54 Favored 'General case' 0 C--O 1.234 0.249 0 C-N-CA 124.152 0.981 . . . . 0.0 110.416 153.873 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 48' ' ' SER . . . . . . . . . . . . . 0.2 OUTLIER -167.92 162.41 13.47 Favored 'General case' 0 C--O 1.236 0.366 0 C-N-CA 124.305 1.042 . . . . 0.0 109.457 174.545 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 49' ' ' GLY . . . . . . . . . . . . . . . -176.66 173.74 46.51 Favored Glycine 0 CA--C 1.53 1.021 0 CA-C-N 119.925 1.239 . . . . 0.0 113.23 175.573 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 50' ' ' GLU . . . . . . . . . . . . . 47.1 mt-10 -79.31 94.09 5.41 Favored 'General case' 0 C--O 1.238 0.452 0 C-N-CA 125.008 1.323 . . . . 0.0 107.771 167.263 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 51' ' ' GLY . . . . . . . . . . . . . . . -69.59 164.39 51.02 Favored Glycine 0 C--O 1.238 0.375 0 N-CA-C 110.995 -0.842 . . . . 0.0 110.995 168.455 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 52' ' ' LYS . . . . . . . . . . . . . 2.0 tttp -162.6 151.34 14.82 Favored 'General case' 0 N--CA 1.457 -0.084 0 C-N-CA 123.378 0.671 . . . . 0.0 110.06 169.915 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 53' ' ' LEU . . . . . . . . . . . . . 23.6 tp -148.68 135.13 19.54 Favored 'General case' 0 C--N 1.333 -0.12 0 N-CA-C 107.04 -1.467 . . . . 0.0 107.04 174.731 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 2.8 t -157.42 11.57 0.21 Allowed 'General case' 0 CA--C 1.543 0.687 0 CA-C-N 118.435 0.562 . . . . 0.0 111.929 170.123 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 55' ' ' ASN . . . . . . . . . . . . . 40.1 p30 -151.83 -2.02 0.3 Allowed 'General case' 0 N--CA 1.471 0.61 0 N-CA-C 114.232 1.197 . . . . 0.0 114.232 -172.572 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 56' ' ' GLY . . . . . . . . . . . . . . . 107.39 -2.24 34.75 Favored Glycine 0 CA--C 1.532 1.139 0 C-N-CA 125.437 1.494 . . . . 0.0 113.574 -175.049 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 57' ' ' GLU . . . . . . . . . . . . . 28.0 tt0 -119.25 142.79 47.73 Favored 'General case' 0 CA--C 1.539 0.524 0 CA-C-N 118.678 1.239 . . . . 0.0 109.542 -177.215 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 58' ' ' LEU . . . . . . . . . . . . . 57.2 tp -117.6 122.84 44.68 Favored 'General case' 0 C--O 1.232 0.175 0 C-N-CA 126.086 1.754 . . . . 0.0 109.713 175.919 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 59' ' ' THR . . . . . . . . . . . . . 63.5 p -109.24 166.24 11.0 Favored 'General case' 0 CA--C 1.534 0.331 0 C-N-CA 124.223 1.009 . . . . 0.0 110.782 165.103 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 60' ' ' ALA . . . . . . . . . . . . . . . -129.76 86.32 2.4 Favored 'General case' 0 C--O 1.235 0.301 0 CA-C-O 122.415 1.102 . . . . 0.0 108.67 150.266 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 61' ' ' LYS . . . . . . . . . . . . . 74.7 tttt -74.85 100.02 3.95 Favored 'General case' 0 C--O 1.236 0.38 0 N-CA-C 107.601 -1.259 . . . . 0.0 107.601 168.18 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 62' ' ' GLY . . . . . . . . . . . . . . . 111.87 48.18 0.69 Allowed Glycine 0 CA--C 1.525 0.716 0 C-N-CA 124.105 0.859 . . . . 0.0 111.744 -176.638 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 63' ' ' LEU . . . . . . . . . . . . . 4.0 tp -67.33 168.57 10.37 Favored 'General case' 0 CA--C 1.539 0.542 0 C-N-CA 125.071 1.348 . . . . 0.0 110.516 172.654 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 64' ' ' ALA . . . . . . . . . . . . . . . -143.4 160.92 39.68 Favored 'General case' 0 C--N 1.329 -0.316 0 O-C-N 119.885 -1.76 . . . . 0.0 107.395 159.731 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 65' ' ' MET . . . . . . . . . . . . . 68.3 mtp -152.82 -171.39 3.92 Favored 'General case' 0 CA--C 1.54 0.56 0 C-N-CA 126.848 2.059 . . . . 0.0 107.777 179.38 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 66' ' ' THR . . . . . . . . . . . . . 0.9 OUTLIER -131.86 -164.87 1.5 Allowed 'General case' 0 CA--C 1.545 0.755 0 C-N-CA 124.239 1.016 . . . . 0.0 109.36 164.993 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 67' ' ' ARG . . . . . . . . . . . . . 3.1 ppt_? -125.11 52.56 1.58 Allowed 'General case' 0 N--CA 1.466 0.347 0 C-N-CA 124.964 1.306 . . . . 0.0 110.931 176.916 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 68' ' ' MET . . . . . . . . . . . . . 22.5 ptp -102.56 163.08 12.43 Favored 'General case' 0 CA--C 1.52 -0.207 0 O-C-N 121.29 -0.881 . . . . 0.0 109.205 167.007 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 69' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -124.42 155.67 38.45 Favored 'General case' 0 C--N 1.323 -0.582 0 C-N-CA 126.772 2.029 . . . . 0.0 108.316 -170.639 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 70' ' ' CYS . . . . . 1.296 ' SG ' ' SG ' ' A' ' 44' ' ' CYS . 1.6 p -116.67 160.59 20.49 Favored 'General case' 0 C--N 1.324 -0.541 0 C-N-CA 125.528 1.531 . . . . 0.0 110.097 -174.984 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 71' ' ' ALA . . . . . . . . . . . . . . . -78.96 16.86 0.82 Allowed 'General case' 0 CA--C 1.54 0.591 0 C-N-CA 124.29 1.036 . . . . 0.0 112.097 176.548 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 72' ' ' ASN . . . . . . . . . . . . . 17.3 t-20 -136.17 143.62 44.63 Favored Pre-proline 0 CA--C 1.534 0.348 0 O-C-N 120.509 -1.369 . . . . 0.0 108.464 -173.589 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 73' ' ' PRO . . . . . . . . . . . . . 48.4 Cg_endo -71.72 -52.63 0.2 Allowed 'Trans proline' 0 C--N 1.349 0.587 0 C-N-CA 122.965 2.443 . . . . 0.0 111.455 179.721 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 74' ' ' GLN . . . . . . . . . . . . . 12.1 tt0 -57.83 -45.31 86.36 Favored 'General case' 0 C--O 1.22 -0.498 0 C-N-CA 124.277 1.031 . . . . 0.0 109.798 -175.691 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 75' ' ' LEU . . . . . . . . . . . . . 98.2 mt -61.29 -39.16 89.43 Favored 'General case' 0 CA--C 1.535 0.371 0 CA-C-N 118.966 0.803 . . . . 0.0 111.106 -177.331 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 76' ' ' ASN . . . . . . . . . . . . . 0.2 OUTLIER -64.46 -50.47 67.37 Favored 'General case' 0 N--CA 1.468 0.426 0 C-N-CA 124.554 1.142 . . . . 0.0 110.018 174.749 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 77' ' ' GLU . . . . . . . . . . . . . 18.5 tt0 -54.08 -34.75 60.97 Favored 'General case' 0 CA--C 1.539 0.542 0 C-N-CA 126.0 1.72 . . . . 0.0 111.145 175.082 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 78' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -73.88 -20.74 60.32 Favored 'General case' 0 N--CA 1.446 -0.655 0 CA-C-O 116.836 -1.554 . . . . 0.0 112.696 -175.116 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 79' ' ' ASP . . . . . . . . . . . . . 0.0 OUTLIER -54.49 -45.45 73.25 Favored 'General case' 0 N--CA 1.471 0.617 0 CA-C-N 120.474 1.488 . . . . 0.0 110.433 176.23 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 80' ' ' ASN . . . . . . . . . . . . . 3.1 p30 -99.15 -23.78 15.11 Favored 'General case' 0 N--CA 1.441 -0.887 0 C-N-CA 124.402 1.081 . . . . 0.0 109.811 -168.013 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 81' ' ' THR . . . . . . . . . . . . . 15.3 m -57.44 -57.24 13.55 Favored 'General case' 0 CA--C 1.541 0.618 0 N-CA-C 109.157 -0.683 . . . . 0.0 109.157 161.539 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 82' ' ' ILE . . . . . . . . . . . . . 10.8 tp -66.38 -37.94 80.72 Favored 'Isoleucine or valine' 0 C--N 1.345 0.372 0 CA-C-N 119.855 1.207 . . . . 0.0 111.089 -172.107 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 83' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -57.21 -46.63 82.73 Favored 'General case' 0 CA--C 1.533 0.319 0 CA-C-N 119.236 0.926 . . . . 0.0 110.529 -176.053 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 84' ' ' GLU . . . . . . . . . . . . . 4.0 mt-10 -81.56 -5.24 57.81 Favored 'General case' 0 N--CA 1.448 -0.547 0 CA-C-O 118.448 -0.787 . . . . 0.0 112.864 179.536 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 85' ' ' MET . . . . . . . . . . . . . 90.0 mtp -90.71 -4.21 56.89 Favored 'General case' 0 CA--C 1.537 0.445 0 CA-C-N 120.07 1.305 . . . . 0.0 111.985 164.8 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 86' ' ' LEU . . . . . . . . . . . . . 3.4 mm? -113.13 -32.36 6.35 Favored 'General case' 0 C--N 1.333 -0.112 0 O-C-N 121.231 -0.918 . . . . 0.0 112.071 178.043 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 87' ' ' LYS . . . . . . . . . . . . . 76.9 mttt -72.14 -49.4 36.22 Favored 'General case' 0 N--CA 1.448 -0.554 0 CA-C-N 118.817 0.735 . . . . 0.0 110.501 -177.408 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 88' ' ' GLU . . . . . . . . . . . . . 7.3 mm-40 -80.81 -3.31 50.65 Favored 'General case' 0 CA--C 1.54 0.591 0 C-N-CA 126.097 1.759 . . . . 0.0 112.642 -174.87 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 89' ' ' GLY . . . . . . . . . . . . . . . 84.5 106.04 0.6 Allowed Glycine 0 CA--C 1.524 0.656 0 CA-C-N 120.137 1.335 . . . . 0.0 110.916 -179.762 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 90' ' ' ALA . . . . . . . . . . . . . . . -79.87 152.25 29.76 Favored 'General case' 0 CA--C 1.516 -0.33 0 N-CA-C 109.014 -0.736 . . . . 0.0 109.014 170.632 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 91' ' ' GLN . . . . . . . . . . . . . 93.2 mm-40 -73.62 141.75 46.55 Favored 'General case' 0 N--CA 1.442 -0.858 0 N-CA-C 105.398 -2.075 . . . . 0.0 105.398 156.206 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 92' ' ' VAL . . . . . . . . . . . . . 7.4 p -128.9 108.8 17.74 Favored 'Isoleucine or valine' 0 N--CA 1.443 -0.821 0 N-CA-C 104.967 -2.234 . . . . 0.0 104.967 -179.502 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 93' ' ' ASP . . . . . . . . . . . . . 0.7 OUTLIER -124.81 75.48 1.43 Allowed 'General case' 0 C--N 1.327 -0.37 0 N-CA-C 106.444 -1.687 . . . . 0.0 106.444 -167.552 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 94' ' ' LEU . . . . . 0.631 HD22 HD21 ' A' ' 7' ' ' LEU . 42.0 tp -77.45 121.52 23.93 Favored 'General case' 0 C--O 1.234 0.254 0 N-CA-C 107.923 -1.14 . . . . 0.0 107.923 -178.188 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 95' ' ' THR . . . . . . . . . . . . . 1.4 m -86.65 -167.22 1.8 Allowed 'General case' 0 C--N 1.319 -0.743 0 C-N-CA 126.496 1.918 . . . . 0.0 108.057 168.238 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 96' ' ' ALA . . . . . . . . . . . . . . . -50.55 -37.87 41.87 Favored 'General case' 0 CA--C 1.543 0.676 0 O-C-N 119.563 -1.96 . . . . 0.0 113.729 -171.647 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 97' ' ' ASN . . . . . . . . . . . . . 1.3 p30 -157.3 18.48 0.29 Allowed 'General case' 0 CA--C 1.54 0.577 0 C-N-CA 125.783 1.633 . . . . 0.0 111.479 -173.363 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 98' ' ' GLN . . . . . . . . . . . . . 12.3 tt0 -136.03 116.87 14.11 Favored 'General case' 0 C--N 1.339 0.149 0 O-C-N 121.137 -0.977 . . . . 0.0 109.813 -177.673 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 99' ' ' LEU . . . . . 0.467 ' HB3' ' HB2' ' A' ' 110' ' ' TYR . 7.5 tp -77.2 117.94 19.22 Favored 'General case' 0 C--O 1.237 0.421 0 C-N-CA 127.509 2.324 . . . . 0.0 108.02 176.854 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 100' ' ' THR . . . . . . . . . . . . . 8.8 m -94.63 106.76 18.76 Favored 'General case' 0 CA--C 1.537 0.462 0 N-CA-C 106.758 -1.571 . . . . 0.0 106.758 165.192 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 101' ' ' LEU . . . . . . . . . . . . . 1.6 mm? -95.18 116.77 29.17 Favored 'General case' 0 CA--C 1.515 -0.373 0 N-CA-C 107.534 -1.284 . . . . 0.0 107.534 167.006 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 102' ' ' ALA . . . . . . . . . . . . . . . -126.71 139.47 53.12 Favored 'General case' 0 C--O 1.233 0.196 0 C-N-CA 123.499 0.719 . . . . 0.0 109.578 176.365 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 103' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -155.25 171.75 19.31 Favored 'General case' 0 N--CA 1.444 -0.755 0 C-N-CA 126.296 1.839 . . . . 0.0 107.959 178.346 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 104' ' ' ALA . . . . . . . . . . . . . . . -64.27 -22.14 66.84 Favored 'General case' 0 CA--C 1.539 0.536 0 N-CA-C 112.911 0.708 . . . . 0.0 112.911 178.025 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 105' ' ' LYS . . . . . . . . . . . . . 0.3 OUTLIER -67.61 -75.25 0.1 Allowed 'General case' 0 C--N 1.345 0.391 0 CA-C-N 119.19 0.905 . . . . 0.0 109.687 174.491 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 106' ' ' GLN . . . . . . . . . . . . . 7.8 mt-30 -147.29 178.5 8.36 Favored 'General case' 0 CA--C 1.536 0.431 0 C-N-CA 127.47 2.308 . . . . 0.0 107.825 -177.119 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 107' ' ' THR . . . . . . . . . . . . . 1.0 OUTLIER -128.7 158.22 39.19 Favored 'General case' 0 CA--C 1.542 0.636 0 C-N-CA 125.672 1.589 . . . . 0.0 107.467 171.333 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 108' ' ' LEU . . . . . . . . . . . . . 87.1 mt -145.76 162.56 37.34 Favored 'General case' 0 N--CA 1.468 0.455 0 C-N-CA 126.085 1.754 . . . . 0.0 110.491 -170.901 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 109' ' ' THR . . . . . . . . . . . . . 99.5 m -122.13 115.43 22.42 Favored 'General case' 0 C--O 1.238 0.456 0 C-N-CA 125.203 1.401 . . . . 0.0 108.196 172.293 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 110' ' ' TYR . . . . . 0.467 ' HB2' ' HB3' ' A' ' 99' ' ' LEU . 95.6 m-85 -109.68 143.32 39.61 Favored 'General case' 0 C--O 1.232 0.16 0 N-CA-C 109.617 -0.512 . . . . 0.0 109.617 171.461 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 111' ' ' LYS . . . . . . . . . . . . . 11.0 tppt? -99.08 142.97 29.89 Favored 'General case' 0 C--O 1.234 0.248 0 C-N-CA 123.954 0.902 . . . . 0.0 109.064 -178.134 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 112' ' ' LEU . . . . . . . . . . . . . 15.6 tp -73.95 60.01 0.73 Allowed 'General case' 0 CA--C 1.536 0.435 0 C-N-CA 125.275 1.43 . . . . 0.0 108.731 167.343 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 113' ' ' ALA . . . . . . . . . . . . . . . -81.8 75.43 8.74 Favored 'General case' 0 N--CA 1.449 -0.51 0 N-CA-C 106.863 -1.532 . . . . 0.0 106.863 167.67 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 114' ' ' ASP . . . . . . . . . . . . 0.269 19.5 p-10 . . . . . 0 CA--C 1.522 -0.102 0 CA-C-O 123.085 1.421 . . . . 0.0 112.307 -178.773 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 20.8 ttt . . . . . 0 CA--C 1.536 0.427 0 CA-C-O 121.396 0.617 . . . . 0.0 110.878 . . . . . . . . . 0 0 . 1 . 011 nuclear build core ' A' A ' 2' ' ' VAL . . . . . 0.449 HG11 HG12 ' A' ' 92' ' ' VAL . 14.7 p -52.77 158.12 0.48 Allowed 'Isoleucine or valine' 0 CA--C 1.545 0.777 0 C-N-CA 128.088 2.555 . . . . 0.0 112.271 171.906 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 3' ' ' THR . . . . . . . . . . . . . 57.1 p -133.82 164.99 40.06 Favored Pre-proline 0 N--CA 1.467 0.425 0 O-C-N 121.24 -0.913 . . . . 0.0 111.071 178.367 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 4' ' ' PRO . . . . . . . . . . . . . 37.9 Cg_endo -62.84 -38.94 44.92 Favored 'Trans proline' 0 C--N 1.344 0.311 0 C-N-CA 123.565 2.843 . . . . 0.0 113.058 170.243 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 5' ' ' GLU . . . . . . . . . . . . . 8.7 tt0 -63.92 -44.73 92.02 Favored 'General case' 0 C--N 1.329 -0.284 0 C-N-CA 122.583 0.353 . . . . 0.0 111.019 -173.757 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 6' ' ' GLN . . . . . . . . . . . . . 13.5 pt20 -71.95 13.81 0.26 Allowed 'General case' 0 CA--C 1.541 0.611 0 C-N-CA 123.53 0.732 . . . . 0.0 112.744 179.542 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 7' ' ' LEU . . . . . . . . . . . . . 95.6 mt -126.52 -51.36 1.49 Allowed 'General case' 0 N--CA 1.452 -0.361 0 C-N-CA 125.928 1.691 . . . . 0.0 110.441 -176.58 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 8' ' ' GLN . . . . . . . . . . . . 0.267 2.8 pt20 -54.97 -12.07 0.76 Allowed 'General case' 0 N--CA 1.478 0.929 0 N-CA-C 115.098 1.518 . . . . 0.0 115.098 -173.303 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 9' ' ' HIS . . . . . . . . . . . . . 3.1 m80 -125.63 13.84 8.09 Favored 'General case' 0 N--CA 1.443 -0.815 0 C-N-CA 125.44 1.496 . . . . 0.0 110.469 -169.509 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 10' ' ' HIS . . . . . . . . . . . . . 81.2 m-70 -141.42 126.02 17.86 Favored 'General case' 0 CA--C 1.538 0.483 0 C-N-CA 124.844 1.258 . . . . 0.0 112.162 -175.196 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 11' ' ' ARG . . . . . . . . . . . . . 39.3 ttt180 -68.66 149.63 48.88 Favored 'General case' 0 N--CA 1.467 0.417 0 C-N-CA 123.7 0.8 . . . . 0.0 110.004 165.63 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 12' ' ' PHE . . . . . . . . . . . . . 30.9 m-85 -129.64 167.07 18.53 Favored 'General case' 0 CA--C 1.538 0.489 0 C-N-CA 124.314 1.046 . . . . 0.0 109.66 163.417 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 13' ' ' VAL . . . . . 0.409 ' HA ' ' HA ' ' A' ' 30' ' ' GLU . 12.7 p -135.44 147.15 28.99 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.619 0 O-C-N 121.053 -1.029 . . . . 0.0 110.313 176.346 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 14' ' ' LEU . . . . . . . . . . . . . 43.6 tp -73.17 97.58 2.43 Favored 'General case' 0 N--CA 1.456 -0.155 0 N-CA-C 107.763 -1.199 . . . . 0.0 107.763 172.011 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 4.9 mm-40 -79.36 -50.64 10.54 Favored 'General case' 0 C--N 1.324 -0.503 0 N-CA-C 108.983 -0.747 . . . . 0.0 108.983 173.527 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 77.5 p -147.72 165.38 30.67 Favored 'General case' 0 C--O 1.236 0.365 0 CA-C-O 122.236 1.017 . . . . 0.0 112.595 -176.643 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 17' ' ' VAL . . . . . . . . . . . . . 13.3 t -132.83 161.85 40.91 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.53 0 C-N-CA 127.04 2.136 . . . . 0.0 107.16 -164.73 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 18' ' ' ASN . . . . . 0.403 ' HB2' ' H ' ' A' ' 107' ' ' THR . 30.9 t30 -56.41 -36.45 68.96 Favored 'General case' 0 N--CA 1.468 0.436 0 C-N-CA 124.272 1.029 . . . . 0.0 113.424 -177.379 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . -94.09 -31.73 7.9 Favored Glycine 0 C--N 1.335 0.473 0 CA-C-O 118.593 -1.115 . . . . 0.0 113.919 -167.521 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 1.3 pttt 174.47 154.85 0.31 Allowed Pre-proline 0 N--CA 1.465 0.317 0 C-N-CA 127.922 2.489 . . . . 0.0 107.012 -177.636 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 21' ' ' PRO . . . . . . . . . . . . . 72.0 Cg_endo -71.29 177.29 6.79 Favored 'Trans proline' 0 N--CA 1.454 -0.816 0 C-N-CA 121.537 1.492 . . . . 0.0 111.289 -179.13 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 22' ' ' VAL . . . . . . . . . . . . . 7.0 p -129.8 164.67 31.84 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.408 0 C-N-CA 125.403 1.481 . . . . 0.0 108.497 -172.792 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 23' ' ' THR . . . . . . . . . . . . . 0.6 OUTLIER -146.64 129.56 16.32 Favored 'General case' 0 CA--C 1.534 0.342 0 N-CA-C 107.11 -1.441 . . . . 0.0 107.11 174.671 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 24' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER -152.29 84.85 1.26 Allowed 'General case' 0 C--N 1.328 -0.347 0 N-CA-C 104.448 -2.427 . . . . 0.0 104.448 171.134 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 25' ' ' ASP . . . . . . . . . . . . . 0.8 OUTLIER -51.51 -40.7 60.11 Favored 'General case' 0 C--N 1.33 -0.25 0 C-N-CA 123.976 0.91 . . . . 0.0 109.492 175.441 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 26' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -91.4 107.18 19.03 Favored 'General case' 0 N--CA 1.449 -0.492 0 C-N-CA 125.829 1.652 . . . . 0.0 108.893 177.99 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 27' ' ' ASN . . . . . . . . . . . . . 73.9 m-80 47.75 73.37 1.01 Allowed Pre-proline 0 CA--C 1.537 0.456 0 C-N-CA 127.356 2.262 . . . . 0.0 112.116 173.228 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 28' ' ' PRO . . . . . . . . . . . . . 52.2 Cg_endo -66.59 170.76 11.83 Favored 'Trans proline' 0 C--O 1.242 0.678 0 C-N-CA 122.839 2.359 . . . . 0.0 112.615 -176.545 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 29' ' ' PRO . . . . . . . . . . . . . 43.6 Cg_endo -71.22 63.64 2.69 Favored 'Trans proline' 0 CA--C 1.538 0.705 0 C-N-CA 123.747 2.964 . . . . 0.0 111.615 173.411 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 30' ' ' GLU . . . . . 0.409 ' HA ' ' HA ' ' A' ' 13' ' ' VAL . 16.4 pt-20 -81.64 166.49 20.13 Favored 'General case' 0 C--O 1.24 0.557 0 O-C-N 120.461 -1.399 . . . . 0.0 109.927 174.275 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 31' ' ' ILE . . . . . . . . . . . . . 12.7 tt -139.57 138.23 39.6 Favored 'Isoleucine or valine' 0 N--CA 1.455 -0.224 0 N-CA-C 107.632 -1.247 . . . . 0.0 107.632 -179.969 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 32' ' ' SER . . . . . . . . . . . . . 36.8 p -124.01 120.97 33.99 Favored 'General case' 0 N--CA 1.445 -0.689 0 N-CA-C 106.627 -1.62 . . . . 0.0 106.627 176.882 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 33' ' ' PHE . . . . . . . . . . . . . 75.3 m-85 -86.88 137.55 32.29 Favored 'General case' 0 N--CA 1.448 -0.536 0 N-CA-C 105.035 -2.209 . . . . 0.0 105.035 171.97 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 34' ' ' GLY . . . . . . . . . . . . . . . -156.97 163.95 32.53 Favored Glycine 0 C--N 1.335 0.504 0 O-C-N 121.063 -1.023 . . . . 0.0 110.663 178.46 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 35' ' ' GLU . . . . . . . . . . . . . 3.9 tt0 63.73 -161.98 0.28 Allowed 'General case' 0 N--CA 1.452 -0.363 0 CA-C-N 118.675 1.238 . . . . 0.0 110.525 175.432 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 2.8 mtpt -59.32 71.71 0.01 OUTLIER 'General case' 0 CA--C 1.539 0.557 0 C-N-CA 127.046 2.139 . . . . 0.0 111.503 -177.005 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 37' ' ' MET . . . . . . . . . . . . 0.297 0.0 OUTLIER 50.71 19.36 0.59 Allowed 'General case' 0 N--CA 1.445 -0.688 0 C-N-CA 128.19 2.596 . . . . 0.0 115.449 -169.52 . . . . . . . . 3 3 . 1 . 011 nuclear build core ' A' A ' 38' ' ' MET . . . . . . . . . . . . . 0.7 OUTLIER -67.34 165.4 16.47 Favored 'General case' 0 N--CA 1.443 -0.777 0 O-C-N 120.877 -1.139 . . . . 0.0 110.757 -174.772 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 39' ' ' ILE . . . . . . . . . . . . . 5.2 mt -135.11 126.46 46.32 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.368 0 N-CA-C 105.75 -1.944 . . . . 0.0 105.75 -169.754 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 40' ' ' SER . . . . . . . . . . . . . 7.4 m -129.92 151.59 50.31 Favored 'General case' 0 CA--C 1.531 0.235 0 N-CA-C 107.819 -1.178 . . . . 0.0 107.819 169.039 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 41' ' ' GLY . . . . . . . . . . . . . . . 178.46 173.91 44.25 Favored Glycine 0 C--O 1.237 0.316 0 N-CA-C 109.599 -1.4 . . . . 0.0 109.599 -178.34 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 42' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -147.38 83.61 1.55 Allowed 'General case' 0 N--CA 1.451 -0.405 0 O-C-N 122.226 -0.573 . . . . 0.0 111.134 179.982 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 43' ' ' MET . . . . . . . . . . . . . 6.1 mmt -47.82 -55.71 9.12 Favored 'General case' 0 C--N 1.342 0.266 0 C-N-CA 123.68 0.792 . . . . 0.0 109.006 169.14 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 44' ' ' CYS . . . . . 1.293 ' SG ' ' SG ' ' A' ' 70' ' ' CYS . 18.0 p -163.26 -27.38 0.04 OUTLIER 'General case' 0 N--CA 1.443 -0.819 0 C-N-CA 125.115 1.366 . . . . 0.0 110.989 176.093 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 45' ' ' ASN . . . . . . . . . . . . . 0.5 OUTLIER -121.38 20.23 11.26 Favored 'General case' 0 N--CA 1.47 0.559 0 C-N-CA 126.265 1.826 . . . . 0.0 112.217 -167.107 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 46' ' ' ARG . . . . . . . . . . . . . 34.3 mtm180 48.35 166.88 0.0 OUTLIER 'General case' 0 C--N 1.329 -0.312 0 C-N-CA 127.011 2.124 . . . . 0.0 111.661 -155.124 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 47' ' ' PHE . . . . . . . . . . . . . 6.0 p90 -164.41 147.93 9.29 Favored 'General case' 0 C--N 1.317 -0.819 0 N-CA-C 106.127 -1.805 . . . . 0.0 106.127 166.029 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 48' ' ' SER . . . . . . . . . . . . . 1.5 p -160.75 151.79 18.82 Favored 'General case' 0 C--N 1.314 -0.954 0 N-CA-C 107.304 -1.369 . . . . 0.0 107.304 179.529 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 49' ' ' GLY . . . . . . . . . . . . . . . -172.51 163.05 35.01 Favored Glycine 0 CA--C 1.524 0.635 0 N-CA-C 106.574 -2.61 . . . . 0.0 106.574 165.852 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 50' ' ' GLU . . . . . . . . . . . . . 25.8 mt-10 -64.27 115.68 5.28 Favored 'General case' 0 C--O 1.238 0.498 0 N-CA-C 107.781 -1.192 . . . . 0.0 107.781 172.109 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 51' ' ' GLY . . . . . . . . . . . . . . . -61.42 161.36 26.48 Favored Glycine 0 CA--C 1.531 1.064 0 O-C-N 123.628 0.58 . . . . 0.0 113.388 174.545 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 52' ' ' LYS . . . . . . . . . . . . . 25.9 ttpt -133.4 135.53 44.71 Favored 'General case' 0 N--CA 1.464 0.227 0 O-C-N 121.692 -0.887 . . . . 0.0 109.219 165.894 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 53' ' ' LEU . . . . . . . . . . . . . 9.6 tp -160.47 93.76 1.04 Allowed 'General case' 0 N--CA 1.453 -0.31 0 C-N-CA 123.511 0.724 . . . . 0.0 109.881 -176.356 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 2.5 t -136.74 -12.45 1.75 Allowed 'General case' 0 C--N 1.326 -0.445 0 C-N-CA 123.721 0.808 . . . . 0.0 111.047 168.765 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 55' ' ' ASN . . . . . . . . . . . . . 4.3 t30 -136.6 24.67 3.14 Favored 'General case' 0 CA--C 1.541 0.602 0 C-N-CA 127.114 2.165 . . . . 0.0 109.944 -171.851 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 56' ' ' GLY . . . . . . . . . . . . . . . 73.66 -3.55 33.8 Favored Glycine 0 CA--C 1.532 1.096 0 O-C-N 120.584 -1.322 . . . . 0.0 114.716 -175.968 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 57' ' ' GLU . . . . . . . . . . . . . 30.9 tt0 -110.45 105.28 14.2 Favored 'General case' 0 N--CA 1.452 -0.363 0 CA-C-N 118.747 1.274 . . . . 0.0 110.159 -161.539 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 58' ' ' LEU . . . . . 0.612 ' HB2' HG21 ' A' ' 92' ' ' VAL . 21.2 tp -75.99 93.83 3.32 Favored 'General case' 0 CA--C 1.536 0.408 0 C-N-CA 125.222 1.409 . . . . 0.0 112.251 176.84 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 59' ' ' THR . . . . . . . . . . . . . 14.9 p -108.02 127.74 54.04 Favored 'General case' 0 N--CA 1.474 0.742 0 C-N-CA 124.815 1.246 . . . . 0.0 109.955 172.916 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 60' ' ' ALA . . . . . . . . . . . . . . . -132.0 87.34 2.43 Favored 'General case' 0 N--CA 1.454 -0.226 0 C-N-CA 124.443 1.097 . . . . 0.0 109.504 173.571 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 61' ' ' LYS . . . . . . . . . . . . . 47.6 tttm -44.89 -62.4 1.24 Allowed 'General case' 0 C--N 1.331 -0.209 0 C-N-CA 125.817 1.647 . . . . 0.0 110.082 167.745 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 62' ' ' GLY . . . . . . . . . . . . . . . -79.38 45.57 2.87 Favored Glycine 0 CA--C 1.521 0.441 0 C-N-CA 125.251 1.405 . . . . 0.0 112.725 -176.52 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 63' ' ' LEU . . . . . . . . . . . . . 5.7 tp -63.56 142.6 58.34 Favored 'General case' 0 N--CA 1.441 -0.879 0 CA-C-N 118.474 1.137 . . . . 0.0 108.248 166.641 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 64' ' ' ALA . . . . . . . . . . . . . . . -128.88 93.11 3.53 Favored 'General case' 0 N--CA 1.455 -0.223 0 C-N-CA 124.727 1.211 . . . . 0.0 109.741 -173.351 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 65' ' ' MET . . . . . . . . . . . . . 74.9 mtp -115.64 156.36 26.01 Favored 'General case' 0 N--CA 1.467 0.406 0 C-N-CA 124.717 1.207 . . . . 0.0 110.346 -177.377 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 66' ' ' THR . . . . . . . . . . . . . 34.7 p -88.73 -172.06 3.57 Favored 'General case' 0 CA--C 1.544 0.717 0 C-N-CA 123.933 0.893 . . . . 0.0 109.736 173.245 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 67' ' ' ARG . . . . . . . . . . . . . 34.0 mtm180 -130.45 14.34 5.52 Favored 'General case' 0 N--CA 1.47 0.564 0 C-N-CA 124.005 0.922 . . . . 0.0 112.97 170.614 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 68' ' ' MET . . . . . . . . . . . . . 4.0 mpp? -61.5 166.53 4.0 Favored 'General case' 0 CA--C 1.532 0.254 0 O-C-N 120.033 -1.667 . . . . 0.0 111.688 178.367 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 69' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -58.02 111.08 1.06 Allowed 'General case' 0 N--CA 1.445 -0.677 0 C-N-CA 125.96 1.704 . . . . 0.0 108.291 171.305 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 70' ' ' CYS . . . . . 1.293 ' SG ' ' SG ' ' A' ' 44' ' ' CYS . 69.7 m -62.12 -14.09 33.34 Favored 'General case' 0 C--O 1.231 0.111 0 CA-C-O 118.485 -0.769 . . . . 0.0 112.86 170.585 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 71' ' ' ALA . . . . . . . . . . . . . . . 61.03 3.98 0.76 Allowed 'General case' 0 CA--C 1.533 0.295 0 C-N-CA 126.69 1.996 . . . . 0.0 115.38 163.941 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 72' ' ' ASN . . . . . . . . . . . . . 7.4 t30 -142.73 143.4 25.72 Favored Pre-proline 0 N--CA 1.466 0.373 0 N-CA-C 107.775 -1.194 . . . . 0.0 107.775 158.315 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 73' ' ' PRO . . . . . . . . . . . . . 19.0 Cg_endo -63.83 -47.02 7.54 Favored 'Trans proline' 0 C--N 1.346 0.411 0 C-N-CA 123.148 2.565 . . . . 0.0 111.815 -165.963 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 74' ' ' GLN . . . . . . . . . . . . . 48.2 tt0 -59.79 -38.65 82.5 Favored 'General case' 0 CA--C 1.532 0.272 0 CA-C-O 119.238 -0.41 . . . . 0.0 110.616 -179.052 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 75' ' ' LEU . . . . . 0.425 ' HB3' ' HB3' ' A' ' 44' ' ' CYS . 36.7 mt -72.24 -41.99 66.17 Favored 'General case' 0 CA--C 1.533 0.301 0 N-CA-C 109.269 -0.641 . . . . 0.0 109.269 -178.115 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 76' ' ' ASN . . . . . 0.416 ' CB ' ' HB2' ' A' ' 70' ' ' CYS . 4.1 t-20 -63.14 -37.85 88.86 Favored 'General case' 0 N--CA 1.469 0.494 0 C-N-CA 123.104 0.562 . . . . 0.0 111.188 -179.721 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 77' ' ' GLU . . . . . . . . . . . . . 0.7 OUTLIER -60.53 -24.33 65.28 Favored 'General case' 0 CA--C 1.542 0.647 0 N-CA-C 113.331 0.863 . . . . 0.0 113.331 175.257 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 78' ' ' LEU . . . . . . . . . . . . . 94.3 mt -89.37 -15.42 33.36 Favored 'General case' 0 CA--C 1.522 -0.128 0 CA-C-O 118.352 -0.832 . . . . 0.0 111.585 -176.375 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 79' ' ' ASP . . . . . . . . . . . . . 35.5 t70 -55.9 -42.26 75.74 Favored 'General case' 0 CA--C 1.518 -0.26 0 C-N-CA 124.952 1.301 . . . . 0.0 111.895 175.58 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 80' ' ' ASN . . . . . . . . . . . . . 71.6 m-20 -77.16 -55.49 5.39 Favored 'General case' 0 N--CA 1.451 -0.398 0 N-CA-C 107.47 -1.307 . . . . 0.0 107.47 -179.104 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 81' ' ' THR . . . . . . . . . . . . . 22.5 m -45.23 -54.95 6.34 Favored 'General case' 0 CA--C 1.536 0.405 0 C-N-CA 126.241 1.816 . . . . 0.0 110.938 -176.931 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 82' ' ' ILE . . . . . . . . . . . . . 9.5 tp -64.93 -40.74 90.08 Favored 'Isoleucine or valine' 0 C--O 1.236 0.362 0 CA-C-N 119.089 0.859 . . . . 0.0 111.373 -175.529 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 83' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -64.86 -38.63 91.61 Favored 'General case' 0 N--CA 1.449 -0.513 0 N-CA-C 109.083 -0.71 . . . . 0.0 109.083 -175.893 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 84' ' ' GLU . . . . . . . . . . . . . 94.7 mt-10 -74.75 -34.1 62.46 Favored 'General case' 0 N--CA 1.446 -0.631 0 C-N-CA 126.705 2.002 . . . . 0.0 111.374 -177.402 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 85' ' ' MET . . . . . . . . . . . . . 84.3 mtp -67.31 -55.09 15.29 Favored 'General case' 0 C--N 1.34 0.192 0 CA-C-O 122.131 0.967 . . . . 0.0 108.556 -179.678 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 86' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -66.6 -20.79 66.09 Favored 'General case' 0 C--N 1.333 -0.122 0 C-N-CA 123.657 0.783 . . . . 0.0 111.98 -173.93 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 87' ' ' LYS . . . . . . . . . . . . . 2.5 tptt -71.19 -40.49 71.16 Favored 'General case' 0 N--CA 1.453 -0.321 0 CA-C-O 117.668 -1.158 . . . . 0.0 111.303 179.153 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 88' ' ' GLU . . . . . . . . . . . . . 0.6 OUTLIER -84.54 -37.94 20.62 Favored 'General case' 0 C--N 1.341 0.225 0 O-C-N 124.282 0.989 . . . . 0.0 112.169 -175.615 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 89' ' ' GLY . . . . . . . . . . . . . . . 122.09 84.94 0.75 Allowed Glycine 0 CA--C 1.503 -0.7 0 N-CA-C 109.937 -1.265 . . . . 0.0 109.937 -174.031 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 90' ' ' ALA . . . . . . . . . . . . . . . -67.33 139.43 57.23 Favored 'General case' 0 N--CA 1.447 -0.616 0 N-CA-C 108.441 -0.948 . . . . 0.0 108.441 175.336 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 91' ' ' GLN . . . . . . . . . . . . . 6.9 mp0 -67.33 141.94 56.97 Favored 'General case' 0 N--CA 1.439 -1.01 0 N-CA-C 105.305 -2.109 . . . . 0.0 105.305 164.897 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 92' ' ' VAL . . . . . 0.612 HG21 ' HB2' ' A' ' 58' ' ' LEU . 79.5 t -130.01 117.76 41.91 Favored 'Isoleucine or valine' 0 N--CA 1.447 -0.607 0 N-CA-C 105.561 -2.015 . . . . 0.0 105.561 178.597 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 93' ' ' ASP . . . . . . . . . . . . . 31.4 m-20 -128.0 84.79 2.28 Favored 'General case' 0 C--N 1.327 -0.375 0 C-N-CA 127.065 2.146 . . . . 0.0 105.309 -171.764 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 94' ' ' LEU . . . . . . . . . . . . . 57.8 tp -85.2 109.17 18.12 Favored 'General case' 0 CA--C 1.516 -0.359 0 CA-C-O 122.336 1.065 . . . . 0.0 108.568 173.131 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 95' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -77.75 179.27 6.74 Favored 'General case' 0 C--N 1.315 -0.933 0 C-N-CA 127.022 2.129 . . . . 0.0 109.115 169.086 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 96' ' ' ALA . . . . . . . . . . . . . . . -44.52 -41.94 6.81 Favored 'General case' 0 CA--C 1.535 0.373 0 C-N-CA 125.021 1.328 . . . . 0.0 114.026 -163.918 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 97' ' ' ASN . . . . . . . . . . . . . 17.0 p30 -150.96 31.55 0.62 Allowed 'General case' 0 CA--C 1.535 0.376 0 C-N-CA 125.352 1.461 . . . . 0.0 111.993 170.92 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 98' ' ' GLN . . . . . . . . . . . . . 13.7 tt0 -147.8 125.57 11.89 Favored 'General case' 0 N--CA 1.457 -0.122 0 O-C-N 121.484 -0.76 . . . . 0.0 109.83 -178.62 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 99' ' ' LEU . . . . . . . . . . . . . 22.5 tp -90.22 129.64 36.45 Favored 'General case' 0 C--N 1.327 -0.399 0 C-N-CA 126.615 1.966 . . . . 0.0 110.448 -177.007 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 100' ' ' THR . . . . . . . . . . . . . 74.5 m -104.58 128.64 52.63 Favored 'General case' 0 N--CA 1.454 -0.271 0 C-N-CA 123.815 0.846 . . . . 0.0 109.593 158.931 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 101' ' ' LEU . . . . . . . . . . . . . 1.0 OUTLIER -98.13 141.93 30.45 Favored 'General case' 0 CA--C 1.519 -0.222 0 C-N-CA 126.175 1.79 . . . . 0.0 107.126 159.881 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 102' ' ' ALA . . . . . . . . . . . . . . . -143.76 148.13 35.18 Favored 'General case' 0 C--N 1.328 -0.362 0 C-N-CA 124.814 1.246 . . . . 0.0 107.831 172.015 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 103' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -162.54 173.42 14.01 Favored 'General case' 0 N--CA 1.442 -0.838 0 C-N-CA 126.89 2.076 . . . . 0.0 107.651 173.591 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 104' ' ' ALA . . . . . . . . . . . . . . . -51.17 -36.64 42.11 Favored 'General case' 0 CA--C 1.531 0.214 0 C-N-CA 123.803 0.841 . . . . 0.0 112.146 173.868 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 105' ' ' LYS . . . . . . . . . . . . . 12.5 mmtp -63.33 -74.61 0.09 Allowed 'General case' 0 C--N 1.339 0.113 0 CA-C-O 118.683 -0.675 . . . . 0.0 111.162 174.706 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 106' ' ' GLN . . . . . . . . . . . . . 2.6 pt20 -152.73 -172.04 4.12 Favored 'General case' 0 CA--C 1.534 0.355 0 CA-C-N 118.625 0.648 . . . . 0.0 111.667 -176.261 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 107' ' ' THR . . . . . 0.403 ' H ' ' HB2' ' A' ' 18' ' ' ASN . 1.8 t -128.58 135.81 49.87 Favored 'General case' 0 CA--C 1.534 0.345 0 C-N-CA 126.321 1.848 . . . . 0.0 107.875 177.498 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 108' ' ' LEU . . . . . 0.401 HD23 ' CE1' ' A' ' 110' ' ' TYR . 5.9 mp -123.78 149.83 45.17 Favored 'General case' 0 C--O 1.233 0.229 0 C-N-CA 128.346 2.658 . . . . 0.0 107.604 -173.838 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 109' ' ' THR . . . . . . . . . . . . . 1.3 m -132.08 102.19 5.71 Favored 'General case' 0 C--O 1.238 0.45 0 CA-C-O 121.746 0.784 . . . . 0.0 109.469 -176.367 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 110' ' ' TYR . . . . . 0.401 ' CE1' HD23 ' A' ' 108' ' ' LEU . 51.5 m-85 -103.26 144.61 31.11 Favored 'General case' 0 N--CA 1.453 -0.318 0 C-N-CA 124.925 1.29 . . . . 0.0 110.375 -173.893 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 111' ' ' LYS . . . . . . . . . . . . . 0.8 OUTLIER -98.81 142.65 30.07 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-O 117.739 -1.124 . . . . 0.0 109.398 -176.769 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 112' ' ' LEU . . . . . . . . . . . . . 39.1 tp -74.14 56.91 0.63 Allowed 'General case' 0 CA--C 1.542 0.644 0 C-N-CA 124.017 0.927 . . . . 0.0 109.214 162.586 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 113' ' ' ALA . . . . . . . . . . . . . . . -92.22 63.68 4.34 Favored 'General case' 0 C--O 1.236 0.368 0 CA-C-O 122.487 1.137 . . . . 0.0 108.456 -177.625 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 114' ' ' ASP . . . . . . . . . . . . . 5.1 p-10 . . . . . 0 C--N 1.326 -0.43 0 CA-C-N 114.633 -1.167 . . . . 0.0 113.203 -157.202 . . . . . . . . 0 0 . 1 . 012 nuclear build core ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 53.0 ttp . . . . . 0 N--CA 1.452 -0.371 0 N-CA-C 108.853 -0.795 . . . . 0.0 108.853 . . . . . . . . . 0 0 . 1 . 012 nuclear build core ' A' A ' 2' ' ' VAL . . . . . 0.426 HG23 ' HB3' ' A' ' 94' ' ' LEU . 13.4 p -67.44 160.46 4.31 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.366 0 C-N-CA 123.986 0.914 . . . . 0.0 111.177 175.117 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 3' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -124.66 156.52 67.99 Favored Pre-proline 0 CA--C 1.541 0.616 0 C-N-CA 125.601 1.56 . . . . 0.0 111.093 163.885 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 4' ' ' PRO . . . . . . . . . . . . . 93.9 Cg_endo -72.72 -33.15 8.53 Favored 'Trans proline' 0 C--N 1.347 0.493 0 C-N-CA 124.001 3.134 . . . . 0.0 111.704 -174.943 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 5' ' ' GLU . . . . . . . . . . . . . 49.6 tt0 -44.51 -44.91 8.97 Favored 'General case' 0 CA--C 1.537 0.443 0 C-N-CA 124.304 1.041 . . . . 0.0 109.277 169.847 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 6' ' ' GLN . . . . . . . . . . . . . 37.8 mt-30 -70.35 4.88 2.0 Favored 'General case' 0 CA--C 1.538 0.503 0 N-CA-C 114.364 1.246 . . . . 0.0 114.364 -179.351 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 7' ' ' LEU . . . . . . . . . . . . . 19.7 mt -125.75 -48.98 1.63 Allowed 'General case' 0 C--N 1.333 -0.123 0 C-N-CA 125.712 1.605 . . . . 0.0 110.299 -174.922 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 8' ' ' GLN . . . . . . . . . . . . . 14.4 mt-30 -58.21 -2.73 0.2 Allowed 'General case' 0 CA--C 1.54 0.573 0 C-N-CA 127.395 2.278 . . . . 0.0 115.682 -171.708 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 9' ' ' HIS . . . . . . . . . . . . . 56.3 m-70 -141.15 8.07 2.03 Favored 'General case' 0 CA--C 1.537 0.461 0 C-N-CA 125.204 1.402 . . . . 0.0 112.809 173.296 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 10' ' ' HIS . . . . . . . . . . . . . 95.8 m-70 -122.6 120.17 32.97 Favored 'General case' 0 CA--C 1.529 0.152 0 CA-C-N 119.339 0.972 . . . . 0.0 109.937 -169.798 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 11' ' ' ARG . . . . . 0.464 HH21 ' CD ' ' A' ' 30' ' ' GLU . 1.2 ttt85 -81.76 150.79 27.76 Favored 'General case' 0 CA--C 1.517 -0.317 0 C-N-CA 124.049 0.94 . . . . 0.0 111.226 -179.577 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 12' ' ' PHE . . . . . 0.439 ' HB3' ' HB3' ' A' ' 110' ' ' TYR . 95.7 m-85 -139.11 159.08 43.0 Favored 'General case' 0 N--CA 1.438 -1.026 0 C-N-CA 125.829 1.652 . . . . 0.0 108.634 174.539 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 13' ' ' VAL . . . . . 0.411 ' HA ' ' HA ' ' A' ' 30' ' ' GLU . 0.0 OUTLIER -136.02 140.06 44.69 Favored 'Isoleucine or valine' 0 C--N 1.312 -1.025 0 C-N-CA 128.346 2.658 . . . . 0.0 106.391 -170.236 . . . . . . . . 3 3 . 1 . 012 nuclear build core ' A' A ' 14' ' ' LEU . . . . . . . . . . . . . 15.2 tp -77.48 77.82 4.0 Favored 'General case' 0 N--CA 1.465 0.287 0 CA-C-O 122.407 1.099 . . . . 0.0 110.376 -177.958 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 7.3 tp10 -63.79 -41.01 98.02 Favored 'General case' 0 C--N 1.324 -0.536 0 C-N-CA 127.03 2.132 . . . . 0.0 110.655 -174.241 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 2.6 p -154.78 147.55 24.39 Favored 'General case' 0 CA--C 1.535 0.365 0 N-CA-C 113.949 1.092 . . . . 0.0 113.949 167.811 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 17' ' ' VAL . . . . . . . . . . . . . 13.7 t -95.9 166.96 1.75 Allowed 'Isoleucine or valine' 0 N--CA 1.462 0.157 0 C-N-CA 125.467 1.507 . . . . 0.0 108.177 176.842 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 18' ' ' ASN . . . . . . . . . . . . . 15.0 t30 -44.8 -23.54 0.14 Allowed 'General case' 0 CA--C 1.536 0.409 0 C-N-CA 128.476 2.71 . . . . 0.0 114.857 168.846 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . -112.01 -54.88 0.48 Allowed Glycine 0 C--N 1.335 0.498 0 C-N-CA 124.256 0.932 . . . . 0.0 112.789 179.761 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -153.99 161.92 28.07 Favored Pre-proline 0 CA--C 1.533 0.3 0 C-N-CA 124.696 1.198 . . . . 0.0 108.821 -166.856 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 21' ' ' PRO . . . . . . . . . . . . . 59.4 Cg_endo -71.95 173.54 12.66 Favored 'Trans proline' 0 N--CA 1.456 -0.688 0 C-N-CA 121.772 1.648 . . . . 0.0 110.995 175.165 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 22' ' ' VAL . . . . . . . . . . . . . 3.9 t -119.9 145.38 26.25 Favored 'Isoleucine or valine' 0 C--O 1.233 0.223 0 N-CA-C 106.917 -1.512 . . . . 0.0 106.917 175.465 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 23' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -145.37 117.55 8.38 Favored 'General case' 0 C--N 1.324 -0.527 0 N-CA-C 108.112 -1.07 . . . . 0.0 108.112 172.959 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 24' ' ' SER . . . . . . . . . . . . . 70.4 p -117.2 4.24 12.65 Favored 'General case' 0 N--CA 1.462 0.169 0 O-C-N 120.971 -1.081 . . . . 0.0 112.746 175.932 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 25' ' ' ASP . . . . . . . . . . . . . 1.7 t70 62.21 -37.61 0.13 Allowed 'General case' 0 N--CA 1.475 0.791 0 C-N-CA 131.183 3.793 . . . . 0.0 114.464 -179.209 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 26' ' ' LYS . . . . . . . . . . . . . 7.0 tptp -134.98 155.45 50.73 Favored 'General case' 0 N--CA 1.438 -1.072 0 C-N-CA 128.223 2.609 . . . . 0.0 105.468 171.435 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 27' ' ' ASN . . . . . . . . . . . . . 76.6 m-20 49.13 68.07 3.88 Favored Pre-proline 0 C--N 1.325 -0.469 0 C-N-CA 126.232 1.813 . . . . 0.0 110.28 177.382 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 28' ' ' PRO . . . . . . . . . . . . . 54.7 Cg_endo -64.51 155.1 68.28 Favored 'Trans proline' 0 N--CA 1.455 -0.738 0 C-N-CA 122.559 2.172 . . . . 0.0 110.633 177.108 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 29' ' ' PRO . . . . . . . . . . . . . 30.1 Cg_endo -69.13 78.95 0.77 Allowed 'Trans proline' 0 N--CA 1.455 -0.776 0 C-N-CA 123.045 2.496 . . . . 0.0 108.841 166.155 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 30' ' ' GLU . . . . . 0.464 ' CD ' HH21 ' A' ' 11' ' ' ARG . 8.4 pt-20 -106.49 150.03 26.5 Favored 'General case' 0 C--N 1.319 -0.735 0 C-N-CA 127.66 2.384 . . . . 0.0 106.38 -178.829 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 31' ' ' ILE . . . . . . . . . . . . . 16.6 tt -132.14 144.8 36.03 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.467 0 N-CA-C 107.001 -1.481 . . . . 0.0 107.001 -173.752 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 32' ' ' SER . . . . . . . . . . . . . 65.6 p -138.5 164.69 28.76 Favored 'General case' 0 N--CA 1.447 -0.602 0 N-CA-C 107.199 -1.408 . . . . 0.0 107.199 172.71 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 33' ' ' PHE . . . . . . . . . . . . . 59.2 m-85 -125.78 163.68 22.33 Favored 'General case' 0 N--CA 1.447 -0.623 0 N-CA-C 109.018 -0.734 . . . . 0.0 109.018 176.505 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 34' ' ' GLY . . . . . . . . . . . . . . . -151.4 -171.85 19.74 Favored Glycine 0 N--CA 1.451 -0.301 0 N-CA-C 109.033 -1.627 . . . . 0.0 109.033 172.748 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 35' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -44.34 150.69 0.29 Allowed 'General case' 0 CA--C 1.531 0.24 0 C-N-CA 126.374 1.87 . . . . 0.0 111.106 -175.577 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 36' ' ' LYS . . . . . 0.433 ' HE3' ' HA ' ' A' ' 36' ' ' LYS . 0.0 OUTLIER 57.1 26.83 12.52 Favored 'General case' 0 CA--C 1.533 0.316 0 C-N-CA 124.496 1.118 . . . . 0.0 111.0 -169.486 . . . . . . . . 3 3 . 1 . 012 nuclear build core ' A' A ' 37' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER 51.6 28.66 4.85 Favored 'General case' 0 CA--C 1.542 0.658 0 C-N-CA 125.587 1.555 . . . . 0.0 111.573 -178.126 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 38' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -57.6 141.64 47.43 Favored 'General case' 0 N--CA 1.444 -0.761 0 C-N-CA 125.536 1.534 . . . . 0.0 109.633 -179.606 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 39' ' ' ILE . . . . . . . . . . . . . 18.8 mt -112.37 126.09 69.73 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.703 0 C-N-CA 126.429 1.892 . . . . 0.0 106.504 -170.099 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 40' ' ' SER . . . . . . . . . . . . . 69.4 m -135.71 135.7 40.26 Favored 'General case' 0 C--O 1.236 0.357 0 C-N-CA 124.213 1.005 . . . . 0.0 110.749 -178.964 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 41' ' ' GLY . . . . . . . . . . . . . . . 167.88 176.87 38.8 Favored Glycine 0 CA--C 1.534 1.245 0 C-N-CA 124.139 0.876 . . . . 0.0 112.225 -174.868 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 42' ' ' SER . . . . . . . . . . . . . 39.9 t -147.52 109.19 4.38 Favored 'General case' 0 N--CA 1.445 -0.725 0 C-N-CA 126.761 2.024 . . . . 0.0 107.901 169.873 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 43' ' ' MET . . . . . . . . . . . . . 11.8 mmt -62.17 -45.03 95.22 Favored 'General case' 0 C--O 1.222 -0.361 0 C-N-CA 120.603 -0.439 . . . . 0.0 110.804 164.339 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 44' ' ' CYS . . . . . 1.304 ' SG ' ' SG ' ' A' ' 70' ' ' CYS . 2.7 t -157.27 -60.87 0.09 Allowed 'General case' 0 CA--C 1.513 -0.444 0 N-CA-C 105.022 -2.214 . . . . 0.0 105.022 -172.32 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 45' ' ' ASN . . . . . . . . . . . . . 1.9 m-20 -101.34 12.85 36.69 Favored 'General case' 0 C--N 1.328 -0.328 0 C-N-CA 125.53 1.532 . . . . 0.0 114.746 -164.541 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 46' ' ' ARG . . . . . . . . . . . . . 18.1 mmm-85 61.38 152.26 0.03 OUTLIER 'General case' 0 C--O 1.218 -0.56 0 C-N-CA 128.191 2.596 . . . . 0.0 112.979 -164.512 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 47' ' ' PHE . . . . . . . . . . . . . 2.9 p90 -158.38 170.86 21.28 Favored 'General case' 0 CA--C 1.515 -0.401 0 C-N-CA 124.62 1.168 . . . . 0.0 107.919 169.639 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 48' ' ' SER . . . . . . . . . . . . . 19.4 m -160.62 163.34 32.67 Favored 'General case' 0 C--N 1.317 -0.824 0 N-CA-C 106.128 -1.804 . . . . 0.0 106.128 179.616 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 49' ' ' GLY . . . . . . . . . . . . . . . -175.91 170.07 42.9 Favored Glycine 0 N--CA 1.445 -0.755 0 CA-C-N 120.532 1.515 . . . . 0.0 110.739 155.487 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 50' ' ' GLU . . . . . . . . . . . . . 27.0 tt0 -74.17 111.68 9.57 Favored 'General case' 0 N--CA 1.441 -0.88 0 N-CA-C 107.266 -1.383 . . . . 0.0 107.266 162.79 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 51' ' ' GLY . . . . . . . . . . . . . . . -82.24 179.93 53.04 Favored Glycine 0 CA--C 1.536 1.377 0 C-N-CA 123.765 0.698 . . . . 0.0 112.927 158.317 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 52' ' ' LYS . . . . . . . . . . . . . 37.9 tttt -162.74 156.83 20.85 Favored 'General case' 0 N--CA 1.473 0.714 0 C-N-CA 126.554 1.941 . . . . 0.0 107.689 168.304 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 53' ' ' LEU . . . . . . . . . . . . . 1.2 tm? -123.89 115.47 21.35 Favored 'General case' 0 C--O 1.234 0.283 0 C-N-CA 124.143 0.977 . . . . 0.0 109.044 176.411 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 28.5 t -134.92 -54.25 0.81 Allowed 'General case' 0 CA--C 1.534 0.365 0 CA-C-O 118.429 -0.796 . . . . 0.0 111.19 175.541 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 55' ' ' ASN . . . . . . . . . . . . . 4.7 p30 -110.6 13.07 22.64 Favored 'General case' 0 N--CA 1.475 0.781 0 N-CA-C 113.55 0.944 . . . . 0.0 113.55 -178.237 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 56' ' ' GLY . . . . . . . . . . . . . . . 91.18 4.86 68.25 Favored Glycine 0 CA--C 1.528 0.887 0 C-N-CA 124.283 0.944 . . . . 0.0 111.911 -172.653 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 57' ' ' GLU . . . . . . . . . . . . . 39.5 tt0 -113.97 109.36 18.36 Favored 'General case' 0 N--CA 1.451 -0.394 0 C-N-CA 124.513 1.125 . . . . 0.0 108.672 -166.13 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 58' ' ' LEU . . . . . . . . . . . . . 35.7 tp -80.42 95.97 6.58 Favored 'General case' 0 N--CA 1.454 -0.257 0 C-N-CA 124.571 1.148 . . . . 0.0 109.074 173.609 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 59' ' ' THR . . . . . . . . . . . . . 1.2 p -95.11 146.86 24.0 Favored 'General case' 0 C--O 1.238 0.461 0 C-N-CA 123.749 0.82 . . . . 0.0 109.805 168.281 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 60' ' ' ALA . . . . . . . . . . . . . . . -68.84 170.28 9.9 Favored 'General case' 0 CA--C 1.537 0.477 0 CA-C-O 121.912 0.863 . . . . 0.0 110.955 163.931 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 61' ' ' LYS . . . . . . . . . . . . . 23.6 tttt -155.02 -9.76 0.12 Allowed 'General case' 0 CA--C 1.535 0.402 0 C-N-CA 128.191 2.596 . . . . 0.0 112.231 179.685 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 62' ' ' GLY . . . . . . . . . . . . . . . 171.03 77.34 0.04 OUTLIER Glycine 0 C--N 1.334 0.464 0 N-CA-C 106.279 -2.728 . . . . 0.0 106.279 -172.827 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 63' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -115.32 146.98 41.0 Favored 'General case' 0 N--CA 1.449 -0.512 0 C-N-CA 124.963 1.305 . . . . 0.0 109.326 -171.915 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 64' ' ' ALA . . . . . . . . . . . . . . . -120.87 167.13 12.87 Favored 'General case' 0 N--CA 1.45 -0.472 0 C-N-CA 125.025 1.33 . . . . 0.0 109.226 -175.01 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 65' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -150.85 -178.66 6.71 Favored 'General case' 0 C--O 1.238 0.456 0 C-N-CA 126.327 1.851 . . . . 0.0 107.223 171.354 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 66' ' ' THR . . . . . . . . . . . . . 4.0 p -129.83 179.53 5.79 Favored 'General case' 0 CA--C 1.538 0.515 0 CA-C-N 119.181 0.9 . . . . 0.0 110.206 164.268 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 67' ' ' ARG . . . . . . . . . . . . . 10.0 mmt85 -127.55 81.29 2.01 Favored 'General case' 0 CA--C 1.529 0.152 0 C-N-CA 125.953 1.701 . . . . 0.0 108.088 179.599 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 68' ' ' MET . . . . . . . . . . . . . 61.5 mtm -118.06 -174.4 2.64 Favored 'General case' 0 CA--C 1.538 0.501 0 C-N-CA 129.242 3.017 . . . . 0.0 109.389 170.933 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 69' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -104.69 173.1 6.45 Favored 'General case' 0 N--CA 1.465 0.284 0 C-N-CA 127.821 2.448 . . . . 0.0 108.709 168.244 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 70' ' ' CYS . . . . . 1.304 ' SG ' ' SG ' ' A' ' 44' ' ' CYS . 68.1 m -142.53 150.01 39.86 Favored 'General case' 0 C--O 1.233 0.214 0 C-N-CA 123.87 0.868 . . . . 0.0 110.265 174.854 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 71' ' ' ALA . . . . . . . . . . . . . . . -84.3 36.7 0.59 Allowed 'General case' 0 CA--C 1.538 0.489 0 C-N-CA 124.149 0.98 . . . . 0.0 111.398 179.074 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 72' ' ' ASN . . . . . . . . . . . . . 4.0 t30 -166.6 150.15 6.52 Favored Pre-proline 0 N--CA 1.465 0.324 0 C-N-CA 124.298 1.039 . . . . 0.0 108.821 159.302 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 73' ' ' PRO . . . . . . . . . . . . . 96.2 Cg_endo -84.2 -33.64 0.3 Allowed 'Trans proline' 0 N--CA 1.461 -0.424 0 C-N-CA 122.352 2.035 . . . . 0.0 113.288 -171.128 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 74' ' ' GLN . . . . . . . . . . . . . 43.2 tt0 -60.88 -37.4 82.06 Favored 'General case' 0 N--CA 1.465 0.317 0 O-C-N 121.671 -0.643 . . . . 0.0 111.541 -175.644 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 75' ' ' LEU . . . . . . . . . . . . . 50.2 mt -53.58 -43.61 68.67 Favored 'General case' 0 CA--C 1.535 0.382 0 C-N-CA 124.968 1.307 . . . . 0.0 108.678 173.186 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 76' ' ' ASN . . . . . . . . . . . . . 0.7 OUTLIER -77.85 5.07 10.33 Favored 'General case' 0 N--CA 1.47 0.528 0 C-N-CA 128.137 2.575 . . . . 0.0 112.4 -174.518 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 77' ' ' GLU . . . . . . . . . . . . . 0.2 OUTLIER -101.72 -46.02 5.06 Favored 'General case' 0 CA--C 1.535 0.394 0 C-N-CA 126.754 2.021 . . . . 0.0 107.79 168.901 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 78' ' ' LEU . . . . . . . . . . . . . 15.3 mt -65.41 -29.03 69.68 Favored 'General case' 0 CA--C 1.53 0.202 0 C-N-CA 124.977 1.311 . . . . 0.0 111.284 176.937 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 79' ' ' ASP . . . . . . . . . . . . . 0.0 OUTLIER -61.56 -6.48 2.47 Favored 'General case' 0 N--CA 1.469 0.498 0 C-N-CA 126.463 1.905 . . . . 0.0 114.467 168.835 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 80' ' ' ASN . . . . . . . . . . . . . 85.6 m-20 -106.95 -40.31 5.5 Favored 'General case' 0 CA--C 1.531 0.242 0 C-N-CA 124.614 1.166 . . . . 0.0 111.223 164.345 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 81' ' ' THR . . . . . . . . . . . . . 6.9 m -55.43 -65.02 0.66 Allowed 'General case' 0 C--N 1.347 0.493 0 CA-C-N 119.997 1.271 . . . . 0.0 111.524 -176.689 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 82' ' ' ILE . . . . . 0.501 HG13 HD12 ' A' ' 86' ' ' LEU . 9.4 tp -60.43 -37.08 73.36 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.297 0 CA-C-N 119.324 0.965 . . . . 0.0 110.345 -168.455 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 83' ' ' SER . . . . . . . . . . . . . 4.4 m -58.17 -46.82 85.05 Favored 'General case' 0 N--CA 1.446 -0.64 0 C-N-CA 124.891 1.276 . . . . 0.0 110.156 -178.857 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 84' ' ' GLU . . . . . . . . . . . . . 29.3 tt0 -76.8 -41.27 45.14 Favored 'General case' 0 N--CA 1.445 -0.704 0 C-N-CA 126.023 1.729 . . . . 0.0 110.368 -176.781 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 85' ' ' MET . . . . . . . . . . . . . 6.3 ptm -66.74 -40.28 88.27 Favored 'General case' 0 CA--C 1.516 -0.357 0 C-N-CA 123.923 0.889 . . . . 0.0 108.614 -176.59 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 86' ' ' LEU . . . . . 0.501 HD12 HG13 ' A' ' 82' ' ' ILE . 0.3 OUTLIER -71.32 -31.54 67.52 Favored 'General case' 0 N--CA 1.447 -0.577 0 C-N-CA 118.292 -1.363 . . . . 0.0 111.696 -171.138 . . . . . . . . 3 3 . 1 . 012 nuclear build core ' A' A ' 87' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -55.92 -49.89 72.23 Favored 'General case' 0 N--CA 1.45 -0.468 0 N-CA-C 107.859 -1.163 . . . . 0.0 107.859 177.953 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 88' ' ' GLU . . . . . . . . . . . . . 28.0 mt-10 -69.12 -26.58 64.97 Favored 'General case' 0 N--CA 1.445 -0.699 0 CA-C-O 117.235 -1.364 . . . . 0.0 112.544 174.978 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 89' ' ' GLY . . . . . . . . . . . . . . . 94.25 104.23 1.81 Allowed Glycine 0 CA--C 1.499 -0.935 0 CA-C-N 120.474 1.488 . . . . 0.0 109.395 -171.865 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 90' ' ' ALA . . . . . . . . . . . . . . . -80.22 136.04 36.38 Favored 'General case' 0 N--CA 1.445 -0.724 0 N-CA-C 108.668 -0.864 . . . . 0.0 108.668 173.346 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 91' ' ' GLN . . . . . . . . . . . . . 86.3 mm-40 -65.89 138.54 57.93 Favored 'General case' 0 N--CA 1.448 -0.57 0 N-CA-C 106.205 -1.776 . . . . 0.0 106.205 163.558 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 92' ' ' VAL . . . . . . . . . . . . . 76.1 t -131.62 119.8 43.42 Favored 'Isoleucine or valine' 0 N--CA 1.445 -0.692 0 N-CA-C 105.746 -1.946 . . . . 0.0 105.746 -178.975 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 93' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -136.62 94.67 3.02 Favored 'General case' 0 N--CA 1.446 -0.629 0 CA-C-O 122.62 1.2 . . . . 0.0 108.796 170.589 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 94' ' ' LEU . . . . . 0.426 ' HB3' HG23 ' A' ' 2' ' ' VAL . 0.4 OUTLIER -65.93 108.73 2.27 Favored 'General case' 0 N--CA 1.446 -0.656 0 N-CA-C 106.661 -1.607 . . . . 0.0 106.661 165.85 . . . . . . . . 3 3 . 1 . 012 nuclear build core ' A' A ' 95' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -71.21 -178.32 2.0 Allowed 'General case' 0 C--N 1.317 -0.811 0 C-N-CA 126.286 1.834 . . . . 0.0 106.862 168.987 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 96' ' ' ALA . . . . . . . . . . . . . . . -44.93 -34.22 2.31 Favored 'General case' 0 CA--C 1.542 0.668 0 N-CA-C 114.328 1.233 . . . . 0.0 114.328 -179.432 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 97' ' ' ASN . . . . . . . . . . . . . 14.2 p30 -152.02 22.43 0.67 Allowed 'General case' 0 N--CA 1.47 0.547 0 N-CA-C 114.459 1.281 . . . . 0.0 114.459 170.788 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 98' ' ' GLN . . . . . . . . . . . . . 1.5 tt0 -141.3 119.27 11.92 Favored 'General case' 0 N--CA 1.465 0.323 0 O-C-N 120.716 -1.24 . . . . 0.0 111.192 -175.56 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 99' ' ' LEU . . . . . 0.439 ' HB3' ' HB2' ' A' ' 110' ' ' TYR . 8.5 tp -70.85 107.29 3.95 Favored 'General case' 0 C--O 1.237 0.408 0 C-N-CA 126.957 2.103 . . . . 0.0 108.489 177.675 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 100' ' ' THR . . . . . . . . . . . . . 3.2 m -88.37 117.29 27.19 Favored 'General case' 0 C--N 1.327 -0.371 0 N-CA-C 106.0 -1.852 . . . . 0.0 106.0 172.778 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 101' ' ' LEU . . . . . . . . . . . . . 1.1 mm? -110.09 147.67 33.19 Favored 'General case' 0 CA--C 1.515 -0.367 0 N-CA-C 108.822 -0.807 . . . . 0.0 108.822 171.424 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 102' ' ' ALA . . . . . . . . . . . . . . . -149.09 161.27 42.29 Favored 'General case' 0 CA--C 1.53 0.209 0 C-N-CA 124.023 0.929 . . . . 0.0 109.654 166.289 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 103' ' ' THR . . . . . . . . . . . . . 1.6 p -147.7 177.19 9.49 Favored 'General case' 0 C--N 1.327 -0.385 0 C-N-CA 127.76 2.424 . . . . 0.0 107.358 159.682 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 104' ' ' ALA . . . . . . . . . . . . . . . -56.11 -25.04 44.18 Favored 'General case' 0 CA--C 1.534 0.334 0 CA-C-O 118.796 -0.621 . . . . 0.0 112.532 162.258 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 105' ' ' LYS . . . . . . . . . . . . . 24.5 mmtt -71.3 -82.41 0.04 OUTLIER 'General case' 0 N--CA 1.456 -0.141 0 C-N-CA 123.476 0.71 . . . . 0.0 109.392 170.835 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 106' ' ' GLN . . . . . . . . . . . . . 14.7 pt20 -156.29 176.6 12.47 Favored 'General case' 0 C--O 1.236 0.358 0 CA-C-O 121.401 0.619 . . . . 0.0 112.635 -171.057 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 107' ' ' THR . . . . . . . . . . . . . 0.8 OUTLIER -120.78 134.99 55.27 Favored 'General case' 0 C--O 1.232 0.172 0 C-N-CA 127.775 2.43 . . . . 0.0 108.848 -168.288 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 108' ' ' LEU . . . . . . . . . . . . . 2.4 mm? -117.29 151.22 37.41 Favored 'General case' 0 C--O 1.236 0.383 0 N-CA-C 107.843 -1.169 . . . . 0.0 107.843 176.904 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 109' ' ' THR . . . . . . . . . . . . . 0.1 OUTLIER -119.29 107.48 13.45 Favored 'General case' 0 C--N 1.324 -0.503 0 N-CA-C 103.564 -2.754 . . . . 0.0 103.564 179.614 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 110' ' ' TYR . . . . . 0.439 ' HB2' ' HB3' ' A' ' 99' ' ' LEU . 67.1 m-85 -110.77 134.05 52.82 Favored 'General case' 0 N--CA 1.447 -0.611 0 N-CA-C 108.645 -0.872 . . . . 0.0 108.645 173.555 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 111' ' ' LYS . . . . . . . . . . . . . 2.5 tmtt? -94.21 142.63 27.18 Favored 'General case' 0 C--N 1.322 -0.628 0 N-CA-C 108.246 -1.02 . . . . 0.0 108.246 -178.387 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 112' ' ' LEU . . . . . . . . . . . . . 56.8 tp -66.27 105.74 1.5 Allowed 'General case' 0 C--N 1.329 -0.31 0 N-CA-C 107.547 -1.279 . . . . 0.0 107.547 169.064 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 113' ' ' ALA . . . . . . . . . . . . . . . -137.72 98.38 3.66 Favored 'General case' 0 CA--C 1.516 -0.353 0 N-CA-C 107.038 -1.467 . . . . 0.0 107.038 177.846 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 114' ' ' ASP . . . . . . . . . . . . . 30.9 t0 . . . . . 0 C--N 1.325 -0.494 0 CA-C-O 123.67 1.7 . . . . 0.0 111.244 -169.115 . . . . . . . . 0 0 . 1 . 013 nuclear build core ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 18.9 ttt . . . . . 0 C--O 1.236 0.385 0 N-CA-C 109.311 -0.626 . . . . 0.0 109.311 . . . . . . . . . 0 0 . 1 . 013 nuclear build core ' A' A ' 2' ' ' VAL . . . . . . . . . . . . . 7.5 p -55.12 129.51 16.48 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.439 0 N-CA-C 109.397 -0.594 . . . . 0.0 109.397 175.78 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 3' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -122.64 159.93 50.93 Favored Pre-proline 0 N--CA 1.449 -0.487 0 N-CA-C 109.867 -0.42 . . . . 0.0 109.867 -179.164 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 4' ' ' PRO . . . . . . . . . . . . . 36.6 Cg_endo -70.67 -37.03 7.47 Favored 'Trans proline' 0 N--CA 1.464 -0.262 0 C-N-CA 122.472 2.115 . . . . 0.0 112.799 -173.757 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 5' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -57.84 -54.17 49.97 Favored 'General case' 0 C--N 1.328 -0.365 0 C-N-CA 125.788 1.635 . . . . 0.0 109.67 -179.289 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 6' ' ' GLN . . . . . . . . . . . . . 3.5 pt20 -67.02 25.34 0.02 OUTLIER 'General case' 0 CA--C 1.545 0.772 0 C-N-CA 126.24 1.816 . . . . 0.0 114.779 177.917 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 7' ' ' LEU . . . . . . . . . . . . . 97.4 mt -141.74 -49.41 0.39 Allowed 'General case' 0 N--CA 1.451 -0.398 0 C-N-CA 127.249 2.219 . . . . 0.0 108.869 -177.761 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 8' ' ' GLN . . . . . . . . . . . . . 3.1 mt-30 -46.94 -6.3 0.01 OUTLIER 'General case' 0 N--CA 1.471 0.623 0 C-N-CA 130.119 3.367 . . . . 0.0 118.215 -177.914 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 9' ' ' HIS . . . . . . . . . . . . . 32.0 p80 -145.77 10.84 1.22 Allowed 'General case' 0 C--N 1.325 -0.463 0 CA-C-N 119.641 1.109 . . . . 0.0 112.972 174.798 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 10' ' ' HIS . . . . . . . . . . . . . 32.0 m-70 -100.69 163.96 12.09 Favored 'General case' 0 C--O 1.238 0.489 0 C-N-CA 123.711 0.804 . . . . 0.0 109.733 -176.631 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 11' ' ' ARG . . . . . 0.407 HH21 ' CD ' ' A' ' 30' ' ' GLU . 4.4 ttt85 -126.96 145.69 50.6 Favored 'General case' 0 CA--C 1.514 -0.407 0 C-N-CA 125.456 1.502 . . . . 0.0 107.811 173.184 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 12' ' ' PHE . . . . . . . . . . . . . 42.4 m-85 -136.21 148.13 47.96 Favored 'General case' 0 N--CA 1.445 -0.724 0 N-CA-C 105.717 -1.957 . . . . 0.0 105.717 179.478 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 13' ' ' VAL . . . . . . . . . . . . . 2.5 t -122.2 148.99 25.55 Favored 'Isoleucine or valine' 0 C--O 1.24 0.583 0 C-N-CA 125.413 1.485 . . . . 0.0 108.492 178.981 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 14' ' ' LEU . . . . . . . . . . . . . 7.5 tp -77.37 80.74 3.86 Favored 'General case' 0 N--CA 1.447 -0.596 0 O-C-N 124.418 1.074 . . . . 0.0 109.835 -178.471 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -61.08 -34.97 75.77 Favored 'General case' 0 CA--C 1.534 0.341 0 C-N-CA 123.969 0.908 . . . . 0.0 110.047 -179.961 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 3.2 m -165.83 143.69 5.71 Favored 'General case' 0 CA--C 1.535 0.373 0 O-C-N 121.35 -0.844 . . . . 0.0 111.717 176.368 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 17' ' ' VAL . . . . . . . . . . . . . 2.8 t -97.31 161.13 2.86 Favored 'Isoleucine or valine' 0 CA--C 1.542 0.644 0 C-N-CA 126.396 1.878 . . . . 0.0 108.25 -177.371 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 18' ' ' ASN . . . . . . . . . . . . . 19.9 t30 -51.85 -32.12 30.67 Favored 'General case' 0 N--CA 1.473 0.692 0 C-N-CA 123.438 0.695 . . . . 0.0 112.416 167.4 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . -78.66 -54.48 4.23 Favored Glycine 0 N--CA 1.445 -0.736 0 CA-C-O 119.039 -0.867 . . . . 0.0 111.842 -178.36 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 8.5 mtmt -168.87 166.35 6.49 Favored Pre-proline 0 N--CA 1.466 0.331 0 C-N-CA 126.709 2.003 . . . . 0.0 110.444 -168.703 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 21' ' ' PRO . . . . . . . . . . . . . 36.3 Cg_endo -58.29 161.93 12.98 Favored 'Trans proline' 0 N--CA 1.457 -0.648 0 C-N-CA 121.57 1.514 . . . . 0.0 111.151 163.572 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 22' ' ' VAL . . . . . . . . . . . . . 11.6 p -141.7 127.9 19.25 Favored 'Isoleucine or valine' 0 CA--C 1.529 0.162 0 C-N-CA 124.014 0.926 . . . . 0.0 108.677 175.267 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 23' ' ' THR . . . . . . . . . . . . . 0.6 OUTLIER -136.41 130.94 33.47 Favored 'General case' 0 N--CA 1.451 -0.377 0 N-CA-C 106.678 -1.601 . . . . 0.0 106.678 171.842 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 24' ' ' SER . . . . . . . . . . . . . 0.5 OUTLIER -126.74 67.59 1.25 Allowed 'General case' 0 N--CA 1.453 -0.315 0 N-CA-C 106.886 -1.524 . . . . 0.0 106.886 178.673 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 25' ' ' ASP . . . . . . . . . . . . . 2.0 t70 65.38 -70.69 0.09 Allowed 'General case' 0 C--O 1.233 0.2 0 C-N-CA 128.772 2.829 . . . . 0.0 113.878 173.003 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 26' ' ' LYS . . . . . . . . . . . . . 16.1 ttmt -145.88 -7.86 0.56 Allowed 'General case' 0 CA--C 1.531 0.217 0 C-N-CA 126.414 1.886 . . . . 0.0 111.928 175.07 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 27' ' ' ASN . . . . . . . . . . . . . 80.0 m-20 -124.18 73.33 57.64 Favored Pre-proline 0 C--O 1.232 0.135 0 C-N-CA 124.607 1.163 . . . . 0.0 108.424 -174.303 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 28' ' ' PRO . . . . . . . . . . . . . 55.5 Cg_endo -69.72 173.21 11.27 Favored 'Trans proline' 0 N--CA 1.457 -0.645 0 C-N-CA 123.259 2.639 . . . . 0.0 112.728 179.115 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 29' ' ' PRO . . . . . . . . . . . . . 34.8 Cg_endo -65.7 64.83 0.4 Allowed 'Trans proline' 0 CA--C 1.537 0.637 0 C-N-CA 125.145 3.897 . . . . 0.0 112.301 166.517 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 30' ' ' GLU . . . . . 0.407 ' CD ' HH21 ' A' ' 11' ' ' ARG . 4.5 pt-20 -79.99 169.68 17.52 Favored 'General case' 0 CA--C 1.538 0.489 0 O-C-N 120.592 -1.318 . . . . 0.0 110.218 175.203 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 31' ' ' ILE . . . . . . . . . . . . . 9.1 tt -145.48 143.5 21.84 Favored 'Isoleucine or valine' 0 C--O 1.238 0.45 0 N-CA-C 106.676 -1.602 . . . . 0.0 106.676 -179.058 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 32' ' ' SER . . . . . . . . . . . . . 80.4 p -140.08 150.5 44.41 Favored 'General case' 0 C--O 1.236 0.368 0 N-CA-C 108.762 -0.829 . . . . 0.0 108.762 174.139 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 33' ' ' PHE . . . . . . . . . . . . . 9.0 m-30 -127.66 133.11 49.63 Favored 'General case' 0 CA--C 1.535 0.385 0 C-N-CA 127.063 2.145 . . . . 0.0 105.237 -169.669 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 34' ' ' GLY . . . . . . . . . . . . . . . -112.43 -166.74 17.34 Favored Glycine 0 N--CA 1.471 0.999 0 C-N-CA 124.761 1.172 . . . . 0.0 111.642 -179.371 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 35' ' ' GLU . . . . . . . . . . . . . 16.8 tt0 -69.93 32.67 0.04 OUTLIER 'General case' 0 CA--C 1.546 0.823 0 C-N-CA 127.931 2.492 . . . . 0.0 116.143 -164.802 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 1.1 mmtm -157.16 10.98 0.21 Allowed 'General case' 0 N--CA 1.44 -0.959 0 C-N-CA 127.919 2.488 . . . . 0.0 116.609 -166.209 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 37' ' ' MET . . . . . . . . . . . . . 41.1 mmm 53.66 21.02 2.4 Favored 'General case' 0 CA--C 1.555 1.153 0 CA-C-N 120.129 1.332 . . . . 0.0 112.106 -161.576 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 38' ' ' MET . . . . . . . . . . . . . 11.0 mmm -69.76 165.6 21.05 Favored 'General case' 0 C--O 1.227 -0.127 0 O-C-N 120.178 -1.576 . . . . 0.0 110.979 177.765 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 39' ' ' ILE . . . . . . . . . . . . . 58.5 mt -137.27 138.03 45.66 Favored 'Isoleucine or valine' 0 C--O 1.237 0.411 0 O-C-N 121.85 -0.531 . . . . 0.0 109.749 -176.401 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 40' ' ' SER . . . . . . . . . . . . . 9.3 p -143.85 118.52 9.81 Favored 'General case' 0 CA--C 1.539 0.55 0 C-N-CA 125.194 1.398 . . . . 0.0 109.465 171.728 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 41' ' ' GLY . . . . . . . . . . . . . . . -157.48 -173.93 26.53 Favored Glycine 0 CA--C 1.533 1.187 0 C-N-CA 125.169 1.366 . . . . 0.0 111.138 178.114 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 42' ' ' SER . . . . . . . . . . . . . 74.0 p -157.39 94.2 1.36 Allowed 'General case' 0 C--O 1.223 -0.297 0 C-N-CA 124.208 1.003 . . . . 0.0 110.311 178.754 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 43' ' ' MET . . . . . . . . . . . . . 2.2 mmt -67.01 -40.98 87.4 Favored 'General case' 0 CA--C 1.534 0.331 0 CA-C-O 120.978 0.418 . . . . 0.0 110.868 176.622 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 44' ' ' CYS . . . . . 1.285 ' SG ' ' SG ' ' A' ' 70' ' ' CYS . 33.1 t -151.12 -63.24 0.19 Allowed 'General case' 0 N--CA 1.448 -0.554 0 N-CA-C 104.808 -2.293 . . . . 0.0 104.808 158.457 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 45' ' ' ASN . . . . . . . . . . . . . 71.4 m-20 -83.67 30.0 0.51 Allowed 'General case' 0 CA--C 1.528 0.134 0 C-N-CA 126.47 1.908 . . . . 0.0 114.328 -168.798 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 46' ' ' ARG . . . . . . . . . . . . . 61.7 mtt180 59.25 167.56 0.06 Allowed 'General case' 0 N--CA 1.472 0.649 0 C-N-CA 126.117 1.767 . . . . 0.0 110.965 -171.668 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 47' ' ' PHE . . . . . . . . . . . . . 34.8 p90 -159.31 167.2 29.49 Favored 'General case' 0 C--O 1.239 0.55 0 N-CA-C 108.506 -0.924 . . . . 0.0 108.506 154.122 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 48' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -162.1 137.03 7.07 Favored 'General case' 0 C--O 1.238 0.48 0 N-CA-C 108.352 -0.981 . . . . 0.0 108.352 177.529 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 49' ' ' GLY . . . . . . . . . . . . . . . -170.9 162.48 35.43 Favored Glycine 0 C--N 1.339 0.703 0 N-CA-C 110.209 -1.157 . . . . 0.0 110.209 172.152 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 50' ' ' GLU . . . . . . . . . . . . . 40.3 mt-10 -74.13 101.33 3.9 Favored 'General case' 0 C--O 1.237 0.407 0 C-N-CA 124.323 1.049 . . . . 0.0 108.442 170.258 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 51' ' ' GLY . . . . . . . . . . . . . . . -68.63 -179.46 19.4 Favored Glycine 0 CA--C 1.535 1.341 0 C-N-CA 123.542 0.592 . . . . 0.0 112.561 164.269 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 52' ' ' LYS . . . . . . . . . . . . . 13.9 ttmt -156.0 161.26 40.5 Favored 'General case' 0 CA--C 1.535 0.373 0 C-N-CA 126.373 1.869 . . . . 0.0 108.835 176.257 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 53' ' ' LEU . . . . . 0.406 HD13 ' N ' ' A' ' 54' ' ' SER . 1.2 tm? -146.67 129.59 16.32 Favored 'General case' 0 CA--C 1.519 -0.214 0 N-CA-C 105.597 -2.001 . . . . 0.0 105.597 174.162 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 54' ' ' SER . . . . . 0.406 ' N ' HD13 ' A' ' 53' ' ' LEU . 2.2 t -152.25 -33.84 0.13 Allowed 'General case' 0 CA--C 1.536 0.426 0 CA-C-N 117.642 0.201 . . . . 0.0 111.258 162.9 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 55' ' ' ASN . . . . . . . . . . . . . 20.0 p-10 -131.33 31.15 4.4 Favored 'General case' 0 CA--C 1.534 0.36 0 C-N-CA 128.052 2.541 . . . . 0.0 111.2 -164.761 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 56' ' ' GLY . . . . . . . . . . . . . . . 60.56 31.65 75.51 Favored Glycine 0 CA--C 1.532 1.1 0 O-C-N 121.591 -0.693 . . . . 0.0 111.645 -176.72 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 57' ' ' GLU . . . . . . . . . . . . . 33.5 tt0 -134.15 139.6 45.98 Favored 'General case' 0 C--O 1.237 0.426 0 N-CA-C 107.631 -1.248 . . . . 0.0 107.631 177.528 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 58' ' ' LEU . . . . . . . . . . . . . 56.6 tp -120.59 95.92 4.92 Favored 'General case' 0 CA--C 1.534 0.349 0 C-N-CA 127.806 2.442 . . . . 0.0 108.843 -176.198 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 59' ' ' THR . . . . . . . . . . . . . 15.6 p -98.48 137.61 36.91 Favored 'General case' 0 C--O 1.237 0.434 0 C-N-CA 124.982 1.313 . . . . 0.0 110.671 174.719 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 60' ' ' ALA . . . . . . . . . . . . . . . -123.32 85.46 2.42 Favored 'General case' 0 CA--C 1.536 0.411 0 C-N-CA 125.145 1.378 . . . . 0.0 111.476 171.888 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 61' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -53.19 -15.45 0.91 Allowed 'General case' 0 N--CA 1.455 -0.189 0 C-N-CA 128.82 2.848 . . . . 0.0 117.151 -178.903 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 62' ' ' GLY . . . . . . . . . . . . . . . -148.8 45.66 0.7 Allowed Glycine 0 CA--C 1.52 0.392 0 C-N-CA 124.734 1.159 . . . . 0.0 110.985 -174.379 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 63' ' ' LEU . . . . . . . . . . . . . 9.3 tp -55.91 139.82 44.85 Favored 'General case' 0 N--CA 1.446 -0.649 0 N-CA-C 108.831 -0.803 . . . . 0.0 108.831 168.171 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 64' ' ' ALA . . . . . . . . . . . . . . . -127.13 162.02 27.1 Favored 'General case' 0 C--N 1.327 -0.373 0 N-CA-C 108.17 -1.048 . . . . 0.0 108.17 166.35 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 65' ' ' MET . . . . . . . . . . . . . 0.1 OUTLIER -150.5 177.09 10.34 Favored 'General case' 0 CA--C 1.538 0.507 0 C-N-CA 126.468 1.907 . . . . 0.0 108.591 -175.571 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 66' ' ' THR . . . . . . . . . . . . . 25.4 p -118.0 -178.21 3.45 Favored 'General case' 0 N--CA 1.469 0.524 0 C-N-CA 125.141 1.376 . . . . 0.0 111.12 -178.401 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 67' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -126.2 87.27 2.65 Favored 'General case' 0 C--O 1.236 0.353 0 C-N-CA 123.858 0.863 . . . . 0.0 110.477 172.955 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 68' ' ' MET . . . . . . . . . . . . . 37.0 mtm -132.16 -166.13 1.69 Allowed 'General case' 0 CA--C 1.537 0.471 0 C-N-CA 128.161 2.584 . . . . 0.0 108.534 174.424 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 69' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -145.57 173.95 11.6 Favored 'General case' 0 CA--C 1.539 0.531 0 C-N-CA 125.183 1.393 . . . . 0.0 109.645 174.692 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 70' ' ' CYS . . . . . 1.285 ' SG ' ' SG ' ' A' ' 44' ' ' CYS . 73.0 m -130.48 14.08 5.5 Favored 'General case' 0 C--O 1.234 0.284 0 N-CA-C 114.174 1.176 . . . . 0.0 114.174 -172.707 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 71' ' ' ALA . . . . . . . . . . . . . . . 60.8 10.4 2.68 Favored 'General case' 0 CA--C 1.534 0.338 0 C-N-CA 124.943 1.297 . . . . 0.0 113.271 178.419 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 72' ' ' ASN . . . . . . . . . . . . . 0.2 OUTLIER -133.46 164.96 40.25 Favored Pre-proline 0 CA--C 1.547 0.828 0 C-N-CA 125.213 1.405 . . . . 0.0 107.26 168.667 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 73' ' ' PRO . . . . . . . . . . . . . 60.7 Cg_endo -82.25 -45.91 0.07 OUTLIER 'Trans proline' 0 N--CA 1.46 -0.454 0 C-N-CA 123.71 2.94 . . . . 0.0 111.917 175.157 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 74' ' ' GLN . . . . . . . . . . . . . 58.7 tt0 -47.95 -53.93 14.43 Favored 'General case' 0 C--O 1.223 -0.29 0 C-N-CA 126.394 1.878 . . . . 0.0 110.615 -171.55 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 75' ' ' LEU . . . . . . . . . . . . . 55.0 mt -60.28 -37.18 79.67 Favored 'General case' 0 CA--C 1.535 0.403 0 C-N-CA 125.764 1.626 . . . . 0.0 110.875 -178.567 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 76' ' ' ASN . . . . . . . . . . . . . 1.7 t-20 -73.03 -4.68 33.95 Favored 'General case' 0 N--CA 1.469 0.483 0 C-N-CA 126.198 1.799 . . . . 0.0 111.938 177.926 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 77' ' ' GLU . . . . . . . . . . . . . 1.0 OUTLIER -113.65 -24.4 9.22 Favored 'General case' 0 CA--C 1.535 0.394 0 C-N-CA 125.265 1.426 . . . . 0.0 110.439 170.609 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 78' ' ' LEU . . . . . . . . . . . . . 6.2 mp -63.99 -36.66 84.7 Favored 'General case' 0 N--CA 1.464 0.253 0 O-C-N 120.842 -1.161 . . . . 0.0 109.861 170.453 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 79' ' ' ASP . . . . . . . . . . . . . 0.0 OUTLIER -56.95 -32.69 66.27 Favored 'General case' 0 CA--C 1.53 0.182 0 C-N-CA 123.816 0.846 . . . . 0.0 111.38 173.958 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 80' ' ' ASN . . . . . . . . . . . . . 12.2 m-20 -91.22 -28.57 17.73 Favored 'General case' 0 N--CA 1.452 -0.356 0 C-N-CA 123.017 0.527 . . . . 0.0 110.529 178.558 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 81' ' ' THR . . . . . . . . . . . . . 29.7 m -54.02 -65.14 0.62 Allowed 'General case' 0 CA--C 1.534 0.348 0 C-N-CA 124.926 1.29 . . . . 0.0 108.7 171.27 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 82' ' ' ILE . . . . . . . . . . . . . 10.4 tp -64.18 -35.1 72.8 Favored 'Isoleucine or valine' 0 C--O 1.234 0.284 0 O-C-N 121.84 -0.537 . . . . 0.0 111.011 -171.539 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 83' ' ' SER . . . . . . . . . . . . . 8.6 m -64.3 -40.92 96.92 Favored 'General case' 0 N--CA 1.443 -0.804 0 CA-C-O 118.305 -0.855 . . . . 0.0 111.983 -170.605 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 84' ' ' GLU . . . . . 0.48 ' OE1' ' HE2' ' A' ' 105' ' ' LYS . 4.6 mt-10 -77.86 -39.5 43.15 Favored 'General case' 0 N--CA 1.45 -0.432 0 CA-C-O 118.497 -0.763 . . . . 0.0 110.963 175.421 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 85' ' ' MET . . . . . . . . . . . . . 96.0 mtp -57.88 -49.15 77.68 Favored 'General case' 0 N--CA 1.463 0.201 0 CA-C-O 121.919 0.866 . . . . 0.0 108.725 -173.147 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 86' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -71.7 -25.49 62.11 Favored 'General case' 0 N--CA 1.453 -0.32 0 C-N-CA 123.714 0.806 . . . . 0.0 112.861 -177.197 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 87' ' ' LYS . . . . . . . . . . . . . 6.5 tptm -73.81 -49.74 23.84 Favored 'General case' 0 CA--C 1.516 -0.328 0 N-CA-C 108.338 -0.986 . . . . 0.0 108.338 -178.292 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 88' ' ' GLU . . . . . . . . . . . . . 5.6 mm-40 -69.83 -38.86 76.66 Favored 'General case' 0 N--CA 1.447 -0.616 0 O-C-N 124.449 1.093 . . . . 0.0 110.254 -177.177 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 89' ' ' GLY . . . . . . . . . . . . . . . 126.09 92.27 0.85 Allowed Glycine 0 C--N 1.339 0.695 0 N-CA-C 109.125 -1.59 . . . . 0.0 109.125 -179.594 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 90' ' ' ALA . . . . . . . . . . . . . . . -69.66 136.38 51.05 Favored 'General case' 0 N--CA 1.452 -0.341 0 N-CA-C 106.983 -1.488 . . . . 0.0 106.983 178.388 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 91' ' ' GLN . . . . . . . . . . . . . 4.9 mp0 -68.78 136.43 52.76 Favored 'General case' 0 N--CA 1.442 -0.845 0 N-CA-C 104.385 -2.45 . . . . 0.0 104.385 167.617 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 92' ' ' VAL . . . . . . . . . . . . . 4.0 p -127.47 122.58 59.74 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.392 0 N-CA-C 105.88 -1.896 . . . . 0.0 105.88 -177.27 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 93' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -139.23 92.4 2.59 Favored 'General case' 0 C--N 1.33 -0.277 0 N-CA-C 108.475 -0.935 . . . . 0.0 108.475 178.914 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 94' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -89.54 107.37 19.04 Favored 'General case' 0 C--N 1.333 -0.14 0 N-CA-C 106.809 -1.552 . . . . 0.0 106.809 174.125 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 95' ' ' THR . . . . . . . . . . . . . 13.4 t -67.8 -163.22 0.03 OUTLIER 'General case' 0 CA--C 1.536 0.424 0 C-N-CA 125.822 1.649 . . . . 0.0 108.767 169.588 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 96' ' ' ALA . . . . . . . . . . . . . . . -44.62 -40.95 6.21 Favored 'General case' 0 CA--C 1.544 0.714 0 O-C-N 120.288 -1.507 . . . . 0.0 112.421 178.929 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 97' ' ' ASN . . . . . . . . . . . . . 9.9 p30 -157.12 4.02 0.14 Allowed 'General case' 0 CA--C 1.541 0.619 0 N-CA-C 114.839 1.422 . . . . 0.0 114.839 -170.135 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 98' ' ' GLN . . . . . . . . . . . . . 8.5 tt0 -126.96 129.89 49.02 Favored 'General case' 0 N--CA 1.464 0.257 0 CA-C-N 120.361 1.437 . . . . 0.0 109.649 -176.809 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 99' ' ' LEU . . . . . 0.439 ' HB3' ' HB2' ' A' ' 110' ' ' TYR . 9.9 tp -81.32 133.56 35.45 Favored 'General case' 0 N--CA 1.449 -0.482 0 C-N-CA 123.864 0.866 . . . . 0.0 109.275 175.584 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 100' ' ' THR . . . . . . . . . . . . . 1.1 m -115.13 128.15 56.02 Favored 'General case' 0 C--N 1.323 -0.575 0 N-CA-C 105.223 -2.14 . . . . 0.0 105.223 171.247 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 101' ' ' LEU . . . . . . . . . . . . . 8.5 mp -112.74 163.96 13.95 Favored 'General case' 0 CA--C 1.512 -0.49 0 N-CA-C 110.073 -0.343 . . . . 0.0 110.073 163.311 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 102' ' ' ALA . . . . . . . . . . . . . . . -151.81 160.68 43.48 Favored 'General case' 0 C--N 1.325 -0.488 0 C-N-CA 126.764 2.026 . . . . 0.0 106.187 158.418 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 103' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -165.84 178.63 6.4 Favored 'General case' 0 N--CA 1.444 -0.73 0 C-N-CA 129.17 2.988 . . . . 0.0 106.208 164.134 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 104' ' ' ALA . . . . . . . . . . . . . . . -46.86 -45.06 20.06 Favored 'General case' 0 CA--C 1.533 0.292 0 O-C-N 121.417 -0.802 . . . . 0.0 111.089 169.511 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 105' ' ' LYS . . . . . 0.48 ' HE2' ' OE1' ' A' ' 84' ' ' GLU . 22.0 mttm -58.04 -74.32 0.06 Allowed 'General case' 0 C--N 1.343 0.284 0 N-CA-C 112.202 0.445 . . . . 0.0 112.202 179.955 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 106' ' ' GLN . . . . . . . . . . . . . 4.1 pt20 -163.0 -174.46 3.89 Favored 'General case' 0 C--N 1.33 -0.274 0 C-N-CA 123.247 0.619 . . . . 0.0 109.743 -173.368 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 107' ' ' THR . . . . . . . . . . . . . 2.1 t -105.51 166.2 10.6 Favored 'General case' 0 CA--C 1.539 0.55 0 C-N-CA 125.6 1.56 . . . . 0.0 107.924 168.746 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 108' ' ' LEU . . . . . . . . . . . . . 76.6 mt -139.92 150.43 44.55 Favored 'General case' 0 C--O 1.237 0.436 0 C-N-CA 126.556 1.942 . . . . 0.0 106.517 169.425 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 109' ' ' THR . . . . . . . . . . . . . 4.9 m -123.48 108.47 12.7 Favored 'General case' 0 C--O 1.238 0.497 0 N-CA-C 107.92 -1.141 . . . . 0.0 107.92 176.152 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 110' ' ' TYR . . . . . 0.439 ' HB2' ' HB3' ' A' ' 99' ' ' LEU . 75.2 m-85 -110.17 156.06 21.13 Favored 'General case' 0 N--CA 1.453 -0.282 0 N-CA-C 109.684 -0.487 . . . . 0.0 109.684 179.302 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 111' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -127.93 134.59 49.33 Favored 'General case' 0 C--O 1.236 0.377 0 CA-C-O 118.0 -1.0 . . . . 0.0 108.582 -172.394 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 112' ' ' LEU . . . . . . . . . . . . . 64.1 tp -60.63 82.28 0.01 OUTLIER 'General case' 0 CA--C 1.534 0.344 0 C-N-CA 127.911 2.484 . . . . 0.0 110.653 177.568 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 113' ' ' ALA . . . . . . . . . . . . . . . -115.39 83.0 1.85 Allowed 'General case' 0 C--N 1.33 -0.262 0 N-CA-C 106.015 -1.846 . . . . 0.0 106.015 172.673 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 114' ' ' ASP . . . . . . . . . . . . . 3.0 p-10 . . . . . 0 C--N 1.332 -0.155 0 C-N-CA 123.809 0.844 . . . . 0.0 110.848 -176.382 . . . . . . . . 0 0 . 1 . 014 nuclear build core ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 CA--C 1.534 0.36 0 CA-C-O 121.827 0.823 . . . . 0.0 110.837 . . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 2' ' ' VAL . . . . . . . . . . . . . 8.7 p -57.11 152.09 2.83 Favored 'Isoleucine or valine' 0 CA--C 1.544 0.737 0 C-N-CA 126.672 1.989 . . . . 0.0 110.521 164.115 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 3' ' ' THR . . . . . . . . . . . . . 29.6 p -128.03 162.32 50.62 Favored Pre-proline 0 CA--C 1.537 0.467 0 O-C-N 120.993 -1.067 . . . . 0.0 110.594 176.573 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 4' ' ' PRO . . . . . . . . . . . . . 18.1 Cg_endo -65.99 -41.48 13.45 Favored 'Trans proline' 0 C--N 1.345 0.394 0 C-N-CA 122.436 2.091 . . . . 0.0 112.54 175.117 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 5' ' ' GLU . . . . . . . . . . . . . 2.9 mt-10 -57.33 -50.03 74.23 Favored 'General case' 0 C--N 1.329 -0.286 0 C-N-CA 124.163 0.985 . . . . 0.0 111.016 -176.425 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 6' ' ' GLN . . . . . . . . . . . . . 5.5 pt20 -71.7 14.56 0.19 Allowed 'General case' 0 CA--C 1.541 0.604 0 N-CA-C 114.649 1.351 . . . . 0.0 114.649 -170.951 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 7' ' ' LEU . . . . . . . . . . . . . 94.1 mt -126.22 -52.51 1.51 Allowed 'General case' 0 CA--C 1.516 -0.344 0 C-N-CA 126.358 1.863 . . . . 0.0 109.27 -170.555 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 8' ' ' GLN . . . . . . . . . . . . . 2.0 mt-30 -44.9 -20.67 0.04 OUTLIER 'General case' 0 CA--C 1.539 0.538 0 C-N-CA 127.829 2.452 . . . . 0.0 116.701 -176.187 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 9' ' ' HIS . . . . . . . . . . . . . 33.2 p80 -138.66 19.33 2.69 Favored 'General case' 0 CA--C 1.537 0.446 0 C-N-CA 123.825 0.85 . . . . 0.0 113.245 177.769 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 10' ' ' HIS . . . . . . . . . . . . . 78.1 m-70 -118.6 118.46 31.74 Favored 'General case' 0 CA--C 1.531 0.246 0 C-N-CA 124.104 0.961 . . . . 0.0 108.438 179.22 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 11' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -74.5 140.85 44.83 Favored 'General case' 0 N--CA 1.465 0.284 0 N-CA-C 108.692 -0.855 . . . . 0.0 108.692 175.916 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 12' ' ' PHE . . . . . . . . . . . . . 3.3 m-85 -121.19 162.25 20.47 Favored 'General case' 0 N--CA 1.446 -0.633 0 CA-C-O 124.749 2.214 . . . . 0.0 108.762 163.98 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 13' ' ' VAL . . . . . . . . . . . . . 0.0 OUTLIER -136.79 145.98 29.25 Favored 'Isoleucine or valine' 0 C--N 1.31 -1.112 0 C-N-CA 130.143 3.377 . . . . 0.0 106.873 -179.218 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 14' ' ' LEU . . . . . . . . . . . . . 0.8 OUTLIER -69.75 140.92 53.5 Favored 'General case' 0 CA--C 1.504 -0.805 0 N-CA-C 106.532 -1.655 . . . . 0.0 106.532 166.555 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -117.29 -55.7 2.3 Favored 'General case' 0 N--CA 1.44 -0.952 0 O-C-N 124.222 0.951 . . . . 0.0 108.859 177.017 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 55.3 p -133.43 113.22 12.28 Favored 'General case' 0 N--CA 1.447 -0.616 0 CA-C-O 122.364 1.078 . . . . 0.0 109.841 -173.548 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 17' ' ' VAL . . . . . . . . . . . . . 3.2 t -74.25 160.0 5.4 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.45 0 C-N-CA 125.485 1.514 . . . . 0.0 107.648 179.639 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 18' ' ' ASN . . . . . . . . . . . . . 0.2 OUTLIER -44.75 -35.99 2.97 Favored 'General case' 0 N--CA 1.466 0.371 0 C-N-CA 125.536 1.534 . . . . 0.0 113.773 174.795 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . -107.4 -8.84 30.28 Favored Glycine 0 CA--C 1.528 0.855 0 CA-C-O 116.88 -2.067 . . . . 0.0 115.392 -173.519 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 20' ' ' LYS . . . . . 0.428 ' HB2' ' HD2' ' A' ' 21' ' ' PRO . 16.0 ptpt 174.62 165.21 0.35 Allowed Pre-proline 0 N--CA 1.476 0.833 0 CA-C-N 120.497 2.149 . . . . 0.0 112.146 178.742 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 21' ' ' PRO . . . . . 0.428 ' HD2' ' HB2' ' A' ' 20' ' ' LYS . 45.5 Cg_endo -62.12 173.69 3.04 Favored 'Trans proline' 0 CA--C 1.534 0.499 0 C-N-CA 123.284 2.656 . . . . 0.0 111.856 164.064 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 22' ' ' VAL . . . . . . . . . . . . . 9.0 p -145.6 150.99 15.16 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.508 0 CA-C-O 121.66 0.743 . . . . 0.0 111.013 168.428 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 23' ' ' THR . . . . . . . . . . . . . 14.6 p -115.47 103.96 11.28 Favored 'General case' 0 N--CA 1.452 -0.326 0 C-N-CA 126.458 1.903 . . . . 0.0 107.338 172.743 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 24' ' ' SER . . . . . . . . . . . . . 14.9 m -127.72 75.73 1.62 Allowed 'General case' 0 C--N 1.332 -0.154 0 N-CA-C 106.88 -1.526 . . . . 0.0 106.88 -179.07 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 25' ' ' ASP . . . . . . . . . . . . . 97.2 m-20 -81.79 14.3 2.75 Favored 'General case' 0 N--CA 1.468 0.431 0 C-N-CA 123.917 0.887 . . . . 0.0 111.873 -169.927 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 26' ' ' LYS . . . . . . . . . . . . . 32.8 ttpt -148.88 114.8 5.72 Favored 'General case' 0 N--CA 1.45 -0.447 0 N-CA-C 105.881 -1.896 . . . . 0.0 105.881 179.947 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 27' ' ' ASN . . . . . . . . . . . . . 0.0 OUTLIER 43.6 73.76 0.89 Allowed Pre-proline 0 CA--C 1.546 0.804 0 C-N-CA 127.73 2.412 . . . . 0.0 109.788 -172.724 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 28' ' ' PRO . . . . . . . . . . . . . 9.3 Cg_endo -60.0 164.53 11.98 Favored 'Trans proline' 0 CA--C 1.538 0.677 0 CA-C-N 120.952 1.376 . . . . 0.0 111.988 -176.091 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 29' ' ' PRO . . . . . . . . . . . . . 61.5 Cg_endo -63.9 92.89 0.18 Allowed 'Trans proline' 0 N--CA 1.452 -0.934 0 N-CA-C 106.972 -1.972 . . . . 0.0 106.972 161.045 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 30' ' ' GLU . . . . . . . . . . . . . 7.9 pt-20 -123.24 157.81 32.28 Favored 'General case' 0 C--N 1.32 -0.715 0 C-N-CA 124.652 1.181 . . . . 0.0 108.112 -168.199 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 31' ' ' ILE . . . . . 0.503 HD11 HG23 ' A' ' 39' ' ' ILE . 16.3 tt -143.48 109.83 1.51 Allowed 'Isoleucine or valine' 0 N--CA 1.453 -0.293 0 N-CA-C 108.223 -1.029 . . . . 0.0 108.223 178.596 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 32' ' ' SER . . . . . . . . . . . . . 22.9 t -88.31 171.77 9.92 Favored 'General case' 0 N--CA 1.445 -0.684 0 N-CA-C 107.341 -1.355 . . . . 0.0 107.341 159.684 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 33' ' ' PHE . . . . . . . . . . . . . 92.0 m-85 -133.73 -170.09 2.43 Favored 'General case' 0 N--CA 1.441 -0.893 0 C-N-CA 125.467 1.507 . . . . 0.0 107.327 178.08 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 34' ' ' GLY . . . . . . . . . . . . . . . 170.87 -163.43 36.5 Favored Glycine 0 N--CA 1.444 -0.771 0 N-CA-C 109.57 -1.412 . . . . 0.0 109.57 172.142 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 35' ' ' GLU . . . . . . . . . . . . . 2.2 tt0 -55.76 157.09 4.44 Favored 'General case' 0 CA--C 1.534 0.334 0 C-N-CA 124.229 1.012 . . . . 0.0 112.096 -162.378 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 30.2 mtmt 52.74 20.83 1.69 Allowed 'General case' 0 CA--C 1.537 0.448 0 C-N-CA 124.235 1.014 . . . . 0.0 113.109 -168.94 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 37' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER 61.93 29.07 17.71 Favored 'General case' 0 CA--C 1.542 0.666 0 C-N-CA 125.475 1.51 . . . . 0.0 110.638 -175.967 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 38' ' ' MET . . . . . . . . . . . . . 0.7 OUTLIER -60.32 162.05 6.53 Favored 'General case' 0 C--O 1.233 0.232 0 O-C-N 120.794 -1.191 . . . . 0.0 111.633 172.957 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 39' ' ' ILE . . . . . 0.503 HG23 HD11 ' A' ' 31' ' ' ILE . 19.7 mt -122.96 135.21 63.78 Favored 'Isoleucine or valine' 0 C--O 1.237 0.401 0 C-N-CA 126.123 1.769 . . . . 0.0 107.217 -174.262 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 40' ' ' SER . . . . . . . . . . . . . 56.8 m -137.49 114.53 10.74 Favored 'General case' 0 C--O 1.226 -0.156 0 N-CA-C 108.019 -1.104 . . . . 0.0 108.019 170.983 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 41' ' ' GLY . . . . . . . . . . . . . . . -146.96 174.65 26.7 Favored Glycine 0 C--N 1.335 0.495 0 CA-C-N 119.335 0.97 . . . . 0.0 112.53 177.288 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 42' ' ' SER . . . . . 0.409 ' HA ' ' HA ' ' A' ' 46' ' ' ARG . 8.4 t -150.75 70.7 1.01 Allowed 'General case' 0 C--O 1.226 -0.137 0 C-N-CA 123.567 0.747 . . . . 0.0 110.55 -172.009 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 43' ' ' MET . . . . . . . . . . . . . 82.8 mmm -54.71 -62.82 1.41 Allowed 'General case' 0 C--N 1.344 0.336 0 N-CA-C 108.324 -0.991 . . . . 0.0 108.324 173.475 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 44' ' ' CYS . . . . . 1.283 ' SG ' ' SG ' ' A' ' 70' ' ' CYS . 8.8 t -139.33 -50.43 0.51 Allowed 'General case' 0 N--CA 1.451 -0.387 0 C-N-CA 123.625 0.77 . . . . 0.0 110.548 165.664 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 45' ' ' ASN . . . . . . . . . . . . . 48.6 m-80 -103.69 19.35 20.03 Favored 'General case' 0 N--CA 1.472 0.649 0 CA-C-N 119.973 1.26 . . . . 0.0 113.342 -171.309 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 46' ' ' ARG . . . . . 0.409 ' HA ' ' HA ' ' A' ' 42' ' ' SER . 0.0 OUTLIER 66.04 152.47 0.06 Allowed 'General case' 0 N--CA 1.464 0.253 0 C-N-CA 125.431 1.493 . . . . 0.0 111.043 -177.848 . . . . . . . . 3 3 . 1 . 014 nuclear build core ' A' A ' 47' ' ' PHE . . . . . . . . . . . . . 25.0 p90 -154.54 168.36 26.98 Favored 'General case' 0 N--CA 1.447 -0.611 0 CA-C-O 122.768 1.27 . . . . 0.0 108.621 171.26 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 48' ' ' SER . . . . . . . . . . . . . 3.9 p -152.15 171.94 17.13 Favored 'General case' 0 N--CA 1.44 -0.973 0 CA-C-N 113.889 -1.505 . . . . 0.0 108.027 177.597 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 49' ' ' GLY . . . . . . . . . . . . . . . 179.25 163.78 30.76 Favored Glycine 0 N--CA 1.445 -0.73 0 N-CA-C 109.337 -1.505 . . . . 0.0 109.337 164.628 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 50' ' ' GLU . . . . . . . . . . . . . 13.5 pt-20 -82.99 95.37 7.99 Favored 'General case' 0 N--CA 1.44 -0.939 0 N-CA-C 105.572 -2.011 . . . . 0.0 105.572 165.032 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 51' ' ' GLY . . . . . . . . . . . . . . . -70.13 169.93 45.38 Favored Glycine 0 N--CA 1.447 -0.62 0 N-CA-C 109.781 -1.328 . . . . 0.0 109.781 167.85 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 52' ' ' LYS . . . . . . . . . . . . . 2.1 tppm? -153.27 146.42 24.66 Favored 'General case' 0 N--CA 1.452 -0.344 0 N-CA-C 107.72 -1.215 . . . . 0.0 107.72 169.585 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 53' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -121.33 82.39 1.93 Allowed 'General case' 0 CA--C 1.515 -0.385 0 N-CA-C 106.236 -1.765 . . . . 0.0 106.236 -178.992 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 1.5 t -103.91 -53.53 2.74 Favored 'General case' 0 N--CA 1.448 -0.567 0 N-CA-C 108.222 -1.029 . . . . 0.0 108.222 178.502 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 55' ' ' ASN . . . . . . . . . . . . . 17.6 p-10 -132.39 28.88 4.32 Favored 'General case' 0 CA--C 1.537 0.474 0 C-N-CA 125.889 1.676 . . . . 0.0 112.749 -163.954 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 56' ' ' GLY . . . . . . . . . . . . . . . 69.26 30.25 71.69 Favored Glycine 0 CA--C 1.53 1.007 0 O-C-N 121.146 -0.971 . . . . 0.0 111.806 -179.077 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 57' ' ' GLU . . . . . . . . . . . . . 42.8 tt0 -131.84 126.27 33.85 Favored 'General case' 0 N--CA 1.449 -0.5 0 N-CA-C 107.28 -1.378 . . . . 0.0 107.28 -178.176 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 58' ' ' LEU . . . . . 0.502 ' HB2' HG21 ' A' ' 92' ' ' VAL . 49.5 tp -102.6 103.62 13.94 Favored 'General case' 0 C--O 1.234 0.274 0 C-N-CA 124.073 0.949 . . . . 0.0 109.163 173.109 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 59' ' ' THR . . . . . . . . . . . . . 2.8 p -93.04 153.44 18.7 Favored 'General case' 0 CA--C 1.532 0.273 0 C-N-CA 122.883 0.473 . . . . 0.0 110.478 168.439 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 60' ' ' ALA . . . . . . . . . . . . . . . -155.34 106.3 2.55 Favored 'General case' 0 C--O 1.234 0.256 0 C-N-CA 125.58 1.552 . . . . 0.0 108.399 153.852 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 61' ' ' LYS . . . . . . . . . . . . . 29.1 ttpt -79.48 -25.3 41.91 Favored 'General case' 0 CA--C 1.535 0.365 0 C-N-CA 123.226 0.611 . . . . 0.0 110.638 168.157 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 62' ' ' GLY . . . . . . . . . . . . . . . -83.83 37.45 2.82 Favored Glycine 0 C--N 1.334 0.434 0 C-N-CA 126.443 1.973 . . . . 0.0 112.852 -176.399 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 63' ' ' LEU . . . . . 0.457 HD22 ' HA ' ' A' ' 83' ' ' SER . 0.5 OUTLIER -82.03 81.33 8.02 Favored 'General case' 0 N--CA 1.444 -0.729 0 CA-C-O 121.857 0.837 . . . . 0.0 111.7 -164.096 . . . . . . . . 3 3 . 1 . 014 nuclear build core ' A' A ' 64' ' ' ALA . . . . . . . . . . . . . . . -72.46 131.43 42.55 Favored 'General case' 0 C--N 1.327 -0.402 0 CA-C-N 115.278 -0.874 . . . . 0.0 108.98 176.09 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 65' ' ' MET . . . . . . . . . . . . . 54.9 mtp -130.97 -178.22 4.72 Favored 'General case' 0 CA--C 1.543 0.691 0 C-N-CA 128.239 2.616 . . . . 0.0 109.832 179.666 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 66' ' ' THR . . . . . . . . . . . . . 18.2 p -116.68 -168.93 1.54 Allowed 'General case' 0 N--CA 1.472 0.643 0 C-N-CA 125.339 1.456 . . . . 0.0 111.834 -179.171 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 67' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -138.35 79.97 1.77 Allowed 'General case' 0 N--CA 1.452 -0.36 0 C-N-CA 126.556 1.943 . . . . 0.0 107.014 -177.024 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 68' ' ' MET . . . . . . . . . . . . . 76.1 mtm -131.72 -160.31 1.04 Allowed 'General case' 0 C--N 1.325 -0.475 0 C-N-CA 126.804 2.042 . . . . 0.0 107.575 178.962 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 69' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -143.53 155.96 44.47 Favored 'General case' 0 N--CA 1.445 -0.685 0 C-N-CA 124.993 1.317 . . . . 0.0 110.205 160.382 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 70' ' ' CYS . . . . . 1.283 ' SG ' ' SG ' ' A' ' 44' ' ' CYS . 1.6 p -92.0 -9.01 44.47 Favored 'General case' 0 C--N 1.321 -0.663 0 C-N-CA 126.946 2.099 . . . . 0.0 112.001 171.006 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 71' ' ' ALA . . . . . . . . . . . . . . . 59.64 5.99 0.77 Allowed 'General case' 0 CA--C 1.538 0.503 0 C-N-CA 126.675 1.99 . . . . 0.0 114.183 -167.636 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 72' ' ' ASN . . . . . . . . . . . . . 21.2 t-20 -111.24 144.66 30.91 Favored Pre-proline 0 CA--C 1.533 0.301 0 C-N-CA 124.828 1.251 . . . . 0.0 108.567 174.362 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 73' ' ' PRO . . . . . . . . . . . . . 87.5 Cg_endo -77.48 -47.05 0.13 Allowed 'Trans proline' 0 CA--C 1.534 0.513 0 C-N-CA 122.652 2.235 . . . . 0.0 111.912 -178.471 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 74' ' ' GLN . . . . . . . . . . . . . 15.4 tt0 -59.12 -45.75 90.11 Favored 'General case' 0 N--CA 1.452 -0.361 0 C-N-CA 127.381 2.272 . . . . 0.0 110.175 -171.749 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 75' ' ' LEU . . . . . . . . . . . . . 98.6 mt -65.06 -42.99 93.71 Favored 'General case' 0 N--CA 1.452 -0.344 0 C-N-CA 125.138 1.375 . . . . 0.0 110.498 177.687 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 76' ' ' ASN . . . . . . . . . . . . . 0.6 OUTLIER -60.55 -44.99 95.53 Favored 'General case' 0 N--CA 1.468 0.473 0 C-N-CA 123.854 0.861 . . . . 0.0 111.679 177.977 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 77' ' ' GLU . . . . . . . . . . . . . 21.3 tp10 -63.99 -34.5 78.15 Favored 'General case' 0 CA--C 1.536 0.435 0 C-N-CA 123.699 0.8 . . . . 0.0 111.23 175.077 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 78' ' ' LEU . . . . . . . . . . . . . 21.7 mt -64.2 -20.49 66.06 Favored 'General case' 0 CA--C 1.533 0.3 0 CA-C-O 118.166 -0.921 . . . . 0.0 112.259 178.682 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 79' ' ' ASP . . . . . . . . . . . . . 67.6 m-20 -65.1 -27.67 68.92 Favored 'General case' 0 N--CA 1.467 0.406 0 CA-C-N 119.641 1.109 . . . . 0.0 111.39 172.153 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 80' ' ' ASN . . . . . . . . . . . . . 5.2 m-20 -76.12 -52.93 9.09 Favored 'General case' 0 N--CA 1.455 -0.214 0 N-CA-C 107.749 -1.204 . . . . 0.0 107.749 175.85 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 81' ' ' THR . . . . . . . . . . . . . 28.9 m -47.98 -57.27 5.97 Favored 'General case' 0 CA--C 1.535 0.391 0 C-N-CA 124.066 0.946 . . . . 0.0 110.468 178.482 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 82' ' ' ILE . . . . . . . . . . . . . 10.7 tp -58.13 -39.98 75.26 Favored 'Isoleucine or valine' 0 C--O 1.233 0.193 0 CA-C-N 119.538 1.063 . . . . 0.0 111.401 -172.851 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 83' ' ' SER . . . . . 0.457 ' HA ' HD22 ' A' ' 63' ' ' LEU . 28.6 t -60.65 -53.9 51.88 Favored 'General case' 0 N--CA 1.446 -0.645 0 C-N-CA 123.572 0.749 . . . . 0.0 109.008 -177.459 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 84' ' ' GLU . . . . . . . . . . . . . 9.7 tt0 -76.34 -16.21 59.8 Favored 'General case' 0 CA--C 1.539 0.53 0 N-CA-C 112.765 0.654 . . . . 0.0 112.765 -175.765 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 85' ' ' MET . . . . . . . . . . . . . 77.6 mtp -67.41 -61.18 2.03 Favored 'General case' 0 C--N 1.34 0.175 0 CA-C-N 120.175 1.352 . . . . 0.0 107.499 166.657 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 86' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -63.45 -29.09 70.43 Favored 'General case' 0 C--N 1.33 -0.249 0 C-N-CA 124.63 1.172 . . . . 0.0 112.025 -172.614 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 87' ' ' LYS . . . . . . . . . . . . . 10.9 mttt -64.4 -34.88 79.2 Favored 'General case' 0 C--N 1.333 -0.116 0 CA-C-N 118.752 0.706 . . . . 0.0 110.735 179.703 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 88' ' ' GLU . . . . . . . . . . . . . 9.4 mm-40 -105.07 0.56 27.66 Favored 'General case' 0 CA--C 1.53 0.2 0 C-N-CA 124.669 1.188 . . . . 0.0 111.845 -167.876 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 89' ' ' GLY . . . . . . . . . . . . . . . 86.77 96.68 0.84 Allowed Glycine 0 C--N 1.336 0.545 0 N-CA-C 108.797 -1.721 . . . . 0.0 108.797 -177.432 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 90' ' ' ALA . . . . . . . . . . . . . . . -78.29 135.23 37.49 Favored 'General case' 0 N--CA 1.449 -0.481 0 N-CA-C 109.074 -0.713 . . . . 0.0 109.074 175.759 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 91' ' ' GLN . . . . . . . . . . . . . 2.4 mp0 -72.76 112.14 8.53 Favored 'General case' 0 N--CA 1.449 -0.481 0 N-CA-C 105.548 -2.019 . . . . 0.0 105.548 176.125 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 92' ' ' VAL . . . . . 0.502 HG21 ' HB2' ' A' ' 58' ' ' LEU . 55.4 t -104.15 105.94 19.4 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.35 0 N-CA-C 106.551 -1.648 . . . . 0.0 106.551 -178.731 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 93' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER -121.58 91.49 3.53 Favored 'General case' 0 CA--C 1.516 -0.36 0 N-CA-C 108.478 -0.934 . . . . 0.0 108.478 176.72 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 94' ' ' LEU . . . . . . . . . . . . . 44.0 tp -76.73 134.34 39.22 Favored 'General case' 0 N--CA 1.451 -0.408 0 N-CA-C 107.527 -1.286 . . . . 0.0 107.527 167.519 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 95' ' ' THR . . . . . . . . . . . . . 1.2 t -117.7 178.36 4.43 Favored 'General case' 0 C--N 1.319 -0.746 0 N-CA-C 104.969 -2.234 . . . . 0.0 104.969 169.581 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 96' ' ' ALA . . . . . . . . . . . . . . . -44.78 -21.15 0.05 OUTLIER 'General case' 0 CA--C 1.545 0.758 0 N-CA-C 118.542 2.793 . . . . 0.0 118.542 -157.617 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 97' ' ' ASN . . . . . . . . . . . . . 0.4 OUTLIER -160.35 14.72 0.12 Allowed 'General case' 0 CA--C 1.542 0.643 0 C-N-CA 125.257 1.423 . . . . 0.0 111.68 162.693 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 98' ' ' GLN . . . . . . . . . . . . . 16.4 tt0 -130.57 124.95 32.97 Favored 'General case' 0 N--CA 1.466 0.326 0 O-C-N 120.466 -1.396 . . . . 0.0 109.197 -176.388 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 99' ' ' LEU . . . . . 0.492 ' HB3' ' HB2' ' A' ' 110' ' ' TYR . 12.6 tp -79.06 148.22 32.53 Favored 'General case' 0 C--N 1.326 -0.441 0 C-N-CA 125.875 1.67 . . . . 0.0 109.052 172.676 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 100' ' ' THR . . . . . . . . . . . . . 22.8 m -122.07 129.27 52.25 Favored 'General case' 0 N--CA 1.454 -0.228 0 N-CA-C 106.973 -1.491 . . . . 0.0 106.973 152.077 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 101' ' ' LEU . . . . . . . . . . . . . 1.5 mm? -102.2 100.39 10.59 Favored 'General case' 0 CA--C 1.517 -0.313 0 N-CA-C 105.716 -1.957 . . . . 0.0 105.716 160.703 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 102' ' ' ALA . . . . . . . . . . . . . . . -94.42 151.03 19.7 Favored 'General case' 0 CA--C 1.532 0.286 0 N-CA-C 107.863 -1.162 . . . . 0.0 107.863 167.793 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 103' ' ' THR . . . . . 0.426 HG22 ' H ' ' A' ' 104' ' ' ALA . 0.2 OUTLIER -161.82 177.76 9.58 Favored 'General case' 0 N--CA 1.443 -0.809 0 C-N-CA 126.209 1.803 . . . . 0.0 108.177 166.524 . . . . . . . . 3 3 . 1 . 014 nuclear build core ' A' A ' 104' ' ' ALA . . . . . 0.426 ' H ' HG22 ' A' ' 103' ' ' THR . . . -50.86 -37.87 45.93 Favored 'General case' 0 N--CA 1.447 -0.589 0 C-N-CA 123.418 0.687 . . . . 0.0 112.715 174.05 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 105' ' ' LYS . . . . . . . . . . . . . 0.3 OUTLIER -60.85 -71.99 0.13 Allowed 'General case' 0 C--N 1.342 0.255 0 N-CA-C 112.604 0.594 . . . . 0.0 112.604 178.928 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 106' ' ' GLN . . . . . . . . . . . . . 73.3 mt-30 -150.75 176.86 10.64 Favored 'General case' 0 C--N 1.329 -0.307 0 C-N-CA 127.573 2.349 . . . . 0.0 106.76 -171.956 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 107' ' ' THR . . . . . . . . . . . . . 5.8 t -114.13 149.6 35.39 Favored 'General case' 0 N--CA 1.448 -0.555 0 N-CA-C 106.523 -1.658 . . . . 0.0 106.523 161.697 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 108' ' ' LEU . . . . . . . . . . . . . 78.9 mt -140.59 123.22 16.19 Favored 'General case' 0 C--O 1.237 0.403 0 N-CA-C 106.773 -1.566 . . . . 0.0 106.773 -175.6 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 109' ' ' THR . . . . . . . . . . . . . 24.4 m -89.65 122.27 32.62 Favored 'General case' 0 C--O 1.24 0.566 0 N-CA-C 107.286 -1.376 . . . . 0.0 107.286 176.974 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 110' ' ' TYR . . . . . 0.492 ' HB2' ' HB3' ' A' ' 99' ' ' LEU . 95.4 m-85 -114.32 157.52 22.68 Favored 'General case' 0 N--CA 1.453 -0.324 0 N-CA-C 108.717 -0.846 . . . . 0.0 108.717 174.045 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 111' ' ' LYS . . . . . . . . . . . . . 0.8 OUTLIER -122.38 141.02 52.02 Favored 'General case' 0 C--N 1.332 -0.163 0 C-N-CA 124.029 0.932 . . . . 0.0 109.016 -173.271 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 112' ' ' LEU . . . . . . . . . . . . . 25.3 tp -73.86 54.19 0.49 Allowed 'General case' 0 CA--C 1.534 0.343 0 C-N-CA 128.347 2.659 . . . . 0.0 108.875 171.857 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 113' ' ' ALA . . . . . . . . . . . . . . . -93.64 79.75 4.28 Favored 'General case' 0 N--CA 1.448 -0.526 0 N-CA-C 105.26 -2.126 . . . . 0.0 105.26 174.808 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 114' ' ' ASP . . . . . . . . . . . . . 20.4 t0 . . . . . 0 C--N 1.327 -0.384 0 CA-C-O 123.745 1.736 . . . . 0.0 109.99 -170.153 . . . . . . . . 0 0 . 1 . 015 nuclear build core ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 4.6 ttp . . . . . 0 C--O 1.234 0.269 0 N-CA-C 108.195 -1.039 . . . . 0.0 108.195 . . . . . . . . . 0 0 . 1 . 015 nuclear build core ' A' A ' 2' ' ' VAL . . . . . . . . . . . . . 54.2 t -61.89 156.32 4.07 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.446 0 C-N-CA 124.573 1.149 . . . . 0.0 109.861 179.781 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 3' ' ' THR . . . . . 0.419 ' HB ' ' HD2' ' A' ' 4' ' ' PRO . 62.2 p -134.16 165.66 35.05 Favored Pre-proline 0 CA--C 1.53 0.209 0 O-C-N 121.844 -0.535 . . . . 0.0 111.919 170.277 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 4' ' ' PRO . . . . . 0.419 ' HD2' ' HB ' ' A' ' 3' ' ' THR . 29.9 Cg_endo -63.38 -35.96 58.51 Favored 'Trans proline' 0 N--CA 1.459 -0.53 0 C-N-CA 123.116 2.544 . . . . 0.0 113.791 170.951 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 5' ' ' GLU . . . . . . . . . . . . . 57.2 tt0 -57.37 -49.63 75.55 Favored 'General case' 0 C--N 1.325 -0.48 0 C-N-CA 123.217 0.607 . . . . 0.0 111.116 -171.935 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 6' ' ' GLN . . . . . . . . . . . . . 3.9 pt20 -68.56 14.22 0.08 Allowed 'General case' 0 CA--C 1.537 0.447 0 C-N-CA 127.374 2.27 . . . . 0.0 114.491 -178.259 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 7' ' ' LEU . . . . . . . . . . . . . 72.1 mt -134.7 -49.54 0.77 Allowed 'General case' 0 N--CA 1.456 -0.129 0 C-N-CA 124.449 1.1 . . . . 0.0 112.372 -170.726 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 8' ' ' GLN . . . . . . . . . . . . . 5.2 mt-30 -52.65 -1.35 0.02 OUTLIER 'General case' 0 N--CA 1.466 0.362 0 C-N-CA 128.518 2.727 . . . . 0.0 117.902 -172.771 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 9' ' ' HIS . . . . . . . . . . . . . 91.8 m-70 -143.55 10.94 1.66 Allowed 'General case' 0 CA--C 1.535 0.393 0 CA-C-N 120.269 1.395 . . . . 0.0 111.695 172.538 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 10' ' ' HIS . . . . . . . . . . . . . 81.7 m-70 -108.42 115.26 29.77 Favored 'General case' 0 N--CA 1.452 -0.346 0 C-N-CA 124.909 1.284 . . . . 0.0 108.563 -167.892 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 11' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -70.38 142.08 52.13 Favored 'General case' 0 N--CA 1.464 0.27 0 N-CA-C 107.777 -1.194 . . . . 0.0 107.777 169.726 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 12' ' ' PHE . . . . . . . . . . . . . 41.9 m-85 -125.47 164.61 20.09 Favored 'General case' 0 N--CA 1.444 -0.76 0 C-N-CA 125.623 1.569 . . . . 0.0 107.874 162.459 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 13' ' ' VAL . . . . . . . . . . . . . 4.3 t -134.29 146.91 30.44 Favored 'Isoleucine or valine' 0 C--O 1.236 0.345 0 N-CA-C 107.784 -1.191 . . . . 0.0 107.784 -178.794 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 14' ' ' LEU . . . . . . . . . . . . . 27.2 tp -75.18 91.28 2.6 Favored 'General case' 0 N--CA 1.454 -0.252 0 O-C-N 123.787 0.679 . . . . 0.0 109.402 -175.301 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 0.7 OUTLIER -66.44 -42.38 87.74 Favored 'General case' 0 C--O 1.237 0.397 0 C-N-CA 124.656 1.182 . . . . 0.0 109.514 -177.134 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -161.9 152.95 18.02 Favored 'General case' 0 N--CA 1.449 -0.51 0 CA-C-O 121.737 0.78 . . . . 0.0 111.174 -174.146 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 17' ' ' VAL . . . . . . . . . . . . . 2.0 t -116.72 161.29 15.58 Favored 'Isoleucine or valine' 0 C--O 1.235 0.324 0 N-CA-C 107.011 -1.477 . . . . 0.0 107.011 -179.53 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 18' ' ' ASN . . . . . . . . . . . . . 17.9 t30 -51.17 -42.2 60.68 Favored 'General case' 0 N--CA 1.46 0.07 0 C-N-CA 123.147 0.579 . . . . 0.0 111.902 176.846 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . -62.54 -72.89 0.58 Allowed Glycine 0 CA--C 1.525 0.697 0 N-CA-C 110.159 -1.176 . . . . 0.0 110.159 174.265 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 17.0 mttt -165.74 166.88 9.58 Favored Pre-proline 0 C--N 1.332 -0.176 0 C-N-CA 128.239 2.616 . . . . 0.0 108.405 -171.445 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 21' ' ' PRO . . . . . . . . . . . . . 56.8 Cg_endo -58.96 169.43 3.51 Favored 'Trans proline' 0 N--CA 1.455 -0.751 0 CA-C-N 120.389 1.175 . . . . 0.0 110.679 172.389 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 22' ' ' VAL . . . . . . . . . . . . . 2.7 t -105.97 162.4 5.06 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.396 0 N-CA-C 107.067 -1.457 . . . . 0.0 107.067 174.922 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 23' ' ' THR . . . . . . . . . . . . . 0.6 OUTLIER -136.96 81.0 1.85 Allowed 'General case' 0 C--N 1.329 -0.289 0 C-N-CA 124.3 1.04 . . . . 0.0 108.533 -172.868 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 24' ' ' SER . . . . . . . . . . . . . 27.7 m -128.88 100.51 5.71 Favored 'General case' 0 C--N 1.325 -0.458 0 C-N-CA 125.701 1.6 . . . . 0.0 107.179 -175.637 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 25' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER -75.1 -16.06 60.58 Favored 'General case' 0 N--CA 1.467 0.405 0 C-N-CA 125.765 1.626 . . . . 0.0 112.151 -174.164 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 26' ' ' LYS . . . . . . . . . . . . . 20.4 tttp -143.4 136.72 28.09 Favored 'General case' 0 N--CA 1.448 -0.554 0 N-CA-C 105.748 -1.945 . . . . 0.0 105.748 -174.679 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 27' ' ' ASN . . . . . . . . . . . . . 42.8 m-20 44.93 66.62 4.96 Favored Pre-proline 0 CA--C 1.547 0.839 0 C-N-CA 125.844 1.657 . . . . 0.0 110.862 178.895 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 28' ' ' PRO . . . . . . . . . . . . . 56.2 Cg_endo -65.87 173.82 6.48 Favored 'Trans proline' 0 C--N 1.346 0.413 0 C-N-CA 123.988 3.125 . . . . 0.0 112.751 -176.275 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 29' ' ' PRO . . . . . . . . . . . . . 70.3 Cg_endo -72.82 93.79 0.79 Allowed 'Trans proline' 0 N--CA 1.446 -1.272 0 N-CA-C 108.397 -1.424 . . . . 0.0 108.397 157.359 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 30' ' ' GLU . . . . . . . . . . . . . 0.2 OUTLIER -98.38 177.64 5.29 Favored 'General case' 0 C--N 1.327 -0.403 0 O-C-N 120.546 -1.346 . . . . 0.0 109.686 167.754 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 31' ' ' ILE . . . . . . . . . . . . . 9.0 tt -147.54 114.33 0.98 Allowed 'Isoleucine or valine' 0 N--CA 1.451 -0.378 0 N-CA-C 106.952 -1.499 . . . . 0.0 106.952 171.348 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 32' ' ' SER . . . . . . . . . . . . . 15.1 m -116.11 159.61 21.5 Favored 'General case' 0 C--O 1.238 0.477 0 N-CA-C 108.902 -0.777 . . . . 0.0 108.902 174.441 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 33' ' ' PHE . . . . . . . . . . . . . 29.0 m-85 -130.55 152.55 49.8 Favored 'General case' 0 N--CA 1.448 -0.555 0 N-CA-C 108.364 -0.976 . . . . 0.0 108.364 175.862 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 34' ' ' GLY . . . . . . . . . . . . . . . -117.98 -178.44 17.26 Favored Glycine 0 C--N 1.332 0.317 0 N-CA-C 109.568 -1.413 . . . . 0.0 109.568 171.13 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 35' ' ' GLU . . . . . . . . . . . . . 3.8 pt-20 -63.22 -26.17 68.67 Favored 'General case' 0 C--N 1.324 -0.513 0 C-N-CA 128.671 2.788 . . . . 0.0 112.527 -158.359 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 0.3 OUTLIER -85.2 13.44 6.35 Favored 'General case' 0 N--CA 1.437 -1.121 0 C-N-CA 129.296 3.038 . . . . 0.0 114.308 173.352 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 37' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER 60.8 14.78 5.38 Favored 'General case' 0 CA--C 1.55 0.946 0 C-N-CA 127.394 2.278 . . . . 0.0 112.522 -168.305 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 38' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -54.58 160.51 1.77 Allowed 'General case' 0 N--CA 1.467 0.416 0 O-C-N 119.912 -1.742 . . . . 0.0 110.623 177.658 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 39' ' ' ILE . . . . . . . . . . . . . 17.9 mt -132.12 120.7 44.53 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.514 0 N-CA-C 105.555 -2.017 . . . . 0.0 105.555 -177.546 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 40' ' ' SER . . . . . . . . . . . . . 17.3 m -129.18 89.1 2.8 Favored 'General case' 0 CA--C 1.535 0.378 0 C-N-CA 126.131 1.772 . . . . 0.0 108.607 -174.674 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 41' ' ' GLY . . . . . . . . . . . . . . . -135.61 -167.91 11.42 Favored Glycine 0 CA--C 1.538 1.487 0 C-N-CA 124.304 0.954 . . . . 0.0 110.95 -173.735 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 42' ' ' SER . . . . . . . . . . . . . 23.6 t -171.91 93.02 0.14 Allowed 'General case' 0 CA--C 1.535 0.379 0 C-N-CA 128.247 2.619 . . . . 0.0 108.525 177.497 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 43' ' ' MET . . . . . . . . . . . . . 2.6 mmt -63.74 -51.1 66.46 Favored 'General case' 0 C--O 1.231 0.107 0 N-CA-C 108.651 -0.87 . . . . 0.0 108.651 170.761 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 44' ' ' CYS . . . . . 1.302 ' SG ' ' SG ' ' A' ' 70' ' ' CYS . 48.9 t -148.79 -66.06 0.23 Allowed 'General case' 0 CA--C 1.514 -0.427 0 N-CA-C 108.182 -1.044 . . . . 0.0 108.182 169.023 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 45' ' ' ASN . . . . . . . . . . . . . 4.4 m-20 -75.93 17.36 0.33 Allowed 'General case' 0 CA--C 1.534 0.347 0 C-N-CA 127.835 2.454 . . . . 0.0 112.549 -172.612 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 46' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER 61.68 161.32 0.07 Allowed 'General case' 0 N--CA 1.463 0.207 0 C-N-CA 125.855 1.662 . . . . 0.0 111.545 -163.952 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 47' ' ' PHE . . . . . . . . . . . . . 35.0 p90 -158.81 159.78 35.5 Favored 'General case' 0 C--N 1.329 -0.308 0 N-CA-C 107.541 -1.281 . . . . 0.0 107.541 153.348 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 48' ' ' SER . . . . . . . . . . . . . 1.4 m -151.91 158.47 43.22 Favored 'General case' 0 C--O 1.237 0.427 0 N-CA-C 108.561 -0.903 . . . . 0.0 108.561 161.075 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 49' ' ' GLY . . . . . . . . . . . . . . . -177.76 166.68 37.12 Favored Glycine 0 CA--C 1.52 0.389 0 N-CA-C 110.136 -1.186 . . . . 0.0 110.136 179.578 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 50' ' ' GLU . . . . . . . . . . . . . 43.4 mt-10 -88.51 98.26 11.54 Favored 'General case' 0 N--CA 1.449 -0.488 0 N-CA-C 107.575 -1.268 . . . . 0.0 107.575 -176.832 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 51' ' ' GLY . . . . . . . . . . . . . . . -59.61 169.87 6.54 Favored Glycine 0 CA--C 1.531 1.083 0 CA-C-N 115.737 -0.665 . . . . 0.0 112.424 172.106 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 52' ' ' LYS . . . . . . . . . . . . . 35.6 ttpt -155.02 147.03 23.6 Favored 'General case' 0 C--O 1.235 0.327 0 O-C-N 121.549 -0.971 . . . . 0.0 111.142 169.606 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 53' ' ' LEU . . . . . . . . . . . . . 24.2 tp -134.77 139.73 45.37 Favored 'General case' 0 N--CA 1.453 -0.324 0 C-N-CA 127.575 2.35 . . . . 0.0 107.484 170.148 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 54' ' ' SER . . . . . 0.411 ' H ' ' H ' ' A' ' 55' ' ' ASN . 1.3 t -162.21 -14.77 0.04 OUTLIER 'General case' 0 CA--C 1.541 0.606 0 C-N-CA 125.574 1.55 . . . . 0.0 110.39 163.917 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 55' ' ' ASN . . . . . 0.411 ' H ' ' H ' ' A' ' 54' ' ' SER . 43.9 m-20 -123.44 14.12 9.54 Favored 'General case' 0 CA--C 1.541 0.601 0 C-N-CA 124.761 1.224 . . . . 0.0 113.099 -170.407 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 56' ' ' GLY . . . . . . . . . . . . . . . 72.09 19.7 78.61 Favored Glycine 0 CA--C 1.533 1.183 0 CA-C-N 120.429 1.468 . . . . 0.0 112.672 -172.24 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 57' ' ' GLU . . . . . . . . . . . . . 19.7 tt0 -130.01 149.84 51.55 Favored 'General case' 0 CA--C 1.541 0.607 0 C-N-CA 125.187 1.395 . . . . 0.0 107.958 -176.726 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 58' ' ' LEU . . . . . . . . . . . . . 66.2 tp -114.72 124.74 52.57 Favored 'General case' 0 N--CA 1.465 0.291 0 CA-C-N 119.603 1.092 . . . . 0.0 109.066 177.516 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 59' ' ' THR . . . . . . . . . . . . . 11.8 p -123.01 159.47 28.32 Favored 'General case' 0 C--N 1.326 -0.42 0 C-N-CA 126.171 1.788 . . . . 0.0 110.15 169.531 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 60' ' ' ALA . . . . . 0.618 ' HB2' ' HB3' ' A' ' 86' ' ' LEU . . . -80.54 169.62 17.44 Favored 'General case' 0 N--CA 1.451 -0.423 0 C-N-CA 126.191 1.796 . . . . 0.0 113.468 162.532 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 61' ' ' LYS . . . . . . . . . . . . . 77.6 tttt -135.79 121.51 19.66 Favored 'General case' 0 N--CA 1.441 -0.876 0 N-CA-C 105.211 -2.144 . . . . 0.0 105.211 147.212 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 62' ' ' GLY . . . . . . . . . . . . . . . 104.41 -61.25 0.41 Allowed Glycine 0 CA--C 1.526 0.73 0 CA-C-O 118.575 -1.125 . . . . 0.0 113.775 160.569 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 63' ' ' LEU . . . . . . . . . . . . . 2.5 tp 44.85 87.79 0.02 OUTLIER 'General case' 0 CA--C 1.54 0.578 0 C-N-CA 128.305 2.642 . . . . 0.0 113.591 -175.499 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 64' ' ' ALA . . . . . . . . . . . . . . . -71.57 147.44 47.63 Favored 'General case' 0 C--N 1.33 -0.25 0 N-CA-C 107.094 -1.446 . . . . 0.0 107.094 162.05 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 65' ' ' MET . . . . . . . . . . . . . 63.9 mtp -147.06 -171.11 3.7 Favored 'General case' 0 CA--C 1.542 0.666 0 C-N-CA 126.806 2.042 . . . . 0.0 107.625 174.679 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 66' ' ' THR . . . . . . . . . . . . . 3.9 p -139.15 -168.82 2.52 Favored 'General case' 0 CA--C 1.546 0.812 0 C-N-CA 124.494 1.118 . . . . 0.0 109.847 176.785 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 67' ' ' ARG . . . . . . . . . . . . . 16.6 mmt85 -119.18 28.44 8.24 Favored 'General case' 0 N--CA 1.473 0.716 0 C-N-CA 127.322 2.249 . . . . 0.0 111.935 177.934 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 68' ' ' MET . . . . . . . . . . . . . 77.4 mtm -74.98 -169.7 0.96 Allowed 'General case' 0 CA--C 1.541 0.621 0 O-C-N 120.632 -1.293 . . . . 0.0 109.698 178.651 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 69' ' ' MET . . . . . . . . . . . . . 1.0 OUTLIER -149.63 176.68 10.44 Favored 'General case' 0 CA--C 1.522 -0.134 0 C-N-CA 125.531 1.532 . . . . 0.0 109.626 174.321 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 70' ' ' CYS . . . . . 1.302 ' SG ' ' SG ' ' A' ' 44' ' ' CYS . 75.9 m -133.8 15.38 3.96 Favored 'General case' 0 CA--C 1.537 0.461 0 C-N-CA 124.225 1.01 . . . . 0.0 111.658 179.986 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 71' ' ' ALA . . . . . . . . . . . . . . . 60.6 -25.75 0.04 OUTLIER 'General case' 0 CA--C 1.537 0.455 0 C-N-CA 130.184 3.394 . . . . 0.0 115.308 -171.212 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 72' ' ' ASN . . . . . . . . . . . . . 19.8 t30 -96.42 144.56 28.04 Favored Pre-proline 0 C--O 1.236 0.347 0 C-N-CA 124.116 0.967 . . . . 0.0 110.366 -176.552 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 73' ' ' PRO . . . . . . . . . . . . . 53.5 Cg_endo -73.72 -38.19 2.55 Favored 'Trans proline' 0 N--CA 1.46 -0.447 0 C-N-CA 122.044 1.829 . . . . 0.0 112.284 -174.6 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 74' ' ' GLN . . . . . . . . . . . . . 63.1 tt0 -52.48 -46.25 66.5 Favored 'General case' 0 C--O 1.224 -0.277 0 CA-C-N 118.973 0.806 . . . . 0.0 110.661 -178.378 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 75' ' ' LEU . . . . . . . . . . . . . 90.0 mt -66.12 -37.65 86.26 Favored 'General case' 0 CA--C 1.534 0.347 0 O-C-N 121.873 -0.517 . . . . 0.0 111.623 -179.557 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 76' ' ' ASN . . . . . . . . . . . . . 0.8 OUTLIER -76.05 -28.92 57.84 Favored 'General case' 0 N--CA 1.467 0.38 0 CA-C-N 118.936 0.789 . . . . 0.0 111.691 -178.483 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 77' ' ' GLU . . . . . . . . . . . . . 3.3 tp10 -65.75 -36.64 84.14 Favored 'General case' 0 CA--C 1.533 0.321 0 C-N-CA 125.047 1.339 . . . . 0.0 109.008 166.729 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 78' ' ' LEU . . . . . . . . . . . . . 5.2 mp -70.63 -13.17 61.98 Favored 'General case' 0 N--CA 1.453 -0.298 0 O-C-N 121.121 -0.987 . . . . 0.0 113.55 -177.429 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 79' ' ' ASP . . . . . . . . . . . . . 13.4 t70 -52.99 -58.28 7.51 Favored 'General case' 0 C--O 1.231 0.12 0 C-N-CA 124.725 1.21 . . . . 0.0 110.696 163.273 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 80' ' ' ASN . . . . . . . . . . . . . 13.4 p30 -75.33 -35.7 61.15 Favored 'General case' 0 N--CA 1.444 -0.731 0 N-CA-C 109.605 -0.517 . . . . 0.0 109.605 -173.525 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 81' ' ' THR . . . . . . . . . . . . . 32.6 m -48.43 -53.15 18.86 Favored 'General case' 0 N--CA 1.447 -0.606 0 C-N-CA 125.29 1.436 . . . . 0.0 110.349 174.29 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 82' ' ' ILE . . . . . . . . . . . . . 8.9 tp -77.2 -38.31 27.15 Favored 'Isoleucine or valine' 0 C--N 1.341 0.231 0 CA-C-N 120.069 1.304 . . . . 0.0 111.586 -178.686 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 83' ' ' SER . . . . . . . . . . . . . 4.2 t -50.46 -50.96 51.0 Favored 'General case' 0 C--O 1.238 0.467 0 C-N-CA 123.679 0.791 . . . . 0.0 109.851 -179.904 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 84' ' ' GLU . . . . . . . . . . . . . 0.5 OUTLIER -67.41 -44.64 78.31 Favored 'General case' 0 N--CA 1.45 -0.444 0 C-N-CA 124.46 1.104 . . . . 0.0 112.006 -178.451 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 85' ' ' MET . . . . . . . . . . . . . 90.2 mtp -66.8 -23.41 66.05 Favored 'General case' 0 C--O 1.232 0.16 0 CA-C-O 121.864 0.84 . . . . 0.0 110.7 -166.667 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 86' ' ' LEU . . . . . 0.618 ' HB3' ' HB2' ' A' ' 60' ' ' ALA . 2.8 mm? -98.02 -31.42 12.16 Favored 'General case' 0 N--CA 1.446 -0.664 0 C-N-CA 125.301 1.44 . . . . 0.0 110.413 -177.814 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 87' ' ' LYS . . . . . . . . . . . . . 54.0 mttt -66.6 -49.91 64.77 Favored 'General case' 0 N--CA 1.439 -0.986 0 N-CA-C 107.438 -1.319 . . . . 0.0 107.438 179.16 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 88' ' ' GLU . . . . . . . . . . . . . 31.2 mt-10 -89.15 -8.44 53.68 Favored 'General case' 0 CA--C 1.532 0.265 0 N-CA-C 113.169 0.804 . . . . 0.0 113.169 -168.115 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 89' ' ' GLY . . . . . . . . . . . . . . . 83.54 138.91 3.63 Favored Glycine 0 C--N 1.337 0.588 0 C-N-CA 124.358 0.98 . . . . 0.0 112.423 175.45 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 90' ' ' ALA . . . . . . . . . . . . . . . -131.48 154.03 49.16 Favored 'General case' 0 CA--C 1.514 -0.426 0 N-CA-C 114.127 1.158 . . . . 0.0 114.127 -165.275 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 91' ' ' GLN . . . . . . . . . . . . . 9.0 mp0 -70.36 129.22 38.71 Favored 'General case' 0 N--CA 1.445 -0.709 0 N-CA-C 104.242 -2.503 . . . . 0.0 104.242 163.1 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 92' ' ' VAL . . . . . . . . . . . . . 3.3 p -128.6 77.32 0.55 Allowed 'Isoleucine or valine' 0 C--N 1.325 -0.489 0 N-CA-C 106.512 -1.662 . . . . 0.0 106.512 -177.135 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 93' ' ' ASP . . . . . . . . . . . . . 2.4 m-20 -72.32 147.65 46.12 Favored 'General case' 0 N--CA 1.448 -0.546 0 N-CA-C 107.206 -1.405 . . . . 0.0 107.206 172.537 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 94' ' ' LEU . . . . . . . . . . . . . 61.1 tp -142.07 102.73 4.18 Favored 'General case' 0 N--CA 1.448 -0.534 0 N-CA-C 107.909 -1.145 . . . . 0.0 107.909 171.283 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 95' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -70.67 179.48 2.58 Favored 'General case' 0 N--CA 1.442 -0.855 0 CA-C-N 114.771 -1.104 . . . . 0.0 108.825 168.486 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 96' ' ' ALA . . . . . . . . . . . . . . . -47.07 -33.01 4.53 Favored 'General case' 0 CA--C 1.535 0.401 0 C-N-CA 126.273 1.829 . . . . 0.0 115.173 -169.955 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 97' ' ' ASN . . . . . . . . . . . . . 0.0 OUTLIER -148.35 6.8 0.76 Allowed 'General case' 0 CA--C 1.537 0.445 0 C-N-CA 126.325 1.85 . . . . 0.0 110.69 -173.897 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 98' ' ' GLN . . . . . . . . . . . . . 24.7 tt0 -143.46 111.41 6.09 Favored 'General case' 0 CA--C 1.529 0.156 0 CA-C-N 119.566 1.076 . . . . 0.0 109.899 -164.9 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 99' ' ' LEU . . . . . 0.446 ' HB3' ' HB2' ' A' ' 110' ' ' TYR . 10.9 tp -66.79 147.37 53.35 Favored 'General case' 0 C--O 1.235 0.321 0 C-N-CA 125.63 1.572 . . . . 0.0 107.745 170.744 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 100' ' ' THR . . . . . . . . . . . . . 85.3 m -143.46 100.69 3.65 Favored 'General case' 0 C--N 1.326 -0.439 0 N-CA-C 106.638 -1.615 . . . . 0.0 106.638 169.506 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 101' ' ' LEU . . . . . . . . . . . . . 3.2 mm? -81.37 146.33 30.38 Favored 'General case' 0 CA--C 1.517 -0.303 0 N-CA-C 107.651 -1.241 . . . . 0.0 107.651 175.571 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 102' ' ' ALA . . . . . . . . . . . . . . . -143.46 152.03 41.04 Favored 'General case' 0 C--O 1.235 0.336 0 C-N-CA 123.679 0.792 . . . . 0.0 109.7 164.126 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 103' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -151.61 173.92 14.07 Favored 'General case' 0 C--N 1.326 -0.448 0 C-N-CA 126.93 2.092 . . . . 0.0 108.735 179.631 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 104' ' ' ALA . . . . . . . . . . . . . . . -49.85 -19.19 0.62 Allowed 'General case' 0 CA--C 1.536 0.419 0 N-CA-C 115.44 1.644 . . . . 0.0 115.44 164.392 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 105' ' ' LYS . . . . . . . . . . . . . 23.8 mmtt -87.95 -74.15 0.46 Allowed 'General case' 0 N--CA 1.455 -0.19 0 CA-C-N 119.775 1.171 . . . . 0.0 109.245 172.67 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 106' ' ' GLN . . . . . . . . . . . . . 71.3 mt-30 -150.34 179.76 7.86 Favored 'General case' 0 N--CA 1.462 0.151 0 C-N-CA 124.644 1.178 . . . . 0.0 109.835 -160.862 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 107' ' ' THR . . . . . . . . . . . . . 3.5 t -135.22 125.51 26.36 Favored 'General case' 0 CA--C 1.538 0.506 0 C-N-CA 124.587 1.155 . . . . 0.0 109.699 177.777 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 108' ' ' LEU . . . . . . . . . . . . . 8.5 mp -119.44 149.02 42.56 Favored 'General case' 0 C--O 1.234 0.245 0 C-N-CA 126.746 2.018 . . . . 0.0 109.337 -172.257 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 109' ' ' THR . . . . . . . . . . . . . 32.2 m -121.27 124.69 45.24 Favored 'General case' 0 N--CA 1.451 -0.419 0 N-CA-C 108.338 -0.986 . . . . 0.0 108.338 -173.022 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 110' ' ' TYR . . . . . 0.446 ' HB2' ' HB3' ' A' ' 99' ' ' LEU . 32.3 m-85 -124.39 163.86 20.88 Favored 'General case' 0 CA--C 1.518 -0.272 0 N-CA-C 109.482 -0.562 . . . . 0.0 109.482 -179.98 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 111' ' ' LYS . . . . . 0.511 ' HE2' ' HB2' ' A' ' 113' ' ' ALA . 0.5 OUTLIER -128.0 140.08 52.18 Favored 'General case' 0 CA--C 1.514 -0.405 0 CA-C-O 117.54 -1.219 . . . . 0.0 108.883 -171.734 . . . . . . . . 3 3 . 1 . 015 nuclear build core ' A' A ' 112' ' ' LEU . . . . . . . . . . . . . 28.9 tp -71.85 47.01 0.13 Allowed 'General case' 0 CA--C 1.54 0.592 0 C-N-CA 127.386 2.275 . . . . 0.0 110.079 175.078 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 113' ' ' ALA . . . . . 0.511 ' HB2' ' HE2' ' A' ' 111' ' ' LYS . . . -78.96 82.32 5.15 Favored 'General case' 0 N--CA 1.446 -0.644 0 N-CA-C 106.489 -1.671 . . . . 0.0 106.489 166.225 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 114' ' ' ASP . . . . . . . . . . . . . 45.1 t0 . . . . . 0 CA--C 1.506 -0.73 0 N-CA-C 107.421 -1.325 . . . . 0.0 107.421 173.908 . . . . . . . . 0 0 . 1 . 016 nuclear build core ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 C--O 1.237 0.424 0 N-CA-C 110.069 -0.345 . . . . 0.0 110.069 . . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 2' ' ' VAL . . . . . . . . . . . . . 7.3 p -55.63 142.89 9.54 Favored 'Isoleucine or valine' 0 N--CA 1.447 -0.59 0 C-N-CA 124.133 0.973 . . . . 0.0 109.331 175.377 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 3' ' ' THR . . . . . . . . . . . . . 0.8 OUTLIER -130.74 162.88 52.44 Favored Pre-proline 0 C--N 1.327 -0.403 0 C-N-CA 124.953 1.301 . . . . 0.0 109.196 -176.939 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 4' ' ' PRO . . . . . . . . . . . . . 30.7 Cg_endo -65.53 -34.52 42.25 Favored 'Trans proline' 0 N--CA 1.457 -0.636 0 C-N-CA 122.275 1.984 . . . . 0.0 111.731 -178.579 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 5' ' ' GLU . . . . . . . . . . . . . 55.1 tt0 -58.63 -55.13 39.02 Favored 'General case' 0 C--N 1.322 -0.61 0 C-N-CA 124.731 1.212 . . . . 0.0 110.656 -177.156 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 6' ' ' GLN . . . . . . . . . . . . . 7.4 pt20 -66.35 12.65 0.06 Allowed 'General case' 0 CA--C 1.541 0.635 0 C-N-CA 125.348 1.459 . . . . 0.0 113.793 177.829 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 7' ' ' LEU . . . . . . . . . . . . . 82.4 mt -124.46 -47.19 1.86 Allowed 'General case' 0 N--CA 1.454 -0.238 0 C-N-CA 126.378 1.871 . . . . 0.0 110.456 177.815 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 8' ' ' GLN . . . . . . . . . . . . 0.259 3.3 pt20 -56.34 -14.53 2.98 Favored 'General case' 0 N--CA 1.472 0.66 0 N-CA-C 114.874 1.435 . . . . 0.0 114.874 -176.361 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 9' ' ' HIS . . . . . . . . . . . . . 8.8 m80 -124.92 16.64 8.58 Favored 'General case' 0 C--N 1.32 -0.685 0 C-N-CA 124.489 1.116 . . . . 0.0 111.274 -174.811 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 10' ' ' HIS . . . . . . . . . . . . . 97.8 m-70 -142.53 121.3 12.67 Favored 'General case' 0 CA--C 1.541 0.63 0 C-N-CA 125.711 1.604 . . . . 0.0 110.805 -179.879 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 11' ' ' ARG . . . . . . . . . . . . . 4.4 ptm85 -78.67 160.18 27.64 Favored 'General case' 0 N--CA 1.467 0.397 0 C-N-CA 124.853 1.261 . . . . 0.0 109.578 174.164 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 12' ' ' PHE . . . . . . . . . . . . . 34.2 m-85 -140.03 134.74 31.84 Favored 'General case' 0 C--N 1.329 -0.286 0 C-N-CA 123.926 0.891 . . . . 0.0 110.664 -179.171 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 13' ' ' VAL . . . . . . . . . . . . . 11.0 p -120.88 144.21 30.55 Favored 'Isoleucine or valine' 0 C--O 1.233 0.226 0 O-C-N 121.192 -0.942 . . . . 0.0 110.149 -179.213 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 14' ' ' LEU . . . . . . . . . . . . . 35.0 tp -79.42 86.56 5.11 Favored 'General case' 0 C--N 1.332 -0.193 0 C-N-CA 124.959 1.304 . . . . 0.0 110.598 -169.383 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 4.0 mm-40 -55.44 -42.3 74.02 Favored 'General case' 0 C--O 1.235 0.322 0 C-N-CA 124.527 1.131 . . . . 0.0 111.022 176.169 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 22.3 t -155.11 142.98 19.98 Favored 'General case' 0 N--CA 1.452 -0.369 0 CA-C-O 121.918 0.866 . . . . 0.0 110.962 174.571 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 17' ' ' VAL . . . . . . . . . . . . . 44.3 t -67.2 171.15 0.85 Allowed 'Isoleucine or valine' 0 C--O 1.24 0.594 0 N-CA-C 107.235 -1.394 . . . . 0.0 107.235 159.42 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 18' ' ' ASN . . . . . . . . . . . . . 0.2 OUTLIER -46.65 -44.47 18.44 Favored 'General case' 0 CA--C 1.528 0.129 0 C-N-CA 124.245 1.018 . . . . 0.0 111.503 170.888 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . -86.73 -58.57 1.9 Allowed Glycine 0 N--CA 1.446 -0.649 0 O-C-N 124.223 0.952 . . . . 0.0 110.988 -166.421 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 24.3 mttt -149.42 166.15 15.95 Favored Pre-proline 0 C--O 1.238 0.493 0 C-N-CA 126.286 1.834 . . . . 0.0 110.449 -173.178 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 21' ' ' PRO . . . . . . . . . . . . . 42.4 Cg_endo -56.11 171.27 0.86 Allowed 'Trans proline' 0 N--CA 1.455 -0.793 0 C-N-CA 122.082 1.854 . . . . 0.0 111.897 164.329 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 22' ' ' VAL . . . . . . . . . . . . . 4.1 p -128.37 147.15 32.94 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.341 0 C-N-CA 124.775 1.23 . . . . 0.0 108.415 -178.757 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 23' ' ' THR . . . . . . . . . . . . . 1.4 p -110.61 145.57 37.64 Favored 'General case' 0 N--CA 1.452 -0.358 0 C-N-CA 124.734 1.214 . . . . 0.0 109.38 179.172 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 24' ' ' SER . . . . . . . . . . . . . 23.3 t -150.27 137.91 19.88 Favored 'General case' 0 N--CA 1.437 -1.096 0 C-N-CA 127.5 2.32 . . . . 0.0 105.247 176.483 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 25' ' ' ASP . . . . . . . . . . . . . 37.4 t70 -49.74 -59.27 3.97 Favored 'General case' 0 C--N 1.32 -0.706 0 C-N-CA 124.098 0.959 . . . . 0.0 111.905 171.875 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 26' ' ' LYS . . . . . . . . . . . . . 11.2 tttt -153.47 -3.58 0.2 Allowed 'General case' 0 N--CA 1.47 0.542 0 N-CA-C 113.946 1.091 . . . . 0.0 113.946 -175.97 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 27' ' ' ASN . . . . . . . . . . . . . 43.4 m-80 -127.02 83.36 66.2 Favored Pre-proline 0 C--O 1.234 0.263 0 N-CA-C 107.543 -1.28 . . . . 0.0 107.543 -176.249 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 28' ' ' PRO . . . . . . . . . . . . . 49.2 Cg_endo -65.77 162.86 32.86 Favored 'Trans proline' 0 N--CA 1.453 -0.909 0 C-N-CA 121.817 1.678 . . . . 0.0 110.633 -176.559 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 29' ' ' PRO . . . . . . . . . . . . . 30.0 Cg_endo -65.29 84.8 0.2 Allowed 'Trans proline' 0 N--CA 1.449 -1.131 0 C-N-CA 122.437 2.091 . . . . 0.0 108.512 162.913 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 30' ' ' GLU . . . . . . . . . . . . . 11.6 pt-20 -105.49 162.21 13.67 Favored 'General case' 0 C--O 1.241 0.622 0 C-N-CA 124.337 1.055 . . . . 0.0 108.31 169.709 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 31' ' ' ILE . . . . . . . . . . . . . 20.2 tt -138.53 137.19 43.63 Favored 'Isoleucine or valine' 0 N--CA 1.447 -0.622 0 C-N-CA 127.606 2.363 . . . . 0.0 105.501 177.894 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 32' ' ' SER . . . . . . . . . . . . . 1.5 m -131.39 163.72 27.26 Favored 'General case' 0 N--CA 1.447 -0.622 0 N-CA-C 107.974 -1.121 . . . . 0.0 107.974 174.159 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 33' ' ' PHE . . . . . . . . . . . . . 35.3 m-85 -131.65 166.6 21.1 Favored 'General case' 0 N--CA 1.445 -0.679 0 N-CA-C 107.097 -1.446 . . . . 0.0 107.097 -179.698 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 34' ' ' GLY . . . . . . . . . . . . . . . 166.93 141.15 3.07 Favored Glycine 0 CA--C 1.503 -0.659 0 N-CA-C 108.208 -1.957 . . . . 0.0 108.208 -174.966 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 35' ' ' GLU . . . . . . . . . . . . . 90.8 mt-10 59.64 108.83 0.02 OUTLIER 'General case' 0 C--O 1.222 -0.348 0 C-N-CA 127.698 2.399 . . . . 0.0 110.675 -176.612 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 35.5 mtpt 61.48 12.31 4.33 Favored 'General case' 0 N--CA 1.473 0.701 0 N-CA-C 115.312 1.597 . . . . 0.0 115.312 169.486 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 37' ' ' MET . . . . . . . . . . . . . 13.5 mmm 58.06 49.84 10.97 Favored 'General case' 0 CA--C 1.537 0.479 0 C-N-CA 124.35 1.06 . . . . 0.0 112.488 -161.097 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 38' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -63.27 167.13 5.48 Favored 'General case' 0 N--CA 1.452 -0.346 0 O-C-N 120.624 -1.298 . . . . 0.0 109.279 150.017 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 39' ' ' ILE . . . . . . . . . . . . . 10.3 mt -132.61 133.46 59.53 Favored 'Isoleucine or valine' 0 C--O 1.238 0.477 0 C-N-CA 125.503 1.521 . . . . 0.0 107.214 -179.223 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 40' ' ' SER . . . . . . . . . . . . . 16.4 m -131.47 151.84 51.22 Favored 'General case' 0 C--N 1.33 -0.268 0 N-CA-C 106.887 -1.523 . . . . 0.0 106.887 156.361 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 41' ' ' GLY . . . . . . . . . . . . . . . -178.06 178.42 48.51 Favored Glycine 0 N--CA 1.446 -0.699 0 N-CA-C 109.767 -1.333 . . . . 0.0 109.767 174.158 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 42' ' ' SER . . . . . . . . . . . . . 6.1 p -151.95 84.53 1.28 Allowed 'General case' 0 N--CA 1.445 -0.687 0 N-CA-C 108.978 -0.749 . . . . 0.0 108.978 -169.673 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 43' ' ' MET . . . . . . . . . . . . . 17.5 mmm -60.81 -46.38 90.73 Favored 'General case' 0 C--N 1.341 0.228 0 N-CA-C 108.43 -0.952 . . . . 0.0 108.43 169.726 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 44' ' ' CYS . . . . . 1.282 ' SG ' ' SG ' ' A' ' 70' ' ' CYS . 2.2 t -159.84 -66.93 0.07 Allowed 'General case' 0 N--CA 1.433 -1.319 0 N-CA-C 105.14 -2.17 . . . . 0.0 105.14 165.559 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 45' ' ' ASN . . . . . . . . . . . . . 5.0 m-80 -74.63 10.96 1.14 Allowed 'General case' 0 N--CA 1.471 0.595 0 C-N-CA 125.633 1.573 . . . . 0.0 114.682 -166.89 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 46' ' ' ARG . . . . . . . . . . . . . 6.7 mmm-85 56.46 164.79 0.02 OUTLIER 'General case' 0 C--N 1.332 -0.195 0 C-N-CA 126.671 1.988 . . . . 0.0 112.695 -169.329 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 47' ' ' PHE . . . . . . . . . . . . . 53.0 p90 -167.05 165.21 15.84 Favored 'General case' 0 C--N 1.325 -0.496 0 C-N-CA 125.561 1.544 . . . . 0.0 107.727 178.403 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 48' ' ' SER . . . . . . . . . . . . . 0.5 OUTLIER -168.54 141.37 2.93 Favored 'General case' 0 C--N 1.329 -0.303 0 C-N-CA 125.611 1.564 . . . . 0.0 107.742 171.688 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 49' ' ' GLY . . . . . . . . . . . . . . . -152.94 163.33 30.44 Favored Glycine 0 CA--C 1.53 1.028 0 N-CA-C 111.019 -0.832 . . . . 0.0 111.019 175.21 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 50' ' ' GLU . . . . . . . . . . . . . 9.9 pt-20 -63.76 83.18 0.03 OUTLIER 'General case' 0 CA--C 1.538 0.504 0 C-N-CA 128.258 2.623 . . . . 0.0 110.038 172.432 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 51' ' ' GLY . . . . . . . . . . . . . . . -63.8 -76.79 0.26 Allowed Glycine 0 N--CA 1.466 0.635 0 O-C-N 121.386 -0.821 . . . . 0.0 113.355 -166.754 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 52' ' ' LYS . . . . . . . . . . . . . 3.4 ttpm? 57.33 126.94 0.0 OUTLIER 'General case' 0 C--N 1.331 -0.208 0 C-N-CA 130.631 3.573 . . . . 0.0 112.797 176.518 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 53' ' ' LEU . . . . . . . . . . . . . 32.4 tp -125.07 119.45 28.67 Favored 'General case' 0 N--CA 1.467 0.405 0 O-C-N 121.643 -0.661 . . . . 0.0 110.339 -174.341 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 10.0 t -145.1 -17.09 0.5 Allowed 'General case' 0 CA--C 1.539 0.551 0 C-N-CA 125.185 1.394 . . . . 0.0 110.692 178.703 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 55' ' ' ASN . . . . . . . . . . . . . 6.6 m-20 -129.3 6.65 5.33 Favored 'General case' 0 CA--C 1.536 0.416 0 CA-C-N 119.331 0.969 . . . . 0.0 112.275 -159.734 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 56' ' ' GLY . . . . . . . . . . . . . . . 75.06 4.66 73.25 Favored Glycine 0 CA--C 1.532 1.124 0 O-C-N 121.451 -0.781 . . . . 0.0 112.237 -165.792 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 57' ' ' GLU . . . . . . . . . . . . . 33.2 tt0 -121.03 131.24 54.16 Favored 'General case' 0 C--O 1.234 0.28 0 CA-C-N 118.443 1.121 . . . . 0.0 108.698 -169.052 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 58' ' ' LEU . . . . . . . . . . . . . 47.0 tp -116.65 98.64 6.64 Favored 'General case' 0 C--O 1.236 0.352 0 C-N-CA 124.814 1.246 . . . . 0.0 108.864 173.713 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 59' ' ' THR . . . . . . . . . . . . . 2.1 p -85.34 169.73 13.44 Favored 'General case' 0 C--N 1.327 -0.379 0 C-N-CA 123.961 0.904 . . . . 0.0 111.945 172.492 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 60' ' ' ALA . . . . . . . . . . . . . . . -142.94 103.76 4.22 Favored 'General case' 0 N--CA 1.455 -0.18 0 C-N-CA 125.995 1.718 . . . . 0.0 109.437 148.567 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 61' ' ' LYS . . . . . . . . . . . . . 45.5 tttt -69.23 -18.45 63.88 Favored 'General case' 0 CA--C 1.542 0.672 0 CA-C-O 118.892 -0.575 . . . . 0.0 111.988 173.598 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 62' ' ' GLY . . . . . . . . . . . . . . . -102.84 -83.85 1.75 Allowed Glycine 0 CA--C 1.526 0.73 0 C-N-CA 124.521 1.058 . . . . 0.0 110.764 176.382 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 63' ' ' LEU . . . . . . . . . . . . . 2.4 tp 65.03 79.06 0.26 Allowed 'General case' 0 N--CA 1.448 -0.546 0 C-N-CA 129.442 3.097 . . . . 0.0 114.379 -178.003 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 64' ' ' ALA . . . . . . . . . . . . . . . -70.09 92.65 0.76 Allowed 'General case' 0 CA--C 1.539 0.525 0 C-N-CA 125.121 1.368 . . . . 0.0 112.367 178.591 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 65' ' ' MET . . . . . . . . . . . . . 52.8 mtp -99.22 173.81 6.61 Favored 'General case' 0 N--CA 1.472 0.628 0 C-N-CA 124.649 1.18 . . . . 0.0 111.45 176.205 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 66' ' ' THR . . . . . . . . . . . . . 5.5 p -115.76 -164.84 0.98 Allowed 'General case' 0 CA--C 1.547 0.836 0 C-N-CA 124.725 1.21 . . . . 0.0 112.104 -178.429 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 67' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -141.26 31.53 1.73 Allowed 'General case' 0 N--CA 1.474 0.772 0 C-N-CA 126.449 1.9 . . . . 0.0 112.332 -173.265 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 68' ' ' MET . . . . . . . . . . . . . 76.6 mtm -76.71 179.97 5.72 Favored 'General case' 0 CA--C 1.545 0.785 0 C-N-CA 125.302 1.441 . . . . 0.0 109.969 173.079 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 69' ' ' MET . . . . . . . . . . . . . 1.5 mpp? -110.91 168.63 9.34 Favored 'General case' 0 C--O 1.237 0.417 0 C-N-CA 128.415 2.686 . . . . 0.0 109.702 172.915 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 70' ' ' CYS . . . . . 1.282 ' SG ' ' SG ' ' A' ' 44' ' ' CYS . 1.7 m -140.12 150.26 44.05 Favored 'General case' 0 N--CA 1.469 0.487 0 C-N-CA 125.161 1.384 . . . . 0.0 112.427 176.522 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 71' ' ' ALA . . . . . . . . . . . . . . . -70.29 -10.96 60.47 Favored 'General case' 0 CA--C 1.534 0.354 0 C-N-CA 126.039 1.736 . . . . 0.0 114.91 -174.443 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 72' ' ' ASN . . . . . . . . . . . . . 61.3 t30 -135.67 142.53 41.22 Favored Pre-proline 0 C--O 1.235 0.303 0 N-CA-C 105.756 -1.942 . . . . 0.0 105.756 177.716 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 73' ' ' PRO . . . . . . . . . . . . . 87.2 Cg_endo -84.56 -23.95 2.55 Favored 'Trans proline' 0 N--CA 1.458 -0.575 0 CA-C-N 120.536 1.227 . . . . 0.0 111.384 -163.862 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 74' ' ' GLN . . . . . . . . . . . . . 57.4 tt0 -60.06 -43.63 95.29 Favored 'General case' 0 N--CA 1.452 -0.332 0 C-N-CA 123.574 0.75 . . . . 0.0 109.004 175.311 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 75' ' ' LEU . . . . . . . . . . . . . 65.3 mt -59.25 -45.91 89.91 Favored 'General case' 0 C--N 1.341 0.199 0 CA-C-N 118.213 0.461 . . . . 0.0 110.309 178.726 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 76' ' ' ASN . . . . . . . . . . . . . 27.2 t-20 -64.83 -49.63 69.85 Favored 'General case' 0 C--O 1.222 -0.368 0 N-CA-C 108.892 -0.781 . . . . 0.0 108.892 -176.768 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 77' ' ' GLU . . . . . . . . . . . . . 8.4 tt0 -56.61 -34.5 67.29 Favored 'General case' 0 CA--C 1.537 0.471 0 C-N-CA 125.392 1.477 . . . . 0.0 112.754 -178.961 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 78' ' ' LEU . . . . . . . . . . . . . 3.5 mp -67.51 -14.01 62.56 Favored 'General case' 0 C--O 1.236 0.348 0 C-N-CA 125.056 1.343 . . . . 0.0 112.758 -179.574 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 79' ' ' ASP . . . . . . . . . . . . . 5.0 p-10 -60.23 -38.0 82.05 Favored 'General case' 0 CA--C 1.52 -0.196 0 CA-C-N 119.217 0.917 . . . . 0.0 111.531 176.355 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 80' ' ' ASN . . . . . . . . . . . . . 63.3 m-20 -77.26 -38.81 50.17 Favored 'General case' 0 N--CA 1.445 -0.675 0 CA-C-O 118.11 -0.948 . . . . 0.0 109.999 178.02 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 81' ' ' THR . . . . . . . . . . . . . 41.7 m -54.62 -52.76 61.22 Favored 'General case' 0 C--N 1.341 0.199 0 CA-C-N 118.983 0.81 . . . . 0.0 109.73 179.336 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 82' ' ' ILE . . . . . . . . . . . . . 9.6 tp -65.63 -36.89 78.69 Favored 'Isoleucine or valine' 0 CA--C 1.531 0.216 0 CA-C-N 118.842 0.746 . . . . 0.0 110.273 -175.182 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 83' ' ' SER . . . . . . . . . . . . . 10.8 t -58.11 -49.33 77.32 Favored 'General case' 0 C--O 1.234 0.269 0 CA-C-N 117.994 0.361 . . . . 0.0 110.897 174.819 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 84' ' ' GLU . . . . . . . . . . . . . 78.1 tt0 -78.18 -7.64 57.32 Favored 'General case' 0 C--N 1.327 -0.411 0 C-N-CA 126.593 1.957 . . . . 0.0 111.62 -175.557 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 85' ' ' MET . . . . . . . . . . . . . 81.5 mtp -90.28 -52.19 5.06 Favored 'General case' 0 CA--C 1.515 -0.371 0 CA-C-N 120.999 1.727 . . . . 0.0 110.373 167.243 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 86' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -66.47 -29.67 69.85 Favored 'General case' 0 N--CA 1.453 -0.293 0 CA-C-O 118.816 -0.612 . . . . 0.0 110.882 -169.387 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 87' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -58.84 -56.82 17.29 Favored 'General case' 0 N--CA 1.452 -0.357 0 CA-C-N 119.345 0.975 . . . . 0.0 112.405 -171.933 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 88' ' ' GLU . . . . . . . . . . . . . 81.1 mt-10 -73.39 -34.98 65.81 Favored 'General case' 0 C--N 1.331 -0.204 0 C-N-CA 123.137 0.575 . . . . 0.0 110.855 -175.327 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 89' ' ' GLY . . . . . . . . . . . . . . . 123.13 104.35 1.71 Allowed Glycine 0 C--N 1.333 0.365 0 N-CA-C 107.373 -2.291 . . . . 0.0 107.373 -176.108 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 90' ' ' ALA . . . . . . . . . . . . . . . -74.96 137.15 41.42 Favored 'General case' 0 N--CA 1.451 -0.424 0 N-CA-C 107.873 -1.158 . . . . 0.0 107.873 170.768 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 91' ' ' GLN . . . . . . . . . . . . . 17.9 mp0 -65.83 121.98 16.28 Favored 'General case' 0 N--CA 1.442 -0.844 0 N-CA-C 104.738 -2.319 . . . . 0.0 104.738 159.369 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 92' ' ' VAL . . . . . . . . . . . . . 25.2 t -107.33 119.91 57.76 Favored 'Isoleucine or valine' 0 N--CA 1.44 -0.968 0 N-CA-C 104.83 -2.285 . . . . 0.0 104.83 174.229 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 93' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -134.33 104.04 5.98 Favored 'General case' 0 N--CA 1.452 -0.338 0 N-CA-C 107.049 -1.463 . . . . 0.0 107.049 176.773 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 94' ' ' LEU . . . . . . . . . . . . . 27.1 tp -98.2 118.49 34.95 Favored 'General case' 0 CA--C 1.515 -0.39 0 N-CA-C 106.823 -1.547 . . . . 0.0 106.823 173.854 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 95' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -80.71 -165.4 0.88 Allowed 'General case' 0 C--N 1.323 -0.569 0 C-N-CA 124.429 1.091 . . . . 0.0 109.494 165.846 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 96' ' ' ALA . . . . . . . . . . . . . . . -47.74 -52.13 19.67 Favored 'General case' 0 CA--C 1.541 0.633 0 O-C-N 120.524 -1.36 . . . . 0.0 113.143 -179.887 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 97' ' ' ASN . . . . . . . . . . . . . 0.0 OUTLIER -135.26 8.52 3.43 Favored 'General case' 0 N--CA 1.478 0.961 0 N-CA-C 114.05 1.129 . . . . 0.0 114.05 -177.942 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 98' ' ' GLN . . . . . . . . . . . . . 18.4 tt0 -136.79 124.78 22.79 Favored 'General case' 0 N--CA 1.453 -0.294 0 O-C-N 121.233 -0.917 . . . . 0.0 109.371 -170.111 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 99' ' ' LEU . . . . . 0.461 HD22 ' CD2' ' A' ' 101' ' ' LEU . 1.0 OUTLIER -88.45 142.24 27.88 Favored 'General case' 0 N--CA 1.449 -0.515 0 C-N-CA 125.453 1.501 . . . . 0.0 109.229 175.521 . . . . . . . . 3 3 . 1 . 016 nuclear build core ' A' A ' 100' ' ' THR . . . . . . . . . . . . . 79.3 m -122.99 115.55 22.07 Favored 'General case' 0 C--N 1.322 -0.622 0 N-CA-C 105.436 -2.061 . . . . 0.0 105.436 171.685 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 101' ' ' LEU . . . . . 0.461 ' CD2' HD22 ' A' ' 99' ' ' LEU . 0.6 OUTLIER -112.93 101.35 9.41 Favored 'General case' 0 CA--C 1.51 -0.585 0 C-N-CA 126.109 1.764 . . . . 0.0 107.153 -179.05 . . . . . . . . 3 3 . 1 . 016 nuclear build core ' A' A ' 102' ' ' ALA . . . . . . . . . . . . . . . -117.69 152.49 35.12 Favored 'General case' 0 C--N 1.326 -0.444 0 C-N-CA 123.284 0.634 . . . . 0.0 109.59 -177.622 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 103' ' ' THR . . . . . . . . . . . . . 0.4 OUTLIER -159.09 176.12 12.66 Favored 'General case' 0 N--CA 1.44 -0.97 0 C-N-CA 126.481 1.912 . . . . 0.0 106.659 176.147 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 104' ' ' ALA . . . . . . . . . . . . . . . -62.58 -14.01 37.82 Favored 'General case' 0 CA--C 1.536 0.424 0 N-CA-C 113.338 0.866 . . . . 0.0 113.338 173.669 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 105' ' ' LYS . . . . . . . . . . . . . 12.6 tppt? -73.79 -75.76 0.14 Allowed 'General case' 0 N--CA 1.437 -1.084 0 C-N-CA 125.302 1.441 . . . . 0.0 107.461 176.154 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 106' ' ' GLN . . . . . . . . . . . . . 59.6 mt-30 -165.27 178.78 6.66 Favored 'General case' 0 CA--C 1.542 0.646 0 C-N-CA 128.605 2.762 . . . . 0.0 104.834 -169.213 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 107' ' ' THR . . . . . . . . . . . . . 4.6 t -131.42 141.85 49.92 Favored 'General case' 0 CA--C 1.539 0.547 0 C-N-CA 124.796 1.238 . . . . 0.0 110.237 -173.533 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 108' ' ' LEU . . . . . . . . . . . . . 8.9 mp -126.21 154.34 43.41 Favored 'General case' 0 C--O 1.234 0.265 0 C-N-CA 128.419 2.687 . . . . 0.0 108.596 -171.146 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 109' ' ' THR . . . . . . . . . . . . . 27.2 m -123.01 117.74 26.17 Favored 'General case' 0 N--CA 1.466 0.363 0 C-N-CA 123.409 0.684 . . . . 0.0 109.238 173.911 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 110' ' ' TYR . . . . . . . . . . . . . 73.9 m-85 -108.86 160.72 15.76 Favored 'General case' 0 CA--C 1.539 0.523 0 C-N-CA 123.461 0.704 . . . . 0.0 109.508 174.772 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 111' ' ' LYS . . . . . . . . . . . . . 2.1 tppt? -114.83 147.69 39.5 Favored 'General case' 0 N--CA 1.467 0.413 0 C-N-CA 124.603 1.161 . . . . 0.0 110.068 -178.944 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 112' ' ' LEU . . . . . . . . . . . . . 23.9 tp -73.43 38.33 0.09 Allowed 'General case' 0 CA--C 1.542 0.654 0 C-N-CA 127.379 2.272 . . . . 0.0 111.871 171.76 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 113' ' ' ALA . . . . . . . . . . . . . . . -77.05 88.06 3.56 Favored 'General case' 0 C--N 1.324 -0.535 0 O-C-N 119.234 -2.166 . . . . 0.0 109.453 -176.878 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 114' ' ' ASP . . . . . . . . . . . . 0.31 29.8 p-10 . . . . . 0 N--CA 1.464 0.264 0 CA-C-O 123.712 1.72 . . . . 0.0 113.324 -173.134 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 24.6 tpp . . . . . 0 C--O 1.24 0.597 0 N-CA-C 108.895 -0.78 . . . . 0.0 108.895 . . . . . . . . . 0 0 . 1 . 017 nuclear build core ' A' A ' 2' ' ' VAL . . . . . . . . . . . . . 10.0 p -53.9 118.71 1.25 Allowed 'Isoleucine or valine' 0 N--CA 1.449 -0.485 0 C-N-CA 123.884 0.873 . . . . 0.0 109.128 -178.016 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 3' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -128.56 157.53 74.71 Favored Pre-proline 0 N--CA 1.449 -0.501 0 N-CA-C 109.287 -0.634 . . . . 0.0 109.287 -167.776 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 4' ' ' PRO . . . . . . . . . . . . . 21.7 Cg_endo -63.62 -48.45 5.66 Favored 'Trans proline' 0 N--CA 1.456 -0.691 0 C-N-CA 122.74 2.293 . . . . 0.0 111.787 -176.469 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 5' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER -68.17 -12.66 61.32 Favored 'General case' 0 C--N 1.325 -0.491 0 N-CA-C 113.722 1.008 . . . . 0.0 113.722 -173.007 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 6' ' ' GLN . . . . . . . . . . . . . 3.7 pt20 -93.85 15.21 17.18 Favored 'General case' 0 CA--C 1.54 0.566 0 N-CA-C 113.908 1.077 . . . . 0.0 113.908 167.442 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 7' ' ' LEU . . . . . . . . . . . . . 90.6 mt -129.88 -44.76 1.18 Allowed 'General case' 0 N--CA 1.469 0.508 0 C-N-CA 124.569 1.148 . . . . 0.0 111.949 -175.639 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 8' ' ' GLN . . . . . . . . . . . . . 1.5 mp0 -56.64 2.32 0.02 OUTLIER 'General case' 0 N--CA 1.472 0.671 0 N-CA-C 118.353 2.723 . . . . 0.0 118.353 -176.059 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 9' ' ' HIS . . . . . . . . . . . . . 5.7 m-70 -139.66 10.58 2.46 Favored 'General case' 0 C--N 1.319 -0.739 0 C-N-CA 127.946 2.498 . . . . 0.0 112.516 179.95 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 10' ' ' HIS . . . . . . . . . . . . . 33.3 m80 -133.25 110.54 10.17 Favored 'General case' 0 N--CA 1.455 -0.214 0 C-N-CA 124.153 0.981 . . . . 0.0 108.687 -161.462 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 11' ' ' ARG . . . . . . . . . . . . . 20.7 ttt-85 -68.74 147.11 52.28 Favored 'General case' 0 N--CA 1.465 0.315 0 N-CA-C 108.444 -0.947 . . . . 0.0 108.444 172.915 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 12' ' ' PHE . . . . . . . . . . . . . 46.5 m-85 -127.83 161.07 29.87 Favored 'General case' 0 N--CA 1.45 -0.448 0 N-CA-C 107.648 -1.242 . . . . 0.0 107.648 165.502 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 13' ' ' VAL . . . . . 0.425 ' HA ' ' HA ' ' A' ' 30' ' ' GLU . 7.5 p -131.44 143.17 41.33 Favored 'Isoleucine or valine' 0 CA--C 1.512 -0.484 0 N-CA-C 108.188 -1.041 . . . . 0.0 108.188 172.045 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 14' ' ' LEU . . . . . . . . . . . . . 5.6 tt -70.04 110.19 4.96 Favored 'General case' 0 N--CA 1.441 -0.903 0 N-CA-C 107.874 -1.158 . . . . 0.0 107.874 179.977 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 15' ' ' GLU . . . . . 0.432 ' H ' ' HA ' ' A' ' 110' ' ' TYR . 3.1 tt0 -86.0 -42.05 14.33 Favored 'General case' 0 N--CA 1.438 -1.043 0 O-C-N 124.013 0.821 . . . . 0.0 110.217 -169.371 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 12.6 p -154.33 142.81 20.66 Favored 'General case' 0 N--CA 1.448 -0.555 0 CA-C-O 121.735 0.779 . . . . 0.0 109.834 168.369 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 17' ' ' VAL . . . . . 0.574 HG12 ' H ' ' A' ' 18' ' ' ASN . 23.2 t -75.62 175.08 0.76 Allowed 'Isoleucine or valine' 0 CA--C 1.536 0.409 0 N-CA-C 107.028 -1.471 . . . . 0.0 107.028 168.401 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 18' ' ' ASN . . . . . 0.574 ' H ' HG12 ' A' ' 17' ' ' VAL . 10.6 t30 -43.9 -51.6 7.44 Favored 'General case' 0 C--N 1.34 0.194 0 C-N-CA 124.533 1.133 . . . . 0.0 112.628 -171.554 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . -78.29 -66.21 1.77 Allowed Glycine 0 N--CA 1.444 -0.812 0 O-C-N 123.725 0.641 . . . . 0.0 111.609 176.28 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 0.8 OUTLIER -139.68 165.75 29.06 Favored Pre-proline 0 CA--C 1.532 0.259 0 CA-C-N 117.752 0.776 . . . . 0.0 112.917 -159.126 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 21' ' ' PRO . . . . . . . . . . . . . 56.5 Cg_endo -61.46 -176.9 0.19 Allowed 'Trans proline' 0 N--CA 1.457 -0.654 0 C-N-CA 124.094 3.196 . . . . 0.0 113.185 176.627 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 22' ' ' VAL . . . . . . . . . . . . . 81.6 t -120.86 155.36 24.36 Favored 'Isoleucine or valine' 0 N--CA 1.448 -0.544 0 C-N-CA 126.576 1.95 . . . . 0.0 109.208 -179.227 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 23' ' ' THR . . . . . . . . . . . . . 11.3 t -141.17 114.36 8.63 Favored 'General case' 0 C--O 1.235 0.292 0 CA-C-O 123.259 1.504 . . . . 0.0 111.844 168.169 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 24' ' ' SER . . . . . . . . . . . . . 39.1 t -158.18 94.91 1.33 Allowed 'General case' 0 C--N 1.319 -0.74 0 N-CA-C 105.017 -2.216 . . . . 0.0 105.017 172.433 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 25' ' ' ASP . . . . . . . . . . . . . 0.7 OUTLIER -80.06 38.97 0.42 Allowed 'General case' 0 N--CA 1.468 0.451 0 C-N-CA 125.467 1.507 . . . . 0.0 110.552 -176.297 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 26' ' ' LYS . . . . . . . . . . . . . 33.0 ttpt -151.28 -46.73 0.11 Allowed 'General case' 0 CA--C 1.508 -0.654 0 O-C-N 120.268 -1.52 . . . . 0.0 112.083 178.181 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 27' ' ' ASN . . . . . . . . . . . . . 0.0 OUTLIER -150.79 83.27 5.8 Favored Pre-proline 0 C--N 1.319 -0.739 0 N-CA-C 106.708 -1.59 . . . . 0.0 106.708 176.644 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 28' ' ' PRO . . . . . . . . . . . . . 75.2 Cg_endo -71.19 170.74 17.48 Favored 'Trans proline' 0 N--CA 1.454 -0.83 0 C-N-CA 122.171 1.914 . . . . 0.0 109.257 167.561 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 29' ' ' PRO . . . . . . . . . . . . . 37.6 Cg_endo -70.85 63.91 2.43 Favored 'Trans proline' 0 N--CA 1.457 -0.656 0 C-N-CA 124.065 3.177 . . . . 0.0 111.063 173.469 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 30' ' ' GLU . . . . . 0.425 ' HA ' ' HA ' ' A' ' 13' ' ' VAL . 2.4 pt-20 -78.66 168.82 19.2 Favored 'General case' 0 C--O 1.239 0.505 0 O-C-N 120.09 -1.631 . . . . 0.0 109.2 172.608 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 31' ' ' ILE . . . . . . . . . . . . . 14.4 tt -144.16 152.68 15.62 Favored 'Isoleucine or valine' 0 C--O 1.237 0.434 0 N-CA-C 107.641 -1.244 . . . . 0.0 107.641 -177.202 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 32' ' ' SER . . . . . . . . . . . . . 41.1 p -147.09 165.89 28.55 Favored 'General case' 0 N--CA 1.444 -0.747 0 CA-C-O 121.666 0.746 . . . . 0.0 109.372 178.154 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 33' ' ' PHE . . . . . . . . . . . . . 78.5 m-85 -146.13 125.67 13.27 Favored 'General case' 0 N--CA 1.445 -0.713 0 N-CA-C 105.623 -1.992 . . . . 0.0 105.623 -168.373 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 34' ' ' GLY . . . . . . . . . . . . . . . -156.19 167.13 33.31 Favored Glycine 0 CA--C 1.53 1.02 0 N-CA-C 109.631 -1.387 . . . . 0.0 109.631 160.729 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 35' ' ' GLU . . . . . . . . . . . . . 4.6 mt-10 56.54 89.63 0.04 OUTLIER 'General case' 0 N--CA 1.468 0.438 0 C-N-CA 126.945 2.098 . . . . 0.0 113.869 168.641 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 44.3 mtmt 74.14 32.35 1.03 Allowed 'General case' 0 N--CA 1.474 0.769 0 C-N-CA 127.472 2.309 . . . . 0.0 113.204 176.097 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 37' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER 59.03 33.86 23.21 Favored 'General case' 0 CA--C 1.54 0.585 0 C-N-CA 123.791 0.836 . . . . 0.0 110.21 -176.931 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 38' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -67.5 171.38 6.22 Favored 'General case' 0 N--CA 1.453 -0.278 0 O-C-N 120.902 -1.124 . . . . 0.0 111.115 170.535 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 39' ' ' ILE . . . . . . . . . . . . . 27.6 mt -137.33 109.34 6.72 Favored 'Isoleucine or valine' 0 C--O 1.235 0.325 0 N-CA-C 108.061 -1.089 . . . . 0.0 108.061 -176.452 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 40' ' ' SER . . . . . . . . . . . . . 34.7 m -90.1 137.93 31.94 Favored 'General case' 0 C--N 1.33 -0.246 0 C-N-CA 123.601 0.76 . . . . 0.0 109.027 158.642 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 41' ' ' GLY . . . . . . . . . . . . . . . -160.6 -179.33 35.29 Favored Glycine 0 CA--C 1.525 0.668 0 N-CA-C 110.254 -1.139 . . . . 0.0 110.254 165.257 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 42' ' ' SER . . . . . 0.508 ' HB3' ' HA ' ' A' ' 46' ' ' ARG . 1.8 p -160.34 92.78 1.0 Allowed 'General case' 0 N--CA 1.454 -0.24 0 CA-C-N 118.841 1.32 . . . . 0.0 111.254 174.439 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 43' ' ' MET . . . . . . . . . . . . . 9.2 mmt -64.73 -66.94 0.48 Allowed 'General case' 0 C--O 1.232 0.149 0 N-CA-C 109.498 -0.556 . . . . 0.0 109.498 175.316 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 44' ' ' CYS . . . . . 1.283 ' SG ' ' SG ' ' A' ' 70' ' ' CYS . 44.8 t -132.72 -59.83 0.89 Allowed 'General case' 0 N--CA 1.452 -0.358 0 N-CA-C 106.426 -1.694 . . . . 0.0 106.426 168.449 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 45' ' ' ASN . . . . . . . . . . . . . 4.8 m120 -80.34 27.56 0.34 Allowed 'General case' 0 C--N 1.328 -0.329 0 C-N-CA 128.665 2.786 . . . . 0.0 112.064 -165.453 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 46' ' ' ARG . . . . . 0.508 ' HA ' ' HB3' ' A' ' 42' ' ' SER . 0.0 OUTLIER 52.55 -166.19 0.06 Allowed 'General case' 0 C--N 1.327 -0.41 0 C-N-CA 124.769 1.228 . . . . 0.0 108.021 -157.275 . . . . . . . . 3 3 . 1 . 017 nuclear build core ' A' A ' 47' ' ' PHE . . . . . 0.481 ' HA ' ' HB3' ' A' ' 65' ' ' MET . 6.3 p90 -178.42 170.43 1.69 Allowed 'General case' 0 C--O 1.237 0.446 0 C-N-CA 129.19 2.996 . . . . 0.0 107.984 147.616 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 48' ' ' SER . . . . . . . . . . . . . 1.5 p -166.1 160.63 16.53 Favored 'General case' 0 C--N 1.322 -0.6 0 C-N-CA 126.192 1.797 . . . . 0.0 108.751 178.153 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 49' ' ' GLY . . . . . . . . . . . . . . . 177.83 163.1 28.98 Favored Glycine 0 C--N 1.332 0.337 0 N-CA-C 110.721 -0.951 . . . . 0.0 110.721 163.16 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 50' ' ' GLU . . . . . . . . . . . . . 11.1 pt-20 -68.52 100.31 1.09 Allowed 'General case' 0 N--CA 1.449 -0.493 0 CA-C-O 122.048 0.928 . . . . 0.0 108.721 173.525 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 51' ' ' GLY . . . . . . . . . . . . . . . -77.04 171.88 55.14 Favored Glycine 0 CA--C 1.529 0.945 0 C-N-CA 124.224 0.916 . . . . 0.0 111.912 171.421 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 52' ' ' LYS . . . . . . . . . . . . . 6.2 ttpm? -156.9 148.62 22.57 Favored 'General case' 0 N--CA 1.464 0.247 0 C-N-CA 124.916 1.287 . . . . 0.0 108.066 166.444 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 53' ' ' LEU . . . . . . . . . . . . . 50.7 tp -148.37 142.65 26.18 Favored 'General case' 0 C--N 1.338 0.069 0 C-N-CA 124.512 1.125 . . . . 0.0 109.141 174.655 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 23.1 t -156.21 -61.88 0.1 Allowed 'General case' 0 CA--C 1.535 0.393 0 C-N-CA 125.389 1.475 . . . . 0.0 107.792 173.599 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 55' ' ' ASN . . . . . . . . . . . . . 20.7 p-10 -65.46 -58.67 5.25 Favored 'General case' 0 N--CA 1.464 0.265 0 C-N-CA 125.711 1.604 . . . . 0.0 113.016 177.818 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 56' ' ' GLY . . . . . . . . . . . . . . . 150.96 14.16 0.08 OUTLIER Glycine 0 CA--C 1.529 0.944 0 C-N-CA 123.489 0.566 . . . . 0.0 111.911 -163.573 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 57' ' ' GLU . . . . . . . . . . . . . 26.8 tt0 -131.96 115.84 16.37 Favored 'General case' 0 CA--C 1.533 0.29 0 CA-C-N 118.185 0.992 . . . . 0.0 109.146 -175.654 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 58' ' ' LEU . . . . . . . . . . . . . 37.8 tp -93.13 102.4 14.71 Favored 'General case' 0 C--O 1.236 0.366 0 C-N-CA 127.291 2.237 . . . . 0.0 110.159 -177.503 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 59' ' ' THR . . . . . . . . . . . . . 18.2 p -94.68 163.59 13.31 Favored 'General case' 0 CA--C 1.533 0.313 0 C-N-CA 122.945 0.498 . . . . 0.0 110.036 168.122 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 60' ' ' ALA . . . . . . . . . . . . . . . -147.24 103.48 3.58 Favored 'General case' 0 C--N 1.342 0.273 0 C-N-CA 123.673 0.789 . . . . 0.0 111.218 155.465 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 61' ' ' LYS . . . . . . . . . . . . . 73.6 tttt -86.47 77.62 9.4 Favored 'General case' 0 N--CA 1.463 0.18 0 C-N-CA 124.496 1.118 . . . . 0.0 109.48 178.201 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 62' ' ' GLY . . . . . . . . . . . . . . . 148.01 80.44 0.03 OUTLIER Glycine 0 N--CA 1.464 0.526 0 N-CA-C 110.161 -1.176 . . . . 0.0 110.161 175.14 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 63' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -117.47 83.22 1.95 Allowed 'General case' 0 N--CA 1.439 -0.98 0 C-N-CA 124.294 1.038 . . . . 0.0 110.065 -159.609 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 64' ' ' ALA . . . . . . . . . . . . . . . -77.68 96.17 4.79 Favored 'General case' 0 C--O 1.244 0.777 0 C-N-CA 126.034 1.733 . . . . 0.0 112.134 179.756 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 65' ' ' MET . . . . . 0.481 ' HB3' ' HA ' ' A' ' 47' ' ' PHE 0.259 6.5 ptm -124.61 172.3 9.35 Favored 'General case' 0 CA--C 1.531 0.235 0 C-N-CA 123.706 0.803 . . . . 0.0 109.787 170.611 . . . . . . . . 3 3 . 1 . 017 nuclear build core ' A' A ' 66' ' ' THR . . . . . . . . . . . . . 15.8 p -104.85 -165.09 1.1 Allowed 'General case' 0 C--N 1.326 -0.455 0 C-N-CA 124.371 1.068 . . . . 0.0 109.503 -162.25 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 67' ' ' ARG . . . . . . . . . . . . . 0.5 OUTLIER -133.5 26.03 4.09 Favored 'General case' 0 C--O 1.237 0.404 0 C-N-CA 125.416 1.486 . . . . 0.0 112.075 -178.181 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 68' ' ' MET . . . . . . . . . . . . . 18.2 ptm -73.26 -169.68 0.67 Allowed 'General case' 0 CA--C 1.536 0.436 0 C-N-CA 125.321 1.448 . . . . 0.0 110.467 172.693 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 69' ' ' MET . . . . . . . . . . . . . 0.8 OUTLIER -142.6 -179.16 6.14 Favored 'General case' 0 C--O 1.238 0.49 0 C-N-CA 127.157 2.183 . . . . 0.0 109.03 -179.715 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 70' ' ' CYS . . . . . 1.283 ' SG ' ' SG ' ' A' ' 44' ' ' CYS . 70.0 m -149.21 163.71 36.86 Favored 'General case' 0 N--CA 1.455 -0.194 0 C-N-CA 124.417 1.087 . . . . 0.0 111.157 -176.581 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 71' ' ' ALA . . . . . . . . . . . . . . . -69.65 11.9 0.23 Allowed 'General case' 0 CA--C 1.54 0.592 0 C-N-CA 126.377 1.871 . . . . 0.0 113.874 178.214 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 72' ' ' ASN . . . . . . . . . . . . . 13.7 t30 -147.3 143.72 18.53 Favored Pre-proline 0 C--O 1.235 0.305 0 O-C-N 120.667 -1.27 . . . . 0.0 108.598 179.991 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 73' ' ' PRO . . . . . . . . . . . . . 68.1 Cg_endo -75.63 -25.42 10.92 Favored 'Trans proline' 0 N--CA 1.459 -0.556 0 C-N-CA 122.055 1.837 . . . . 0.0 111.601 179.919 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 74' ' ' GLN . . . . . . . . . . . . . 54.1 tt0 -70.13 -48.53 57.1 Favored 'General case' 0 N--CA 1.451 -0.385 0 C-N-CA 124.129 0.971 . . . . 0.0 109.606 -179.341 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 75' ' ' LEU . . . . . . . . . . . . . 41.5 mt -54.71 -45.15 73.97 Favored 'General case' 0 N--CA 1.471 0.612 0 CA-C-N 118.873 0.761 . . . . 0.0 109.149 174.528 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 76' ' ' ASN . . . . . . . . . . . . . 15.0 t-20 -61.07 -39.62 90.58 Favored 'General case' 0 CA--C 1.535 0.366 0 C-N-CA 124.236 1.015 . . . . 0.0 111.166 -175.787 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 77' ' ' GLU . . . . . . . . . . . . . 5.8 tm-20 -81.45 -30.8 33.33 Favored 'General case' 0 N--CA 1.455 -0.221 0 C-N-CA 125.721 1.608 . . . . 0.0 113.349 -177.889 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 78' ' ' LEU . . . . . . . . . . . . . 9.2 mt -61.12 -25.92 67.32 Favored 'General case' 0 N--CA 1.466 0.341 0 C-N-CA 123.231 0.612 . . . . 0.0 112.393 -179.796 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 79' ' ' ASP . . . . . . . . . . . . . 4.2 t70 -47.64 -49.56 26.94 Favored 'General case' 0 CA--C 1.517 -0.295 0 C-N-CA 125.912 1.685 . . . . 0.0 111.416 165.632 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 80' ' ' ASN . . . . . . . . . . . . . 2.7 m120 -74.34 -36.55 63.65 Favored 'General case' 0 N--CA 1.448 -0.568 0 CA-C-O 118.364 -0.827 . . . . 0.0 109.714 -175.234 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 81' ' ' THR . . . . . . . . . . . . . 89.9 m -54.11 -63.06 1.27 Allowed 'General case' 0 C--N 1.344 0.357 0 N-CA-C 108.054 -1.091 . . . . 0.0 108.054 172.152 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 82' ' ' ILE . . . . . 0.4 HD12 ' SD ' ' A' ' 85' ' ' MET . 10.9 tp -65.76 -39.05 83.7 Favored 'Isoleucine or valine' 0 N--CA 1.449 -0.506 0 CA-C-O 118.97 -0.538 . . . . 0.0 110.433 -165.643 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 83' ' ' SER . . . . . . . . . . . . . 8.6 t -61.55 -49.37 76.95 Favored 'General case' 0 N--CA 1.447 -0.592 0 N-CA-C 109.312 -0.625 . . . . 0.0 109.312 -177.842 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 84' ' ' GLU . . . . . . . . . . . . . 3.6 tp10 -67.55 -22.38 65.41 Favored 'General case' 0 CA--C 1.537 0.455 0 C-N-CA 123.738 0.815 . . . . 0.0 111.856 179.813 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 85' ' ' MET . . . . . 0.449 ' HA ' HG21 ' A' ' 103' ' ' THR . 7.1 ptm -87.6 -41.3 13.53 Favored 'General case' 0 CA--C 1.515 -0.388 0 N-CA-C 106.236 -1.765 . . . . 0.0 106.236 -171.691 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 86' ' ' LEU . . . . . . . . . . . . . 2.3 mm? -67.56 -25.57 65.86 Favored 'General case' 0 N--CA 1.439 -1.011 0 C-N-CA 119.272 -0.971 . . . . 0.0 111.926 -173.043 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 87' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -64.87 -53.95 38.62 Favored 'General case' 0 N--CA 1.448 -0.56 0 CA-C-O 118.799 -0.62 . . . . 0.0 110.785 -175.09 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 88' ' ' GLU . . . . . . . . . . . . . 12.4 pt-20 -71.49 -41.76 68.91 Favored 'General case' 0 C--O 1.234 0.255 0 CA-C-O 118.876 -0.583 . . . . 0.0 112.41 -176.092 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 89' ' ' GLY . . . . . . . . . . . . . . . 126.53 93.96 0.89 Allowed Glycine 0 C--N 1.334 0.457 0 N-CA-C 108.879 -1.689 . . . . 0.0 108.879 -173.405 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 90' ' ' ALA . . . . . . . . . . . . . . . -69.4 136.79 52.14 Favored 'General case' 0 N--CA 1.447 -0.612 0 N-CA-C 108.818 -0.808 . . . . 0.0 108.818 176.805 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 91' ' ' GLN . . . . . . . . . . . . . 29.0 mm-40 -74.89 92.71 2.57 Favored 'General case' 0 N--CA 1.446 -0.64 0 N-CA-C 105.011 -2.218 . . . . 0.0 105.011 177.974 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 92' ' ' VAL . . . . . . . . . . . . . 7.5 p -86.67 132.13 33.08 Favored 'Isoleucine or valine' 0 N--CA 1.443 -0.78 0 N-CA-C 106.007 -1.849 . . . . 0.0 106.007 179.955 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 93' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -137.61 152.43 49.35 Favored 'General case' 0 C--N 1.323 -0.559 0 N-CA-C 106.489 -1.671 . . . . 0.0 106.489 167.334 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 94' ' ' LEU . . . . . . . . . . . . . 54.1 tp -132.69 100.51 4.96 Favored 'General case' 0 CA--C 1.514 -0.429 0 CA-C-O 121.7 0.762 . . . . 0.0 108.968 -179.463 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 95' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -64.18 169.47 4.47 Favored 'General case' 0 C--N 1.323 -0.547 0 CA-C-N 113.718 -1.583 . . . . 0.0 109.831 164.099 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 96' ' ' ALA . . . . . . . . . . . . . . . -44.67 -24.54 0.2 Allowed 'General case' 0 N--CA 1.469 0.499 0 C-N-CA 127.952 2.501 . . . . 0.0 116.95 -170.93 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 97' ' ' ASN . . . . . . . . . . . . . 0.0 OUTLIER -155.39 6.71 0.24 Allowed 'General case' 0 CA--C 1.542 0.653 0 C-N-CA 126.551 1.94 . . . . 0.0 111.09 170.299 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 98' ' ' GLN . . . . . . . . . . . . . 25.7 tt0 -127.69 110.44 12.66 Favored 'General case' 0 N--CA 1.469 0.498 0 C-N-CA 125.383 1.473 . . . . 0.0 110.643 -170.382 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 99' ' ' LEU . . . . . 0.548 ' HB3' ' HB2' ' A' ' 110' ' ' TYR . 11.1 tp -75.01 143.72 43.44 Favored 'General case' 0 C--N 1.321 -0.667 0 C-N-CA 127.573 2.349 . . . . 0.0 108.037 173.606 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 100' ' ' THR . . . . . . . . . . . . . 4.6 m -132.81 118.91 19.58 Favored 'General case' 0 C--N 1.327 -0.378 0 N-CA-C 106.669 -1.604 . . . . 0.0 106.669 175.342 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 101' ' ' LEU . . . . . . . . . . . . . 2.7 mm? -115.59 111.08 20.14 Favored 'General case' 0 CA--C 1.513 -0.459 0 N-CA-C 106.099 -1.815 . . . . 0.0 106.099 174.521 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 102' ' ' ALA . . . . . . . . . . . . . . . -106.15 158.08 17.09 Favored 'General case' 0 C--N 1.326 -0.421 0 N-CA-C 108.331 -0.989 . . . . 0.0 108.331 162.775 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 103' ' ' THR . . . . . 0.449 HG21 ' HA ' ' A' ' 85' ' ' MET . 1.8 m -157.09 -179.28 8.05 Favored 'General case' 0 N--CA 1.436 -1.163 0 N-CA-C 105.596 -2.002 . . . . 0.0 105.596 171.853 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 104' ' ' ALA . . . . . . . . . . . . . . . -50.6 -39.01 48.8 Favored 'General case' 0 N--CA 1.451 -0.394 0 C-N-CA 122.683 0.393 . . . . 0.0 111.379 172.14 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 105' ' ' LYS . . . . . . . . . . . . . 4.5 tmtt? -61.69 -67.19 0.43 Allowed 'General case' 0 CA--C 1.532 0.279 0 N-CA-C 114.56 1.318 . . . . 0.0 114.56 -177.67 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 106' ' ' GLN . . . . . . . . . . . . . 3.0 pt20 -167.01 -173.45 2.35 Favored 'General case' 0 C--O 1.238 0.474 0 C-N-CA 126.477 1.911 . . . . 0.0 107.997 -178.993 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 107' ' ' THR . . . . . . . . . . . . . 14.8 t -118.47 140.26 50.15 Favored 'General case' 0 CA--C 1.534 0.345 0 C-N-CA 123.314 0.645 . . . . 0.0 109.869 174.008 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 108' ' ' LEU . . . . . . . . . . . . . 53.5 mt -125.11 138.15 54.17 Favored 'General case' 0 C--O 1.236 0.348 0 C-N-CA 127.726 2.41 . . . . 0.0 106.521 -178.513 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 109' ' ' THR . . . . . . . . . . . . . 31.5 m -112.38 144.96 40.94 Favored 'General case' 0 C--O 1.235 0.3 0 N-CA-C 107.793 -1.188 . . . . 0.0 107.793 179.992 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 110' ' ' TYR . . . . . 0.548 ' HB2' ' HB3' ' A' ' 99' ' ' LEU . 34.4 m-85 -130.5 172.77 11.54 Favored 'General case' 0 C--O 1.233 0.209 0 C-N-CA 123.987 0.915 . . . . 0.0 111.158 -178.918 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 111' ' ' LYS . . . . . . . . . . . . . 8.8 tppt? -125.79 143.87 50.88 Favored 'General case' 0 CA--C 1.514 -0.414 0 C-N-CA 124.885 1.274 . . . . 0.0 109.679 173.202 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 112' ' ' LEU . . . . . . . . . . . . . 43.7 tp -74.07 51.91 0.43 Allowed 'General case' 0 CA--C 1.539 0.535 0 C-N-CA 125.999 1.72 . . . . 0.0 108.93 165.159 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 113' ' ' ALA . . . . . . . . . . . . . . . -85.32 91.27 8.13 Favored 'General case' 0 N--CA 1.451 -0.406 0 O-C-N 119.84 -1.788 . . . . 0.0 106.421 170.238 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 114' ' ' ASP . . . . . . . . . . . . . 43.5 t0 . . . . . 0 CA--C 1.513 -0.457 0 CA-C-O 123.664 1.697 . . . . 0.0 109.243 -178.59 . . . . . . . . 0 0 . 1 . 018 nuclear build core ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 29.5 ttm . . . . . 0 N--CA 1.452 -0.355 0 CA-C-O 121.157 0.503 . . . . 0.0 109.877 . . . . . . . . . 0 0 . 1 . 018 nuclear build core ' A' A ' 2' ' ' VAL . . . . . . . . . . . . . 7.7 p -50.18 151.73 0.6 Allowed 'Isoleucine or valine' 0 CA--C 1.536 0.419 0 C-N-CA 127.377 2.271 . . . . 0.0 111.838 173.238 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 3' ' ' THR . . . . . . . . . . . . . 20.6 p -134.95 165.05 39.62 Favored Pre-proline 0 CA--C 1.533 0.316 0 C-N-CA 123.382 0.673 . . . . 0.0 110.581 177.468 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 4' ' ' PRO . . . . . . . . . . . . . 9.7 Cg_endo -58.28 -36.33 97.81 Favored 'Trans proline' 0 C--O 1.235 0.343 0 C-N-CA 122.999 2.466 . . . . 0.0 113.452 175.828 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 5' ' ' GLU . . . . . . . . . . . . . 0.2 OUTLIER -61.18 -44.29 97.53 Favored 'General case' 0 CA--C 1.538 0.505 0 C-N-CA 124.198 0.999 . . . . 0.0 111.765 -174.947 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 6' ' ' GLN . . . . . . . . . . . . . 14.9 pt20 -75.14 18.94 0.17 Allowed 'General case' 0 CA--C 1.542 0.642 0 C-N-CA 125.306 1.442 . . . . 0.0 112.573 177.279 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 7' ' ' LEU . . . . . . . . . . . . . 81.4 mt -136.71 -51.35 0.68 Allowed 'General case' 0 N--CA 1.469 0.485 0 CA-C-N 119.843 1.202 . . . . 0.0 113.073 -174.12 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 8' ' ' GLN . . . . . . . . . . . . . 0.2 OUTLIER -44.04 -28.75 0.51 Allowed 'General case' 0 N--CA 1.473 0.679 0 N-CA-C 115.712 1.745 . . . . 0.0 115.712 -176.16 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 9' ' ' HIS . . . . . . . . . . . . . 79.5 m-70 -131.43 32.27 4.22 Favored 'General case' 0 C--O 1.238 0.489 0 C-N-CA 123.392 0.677 . . . . 0.0 111.82 -173.562 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 10' ' ' HIS . . . . . . . . . . . . . 98.4 m-70 -129.34 113.67 15.25 Favored 'General case' 0 N--CA 1.452 -0.339 0 C-N-CA 124.995 1.318 . . . . 0.0 109.634 176.537 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 11' ' ' ARG . . . . . . . . . . . . . 17.0 ttt180 -69.64 150.09 47.4 Favored 'General case' 0 C--O 1.233 0.214 0 N-CA-C 108.678 -0.86 . . . . 0.0 108.678 166.511 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 12' ' ' PHE . . . . . . . . . . . . . 99.0 m-85 -138.89 157.98 45.05 Favored 'General case' 0 CA--C 1.503 -0.84 0 CA-C-O 123.994 1.854 . . . . 0.0 108.655 171.018 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 13' ' ' VAL . . . . . 0.405 ' HA ' ' HA ' ' A' ' 30' ' ' GLU . 0.0 OUTLIER -126.7 131.36 71.24 Favored 'Isoleucine or valine' 0 C--N 1.311 -1.103 0 CA-C-N 113.008 -1.906 . . . . 0.0 106.09 -176.358 . . . . . . . . 3 3 . 1 . 018 nuclear build core ' A' A ' 14' ' ' LEU . . . . . . . . . . . . . 26.5 tp -65.64 102.61 0.75 Allowed 'General case' 0 CA--C 1.515 -0.375 0 N-CA-C 107.629 -1.248 . . . . 0.0 107.629 175.963 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -86.2 -52.87 5.38 Favored 'General case' 0 N--CA 1.443 -0.822 0 N-CA-C 107.652 -1.24 . . . . 0.0 107.652 -172.188 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -138.15 123.95 19.95 Favored 'General case' 0 C--O 1.235 0.33 0 CA-C-O 121.573 0.701 . . . . 0.0 110.248 -173.9 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 17' ' ' VAL . . . . . . . . . . . . . 11.3 t -75.86 170.52 1.47 Allowed 'Isoleucine or valine' 0 C--O 1.237 0.437 0 N-CA-C 107.621 -1.252 . . . . 0.0 107.621 172.847 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 18' ' ' ASN . . . . . . . . . . . . . 0.3 OUTLIER -58.17 -20.57 42.0 Favored 'General case' 0 CA--C 1.536 0.424 0 CA-C-O 117.873 -1.06 . . . . 0.0 112.896 168.475 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . -106.85 -64.53 0.61 Allowed Glycine 0 C--N 1.341 0.856 0 C-N-CA 125.491 1.52 . . . . 0.0 111.887 -174.896 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 25.1 mmtm -136.04 164.45 43.04 Favored Pre-proline 0 N--CA 1.469 0.495 0 CA-C-N 118.814 1.307 . . . . 0.0 110.55 -176.86 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 21' ' ' PRO . . . . . . . . . . . . . 57.2 Cg_endo -66.4 153.38 78.25 Favored 'Trans proline' 0 CA--C 1.537 0.659 0 N-CA-C 108.605 -1.344 . . . . 0.0 108.605 159.632 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 22' ' ' VAL . . . . . . . . . . . . . 11.7 t -89.51 158.4 2.96 Favored 'Isoleucine or valine' 0 C--O 1.24 0.601 0 N-CA-C 108.961 -0.755 . . . . 0.0 108.961 176.563 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 23' ' ' THR . . . . . . . . . . . . . 3.1 m -130.7 124.38 31.4 Favored 'General case' 0 CA--C 1.532 0.259 0 C-N-CA 125.143 1.377 . . . . 0.0 107.954 178.453 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 24' ' ' SER . . . . . . . . . . . . . 5.4 m -153.6 136.08 15.07 Favored 'General case' 0 N--CA 1.452 -0.331 0 C-N-CA 127.46 2.304 . . . . 0.0 106.921 -167.595 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 25' ' ' ASP . . . . . . . . . . . . . 2.9 t70 -47.95 -84.06 0.01 OUTLIER 'General case' 0 N--CA 1.472 0.634 0 C-N-CA 127.281 2.232 . . . . 0.0 110.266 -179.752 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 26' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -135.62 -1.36 2.53 Favored 'General case' 0 CA--C 1.531 0.214 0 C-N-CA 125.484 1.514 . . . . 0.0 112.753 173.923 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 27' ' ' ASN . . . . . . . . . . . . . 60.6 m-80 -115.62 81.25 8.92 Favored Pre-proline 0 CA--C 1.532 0.286 0 C-N-CA 126.092 1.757 . . . . 0.0 107.426 -179.038 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 28' ' ' PRO . . . . . . . . . . . . . 19.0 Cg_endo -68.76 169.09 18.36 Favored 'Trans proline' 0 CA--C 1.534 0.506 0 C-N-CA 123.067 2.511 . . . . 0.0 113.659 177.093 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 29' ' ' PRO . . . . . . . . . . . . . 13.6 Cg_endo -62.43 109.91 0.96 Allowed 'Trans proline' 0 N--CA 1.449 -1.131 0 N-CA-C 107.226 -1.875 . . . . 0.0 107.226 145.763 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 30' ' ' GLU . . . . . 0.405 ' HA ' ' HA ' ' A' ' 13' ' ' VAL . 10.4 pt-20 -130.21 165.04 23.2 Favored 'General case' 0 C--N 1.318 -0.767 0 C-N-CA 127.996 2.519 . . . . 0.0 106.046 175.847 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 31' ' ' ILE . . . . . . . . . . . . . 20.3 tt -145.47 146.13 19.88 Favored 'Isoleucine or valine' 0 N--CA 1.447 -0.609 0 C-N-CA 125.556 1.542 . . . . 0.0 107.189 -177.401 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 32' ' ' SER . . . . . . . . . . . . . 27.5 p -133.07 172.85 12.09 Favored 'General case' 0 N--CA 1.441 -0.905 0 C-N-CA 126.022 1.729 . . . . 0.0 107.373 168.223 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 33' ' ' PHE . . . . . . . . . . . . . 98.8 m-85 -137.13 -173.22 3.4 Favored 'General case' 0 N--CA 1.448 -0.535 0 N-CA-C 107.919 -1.141 . . . . 0.0 107.919 -174.663 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 34' ' ' GLY . . . . . . . . . . . . . . . 176.42 -160.43 28.05 Favored Glycine 0 N--CA 1.451 -0.333 0 N-CA-C 109.385 -1.486 . . . . 0.0 109.385 170.545 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 35' ' ' GLU . . . . . . . . . . . . . 1.9 tt0 -52.95 154.25 2.98 Favored 'General case' 0 N--CA 1.448 -0.56 0 C-N-CA 125.016 1.326 . . . . 0.0 111.84 -167.894 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 11.7 mtpt 52.78 26.99 4.92 Favored 'General case' 0 CA--C 1.536 0.423 0 CA-C-O 117.956 -1.021 . . . . 0.0 112.195 -169.193 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 37' ' ' MET . . . . . . . . . . . . . 31.4 mmm 54.95 26.48 7.99 Favored 'General case' 0 CA--C 1.542 0.659 0 C-N-CA 124.823 1.249 . . . . 0.0 111.14 -174.95 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 38' ' ' MET . . . . . . . . . . . . . 25.3 mmm -56.0 155.69 6.09 Favored 'General case' 0 CA--C 1.519 -0.213 0 O-C-N 121.055 -1.028 . . . . 0.0 110.444 175.521 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 39' ' ' ILE . . . . . . . . . . . . . 10.4 mt -123.91 135.61 62.96 Favored 'Isoleucine or valine' 0 N--CA 1.449 -0.511 0 C-N-CA 124.793 1.237 . . . . 0.0 107.815 -175.073 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 40' ' ' SER . . . . . . . . . . . . . 66.6 m -131.04 121.09 24.42 Favored 'General case' 0 N--CA 1.45 -0.437 0 N-CA-C 106.495 -1.669 . . . . 0.0 106.495 169.233 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 41' ' ' GLY . . . . . . . . . . . . . . . -164.82 165.2 37.43 Favored Glycine 0 C--O 1.237 0.291 0 N-CA-C 108.994 -1.642 . . . . 0.0 108.994 179.331 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 42' ' ' SER . . . . . 0.628 ' HA ' ' HA ' ' A' ' 46' ' ' ARG . 92.0 p -157.56 108.41 2.26 Favored 'General case' 0 N--CA 1.444 -0.752 0 CA-C-N 117.596 0.698 . . . . 0.0 111.681 -176.667 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 43' ' ' MET . . . . . . . . . . . . . 7.2 mmt -87.4 -58.43 2.58 Favored 'General case' 0 N--CA 1.451 -0.401 0 C-N-CA 124.121 0.968 . . . . 0.0 109.322 -177.533 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 44' ' ' CYS . . . . . 1.301 ' SG ' ' SG ' ' A' ' 70' ' ' CYS . 43.6 t -155.29 -19.11 0.11 Allowed 'General case' 0 CA--C 1.535 0.379 0 N-CA-C 112.442 0.534 . . . . 0.0 112.442 -179.406 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 45' ' ' ASN . . . . . . . . . . . . . 2.8 m-80 -125.95 16.36 7.96 Favored 'General case' 0 N--CA 1.473 0.687 0 C-N-CA 125.997 1.719 . . . . 0.0 109.413 179.68 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 46' ' ' ARG . . . . . 0.628 ' HA ' ' HA ' ' A' ' 42' ' ' SER 0.376 6.0 ptt180 44.05 -172.48 0.01 OUTLIER 'General case' 0 CA--C 1.536 0.413 0 C-N-CA 127.469 2.308 . . . . 0.0 113.623 -161.956 . . . . . . . . 3 3 . 1 . 018 nuclear build core ' A' A ' 47' ' ' PHE . . . . . . . . . . . . . 21.5 p90 -173.5 162.96 4.33 Favored 'General case' 0 N--CA 1.472 0.646 0 C-N-CA 125.672 1.589 . . . . 0.0 109.151 164.33 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 48' ' ' SER . . . . . . . . . . . . . 7.6 p -155.02 135.1 13.04 Favored 'General case' 0 N--CA 1.449 -0.512 0 C-N-CA 123.998 0.919 . . . . 0.0 108.649 178.134 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 49' ' ' GLY . . . . . . . . . . . . . . . -169.0 165.39 38.89 Favored Glycine 0 C--N 1.337 0.616 0 N-CA-C 110.014 -1.234 . . . . 0.0 110.014 171.519 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 50' ' ' GLU . . . . . . . . . . . . . 2.4 pt-20 -83.48 103.17 12.62 Favored 'General case' 0 N--CA 1.442 -0.867 0 CA-C-O 122.619 1.199 . . . . 0.0 108.796 178.588 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 51' ' ' GLY . . . . . . . . . . . . . . . -58.23 174.97 2.47 Favored Glycine 0 CA--C 1.539 1.559 0 CA-C-N 114.647 -1.16 . . . . 0.0 111.112 163.223 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 52' ' ' LYS . . . . . . . . . . . . . 29.8 ttpt -142.71 159.01 43.06 Favored 'General case' 0 C--N 1.329 -0.315 0 N-CA-C 106.006 -1.85 . . . . 0.0 106.006 156.651 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 53' ' ' LEU . . . . . . . . . . . . . 49.5 tp -148.08 95.29 2.45 Favored 'General case' 0 N--CA 1.447 -0.62 0 N-CA-C 107.195 -1.409 . . . . 0.0 107.195 170.23 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 2.4 t -137.58 6.37 2.73 Favored 'General case' 0 CA--C 1.533 0.3 0 CA-C-N 115.498 -0.773 . . . . 0.0 111.196 174.627 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 55' ' ' ASN . . . . . . . . . . . . . 4.1 p30 -142.74 -21.15 0.66 Allowed 'General case' 0 C--O 1.222 -0.394 0 CA-C-O 117.672 -1.156 . . . . 0.0 114.035 175.725 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 56' ' ' GLY . . . . . . . . . . . . . . . 119.28 7.92 9.72 Favored Glycine 0 CA--C 1.529 0.943 0 CA-C-N 119.29 0.95 . . . . 0.0 112.945 -172.099 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 57' ' ' GLU . . . . . . . . . . . . . 41.3 tt0 -127.16 128.37 46.04 Favored 'General case' 0 C--O 1.235 0.303 0 CA-C-N 118.841 1.32 . . . . 0.0 108.299 -173.836 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 58' ' ' LEU . . . . . . . . . . . . . 52.5 tp -100.42 94.25 6.06 Favored 'General case' 0 CA--C 1.531 0.216 0 C-N-CA 125.628 1.571 . . . . 0.0 108.924 177.505 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 59' ' ' THR . . . . . . . . . . . . . 40.8 p -91.42 146.51 23.75 Favored 'General case' 0 C--O 1.235 0.327 0 N-CA-C 108.129 -1.063 . . . . 0.0 108.129 162.745 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 60' ' ' ALA . . . . . . . . . . . . . . . -140.93 102.37 4.25 Favored 'General case' 0 C--N 1.334 -0.1 0 C-N-CA 124.491 1.116 . . . . 0.0 108.392 166.998 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 61' ' ' LYS . . . . . . . . . . . . . 49.6 mttp -65.4 -60.88 2.49 Favored 'General case' 0 N--CA 1.442 -0.837 0 C-N-CA 124.545 1.138 . . . . 0.0 111.856 -171.148 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 62' ' ' GLY . . . . . . . . . . . . . . . -55.35 -59.93 9.66 Favored Glycine 0 C--O 1.227 -0.282 0 C-N-CA 125.047 1.308 . . . . 0.0 111.262 -165.388 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 63' ' ' LEU . . . . . . . . . . . . . 3.8 tp 49.17 60.86 3.46 Favored 'General case' 0 N--CA 1.445 -0.696 0 C-N-CA 127.646 2.379 . . . . 0.0 113.817 168.962 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 64' ' ' ALA . . . . . . . . . . . . . . . -78.88 135.06 36.9 Favored 'General case' 0 C--N 1.324 -0.525 0 CA-C-N 115.845 -0.616 . . . . 0.0 111.192 -178.004 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 65' ' ' MET . . . . . . . . . . . . . 66.4 mtp -133.57 -175.17 3.73 Favored 'General case' 0 CA--C 1.547 0.84 0 C-N-CA 124.985 1.314 . . . . 0.0 111.288 -172.874 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 66' ' ' THR . . . . . . . . . . . . . 30.0 p -107.78 -164.81 1.0 Allowed 'General case' 0 N--CA 1.47 0.565 0 C-N-CA 127.604 2.361 . . . . 0.0 110.887 177.807 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 67' ' ' ARG . . . . . . . . . . . . . 2.1 mpp_? -132.81 87.44 2.41 Favored 'General case' 0 C--O 1.232 0.15 0 C-N-CA 126.821 2.048 . . . . 0.0 107.215 173.187 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 68' ' ' MET . . . . . . . . . . . . . 10.0 mtm -139.43 162.44 35.03 Favored 'General case' 0 N--CA 1.467 0.418 0 C-N-CA 123.878 0.871 . . . . 0.0 113.061 -173.017 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 69' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -119.01 164.17 15.87 Favored 'General case' 0 C--O 1.235 0.302 0 C-N-CA 127.492 2.317 . . . . 0.0 106.991 171.953 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 70' ' ' CYS . . . . . 1.301 ' SG ' ' SG ' ' A' ' 44' ' ' CYS . 57.5 m -140.36 23.89 2.32 Favored 'General case' 0 N--CA 1.474 0.733 0 C-N-CA 124.033 0.933 . . . . 0.0 112.73 -175.149 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 71' ' ' ALA . . . . . . . . . . . . . . . 54.6 -1.29 0.02 OUTLIER 'General case' 0 CA--C 1.511 -0.534 0 N-CA-C 117.586 2.439 . . . . 0.0 117.586 -176.602 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 72' ' ' ASN . . . . . . . . . . . . . 0.0 OUTLIER -138.58 144.05 40.64 Favored Pre-proline 0 N--CA 1.441 -0.913 0 CA-C-N 118.833 0.742 . . . . 0.0 109.512 167.928 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 73' ' ' PRO . . . . . . . . . . . . . 74.5 Cg_endo -74.97 -20.64 16.73 Favored 'Trans proline' 0 N--CA 1.45 -1.086 0 C-N-CA 121.944 1.763 . . . . 0.0 111.853 -178.056 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 74' ' ' GLN . . . . . . . . . . . . . 39.4 tt0 -58.54 -45.82 88.1 Favored 'General case' 0 CA--C 1.531 0.248 0 CA-C-N 120.606 1.548 . . . . 0.0 110.607 -177.184 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 75' ' ' LEU . . . . . . . . . . . . . 83.4 mt -66.75 -41.51 87.68 Favored 'General case' 0 CA--C 1.522 -0.117 0 C-N-CA 123.843 0.857 . . . . 0.0 110.122 175.911 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 76' ' ' ASN . . . . . . . . . . . . . 3.0 t-20 -59.79 -45.33 92.65 Favored 'General case' 0 C--O 1.219 -0.505 0 C-N-CA 124.052 0.941 . . . . 0.0 110.294 -177.403 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 77' ' ' GLU . . . . . . . . . . . . . 29.7 mt-10 -56.46 -43.01 79.13 Favored 'General case' 0 N--CA 1.448 -0.542 0 C-N-CA 125.508 1.523 . . . . 0.0 111.02 175.43 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 78' ' ' LEU . . . . . . . . . . . . . 0.7 OUTLIER -61.08 -32.05 71.71 Favored 'General case' 0 C--N 1.339 0.121 0 CA-C-O 118.253 -0.879 . . . . 0.0 112.355 -177.808 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 79' ' ' ASP . . . . . . . . . . . . . 0.0 OUTLIER -54.26 -39.82 67.2 Favored 'General case' 0 CA--C 1.535 0.398 0 C-N-CA 124.127 0.971 . . . . 0.0 112.902 174.311 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 80' ' ' ASN . . . . . . . . . . . . . 6.9 p30 -87.29 -37.8 16.86 Favored 'General case' 0 CA--C 1.518 -0.272 0 CA-C-N 119.001 0.819 . . . . 0.0 109.849 175.834 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 81' ' ' THR . . . . . . . . . . . . . 32.7 m -53.24 -54.44 36.14 Favored 'General case' 0 N--CA 1.455 -0.186 0 O-C-N 123.856 0.723 . . . . 0.0 109.18 -174.513 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 82' ' ' ILE . . . . . . . . . . . . . 10.7 tp -64.54 -32.94 59.87 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.475 0 C-N-CA 122.824 0.45 . . . . 0.0 111.356 -176.968 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 83' ' ' SER . . . . . . . . . . . . . 36.4 p -64.08 -53.41 50.24 Favored 'General case' 0 N--CA 1.443 -0.775 0 N-CA-C 109.647 -0.501 . . . . 0.0 109.647 -171.35 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 84' ' ' GLU . . . . . . . . . . . . . 2.4 tp10 -62.72 -42.08 99.47 Favored 'General case' 0 N--CA 1.449 -0.502 0 C-N-CA 124.734 1.213 . . . . 0.0 109.261 -176.421 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 85' ' ' MET . . . . . . . . . . . . . 78.9 mtp -60.28 -41.41 93.29 Favored 'General case' 0 C--N 1.343 0.323 0 C-N-CA 123.778 0.831 . . . . 0.0 110.18 179.141 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 86' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -80.44 -19.35 46.32 Favored 'General case' 0 C--N 1.332 -0.19 0 O-C-N 121.436 -0.79 . . . . 0.0 112.096 -176.657 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 87' ' ' LYS . . . . . . . . . . . . . 2.4 mptm? -76.46 -55.4 5.57 Favored 'General case' 0 N--CA 1.447 -0.584 0 CA-C-O 118.198 -0.906 . . . . 0.0 109.537 169.622 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 88' ' ' GLU . . . . . . . . . . . . . 21.1 pt-20 -69.06 -24.66 64.19 Favored 'General case' 0 CA--C 1.535 0.368 0 CA-C-N 118.768 0.713 . . . . 0.0 111.376 -177.004 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 89' ' ' GLY . . . . . . . . . . . . . . . 106.57 99.14 2.6 Favored Glycine 0 C--N 1.337 0.591 0 N-CA-C 110.106 -1.198 . . . . 0.0 110.106 174.848 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 90' ' ' ALA . . . . . . . . . . . . . . . -74.1 133.67 42.86 Favored 'General case' 0 N--CA 1.446 -0.665 0 C-N-CA 123.075 0.55 . . . . 0.0 110.158 -175.68 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 91' ' ' GLN . . . . . . . . . . . . . 1.8 mp0 -73.04 125.2 27.08 Favored 'General case' 0 N--CA 1.452 -0.356 0 N-CA-C 105.447 -2.057 . . . . 0.0 105.447 170.403 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 92' ' ' VAL . . . . . . . . . . . . . 25.5 t -122.21 126.72 74.7 Favored 'Isoleucine or valine' 0 N--CA 1.446 -0.628 0 N-CA-C 107.743 -1.206 . . . . 0.0 107.743 -174.579 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 93' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -135.38 80.7 1.85 Allowed 'General case' 0 N--CA 1.451 -0.376 0 N-CA-C 106.767 -1.568 . . . . 0.0 106.767 177.679 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 94' ' ' LEU . . . . . . . . . . . . . 1.6 tm? -84.75 102.79 13.29 Favored 'General case' 0 CA--C 1.514 -0.432 0 N-CA-C 107.433 -1.321 . . . . 0.0 107.433 173.726 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 95' ' ' THR . . . . . . . . . . . . . 1.1 m -82.58 177.71 8.57 Favored 'General case' 0 C--N 1.322 -0.611 0 CA-C-N 114.064 -1.425 . . . . 0.0 108.244 178.45 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 96' ' ' ALA . . . . . . . . . . . . . . . -52.62 -20.17 2.86 Favored 'General case' 0 CA--C 1.539 0.554 0 N-CA-C 114.574 1.324 . . . . 0.0 114.574 -173.607 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 97' ' ' ASN . . . . . . . . . . . . . 17.4 p30 -146.62 -10.15 0.47 Allowed 'General case' 0 N--CA 1.467 0.419 0 N-CA-C 116.553 2.057 . . . . 0.0 116.553 160.388 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 98' ' ' GLN . . . . . . . . . . . . . 6.2 tt0 -112.9 128.96 56.61 Favored 'General case' 0 N--CA 1.47 0.549 0 CA-C-N 122.092 2.223 . . . . 0.0 111.356 -178.526 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 99' ' ' LEU . . . . . 0.452 HD22 ' CD2' ' A' ' 101' ' ' LEU . 0.3 OUTLIER -84.24 122.97 29.62 Favored 'General case' 0 C--O 1.235 0.299 0 C-N-CA 125.012 1.325 . . . . 0.0 107.768 170.293 . . . . . . . . 3 3 . 1 . 018 nuclear build core ' A' A ' 100' ' ' THR . . . . . . . . . . . . . 5.1 m -110.18 127.82 55.14 Favored 'General case' 0 C--N 1.326 -0.444 0 N-CA-C 107.239 -1.393 . . . . 0.0 107.239 171.52 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 101' ' ' LEU . . . . . 0.452 ' CD2' HD22 ' A' ' 99' ' ' LEU . 2.7 mm? -114.49 143.12 45.46 Favored 'General case' 0 CA--C 1.514 -0.431 0 C-N-CA 125.464 1.506 . . . . 0.0 108.959 172.353 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 102' ' ' ALA . . . . . . . . . . . . . . . -144.8 159.62 42.59 Favored 'General case' 0 C--O 1.235 0.303 0 C-N-CA 124.936 1.295 . . . . 0.0 108.432 161.693 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 103' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -160.61 174.83 13.42 Favored 'General case' 0 N--CA 1.443 -0.781 0 C-N-CA 126.308 1.843 . . . . 0.0 108.014 170.416 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 104' ' ' ALA . . . . . . . . . . . . . . . -62.25 -28.72 69.91 Favored 'General case' 0 C--O 1.235 0.296 0 O-C-N 121.743 -0.598 . . . . 0.0 111.588 176.395 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 105' ' ' LYS . . . . . . . . . . . . . 8.9 mmtm -69.58 -84.77 0.03 OUTLIER 'General case' 0 N--CA 1.45 -0.434 0 C-N-CA 123.505 0.722 . . . . 0.0 109.769 167.014 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 106' ' ' GLN . . . . . . . . . . . . . 23.3 mt-30 -141.37 -169.83 2.95 Favored 'General case' 0 C--N 1.328 -0.362 0 C-N-CA 123.656 0.782 . . . . 0.0 109.364 -158.711 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 107' ' ' THR . . . . . . . . . . . . . 1.1 t -149.69 147.31 27.92 Favored 'General case' 0 N--CA 1.45 -0.455 0 N-CA-C 106.287 -1.746 . . . . 0.0 106.287 -168.773 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 108' ' ' LEU . . . . . . . . . . . . . 36.8 mt -144.87 160.74 40.81 Favored 'General case' 0 N--CA 1.465 0.324 0 N-CA-C 107.634 -1.247 . . . . 0.0 107.634 -177.503 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 109' ' ' THR . . . . . . . . . . . . . 63.6 m -133.0 133.91 43.76 Favored 'General case' 0 C--O 1.236 0.353 0 N-CA-C 107.609 -1.256 . . . . 0.0 107.609 169.649 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 110' ' ' TYR . . . . . . . . . . . . . 19.1 m-85 -118.32 178.86 4.29 Favored 'General case' 0 C--O 1.236 0.345 0 C-N-CA 124.231 1.013 . . . . 0.0 108.981 178.77 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 111' ' ' LYS . . . . . . . . . . . . . 1.0 OUTLIER -139.13 138.83 37.35 Favored 'General case' 0 N--CA 1.455 -0.215 0 CA-C-O 118.02 -0.99 . . . . 0.0 110.879 178.045 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 112' ' ' LEU . . . . . . . . . . . . . 22.5 tp -60.53 19.68 0.01 OUTLIER 'General case' 0 CA--C 1.544 0.718 0 C-N-CA 131.309 3.843 . . . . 0.0 114.839 175.643 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 113' ' ' ALA . . . . . . . . . . . . . . . -67.82 84.59 0.21 Allowed 'General case' 0 CA--C 1.541 0.609 0 O-C-N 120.233 -1.542 . . . . 0.0 111.082 179.91 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 114' ' ' ASP . . . . . . . . . . . . . 23.4 t0 . . . . . 0 N--CA 1.47 0.541 0 CA-C-O 122.974 1.368 . . . . 0.0 110.791 -176.447 . . . . . . . . 0 0 . 1 . 019 nuclear build core ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 C--O 1.237 0.429 0 N-CA-C 111.097 0.036 . . . . 0.0 111.097 . . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 2' ' ' VAL . . . . . . . . . . . . . 7.2 p -57.92 139.25 17.81 Favored 'Isoleucine or valine' 0 C--O 1.238 0.455 0 O-C-N 123.595 0.56 . . . . 0.0 110.063 175.834 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 3' ' ' THR . . . . . . . . . . . . . 0.8 OUTLIER -121.9 165.05 21.68 Favored Pre-proline 0 N--CA 1.448 -0.53 0 C-N-CA 124.01 0.924 . . . . 0.0 110.173 179.3 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 4' ' ' PRO . . . . . . . . . . . . . 18.3 Cg_endo -61.78 -50.63 4.99 Favored 'Trans proline' 0 N--CA 1.454 -0.832 0 C-N-CA 122.281 1.987 . . . . 0.0 111.133 174.338 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 5' ' ' GLU . . . . . . . . . . . . . 13.9 tt0 -55.01 -40.31 70.02 Favored 'General case' 0 CA--C 1.536 0.407 0 C-N-CA 124.244 1.018 . . . . 0.0 112.613 -168.513 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 6' ' ' GLN . . . . . . . . . . . . . 3.6 pt20 -73.14 14.65 0.28 Allowed 'General case' 0 CA--C 1.538 0.518 0 C-N-CA 125.433 1.493 . . . . 0.0 113.938 179.96 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 7' ' ' LEU . . . . . . . . . . . . . 88.6 mt -129.74 -46.29 1.16 Allowed 'General case' 0 C--N 1.34 0.168 0 C-N-CA 125.081 1.352 . . . . 0.0 110.478 -176.017 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 8' ' ' GLN . . . . . . . . . . . . . 2.3 mp0 -49.01 -15.34 0.1 Allowed 'General case' 0 N--CA 1.473 0.715 0 C-N-CA 127.078 2.151 . . . . 0.0 116.697 -178.944 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 9' ' ' HIS . . . . . . . . . . . . . 94.6 m-70 -130.23 13.5 5.62 Favored 'General case' 0 C--N 1.325 -0.473 0 C-N-CA 124.828 1.251 . . . . 0.0 112.492 -175.819 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 10' ' ' HIS . . . . . . . . . . . . . 52.0 m80 -125.66 138.9 53.92 Favored 'General case' 0 C--O 1.238 0.462 0 C-N-CA 124.815 1.246 . . . . 0.0 107.987 -173.325 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 11' ' ' ARG . . . . . . . . . . . . . 21.6 ttt180 -95.0 146.7 24.07 Favored 'General case' 0 N--CA 1.465 0.279 0 C-N-CA 125.531 1.533 . . . . 0.0 109.754 174.277 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 12' ' ' PHE . . . . . . . . . . . . . 35.5 m-85 -134.26 156.14 48.93 Favored 'General case' 0 N--CA 1.441 -0.914 0 CA-C-O 123.675 1.702 . . . . 0.0 109.253 175.198 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 13' ' ' VAL . . . . . . . . . . . . . 0.0 OUTLIER -138.96 130.82 36.36 Favored 'Isoleucine or valine' 0 C--N 1.313 -1.002 0 CA-C-N 113.03 -1.895 . . . . 0.0 107.242 -172.713 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 14' ' ' LEU . . . . . . . . . . . . . 11.6 tp -64.86 102.72 0.62 Allowed 'General case' 0 N--CA 1.45 -0.475 0 N-CA-C 106.392 -1.707 . . . . 0.0 106.392 176.148 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 15' ' ' GLU . . . . . 0.484 ' HG3' ' HE2' ' A' ' 111' ' ' LYS . 1.3 tm-20 -85.33 -41.38 15.55 Favored 'General case' 0 N--CA 1.449 -0.495 0 N-CA-C 108.91 -0.774 . . . . 0.0 108.91 -173.826 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 5.8 p -151.92 142.71 22.91 Favored 'General case' 0 N--CA 1.442 -0.833 0 CA-C-O 122.442 1.115 . . . . 0.0 109.342 169.229 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 17' ' ' VAL . . . . . 0.51 HG12 ' H ' ' A' ' 18' ' ' ASN . 2.2 t -70.22 175.86 0.57 Allowed 'Isoleucine or valine' 0 CA--C 1.54 0.582 0 N-CA-C 107.111 -1.44 . . . . 0.0 107.111 168.253 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 18' ' ' ASN . . . . . 0.51 ' H ' HG12 ' A' ' 17' ' ' VAL . 0.6 OUTLIER -44.88 -24.01 0.18 Allowed 'General case' 0 CA--C 1.539 0.53 0 C-N-CA 127.473 2.309 . . . . 0.0 116.391 -172.467 . . . . . . . . 3 3 . 1 . 019 nuclear build core ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . -163.89 17.54 0.12 Allowed Glycine 0 CA--C 1.532 1.141 0 CA-C-O 118.356 -1.247 . . . . 0.0 113.413 170.512 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 40.9 mtmt -145.97 155.54 51.47 Favored Pre-proline 0 N--CA 1.469 0.523 0 CA-C-N 120.412 2.106 . . . . 0.0 109.519 -178.032 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 21' ' ' PRO . . . . . . . . . . . . . 80.9 Cg_endo -72.34 171.59 16.66 Favored 'Trans proline' 0 N--CA 1.45 -1.053 0 C-N-CA 122.118 1.879 . . . . 0.0 110.812 176.544 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 22' ' ' VAL . . . . . . . . . . . . . 3.8 p -120.1 165.37 15.58 Favored 'Isoleucine or valine' 0 CA--C 1.54 0.581 0 C-N-CA 124.349 1.059 . . . . 0.0 111.973 178.184 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 23' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -77.15 -175.8 3.78 Favored 'General case' 0 CA--C 1.545 0.778 0 C-N-CA 127.26 2.224 . . . . 0.0 112.503 -175.525 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 24' ' ' SER . . . . . . . . . . . . . 19.6 m 69.17 67.11 0.27 Allowed 'General case' 0 N--CA 1.452 -0.344 0 C-N-CA 128.995 2.918 . . . . 0.0 114.663 160.574 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 25' ' ' ASP . . . . . . . . . . . . . 6.5 m-20 -46.54 -38.9 10.03 Favored 'General case' 0 CA--C 1.538 0.483 0 C-N-CA 125.699 1.6 . . . . 0.0 113.308 176.324 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 26' ' ' LYS . . . . . . . . . . . . . 77.9 tttt -95.42 -17.9 21.15 Favored 'General case' 0 N--CA 1.466 0.335 0 O-C-N 120.874 -1.141 . . . . 0.0 112.501 -175.853 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 27' ' ' ASN . . . . . . . . . . . . . 4.1 p30 -150.44 69.62 8.83 Favored Pre-proline 0 CA--C 1.534 0.335 0 C-N-CA 124.136 0.974 . . . . 0.0 110.437 -177.015 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 28' ' ' PRO . . . . . . . . . . . . . 40.8 Cg_endo -65.38 162.49 33.38 Favored 'Trans proline' 0 N--CA 1.46 -0.5 0 C-N-CA 122.126 1.884 . . . . 0.0 111.279 -176.802 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 29' ' ' PRO . . . . . . . . . . . . . 18.6 Cg_endo -62.52 87.02 0.11 Allowed 'Trans proline' 0 N--CA 1.453 -0.873 0 C-N-CA 123.562 2.842 . . . . 0.0 109.416 160.211 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 30' ' ' GLU . . . . . . . . . . . . . 1.1 pt-20 -97.23 158.74 15.3 Favored 'General case' 0 N--CA 1.447 -0.576 0 C-N-CA 124.765 1.226 . . . . 0.0 108.292 173.504 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 31' ' ' ILE . . . . . . . . . . . . . 16.4 tt -139.06 137.09 42.36 Favored 'Isoleucine or valine' 0 N--CA 1.443 -0.777 0 N-CA-C 105.456 -2.053 . . . . 0.0 105.456 179.558 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 32' ' ' SER . . . . . . . . . . . . . 68.7 p -136.46 160.12 39.72 Favored 'General case' 0 C--N 1.321 -0.663 0 N-CA-C 106.804 -1.554 . . . . 0.0 106.804 170.151 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 33' ' ' PHE . . . . . . . . . . . . . 58.1 m-85 -118.38 164.67 14.89 Favored 'General case' 0 C--N 1.326 -0.445 0 N-CA-C 108.088 -1.078 . . . . 0.0 108.088 179.462 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 34' ' ' GLY . . . . . . . . . . . . . . . 167.91 142.4 3.47 Favored Glycine 0 N--CA 1.448 -0.542 0 N-CA-C 109.017 -1.633 . . . . 0.0 109.017 177.305 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 35' ' ' GLU . . . . . . . . . . . . . 0.3 OUTLIER 57.28 116.01 0.01 OUTLIER 'General case' 0 CA--C 1.537 0.461 0 C-N-CA 129.264 3.026 . . . . 0.0 114.481 168.947 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 8.6 mtmm 59.08 18.31 6.27 Favored 'General case' 0 N--CA 1.473 0.694 0 O-C-N 120.453 -1.404 . . . . 0.0 113.057 -173.091 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 37' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER 58.85 35.73 24.35 Favored 'General case' 0 CA--C 1.535 0.398 0 C-N-CA 124.843 1.257 . . . . 0.0 110.242 -174.163 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 38' ' ' MET . . . . . . . . . . . . . 9.2 mtp -69.05 164.49 22.32 Favored 'General case' 0 N--CA 1.45 -0.428 0 O-C-N 121.469 -0.77 . . . . 0.0 110.307 167.947 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 39' ' ' ILE . . . . . . . . . . . . . 9.3 mt -122.59 139.93 47.94 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.439 0 C-N-CA 126.485 1.914 . . . . 0.0 106.92 179.115 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 40' ' ' SER . . . . . . . . . . . . . 73.1 m -124.14 149.16 46.58 Favored 'General case' 0 N--CA 1.454 -0.239 0 C-N-CA 125.604 1.562 . . . . 0.0 108.364 163.223 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 41' ' ' GLY . . . . . . . . . . . . . . . 172.84 -178.8 44.69 Favored Glycine 0 CA--C 1.523 0.592 0 N-CA-C 109.221 -1.552 . . . . 0.0 109.221 172.199 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 42' ' ' SER . . . . . . . . . . . . . 40.4 t -142.0 154.61 45.14 Favored 'General case' 0 N--CA 1.449 -0.496 0 N-CA-C 107.303 -1.369 . . . . 0.0 107.303 162.569 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 43' ' ' MET . . . . . . . . . . . . . 14.9 mmt -107.03 -53.01 2.67 Favored 'General case' 0 N--CA 1.454 -0.247 0 N-CA-C 107.43 -1.322 . . . . 0.0 107.43 159.211 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 44' ' ' CYS . . . . . 1.298 ' SG ' ' SG ' ' A' ' 70' ' ' CYS . 12.7 t -151.06 -50.57 0.12 Allowed 'General case' 0 CA--C 1.534 0.338 0 N-CA-C 107.114 -1.439 . . . . 0.0 107.114 176.738 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 45' ' ' ASN . . . . . . . . . . . . . 14.1 m-80 -88.39 16.06 6.94 Favored 'General case' 0 CA--C 1.518 -0.25 0 C-N-CA 125.276 1.43 . . . . 0.0 113.967 -175.837 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 46' ' ' ARG . . . . . . . . . . . . . 3.9 mmt180 58.23 172.26 0.06 Allowed 'General case' 0 N--CA 1.465 0.277 0 C-N-CA 123.86 0.864 . . . . 0.0 110.459 -168.775 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 47' ' ' PHE . . . . . . . . . . . . . 48.7 p90 -163.59 172.35 14.47 Favored 'General case' 0 C--O 1.241 0.618 0 C-N-CA 123.841 0.856 . . . . 0.0 109.712 161.232 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 48' ' ' SER . . . . . . . . . . . . . 1.7 p -173.93 143.99 0.99 Allowed 'General case' 0 N--CA 1.449 -0.518 0 C-N-CA 124.898 1.279 . . . . 0.0 108.863 177.205 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 49' ' ' GLY . . . . . . . . . . . . . . . -176.91 169.83 42.35 Favored Glycine 0 CA--C 1.524 0.628 0 O-C-N 121.25 -0.906 . . . . 0.0 112.455 172.776 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 50' ' ' GLU . . . . . . . . . . . . . 17.3 mt-10 -72.31 94.83 1.64 Allowed 'General case' 0 N--CA 1.461 0.092 0 C-N-CA 124.922 1.289 . . . . 0.0 108.257 171.851 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 51' ' ' GLY . . . . . . . . . . . . . . . -58.98 -65.91 3.16 Favored Glycine 0 C--O 1.226 -0.385 0 C-N-CA 125.818 1.675 . . . . 0.0 113.193 -177.555 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 52' ' ' LYS . . . . . . . . . . . . . 2.5 ttmp? 70.57 138.48 0.04 OUTLIER 'General case' 0 C--N 1.326 -0.443 0 C-N-CA 128.041 2.537 . . . . 0.0 112.655 178.018 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 53' ' ' LEU . . . . . . . . . . . . . 24.8 tp -147.09 102.55 3.52 Favored 'General case' 0 C--O 1.236 0.347 0 C-N-CA 123.637 0.775 . . . . 0.0 109.801 179.734 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 2.0 t -153.09 19.48 0.57 Allowed 'General case' 0 CA--C 1.54 0.574 0 C-N-CA 123.775 0.83 . . . . 0.0 111.658 176.525 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 55' ' ' ASN . . . . . . . . . . . . . 11.9 p30 -146.03 3.69 0.94 Allowed 'General case' 0 N--CA 1.47 0.55 0 N-CA-C 113.847 1.055 . . . . 0.0 113.847 164.985 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 56' ' ' GLY . . . . . . . . . . . . . . . 95.68 16.14 40.51 Favored Glycine 0 CA--C 1.527 0.814 0 CA-C-N 119.495 1.043 . . . . 0.0 112.511 -175.695 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 57' ' ' GLU . . . . . . . . . . . . . 23.6 tt0 -136.04 156.67 48.38 Favored 'General case' 0 CA--C 1.537 0.472 0 C-N-CA 124.426 1.09 . . . . 0.0 108.331 -174.618 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 58' ' ' LEU . . . . . . . . . . . . . 38.9 tp -129.62 97.22 4.46 Favored 'General case' 0 CA--C 1.541 0.597 0 C-N-CA 125.182 1.393 . . . . 0.0 110.502 -173.109 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 59' ' ' THR . . . . . . . . . . . . . 2.7 p -113.07 104.99 12.93 Favored 'General case' 0 N--CA 1.474 0.746 0 C-N-CA 127.575 2.35 . . . . 0.0 112.203 -175.448 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 60' ' ' ALA . . . . . . . . . . . . . . . -72.73 126.05 28.97 Favored 'General case' 0 C--O 1.233 0.201 0 O-C-N 122.119 -0.363 . . . . 0.0 110.917 176.583 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 61' ' ' LYS . . . . . . . . . . . . . 16.2 ttpt -77.96 46.25 0.57 Allowed 'General case' 0 CA--C 1.543 0.692 0 C-N-CA 124.909 1.284 . . . . 0.0 113.68 -177.866 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 62' ' ' GLY . . . . . . . . . . . . . . . 134.33 -21.95 3.8 Favored Glycine 0 N--CA 1.474 1.207 0 O-C-N 120.708 -1.245 . . . . 0.0 114.84 170.732 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 63' ' ' LEU . . . . . . . . . . . . . 1.6 tp 44.89 80.06 0.04 OUTLIER 'General case' 0 CA--C 1.546 0.816 0 C-N-CA 128.008 2.523 . . . . 0.0 114.424 169.143 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 64' ' ' ALA . . . . . . . . . . . . . . . -65.18 100.03 0.42 Allowed 'General case' 0 CA--C 1.545 0.765 0 C-N-CA 127.166 2.187 . . . . 0.0 114.056 -175.132 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 65' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -108.55 175.3 5.51 Favored 'General case' 0 N--CA 1.484 1.263 0 C-N-CA 125.11 1.364 . . . . 0.0 111.433 -173.02 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 66' ' ' THR . . . . . . . . . . . . . 17.0 p -118.12 -165.65 1.13 Allowed 'General case' 0 N--CA 1.478 0.926 0 C-N-CA 126.146 1.778 . . . . 0.0 111.462 -177.618 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 67' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -142.79 75.99 1.51 Allowed 'General case' 0 N--CA 1.474 0.733 0 C-N-CA 125.463 1.505 . . . . 0.0 109.559 177.897 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 68' ' ' MET . . . . . . . . . . . . . 51.5 mtm -126.12 164.72 20.29 Favored 'General case' 0 C--N 1.326 -0.434 0 C-N-CA 129.592 3.157 . . . . 0.0 108.604 -179.423 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 69' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -113.63 163.32 15.12 Favored 'General case' 0 N--CA 1.449 -0.523 0 C-N-CA 126.246 1.819 . . . . 0.0 107.016 173.302 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 70' ' ' CYS . . . . . 1.298 ' SG ' ' SG ' ' A' ' 44' ' ' CYS . 0.5 OUTLIER -121.89 -6.94 9.01 Favored 'General case' 0 C--N 1.323 -0.548 0 C-N-CA 126.284 1.833 . . . . 0.0 114.276 -170.081 . . . . . . . . 3 3 . 1 . 019 nuclear build core ' A' A ' 71' ' ' ALA . . . . . . . . . . . . . . . 61.17 4.2 0.84 Allowed 'General case' 0 CA--C 1.538 0.503 0 C-N-CA 125.361 1.464 . . . . 0.0 114.597 -172.403 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 72' ' ' ASN . . . . . . . . . . . . . 21.7 t-20 -132.61 142.5 45.08 Favored Pre-proline 0 N--CA 1.472 0.641 0 CA-C-N 120.67 1.577 . . . . 0.0 108.575 160.457 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 73' ' ' PRO . . . . . . . . . . . . . 70.0 Cg_endo -79.25 -29.36 3.17 Favored 'Trans proline' 0 C--N 1.346 0.401 0 C-N-CA 122.124 1.883 . . . . 0.0 112.179 -169.986 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 74' ' ' GLN . . . . . . . . . . . . . 31.8 tt0 -60.52 -39.63 88.53 Favored 'General case' 0 C--O 1.221 -0.42 0 CA-C-N 116.691 -0.231 . . . . 0.0 110.419 -179.751 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 75' ' ' LEU . . . . . . . . . . . . . 69.5 mt -66.84 -37.73 85.03 Favored 'General case' 0 N--CA 1.467 0.399 0 O-C-N 121.834 -0.541 . . . . 0.0 109.895 174.328 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 76' ' ' ASN . . . . . . . . . . . . . 2.2 t-20 -64.52 -46.37 83.19 Favored 'General case' 0 C--O 1.22 -0.491 0 C-N-CA 125.182 1.393 . . . . 0.0 111.45 -177.663 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 77' ' ' GLU . . . . . . . . . . . . . 8.2 pt-20 -71.3 -30.2 65.95 Favored 'General case' 0 N--CA 1.468 0.455 0 CA-C-N 119.564 1.074 . . . . 0.0 111.935 177.237 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 78' ' ' LEU . . . . . . . . . . . . . 1.0 OUTLIER -61.09 -35.94 78.35 Favored 'General case' 0 C--N 1.329 -0.308 0 C-N-CA 124.13 0.972 . . . . 0.0 109.346 177.388 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 79' ' ' ASP . . . . . . . . . . . . . 0.0 OUTLIER -59.12 -29.03 67.09 Favored 'General case' 0 N--CA 1.463 0.188 0 C-N-CA 124.074 0.95 . . . . 0.0 112.489 173.603 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 80' ' ' ASN . . . . . . . . . . . . . 10.9 t30 -97.68 -20.04 17.87 Favored 'General case' 0 N--CA 1.452 -0.37 0 C-N-CA 124.082 0.953 . . . . 0.0 111.366 -178.842 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 81' ' ' THR . . . . . . . . . . . . . 20.4 m -69.8 -57.95 4.48 Favored 'General case' 0 N--CA 1.448 -0.545 0 N-CA-C 107.051 -1.462 . . . . 0.0 107.051 172.208 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 82' ' ' ILE . . . . . . . . . . . . . 8.9 tp -66.74 -39.91 84.81 Favored 'Isoleucine or valine' 0 N--CA 1.454 -0.269 0 C-N-CA 124.058 0.943 . . . . 0.0 111.333 -170.264 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 83' ' ' SER . . . . . . . . . . . . . 43.3 p -50.15 -49.23 52.78 Favored 'General case' 0 C--O 1.236 0.389 0 C-N-CA 124.542 1.137 . . . . 0.0 110.621 -176.141 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 84' ' ' GLU . . . . . . . . . . . . . 0.9 OUTLIER -70.94 -40.29 72.13 Favored 'General case' 0 N--CA 1.447 -0.582 0 CA-C-O 117.386 -1.293 . . . . 0.0 112.108 178.919 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 85' ' ' MET . . . . . . . . . . . . . 91.8 mtp -58.81 -41.37 86.61 Favored 'General case' 0 C--N 1.347 0.472 0 CA-C-N 120.94 1.7 . . . . 0.0 109.117 -176.279 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 86' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -77.56 -27.77 51.58 Favored 'General case' 0 C--O 1.232 0.179 0 C-N-CA 123.899 0.88 . . . . 0.0 112.043 -175.859 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 87' ' ' LYS . . . . . . . . . . . . . 64.5 mttt -76.34 -52.0 10.82 Favored 'General case' 0 N--CA 1.446 -0.672 0 N-CA-C 108.601 -0.888 . . . . 0.0 108.601 176.765 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 88' ' ' GLU . . . . . . . . . . . . . 18.0 mm-40 -51.19 -51.34 54.69 Favored 'General case' 0 CA--C 1.527 0.072 0 C-N-CA 125.242 1.417 . . . . 0.0 109.511 176.641 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 89' ' ' GLY . . . . . . . . . . . . . . . 106.67 133.16 7.28 Favored Glycine 0 C--N 1.335 0.523 0 N-CA-C 107.677 -2.169 . . . . 0.0 107.677 -166.653 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 90' ' ' ALA . . . . . . . . . . . . . . . -138.19 142.72 40.02 Favored 'General case' 0 CA--C 1.516 -0.35 0 C-N-CA 123.708 0.803 . . . . 0.0 109.695 -168.333 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 91' ' ' GLN . . . . . . . . . . . . . 6.0 mp0 -72.31 129.15 37.74 Favored 'General case' 0 N--CA 1.444 -0.775 0 N-CA-C 105.206 -2.146 . . . . 0.0 105.206 -177.098 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 92' ' ' VAL . . . . . . . . . . . . . 7.5 p -122.14 127.35 75.23 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.325 0 N-CA-C 106.947 -1.501 . . . . 0.0 106.947 -175.9 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 93' ' ' ASP . . . . . . . . . . . . . 0.8 OUTLIER -142.76 94.54 2.65 Favored 'General case' 0 C--O 1.234 0.253 0 N-CA-C 107.822 -1.177 . . . . 0.0 107.822 -173.452 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 94' ' ' LEU . . . . . . . . . . . . . 0.9 OUTLIER -99.45 102.65 14.28 Favored 'General case' 0 CA--C 1.515 -0.371 0 N-CA-C 107.069 -1.456 . . . . 0.0 107.069 176.043 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 95' ' ' THR . . . . . . . . . . . . . 5.8 t -78.02 -168.81 1.36 Allowed 'General case' 0 CA--C 1.536 0.407 0 O-C-N 125.043 1.465 . . . . 0.0 107.9 178.975 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 96' ' ' ALA . . . . . . . . . . . . . . . -53.15 -23.29 7.87 Favored 'General case' 0 CA--C 1.541 0.599 0 N-CA-C 114.041 1.126 . . . . 0.0 114.041 -175.075 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 97' ' ' ASN . . . . . . . . . . . . . 30.2 p30 -158.19 6.35 0.13 Allowed 'General case' 0 N--CA 1.473 0.697 0 N-CA-C 116.247 1.943 . . . . 0.0 116.247 164.757 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 98' ' ' GLN . . . . . . . . . . . . . 3.2 tt0 -121.6 130.53 53.56 Favored 'General case' 0 N--CA 1.471 0.6 0 CA-C-N 121.216 1.826 . . . . 0.0 110.743 -176.766 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 99' ' ' LEU . . . . . 0.465 ' HB3' ' HB2' ' A' ' 110' ' ' TYR . 14.5 tp -83.77 138.84 33.06 Favored 'General case' 0 C--O 1.232 0.168 0 O-C-N 121.523 -0.736 . . . . 0.0 110.145 171.768 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 100' ' ' THR . . . . . . . . . . . . . 28.8 m -120.74 120.14 34.78 Favored 'General case' 0 N--CA 1.448 -0.556 0 N-CA-C 105.773 -1.936 . . . . 0.0 105.773 159.433 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 101' ' ' LEU . . . . . . . . . . . . . 3.2 mm? -96.77 138.59 34.1 Favored 'General case' 0 CA--C 1.505 -0.753 0 N-CA-C 106.661 -1.607 . . . . 0.0 106.661 149.376 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 102' ' ' ALA . . . . . . . . . . . . . . . -131.98 154.04 49.72 Favored 'General case' 0 C--N 1.327 -0.411 0 N-CA-C 107.319 -1.363 . . . . 0.0 107.319 165.529 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 103' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -162.94 172.2 15.44 Favored 'General case' 0 N--CA 1.442 -0.845 0 C-N-CA 127.815 2.446 . . . . 0.0 107.891 176.274 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 104' ' ' ALA . . . . . . . . . . . . . . . -53.47 -29.97 38.52 Favored 'General case' 0 CA--C 1.537 0.471 0 C-N-CA 124.16 0.984 . . . . 0.0 113.103 174.94 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 105' ' ' LYS . . . . . . . . . . . . . 53.2 mmtt -70.7 -72.39 0.21 Allowed 'General case' 0 C--O 1.232 0.138 0 C-N-CA 123.61 0.764 . . . . 0.0 111.815 175.143 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 106' ' ' GLN . . . . . . . . . . . . . 2.6 pt20 -154.57 -168.48 2.93 Favored 'General case' 0 C--O 1.232 0.168 0 C-N-CA 123.49 0.716 . . . . 0.0 110.169 -178.983 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 107' ' ' THR . . . . . . . . . . . . . 7.2 t -130.64 152.91 49.49 Favored 'General case' 0 N--CA 1.446 -0.637 0 C-N-CA 126.284 1.834 . . . . 0.0 107.583 176.264 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 108' ' ' LEU . . . . . . . . . . . . . 3.5 mm? -121.63 166.29 14.47 Favored 'General case' 0 C--O 1.237 0.442 0 C-N-CA 125.193 1.397 . . . . 0.0 109.995 174.179 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 109' ' ' THR . . . . . . . . . . . . . 9.4 m -130.96 106.6 8.52 Favored 'General case' 0 N--CA 1.448 -0.565 0 N-CA-C 107.94 -1.133 . . . . 0.0 107.94 166.225 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 110' ' ' TYR . . . . . 0.465 ' HB2' ' HB3' ' A' ' 99' ' ' LEU . 49.6 m-85 -98.96 165.26 11.84 Favored 'General case' 0 C--O 1.235 0.308 0 N-CA-C 108.946 -0.761 . . . . 0.0 108.946 172.668 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 111' ' ' LYS . . . . . 0.484 ' HE2' ' HG3' ' A' ' 15' ' ' GLU . 5.0 tppt? -122.39 146.18 47.58 Favored 'General case' 0 C--O 1.226 -0.134 0 C-N-CA 124.249 1.02 . . . . 0.0 110.144 178.932 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 112' ' ' LEU . . . . . . . . . . . . . 26.1 tp -69.65 17.82 0.05 OUTLIER 'General case' 0 CA--C 1.546 0.795 0 C-N-CA 128.813 2.845 . . . . 0.0 113.519 -177.736 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 113' ' ' ALA . . . . . . . . . . . . . . . -60.54 90.19 0.02 OUTLIER 'General case' 0 CA--C 1.534 0.361 0 C-N-CA 126.023 1.729 . . . . 0.0 111.794 -168.397 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 114' ' ' ASP . . . . . . . . . . . . . 27.2 t0 . . . . . 0 CA--C 1.51 -0.592 0 CA-C-O 122.901 1.334 . . . . 0.0 111.494 -168.864 . . . . . . . . 0 0 . 1 . 001 nuclear build full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 9.6 ttt . . . . . 0 C--O 1.234 0.252 0 N-CA-C 109.506 -0.553 . . . . 0.0 109.506 . . . . . . . . . 0 0 . 1 . 001 nuclear build full ' A' A ' 2' ' ' VAL . . . . . . . . . . . . . 74.9 t -59.69 137.3 22.3 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.448 0 N-CA-C 108.382 -0.97 . . . . 0.0 108.382 173.403 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 3' ' ' THR . . . . . . . . . . . . . 0.1 OUTLIER -124.75 162.38 43.32 Favored Pre-proline 0 CA--C 1.537 0.444 0 C-N-CA 122.494 0.318 . . . . 0.0 110.98 177.107 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 4' ' ' PRO . . . . . . . . . . . . . 9.2 Cg_endo -71.22 -41.74 2.38 Favored 'Trans proline' 0 CA--C 1.532 0.41 0 C-N-CA 122.833 2.356 . . . . 0.0 112.58 -179.312 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 5' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -61.01 -44.59 97.19 Favored 'General case' 0 C--N 1.325 -0.48 0 C-N-CA 124.231 1.012 . . . . 0.0 110.576 -173.516 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 6' ' ' GLN . . . . . . . . . . . . . 3.7 pt20 -65.5 12.63 0.05 OUTLIER 'General case' 0 CA--C 1.541 0.612 0 C-N-CA 125.803 1.641 . . . . 0.0 114.678 175.135 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 7' ' ' LEU . . . . . . . . . . . . . 77.0 mt -130.97 -45.57 1.03 Allowed 'General case' 0 C--O 1.225 -0.187 0 C-N-CA 125.488 1.515 . . . . 0.0 110.354 -177.34 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 8' ' ' GLN . . . . . . . . . . . . . 19.3 mt-30 -62.12 -3.08 1.12 Allowed 'General case' 0 N--CA 1.469 0.487 0 N-CA-C 115.534 1.679 . . . . 0.0 115.534 -171.956 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 9' ' ' HIS . . . . . . . . . . . . . 97.7 m-70 -135.41 13.68 3.49 Favored 'General case' 0 C--N 1.326 -0.414 0 C-N-CA 125.181 1.393 . . . . 0.0 111.488 177.128 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 10' ' ' HIS . . . . . . . . . . . . . 94.7 m-70 -131.13 108.21 9.58 Favored 'General case' 0 N--CA 1.451 -0.404 0 C-N-CA 124.753 1.221 . . . . 0.0 109.353 -172.119 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 11' ' ' ARG . . . . . . . . . . . . . 9.5 ptt180 -74.83 163.34 27.77 Favored 'General case' 0 C--O 1.235 0.311 0 N-CA-C 108.976 -0.75 . . . . 0.0 108.976 174.617 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 12' ' ' PHE . . . . . . . . . . . . . 46.7 m-85 -139.19 146.8 40.98 Favored 'General case' 0 N--CA 1.448 -0.568 0 N-CA-C 108.416 -0.957 . . . . 0.0 108.416 173.137 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 13' ' ' VAL . . . . . 0.482 ' HA ' ' HA ' ' A' ' 30' ' ' GLU . 7.2 p -112.3 137.17 46.11 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.478 0 O-C-N 121.267 -0.895 . . . . 0.0 109.686 178.622 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 14' ' ' LEU . . . . . . . . . . . . . 26.7 tp -64.22 121.97 15.51 Favored 'General case' 0 N--CA 1.466 0.375 0 N-CA-C 107.254 -1.387 . . . . 0.0 107.254 178.669 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 1.6 tm-20 -105.63 -50.22 3.25 Favored 'General case' 0 C--N 1.326 -0.454 0 N-CA-C 108.134 -1.061 . . . . 0.0 108.134 -174.429 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 5.3 p -146.11 124.23 12.16 Favored 'General case' 0 N--CA 1.446 -0.663 0 CA-C-O 121.995 0.902 . . . . 0.0 110.713 179.833 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 17' ' ' VAL . . . . . . . . . . . . . 2.4 t -64.93 160.04 3.57 Favored 'Isoleucine or valine' 0 C--O 1.239 0.531 0 N-CA-C 107.137 -1.431 . . . . 0.0 107.137 161.776 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 18' ' ' ASN . . . . . . . . . . . . . 1.5 t30 -44.97 -43.31 8.97 Favored 'General case' 0 CA--C 1.53 0.203 0 C-N-CA 123.77 0.828 . . . . 0.0 111.864 165.115 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . -90.43 -33.67 8.49 Favored Glycine 0 CA--C 1.526 0.756 0 CA-C-O 117.686 -1.619 . . . . 0.0 114.389 -170.235 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 10.5 mttt -161.67 165.7 15.93 Favored Pre-proline 0 N--CA 1.469 0.496 0 CA-C-N 119.806 1.803 . . . . 0.0 110.321 -174.357 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 21' ' ' PRO . . . . . . . . . . . . . 97.0 Cg_endo -64.01 -179.96 0.94 Allowed 'Trans proline' 0 CA--C 1.537 0.639 0 C-N-CA 122.614 2.209 . . . . 0.0 110.953 163.121 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 22' ' ' VAL . . . . . . . . . . . . . 3.8 t -130.1 145.37 35.74 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.426 0 N-CA-C 107.909 -1.145 . . . . 0.0 107.909 169.837 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 23' ' ' THR . . . . . . . . . . . . . 0.1 OUTLIER -143.65 111.79 6.24 Favored 'General case' 0 C--O 1.233 0.213 0 C-N-CA 124.877 1.271 . . . . 0.0 108.273 178.107 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 24' ' ' SER . . . . . . . . . . . . . 2.9 m -134.16 45.12 2.64 Favored 'General case' 0 CA--C 1.535 0.378 0 CA-C-N 118.668 0.667 . . . . 0.0 112.244 -163.989 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 25' ' ' ASP . . . . . . . . . . . . . 1.0 OUTLIER 65.14 -81.17 0.03 OUTLIER 'General case' 0 N--CA 1.463 0.178 0 C-N-CA 128.695 2.798 . . . . 0.0 110.171 172.27 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 26' ' ' LYS . . . . . . . . . . . . . 21.3 ttpp -143.63 5.23 1.38 Allowed 'General case' 0 CA--C 1.535 0.373 0 C-N-CA 124.653 1.181 . . . . 0.0 112.008 171.085 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 27' ' ' ASN . . . . . . . . . . . . . 70.0 m-80 -122.41 70.05 33.32 Favored Pre-proline 0 C--O 1.233 0.202 0 C-N-CA 125.514 1.525 . . . . 0.0 108.158 -174.238 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 28' ' ' PRO . . . . . . . . . . . . . 93.0 Cg_endo -72.91 160.68 45.46 Favored 'Trans proline' 0 N--CA 1.454 -0.811 0 C-N-CA 121.986 1.791 . . . . 0.0 111.214 -178.623 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 29' ' ' PRO . . . . . . . . . . . . . 39.6 Cg_endo -68.17 64.84 1.04 Allowed 'Trans proline' 0 N--CA 1.458 -0.568 0 C-N-CA 123.864 3.043 . . . . 0.0 111.392 164.022 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 30' ' ' GLU . . . . . 0.482 ' HA ' ' HA ' ' A' ' 13' ' ' VAL . 14.7 pt-20 -72.71 170.07 15.33 Favored 'General case' 0 N--CA 1.446 -0.635 0 O-C-N 120.316 -1.49 . . . . 0.0 109.408 166.705 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 31' ' ' ILE . . . . . . . . . . . . . 20.0 tt -141.77 149.26 20.05 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.483 0 N-CA-C 106.983 -1.488 . . . . 0.0 106.983 178.475 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 32' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER -134.75 164.35 27.74 Favored 'General case' 0 N--CA 1.442 -0.829 0 CA-C-O 122.856 1.312 . . . . 0.0 109.083 172.929 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 33' ' ' PHE . . . . . . . . . . . . . 95.2 m-85 -133.02 167.13 20.85 Favored 'General case' 0 C--N 1.323 -0.58 0 CA-C-N 113.74 -1.573 . . . . 0.0 107.609 -177.233 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 34' ' ' GLY . . . . . . . . . . . . . . . -166.47 -170.69 31.7 Favored Glycine 0 N--CA 1.447 -0.615 0 N-CA-C 110.007 -1.237 . . . . 0.0 110.007 172.354 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 35' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -44.31 149.15 0.39 Allowed 'General case' 0 C--O 1.234 0.282 0 C-N-CA 126.707 2.003 . . . . 0.0 111.383 -173.261 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 32.7 mmtm 65.01 15.66 10.12 Favored 'General case' 0 CA--C 1.536 0.43 0 C-N-CA 125.574 1.549 . . . . 0.0 111.727 -170.919 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 37' ' ' MET . . . . . . . . . . . . . 11.5 mmm 59.7 20.97 9.68 Favored 'General case' 0 CA--C 1.54 0.576 0 C-N-CA 126.12 1.768 . . . . 0.0 113.272 -171.839 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 38' ' ' MET . . . . . . . . . . . . . 0.8 OUTLIER -61.19 160.01 11.1 Favored 'General case' 0 N--CA 1.452 -0.328 0 O-C-N 121.171 -0.956 . . . . 0.0 112.011 178.911 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 39' ' ' ILE . . . . . . . . . . . . . 10.4 mt -131.7 138.45 52.85 Favored 'Isoleucine or valine' 0 C--O 1.236 0.375 0 C-N-CA 124.851 1.26 . . . . 0.0 108.625 -168.473 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 40' ' ' SER . . . . . . . . . . . . . 13.7 m -135.89 132.83 37.03 Favored 'General case' 0 CA--C 1.531 0.232 0 N-CA-C 106.389 -1.708 . . . . 0.0 106.389 166.47 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 41' ' ' GLY . . . . . . . . . . . . . . . -157.91 172.35 35.08 Favored Glycine 0 C--N 1.334 0.439 0 CA-C-N 119.109 0.868 . . . . 0.0 111.49 -177.965 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 42' ' ' SER . . . . . . . . . . . . . 15.1 p -149.57 72.17 1.13 Allowed 'General case' 0 N--CA 1.452 -0.336 0 O-C-N 121.861 -0.788 . . . . 0.0 112.068 -165.283 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 43' ' ' MET . . . . . . . . . . . . . 6.3 mmt -66.48 -58.42 5.28 Favored 'General case' 0 CA--C 1.537 0.445 0 N-CA-C 109.315 -0.624 . . . . 0.0 109.315 178.207 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 44' ' ' CYS . . . . . 1.293 ' SG ' ' SG ' ' A' ' 70' ' ' CYS . 3.8 t -145.4 -57.32 0.32 Allowed 'General case' 0 N--CA 1.462 0.17 0 N-CA-C 107.128 -1.434 . . . . 0.0 107.128 161.247 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 45' ' ' ASN . . . . . . . . . . . . . 16.1 m-80 -74.42 7.17 3.06 Favored 'General case' 0 C--N 1.331 -0.211 0 C-N-CA 127.363 2.265 . . . . 0.0 113.267 -171.327 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 46' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER 57.9 150.1 0.01 OUTLIER 'General case' 0 C--O 1.225 -0.2 0 C-N-CA 126.831 2.052 . . . . 0.0 112.23 -166.115 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 47' ' ' PHE . . . . . . . . . . . . . 38.4 p90 -146.02 170.14 17.24 Favored 'General case' 0 N--CA 1.445 -0.706 0 CA-C-O 122.63 1.205 . . . . 0.0 109.392 167.963 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 48' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -161.66 161.9 29.71 Favored 'General case' 0 C--N 1.324 -0.531 0 C-N-CA 126.032 1.733 . . . . 0.0 106.83 174.996 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 49' ' ' GLY . . . . . . . . . . . . . . . 174.15 168.04 34.49 Favored Glycine 0 CA--C 1.523 0.591 0 CA-C-N 119.364 0.984 . . . . 0.0 111.976 166.178 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 50' ' ' GLU . . . . . . . . . . . . . 31.1 mt-10 -80.2 94.93 6.14 Favored 'General case' 0 C--O 1.236 0.368 0 C-N-CA 123.514 0.726 . . . . 0.0 109.874 -178.964 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 51' ' ' GLY . . . . . . . . . . . . . . . -69.71 173.37 37.79 Favored Glycine 0 CA--C 1.528 0.857 0 CA-C-O 122.797 1.221 . . . . 0.0 113.135 174.147 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 52' ' ' LYS . . . . . . . . . . . . . 1.4 ttmp? -151.63 154.28 36.09 Favored 'General case' 0 N--CA 1.454 -0.268 0 C-N-CA 126.205 1.802 . . . . 0.0 107.635 -179.66 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 53' ' ' LEU . . . . . . . . . . . . . 1.5 tm? -149.44 117.73 6.44 Favored 'General case' 0 N--CA 1.453 -0.29 0 N-CA-C 106.247 -1.76 . . . . 0.0 106.247 169.231 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 1.3 t -144.06 -26.15 0.54 Allowed 'General case' 0 CA--C 1.535 0.392 0 C-N-CA 124.431 1.092 . . . . 0.0 112.126 -179.341 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 55' ' ' ASN . . . . . . . . . . . . . 0.5 OUTLIER -140.19 -10.75 1.11 Allowed 'General case' 0 N--CA 1.473 0.678 0 CA-C-N 119.924 1.238 . . . . 0.0 113.489 177.246 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 56' ' ' GLY . . . . . . . . . . . . . . . 126.3 6.23 5.82 Favored Glycine 0 CA--C 1.532 1.095 0 O-C-N 121.242 -0.911 . . . . 0.0 112.069 -173.063 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 57' ' ' GLU . . . . . . . . . . . . . 28.1 tt0 -114.26 113.71 24.98 Favored 'General case' 0 C--O 1.237 0.426 0 C-N-CA 125.419 1.488 . . . . 0.0 108.387 -169.535 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 58' ' ' LEU . . . . . . . . . . . . . 47.6 tp -94.36 97.4 10.18 Favored 'General case' 0 CA--C 1.533 0.305 0 C-N-CA 122.878 0.471 . . . . 0.0 110.439 175.354 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 59' ' ' THR . . . . . . . . . . . . . 6.4 p -99.29 139.01 35.57 Favored 'General case' 0 C--O 1.237 0.422 0 C-N-CA 124.171 0.988 . . . . 0.0 110.057 168.66 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 60' ' ' ALA . . . . . . . . . . . . . . . -94.34 108.73 20.62 Favored 'General case' 0 C--O 1.234 0.253 0 C-N-CA 124.799 1.239 . . . . 0.0 109.594 171.523 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 61' ' ' LYS . . . . . . . . . . . . . 11.0 tttt -75.36 72.0 2.37 Favored 'General case' 0 C--O 1.235 0.338 0 C-N-CA 124.916 1.286 . . . . 0.0 108.786 170.06 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 62' ' ' GLY . . . . . . . . . . . . . . . 102.86 104.47 2.86 Favored Glycine 0 N--CA 1.451 -0.349 0 N-CA-C 107.721 -2.152 . . . . 0.0 107.721 -174.433 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 63' ' ' LEU . . . . . . . . . . . . . 1.8 tp -90.42 161.79 15.4 Favored 'General case' 0 N--CA 1.447 -0.619 0 N-CA-C 108.506 -0.924 . . . . 0.0 108.506 160.352 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 64' ' ' ALA . . . . . . . . . . . . . . . -153.8 144.14 22.26 Favored 'General case' 0 C--O 1.235 0.299 0 C-N-CA 124.363 1.065 . . . . 0.0 109.858 165.848 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 65' ' ' MET . . . . . . . . . . . . . 8.5 mtt -145.48 169.31 18.6 Favored 'General case' 0 N--CA 1.472 0.628 0 C-N-CA 127.014 2.126 . . . . 0.0 111.752 -172.313 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 66' ' ' THR . . . . . . . . . . . . . 6.7 p -105.33 -172.37 2.08 Favored 'General case' 0 CA--C 1.544 0.748 0 C-N-CA 124.781 1.232 . . . . 0.0 110.78 177.003 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 67' ' ' ARG . . . . . . . . . . . . . 64.9 mtm-85 -121.48 76.14 1.23 Allowed 'General case' 0 N--CA 1.47 0.571 0 C-N-CA 124.728 1.211 . . . . 0.0 109.604 169.943 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 68' ' ' MET . . . . . . . . . . . . . 78.6 mtm -102.79 178.33 4.6 Favored 'General case' 0 CA--C 1.533 0.322 0 C-N-CA 124.924 1.29 . . . . 0.0 110.81 171.95 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 69' ' ' MET . . . . . . . . . . . . . 0.4 OUTLIER -137.24 171.7 14.09 Favored 'General case' 0 C--O 1.237 0.434 0 C-N-CA 127.058 2.143 . . . . 0.0 105.233 166.54 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 70' ' ' CYS . . . . . 1.293 ' SG ' ' SG ' ' A' ' 44' ' ' CYS . 97.0 m -141.51 9.03 2.01 Favored 'General case' 0 C--N 1.328 -0.327 0 N-CA-C 115.251 1.574 . . . . 0.0 115.251 -168.438 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 71' ' ' ALA . . . . . . . . . . . . . . . 62.19 2.23 0.8 Allowed 'General case' 0 CA--C 1.536 0.43 0 C-N-CA 126.72 2.008 . . . . 0.0 115.037 179.088 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 72' ' ' ASN . . . . . . . . . . . . . 0.1 OUTLIER -121.83 157.12 58.2 Favored Pre-proline 0 N--CA 1.476 0.867 0 N-CA-C 106.53 -1.655 . . . . 0.0 106.53 156.368 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 73' ' ' PRO . . . . . . . . . . . . . 64.7 Cg_endo -77.38 -41.85 0.32 Allowed 'Trans proline' 0 N--CA 1.459 -0.519 0 C-N-CA 122.236 1.957 . . . . 0.0 111.817 -178.487 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 74' ' ' GLN . . . . . . . . . . . . . 40.1 tt0 -47.52 -60.57 2.44 Favored 'General case' 0 CA--C 1.532 0.271 0 C-N-CA 126.972 2.109 . . . . 0.0 110.609 -173.959 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 75' ' ' LEU . . . . . . . . . . . . . 82.4 mt -55.44 -40.65 71.81 Favored 'General case' 0 CA--C 1.536 0.42 0 C-N-CA 125.126 1.37 . . . . 0.0 110.537 -177.786 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 76' ' ' ASN . . . . . . . . . . . . . 23.7 t-20 -75.14 -19.93 59.64 Favored 'General case' 0 N--CA 1.467 0.384 0 C-N-CA 125.309 1.444 . . . . 0.0 112.379 -176.05 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 77' ' ' GLU . . . . . . . . . . . . . 0.3 OUTLIER -92.48 -31.35 15.28 Favored 'General case' 0 CA--C 1.535 0.376 0 C-N-CA 124.501 1.12 . . . . 0.0 111.821 174.338 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 78' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -61.21 -25.48 67.08 Favored 'General case' 0 CA--C 1.534 0.347 0 C-N-CA 126.503 1.921 . . . . 0.0 111.787 -176.982 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 79' ' ' ASP . . . . . . . . . . . . . 20.2 m-20 -56.58 -43.44 80.03 Favored 'General case' 0 C--O 1.237 0.395 0 C-N-CA 125.549 1.54 . . . . 0.0 111.254 170.959 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 80' ' ' ASN . . . . . . . . . . . . . 49.1 m-20 -72.85 -32.07 65.21 Favored 'General case' 0 N--CA 1.453 -0.294 0 C-N-CA 119.288 -0.965 . . . . 0.0 110.261 -177.193 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 81' ' ' THR . . . . . . . . . . . . . 0.9 OUTLIER -58.04 -54.1 50.79 Favored 'General case' 0 N--CA 1.452 -0.367 0 CA-C-N 118.835 0.743 . . . . 0.0 110.264 172.567 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 82' ' ' ILE . . . . . . . . . . . . . 7.3 tp -65.06 -36.46 77.86 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.277 0 C-N-CA 119.77 -0.772 . . . . 0.0 110.143 -175.321 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 83' ' ' SER . . . . . . . . . . . . . 6.4 m -56.61 -51.62 67.96 Favored 'General case' 0 N--CA 1.449 -0.525 0 C-N-CA 122.974 0.51 . . . . 0.0 111.474 176.681 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 84' ' ' GLU . . . . . . . . . . . . . 3.3 mm-40 -56.75 -54.92 40.71 Favored 'General case' 0 N--CA 1.452 -0.355 0 C-N-CA 126.059 1.744 . . . . 0.0 110.083 176.414 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 85' ' ' MET . . . . . . . . . . . . . 87.8 mtp -60.95 -41.66 96.72 Favored 'General case' 0 C--N 1.341 0.233 0 CA-C-O 121.863 0.839 . . . . 0.0 108.762 -169.721 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 86' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -77.35 -20.57 54.64 Favored 'General case' 0 C--N 1.331 -0.223 0 O-C-N 121.361 -0.837 . . . . 0.0 112.407 -177.289 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 87' ' ' LYS . . . . . . . . . . . . . 5.4 tttm -72.66 -54.77 8.12 Favored 'General case' 0 N--CA 1.452 -0.364 0 N-CA-C 108.195 -1.039 . . . . 0.0 108.195 170.304 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 88' ' ' GLU . . . . . . . . . . . . . 15.4 pt-20 -73.95 -33.87 64.07 Favored 'General case' 0 CA--C 1.534 0.362 0 CA-C-O 118.667 -0.682 . . . . 0.0 111.918 -168.433 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 89' ' ' GLY . . . . . . . . . . . . . . . 120.33 87.4 1.01 Allowed Glycine 0 C--N 1.335 0.519 0 N-CA-C 108.616 -1.794 . . . . 0.0 108.616 178.509 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 90' ' ' ALA . . . . . 0.697 ' HB1' HD12 ' A' ' 101' ' ' LEU . . . -69.07 119.3 13.15 Favored 'General case' 0 N--CA 1.443 -0.823 0 N-CA-C 107.535 -1.283 . . . . 0.0 107.535 -173.26 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 91' ' ' GLN . . . . . . . . . . . . . 58.9 mm-40 -79.76 116.02 19.69 Favored 'General case' 0 N--CA 1.447 -0.579 0 N-CA-C 105.48 -2.044 . . . . 0.0 105.48 -177.083 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 92' ' ' VAL . . . . . . . . . . . . . 24.2 t -103.55 108.69 25.06 Favored 'Isoleucine or valine' 0 N--CA 1.448 -0.536 0 C-N-CA 127.422 2.289 . . . . 0.0 109.201 -168.787 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 93' ' ' ASP . . . . . . . . . . . . . 5.1 t0 -107.54 68.59 0.72 Allowed 'General case' 0 C--O 1.238 0.489 0 C-N-CA 126.508 1.923 . . . . 0.0 109.051 174.674 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 94' ' ' LEU . . . . . . . . . . . . . 1.7 tm? -75.55 109.93 9.52 Favored 'General case' 0 N--CA 1.452 -0.327 0 N-CA-C 106.882 -1.525 . . . . 0.0 106.882 168.944 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 95' ' ' THR . . . . . . . . . . . . . 7.7 t -89.52 -163.74 1.05 Allowed 'General case' 0 C--N 1.326 -0.42 0 C-N-CA 125.539 1.536 . . . . 0.0 108.387 175.766 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 96' ' ' ALA . . . . . . . . . . . . . . . -44.76 -40.87 6.41 Favored 'General case' 0 CA--C 1.54 0.584 0 C-N-CA 124.609 1.164 . . . . 0.0 113.791 -174.357 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 97' ' ' ASN . . . . . . . . . . . . . 6.2 p30 -162.91 14.52 0.07 Allowed 'General case' 0 N--CA 1.47 0.536 0 C-N-CA 124.681 1.193 . . . . 0.0 113.207 -173.752 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 98' ' ' GLN . . . . . . . . . . . . . 6.0 tt0 -128.83 130.42 46.91 Favored 'General case' 0 C--N 1.333 -0.143 0 N-CA-C 106.555 -1.646 . . . . 0.0 106.555 174.913 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 99' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -81.3 136.13 35.75 Favored 'General case' 0 C--N 1.327 -0.409 0 N-CA-C 107.17 -1.418 . . . . 0.0 107.17 169.465 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 100' ' ' THR . . . . . . . . . . . . . 0.3 OUTLIER -128.84 137.91 51.75 Favored 'General case' 0 N--CA 1.45 -0.456 0 N-CA-C 106.12 -1.807 . . . . 0.0 106.12 165.228 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 101' ' ' LEU . . . . . 0.697 HD12 ' HB1' ' A' ' 90' ' ' ALA . 4.5 mm? -106.63 157.33 17.77 Favored 'General case' 0 N--CA 1.449 -0.502 0 N-CA-C 107.861 -1.163 . . . . 0.0 107.861 164.753 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 102' ' ' ALA . . . . . . . . . . . . . . . -155.31 109.47 2.89 Favored 'General case' 0 C--N 1.329 -0.283 0 N-CA-C 108.321 -0.992 . . . . 0.0 108.321 159.06 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 103' ' ' THR . . . . . . . . . . . . . 0.5 OUTLIER -121.37 -172.66 2.46 Favored 'General case' 0 C--O 1.238 0.476 0 N-CA-C 108.608 -0.886 . . . . 0.0 108.608 -175.687 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 104' ' ' ALA . . . . . . . . . . . . . . . -53.09 -44.17 67.35 Favored 'General case' 0 N--CA 1.454 -0.26 0 O-C-N 121.102 -0.998 . . . . 0.0 110.202 168.728 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 105' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -59.57 -66.7 0.47 Allowed 'General case' 0 C--O 1.234 0.265 0 N-CA-C 113.277 0.843 . . . . 0.0 113.277 -173.758 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 106' ' ' GLN . . . . . . . . . . . . . 2.2 pt20 -166.22 -172.77 2.36 Favored 'General case' 0 CA--C 1.535 0.393 0 C-N-CA 127.114 2.165 . . . . 0.0 108.139 178.76 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 107' ' ' THR . . . . . . . . . . . . . 4.5 t -100.2 157.45 16.57 Favored 'General case' 0 C--O 1.24 0.57 0 C-N-CA 125.441 1.497 . . . . 0.0 108.186 163.267 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 108' ' ' LEU . . . . . . . . . . . . . 76.6 mt -146.95 141.56 26.62 Favored 'General case' 0 C--N 1.332 -0.173 0 C-N-CA 127.071 2.148 . . . . 0.0 105.968 176.757 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 109' ' ' THR . . . . . . . . . . . . . 27.9 m -130.14 126.5 37.67 Favored 'General case' 0 C--O 1.237 0.411 0 N-CA-C 107.959 -1.126 . . . . 0.0 107.959 -174.147 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 110' ' ' TYR . . . . . . . . . . . . . 12.4 m-85 -124.43 158.58 32.43 Favored 'General case' 0 CA--C 1.531 0.237 0 C-N-CA 124.215 1.006 . . . . 0.0 109.375 -176.04 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 111' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -108.75 145.32 35.31 Favored 'General case' 0 CA--C 1.516 -0.362 0 C-N-CA 124.14 0.976 . . . . 0.0 109.905 -178.931 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 112' ' ' LEU . . . . . . . . . . . . . 25.7 tp -75.61 58.56 1.07 Allowed 'General case' 0 CA--C 1.54 0.582 0 C-N-CA 124.816 1.246 . . . . 0.0 108.515 166.917 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 113' ' ' ALA . . . . . . . . . . . . . . . -78.94 64.5 3.89 Favored 'General case' 0 CA--C 1.529 0.163 0 O-C-N 120.534 -1.354 . . . . 0.0 108.102 170.66 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 114' ' ' ASP . . . . . . . . . . . . . 25.2 t0 -84.44 14.55 4.37 Favored 'General case' 0 N--CA 1.465 0.316 0 CA-C-O 122.04 0.924 . . . . 0.0 113.322 -161.526 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 115' ' ' LEU . . . . . . . . . . . . . 15.3 mt 61.07 15.31 6.09 Favored 'General case' 0 CA--C 1.532 0.282 0 C-N-CA 127.407 2.283 . . . . 0.0 112.186 -172.828 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 116' ' ' MET . . . . . . . . . . . . . 9.8 tpt -120.84 96.16 5.0 Favored 'General case' 0 N--CA 1.448 -0.538 0 N-CA-C 105.807 -1.923 . . . . 0.0 105.807 176.313 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 117' ' ' ASN . . . . . . . . . . . . . 86.1 m-20 . . . . . 0 C--O 1.236 0.379 0 N-CA-C 108.132 -1.062 . . . . 0.0 108.132 178.106 . . . . . . . . 0 0 . 1 . 002 nuclear build full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 48.5 ttp . . . . . 0 N--CA 1.454 -0.239 0 N-CA-C 109.253 -0.647 . . . . 0.0 109.253 . . . . . . . . . 0 0 . 1 . 002 nuclear build full ' A' A ' 2' ' ' VAL . . . . . . . . . . . . . 12.2 p -58.07 142.8 13.3 Favored 'Isoleucine or valine' 0 C--O 1.241 0.649 0 C-N-CA 124.197 0.999 . . . . 0.0 111.336 177.126 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 3' ' ' THR . . . . . 0.458 ' HB ' ' HD2' ' A' ' 4' ' ' PRO . 51.8 p -126.65 165.67 26.92 Favored Pre-proline 0 CA--C 1.535 0.371 0 C-N-CA 124.54 1.136 . . . . 0.0 110.223 179.467 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 4' ' ' PRO . . . . . 0.458 ' HD2' ' HB ' ' A' ' 3' ' ' THR . 45.2 Cg_endo -69.91 -34.45 14.05 Favored 'Trans proline' 0 CA--C 1.533 0.445 0 C-N-CA 122.672 2.248 . . . . 0.0 113.662 175.893 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 5' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -49.18 -59.97 3.2 Favored 'General case' 0 N--CA 1.477 0.88 0 C-N-CA 125.747 1.619 . . . . 0.0 110.121 -179.964 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 6' ' ' GLN . . . . . . . . . . . . . 8.8 pt20 -64.32 14.83 0.02 OUTLIER 'General case' 0 CA--C 1.542 0.64 0 C-N-CA 127.957 2.503 . . . . 0.0 114.789 176.946 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 7' ' ' LEU . . . . . . . . . . . . . 95.5 mt -132.77 -48.74 0.88 Allowed 'General case' 0 CA--C 1.518 -0.259 0 C-N-CA 124.758 1.223 . . . . 0.0 110.633 -175.734 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 8' ' ' GLN . . . . . . . . . . . . . 40.5 mt-30 -56.83 -5.76 0.27 Allowed 'General case' 0 CA--C 1.536 0.429 0 C-N-CA 126.024 1.73 . . . . 0.0 114.699 -175.725 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 9' ' ' HIS . . . . . . . . . . . . . 95.9 m-70 -125.11 0.63 7.87 Favored 'General case' 0 CA--C 1.532 0.27 0 CA-C-O 118.022 -0.99 . . . . 0.0 113.486 178.534 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 10' ' ' HIS . . . . . . . . . . . . . 98.2 m-70 -120.91 126.59 50.4 Favored 'General case' 0 C--O 1.234 0.253 0 CA-C-N 119.595 1.088 . . . . 0.0 111.919 -170.29 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 11' ' ' ARG . . . . . . . . . . . . . 32.8 ttt180 -70.4 154.38 41.96 Favored 'General case' 0 C--N 1.331 -0.212 0 C-N-CA 124.884 1.274 . . . . 0.0 109.06 162.929 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 12' ' ' PHE . . . . . . . . . . . . . 41.4 m-85 -130.83 165.83 22.15 Favored 'General case' 0 N--CA 1.444 -0.76 0 C-N-CA 125.727 1.611 . . . . 0.0 107.982 164.581 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 13' ' ' VAL . . . . . 0.501 ' HA ' ' HA ' ' A' ' 30' ' ' GLU . 7.3 p -128.86 145.83 35.11 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.436 0 O-C-N 120.924 -1.11 . . . . 0.0 108.562 174.495 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 14' ' ' LEU . . . . . . . . . . . . . 4.9 tp -77.86 86.93 4.08 Favored 'General case' 0 C--O 1.233 0.23 0 N-CA-C 107.452 -1.314 . . . . 0.0 107.452 176.838 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 15' ' ' GLU . . . . . 0.404 ' HG2' ' HE2' ' A' ' 111' ' ' LYS . 17.7 tp10 -70.49 -49.86 43.97 Favored 'General case' 0 C--N 1.323 -0.546 0 CA-C-N 115.718 -0.674 . . . . 0.0 109.455 -176.465 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 63.2 p -147.51 136.2 21.92 Favored 'General case' 0 N--CA 1.446 -0.642 0 CA-C-O 122.363 1.078 . . . . 0.0 111.386 176.408 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 17' ' ' VAL . . . . . . . . . . . . . 3.2 t -77.68 169.04 1.81 Allowed 'Isoleucine or valine' 0 C--O 1.238 0.486 0 C-N-CA 125.71 1.604 . . . . 0.0 107.355 174.324 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 18' ' ' ASN . . . . . . . . . . . . . 0.5 OUTLIER -51.23 -34.68 33.25 Favored 'General case' 0 CA--C 1.534 0.329 0 C-N-CA 123.469 0.707 . . . . 0.0 112.205 165.063 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . -93.01 -45.35 3.61 Favored Glycine 0 CA--C 1.527 0.788 0 CA-C-O 118.395 -1.225 . . . . 0.0 113.875 -170.892 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 13.9 mttt -160.28 166.09 16.39 Favored Pre-proline 0 N--CA 1.469 0.488 0 C-N-CA 126.145 1.778 . . . . 0.0 109.819 -173.261 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 21' ' ' PRO . . . . . . . . . . . . . 91.1 Cg_endo -63.5 -178.78 0.54 Allowed 'Trans proline' 0 CA--C 1.542 0.893 0 C-N-CA 122.718 2.279 . . . . 0.0 111.358 163.477 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 22' ' ' VAL . . . . . . . . . . . . . 4.0 t -131.59 154.74 40.93 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.377 0 C-N-CA 124.107 0.963 . . . . 0.0 108.445 172.881 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 23' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -148.63 112.91 5.25 Favored 'General case' 0 C--O 1.234 0.27 0 N-CA-C 105.791 -1.929 . . . . 0.0 105.791 170.832 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 24' ' ' SER . . . . . . . . . . . . . 15.3 m -121.33 48.94 1.58 Allowed 'General case' 0 N--CA 1.469 0.497 0 CA-C-N 119.505 1.048 . . . . 0.0 108.348 174.769 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 25' ' ' ASP . . . . . . . . . . . . . 38.4 t0 51.35 -83.77 0.01 OUTLIER 'General case' 0 N--CA 1.453 -0.308 0 C-N-CA 128.671 2.788 . . . . 0.0 110.852 -169.787 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 26' ' ' LYS . . . . . . . . . . . . . 32.6 tttm -130.5 -4.71 4.23 Favored 'General case' 0 CA--C 1.537 0.465 0 C-N-CA 125.698 1.599 . . . . 0.0 111.214 -172.121 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 27' ' ' ASN . . . . . . . . . . . . . 6.2 p30 -118.8 58.38 3.68 Favored Pre-proline 0 CA--C 1.545 0.753 0 C-N-CA 126.26 1.824 . . . . 0.0 112.885 177.735 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 28' ' ' PRO . . . . . . . . . . . . . 54.1 Cg_endo -71.09 168.07 24.3 Favored 'Trans proline' 0 CA--C 1.548 1.215 0 C-N-CA 123.72 2.947 . . . . 0.0 112.627 -176.6 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 29' ' ' PRO . . . . . . . . . . . . . 20.6 Cg_endo -73.2 63.71 4.3 Favored 'Trans proline' 0 C--N 1.355 0.873 0 C-N-CA 123.59 2.86 . . . . 0.0 113.525 179.067 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 30' ' ' GLU . . . . . 0.501 ' HA ' ' HA ' ' A' ' 13' ' ' VAL . 8.7 pt-20 -72.15 169.44 16.09 Favored 'General case' 0 CA--C 1.537 0.469 0 O-C-N 120.228 -1.545 . . . . 0.0 111.638 175.148 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 31' ' ' ILE . . . . . . . . . . . . . 16.6 tt -143.46 146.46 21.27 Favored 'Isoleucine or valine' 0 CA--C 1.529 0.166 0 N-CA-C 107.909 -1.145 . . . . 0.0 107.909 -179.39 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 32' ' ' SER . . . . . . . . . . . . . 14.7 p -137.48 157.26 46.94 Favored 'General case' 0 C--O 1.237 0.441 0 O-C-N 120.962 -1.086 . . . . 0.0 109.669 170.986 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 33' ' ' PHE . . . . . . . . . . . . . 86.5 m-85 -121.99 155.92 34.56 Favored 'General case' 0 N--CA 1.442 -0.857 0 N-CA-C 107.207 -1.405 . . . . 0.0 107.207 177.681 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 34' ' ' GLY . . . . . . . . . . . . . . . -149.87 -165.12 12.24 Favored Glycine 0 CA--C 1.516 0.12 0 N-CA-C 109.271 -1.532 . . . . 0.0 109.271 177.189 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 35' ' ' GLU . . . . . . . . . . . . . 0.2 OUTLIER -44.1 154.57 0.11 Allowed 'General case' 0 C--O 1.235 0.337 0 C-N-CA 126.745 2.018 . . . . 0.0 111.577 177.774 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 37.8 mtpt 55.92 13.92 1.24 Allowed 'General case' 0 CA--C 1.532 0.275 0 C-N-CA 124.778 1.231 . . . . 0.0 112.311 -171.659 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 37' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER 59.36 25.99 14.78 Favored 'General case' 0 CA--C 1.542 0.653 0 C-N-CA 124.872 1.269 . . . . 0.0 110.903 -175.135 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 38' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -61.86 164.54 6.27 Favored 'General case' 0 N--CA 1.444 -0.748 0 O-C-N 120.449 -1.407 . . . . 0.0 111.575 173.015 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 39' ' ' ILE . . . . . . . . . . . . . 10.6 mt -134.05 139.26 48.72 Favored 'Isoleucine or valine' 0 C--O 1.238 0.455 0 N-CA-C 106.732 -1.581 . . . . 0.0 106.732 -172.108 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 40' ' ' SER . . . . . . . . . . . . . 58.8 m -136.29 152.82 51.1 Favored 'General case' 0 C--O 1.234 0.266 0 N-CA-C 109.591 -0.522 . . . . 0.0 109.591 156.067 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 41' ' ' GLY . . . . . . . . . . . . . . . -164.98 -175.26 35.55 Favored Glycine 0 CA--C 1.527 0.835 0 C-N-CA 124.645 1.117 . . . . 0.0 110.323 172.532 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 42' ' ' SER . . . . . . . . . . . . . 22.1 p -151.27 87.43 1.39 Allowed 'General case' 0 N--CA 1.445 -0.713 0 C-N-CA 124.69 1.196 . . . . 0.0 110.02 177.737 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 43' ' ' MET . . . . . . . . . . . . . 6.2 mmt -61.11 -66.95 0.45 Allowed 'General case' 0 C--N 1.341 0.236 0 N-CA-C 108.455 -0.942 . . . . 0.0 108.455 169.601 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 44' ' ' CYS . . . . . 1.288 ' SG ' ' SG ' ' A' ' 70' ' ' CYS . 17.1 t -138.01 -57.04 0.67 Allowed 'General case' 0 N--CA 1.447 -0.586 0 N-CA-C 106.446 -1.687 . . . . 0.0 106.446 164.571 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 45' ' ' ASN . . . . . . . . . . . . . 5.8 m-80 -76.68 8.28 3.78 Favored 'General case' 0 N--CA 1.464 0.259 0 C-N-CA 127.4 2.28 . . . . 0.0 115.854 -168.394 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 46' ' ' ARG . . . . . . . . . . . . . 8.7 mtm180 53.37 160.24 0.01 OUTLIER 'General case' 0 CA--C 1.52 -0.176 0 C-N-CA 126.78 2.032 . . . . 0.0 112.362 -155.936 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 47' ' ' PHE . . . . . . . . . . . . . 48.8 p90 -159.32 153.1 23.01 Favored 'General case' 0 C--N 1.321 -0.657 0 CA-C-N 113.653 -1.612 . . . . 0.0 107.672 164.83 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 48' ' ' SER . . . . . . . . . . . . . 3.3 m -154.26 156.93 37.93 Favored 'General case' 0 N--CA 1.444 -0.754 0 C-N-CA 125.696 1.598 . . . . 0.0 106.823 176.391 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 49' ' ' GLY . . . . . . . . . . . . . . . 174.57 163.86 28.5 Favored Glycine 0 N--CA 1.448 -0.543 0 N-CA-C 111.193 -0.763 . . . . 0.0 111.193 167.994 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 50' ' ' GLU . . . . . . . . . . . . . 34.0 tt0 -64.66 100.12 0.36 Allowed 'General case' 0 N--CA 1.445 -0.685 0 C-N-CA 125.437 1.495 . . . . 0.0 108.985 171.985 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 51' ' ' GLY . . . . . . . . . . . . . . . -72.18 177.45 39.25 Favored Glycine 0 CA--C 1.527 0.79 0 N-CA-C 111.483 -0.647 . . . . 0.0 111.483 161.027 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 52' ' ' LYS . . . . . . . . . . . . . 16.6 tttp -162.77 151.24 14.38 Favored 'General case' 0 N--CA 1.455 -0.201 0 N-CA-C 106.985 -1.487 . . . . 0.0 106.985 171.281 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 53' ' ' LEU . . . . . . . . . . . . . 42.7 tp -146.9 119.36 8.45 Favored 'General case' 0 CA--C 1.517 -0.299 0 N-CA-C 107.436 -1.32 . . . . 0.0 107.436 173.808 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 2.1 t -157.64 14.63 0.23 Allowed 'General case' 0 CA--C 1.541 0.608 0 C-N-CA 123.158 0.583 . . . . 0.0 110.768 166.945 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 55' ' ' ASN . . . . . . . . . . . . . 18.2 p-10 -154.87 26.68 0.43 Allowed 'General case' 0 CA--C 1.537 0.446 0 C-N-CA 125.178 1.391 . . . . 0.0 111.528 -169.743 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 56' ' ' GLY . . . . . . . . . . . . . . . 63.62 17.08 59.69 Favored Glycine 0 CA--C 1.531 1.044 0 O-C-N 121.609 -0.682 . . . . 0.0 113.62 -179.605 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 57' ' ' GLU . . . . . . . . . . . . . 33.9 tt0 -129.74 151.12 50.67 Favored 'General case' 0 N--CA 1.451 -0.394 0 C-N-CA 125.633 1.573 . . . . 0.0 107.271 -174.24 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 58' ' ' LEU . . . . . . . . . . . . . 59.0 tp -131.6 107.91 9.17 Favored 'General case' 0 N--CA 1.455 -0.203 0 C-N-CA 125.717 1.607 . . . . 0.0 108.012 175.932 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 59' ' ' THR . . . . . . . . . . . . . 4.5 p -107.57 160.01 16.01 Favored 'General case' 0 CA--C 1.536 0.416 0 C-N-CA 125.726 1.611 . . . . 0.0 110.171 176.594 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 60' ' ' ALA . . . . . . . . . . . . . . . -110.14 102.37 11.08 Favored 'General case' 0 C--O 1.234 0.27 0 C-N-CA 124.851 1.26 . . . . 0.0 111.713 168.569 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 61' ' ' LYS . . . . . . . . . . . . . 0.3 OUTLIER -79.23 5.4 12.35 Favored 'General case' 0 CA--C 1.539 0.526 0 N-CA-C 112.755 0.65 . . . . 0.0 112.755 168.639 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 62' ' ' GLY . . . . . . . . . . . . . . . -167.91 48.68 0.24 Allowed Glycine 0 C--N 1.331 0.303 0 CA-C-N 121.384 1.902 . . . . 0.0 111.487 -177.567 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 63' ' ' LEU . . . . . . . . . . . . . 0.9 OUTLIER -61.29 140.03 58.05 Favored 'General case' 0 N--CA 1.45 -0.457 0 N-CA-C 108.351 -0.981 . . . . 0.0 108.351 171.438 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 64' ' ' ALA . . . . . . . . . . . . . . . -144.12 134.81 24.96 Favored 'General case' 0 N--CA 1.454 -0.25 0 N-CA-C 109.024 -0.732 . . . . 0.0 109.024 171.457 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 65' ' ' MET . . . . . . . . . . . . . 68.4 mtp -139.98 179.49 6.58 Favored 'General case' 0 C--O 1.24 0.604 0 C-N-CA 124.656 1.182 . . . . 0.0 110.094 -170.179 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 66' ' ' THR . . . . . . . . . . . . 0.282 3.3 p -120.4 -163.04 0.98 Allowed 'General case' 0 CA--C 1.551 0.992 0 C-N-CA 125.508 1.523 . . . . 0.0 112.671 -176.306 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 67' ' ' ARG . . . . . . . . . . . . . 17.7 mmt180 -130.15 62.25 1.57 Allowed 'General case' 0 N--CA 1.475 0.813 0 C-N-CA 126.6 1.96 . . . . 0.0 111.715 173.741 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 68' ' ' MET . . . . . . . . . . . . . 77.2 mtm -99.53 171.53 7.87 Favored 'General case' 0 N--CA 1.468 0.429 0 C-N-CA 125.837 1.655 . . . . 0.0 111.684 172.901 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 69' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -129.28 161.81 29.36 Favored 'General case' 0 C--O 1.237 0.402 0 C-N-CA 127.627 2.371 . . . . 0.0 108.489 -176.42 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 70' ' ' CYS . . . . . 1.288 ' SG ' ' SG ' ' A' ' 44' ' ' CYS . 66.2 m -145.74 13.08 1.32 Allowed 'General case' 0 N--CA 1.474 0.773 0 N-CA-C 116.585 2.069 . . . . 0.0 116.585 -170.125 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 71' ' ' ALA . . . . . . . . . . . . . . . 68.39 -28.04 0.15 Allowed 'General case' 0 N--CA 1.473 0.697 0 C-N-CA 127.741 2.416 . . . . 0.0 116.182 166.301 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 72' ' ' ASN . . . . . . . . . . . . . 1.1 t-20 -88.73 163.42 35.52 Favored Pre-proline 0 C--O 1.24 0.564 0 C-N-CA 127.235 2.214 . . . . 0.0 105.844 159.634 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 73' ' ' PRO . . . . . . . . . . . . . 24.6 Cg_endo -92.55 -19.68 0.6 Allowed 'Trans proline' 0 N--CA 1.451 -0.98 0 C-N-CA 121.596 1.531 . . . . 0.0 110.951 169.917 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 74' ' ' GLN . . . . . . . . . . . . . 63.3 tt0 -52.65 -62.62 1.53 Allowed 'General case' 0 C--N 1.343 0.312 0 C-N-CA 125.135 1.374 . . . . 0.0 110.586 -176.657 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 75' ' ' LEU . . . . . . . . . . . . . 19.9 mt -62.93 -28.0 69.76 Favored 'General case' 0 CA--C 1.538 0.481 0 C-N-CA 122.959 0.504 . . . . 0.0 110.451 -173.45 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 76' ' ' ASN . . . . . . . . . . . . . 2.0 t-20 -72.52 -34.64 67.73 Favored 'General case' 0 CA--C 1.532 0.27 0 C-N-CA 126.284 1.834 . . . . 0.0 111.811 -179.867 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 77' ' ' GLU . . . . . . . . . . . . . 1.1 mm-40 -78.99 -30.96 44.67 Favored 'General case' 0 C--O 1.234 0.24 0 C-N-CA 123.757 0.823 . . . . 0.0 110.694 172.451 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 78' ' ' LEU . . . . . . . . . . . . . 3.0 mp -62.68 -35.63 80.3 Favored 'General case' 0 N--CA 1.456 -0.155 0 C-N-CA 124.778 1.231 . . . . 0.0 110.442 -179.688 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 79' ' ' ASP . . . . . . . . . . . . . 74.2 m-20 -53.17 -47.55 68.7 Favored 'General case' 0 CA--C 1.517 -0.312 0 C-N-CA 124.207 1.003 . . . . 0.0 110.699 171.514 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 80' ' ' ASN . . . . . . . . . . . . . 37.4 m-20 -78.16 -35.08 49.26 Favored 'General case' 0 N--CA 1.452 -0.328 0 N-CA-C 108.801 -0.815 . . . . 0.0 108.801 -171.482 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 81' ' ' THR . . . . . . . . . . . . . 12.8 m -58.41 -56.22 24.88 Favored 'General case' 0 N--CA 1.445 -0.719 0 C-N-CA 123.814 0.846 . . . . 0.0 109.701 172.316 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 82' ' ' ILE . . . . . . . . . . . . . 10.2 tp -65.25 -34.35 69.91 Favored 'Isoleucine or valine' 0 C--N 1.34 0.195 0 CA-C-N 120.093 1.315 . . . . 0.0 110.905 -174.089 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 83' ' ' SER . . . . . . . . . . . . . 11.2 t -62.35 -54.25 43.13 Favored 'General case' 0 N--CA 1.446 -0.649 0 N-CA-C 109.249 -0.648 . . . . 0.0 109.249 -179.0 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 84' ' ' GLU . . . . . . . . . . . . . 4.5 mm-40 -57.56 -44.83 85.57 Favored 'General case' 0 N--CA 1.449 -0.484 0 C-N-CA 124.864 1.266 . . . . 0.0 110.127 174.99 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 85' ' ' MET . . . . . . . . . . . . . 95.4 mtp -73.02 -1.1 15.85 Favored 'General case' 0 CA--C 1.518 -0.284 0 CA-C-N 119.175 0.898 . . . . 0.0 112.665 -173.86 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 86' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -112.73 -16.19 12.82 Favored 'General case' 0 C--N 1.327 -0.398 0 CA-C-N 119.686 1.13 . . . . 0.0 110.786 170.941 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 87' ' ' LYS . . . . . . . . . . . . . 1.8 mptp? -79.3 -26.84 42.21 Favored 'General case' 0 N--CA 1.453 -0.286 0 CA-C-O 117.861 -1.066 . . . . 0.0 112.385 -173.578 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 88' ' ' GLU . . . . . . . . . . . . . 22.7 pt-20 -110.23 0.77 18.29 Favored 'General case' 0 CA--C 1.54 0.573 0 C-N-CA 124.977 1.311 . . . . 0.0 113.476 -170.778 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 89' ' ' GLY . . . . . . . . . . . . . . . 86.04 99.78 0.75 Allowed Glycine 0 C--N 1.338 0.679 0 C-N-CA 126.862 2.173 . . . . 0.0 110.256 -173.276 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 90' ' ' ALA . . . . . . . . . . . . . . . -71.87 139.68 48.95 Favored 'General case' 0 N--CA 1.465 0.309 0 N-CA-C 107.591 -1.263 . . . . 0.0 107.591 164.988 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 91' ' ' GLN . . . . . . . . . . . . . 78.1 mm-40 -74.17 145.89 43.87 Favored 'General case' 0 N--CA 1.445 -0.677 0 N-CA-C 105.771 -1.937 . . . . 0.0 105.771 158.359 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 92' ' ' VAL . . . . . . . . . . . . . 7.9 p -135.02 124.51 43.19 Favored 'Isoleucine or valine' 0 N--CA 1.449 -0.476 0 N-CA-C 106.645 -1.613 . . . . 0.0 106.645 -172.346 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 93' ' ' ASP . . . . . . . . . . . . . 4.1 m-20 -142.21 85.97 1.94 Allowed 'General case' 0 C--O 1.232 0.169 0 N-CA-C 107.893 -1.151 . . . . 0.0 107.893 -174.098 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 94' ' ' LEU . . . . . . . . . . . . . 42.7 tp -77.9 111.08 13.38 Favored 'General case' 0 N--CA 1.461 0.118 0 N-CA-C 107.474 -1.306 . . . . 0.0 107.474 169.891 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 95' ' ' THR . . . . . . . . . . . . . 8.9 t -77.73 -176.38 4.34 Favored 'General case' 0 CA--C 1.535 0.402 0 N-CA-C 109.292 -0.633 . . . . 0.0 109.292 165.258 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 96' ' ' ALA . . . . . . . . . . . . . . . -44.17 -41.1 5.49 Favored 'General case' 0 CA--C 1.532 0.27 0 C-N-CA 126.58 1.952 . . . . 0.0 113.053 -171.999 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 97' ' ' ASN . . . . . . . . . . . . . 12.9 p30 -161.41 70.25 0.35 Allowed 'General case' 0 N--CA 1.449 -0.516 0 C-N-CA 124.474 1.11 . . . . 0.0 108.174 168.532 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 98' ' ' GLN . . . . . . . . . . . . . 0.3 OUTLIER -170.25 135.31 1.28 Allowed 'General case' 0 N--CA 1.472 0.654 0 C-N-CA 125.836 1.654 . . . . 0.0 107.501 157.582 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 99' ' ' LEU . . . . . 0.699 HD22 ' CD2' ' A' ' 101' ' ' LEU . 0.5 OUTLIER -85.5 112.13 20.63 Favored 'General case' 0 N--CA 1.451 -0.383 0 C-N-CA 123.681 0.792 . . . . 0.0 109.736 174.775 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 100' ' ' THR . . . . . . . . . . . . . 53.4 m -89.42 115.66 27.03 Favored 'General case' 0 C--N 1.324 -0.504 0 N-CA-C 106.338 -1.727 . . . . 0.0 106.338 166.751 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 101' ' ' LEU . . . . . 0.699 ' CD2' HD22 ' A' ' 99' ' ' LEU . 1.7 mm? -109.7 141.67 41.95 Favored 'General case' 0 CA--C 1.507 -0.7 0 C-N-CA 124.656 1.182 . . . . 0.0 108.661 171.892 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 102' ' ' ALA . . . . . . . . . . . . . . . -145.0 143.55 30.56 Favored 'General case' 0 C--O 1.234 0.277 0 O-C-N 124.504 1.128 . . . . 0.0 110.351 178.573 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 103' ' ' THR . . . . . . . . . . . . . 0.6 OUTLIER -158.65 171.84 19.37 Favored 'General case' 0 N--CA 1.443 -0.818 0 C-N-CA 126.868 2.067 . . . . 0.0 108.278 174.35 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 104' ' ' ALA . . . . . . . . . . . . . . . -58.24 -35.39 71.65 Favored 'General case' 0 CA--C 1.533 0.326 0 O-C-N 121.34 -0.85 . . . . 0.0 111.275 178.117 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 105' ' ' LYS . . . . . . . . . . . . . 1.4 mmpt? -55.76 -72.58 0.07 Allowed 'General case' 0 CA--C 1.534 0.337 0 CA-C-O 118.424 -0.798 . . . . 0.0 113.005 170.992 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 106' ' ' GLN . . . . . . . . . . . . . 3.0 pt20 -159.8 -165.12 1.45 Allowed 'General case' 0 CA--C 1.536 0.41 0 C-N-CA 124.215 1.006 . . . . 0.0 110.129 -174.301 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 107' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -134.26 134.22 41.7 Favored 'General case' 0 CA--C 1.537 0.449 0 C-N-CA 126.564 1.945 . . . . 0.0 106.445 -179.5 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 108' ' ' LEU . . . . . . . . . . . . . 3.8 mm? -112.14 156.65 21.93 Favored 'General case' 0 C--O 1.235 0.315 0 C-N-CA 124.867 1.267 . . . . 0.0 109.065 174.585 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 109' ' ' THR . . . . . . . . . . . . . 3.3 m -127.52 87.77 2.68 Favored 'General case' 0 C--O 1.237 0.408 0 N-CA-C 105.946 -1.872 . . . . 0.0 105.946 -177.097 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 110' ' ' TYR . . . . . . . . . . . . . 91.4 m-85 -91.54 139.01 31.12 Favored 'General case' 0 CA--C 1.531 0.217 0 N-CA-C 109.42 -0.585 . . . . 0.0 109.42 -175.344 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 111' ' ' LYS . . . . . 0.404 ' HE2' ' HG2' ' A' ' 15' ' ' GLU . 2.5 tppt? -94.61 141.69 28.32 Favored 'General case' 0 N--CA 1.464 0.234 0 C-N-CA 123.733 0.813 . . . . 0.0 108.894 -178.47 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 112' ' ' LEU . . . . . . . . . . . . . 19.8 tp -75.07 49.67 0.45 Allowed 'General case' 0 CA--C 1.544 0.713 0 C-N-CA 126.572 1.949 . . . . 0.0 110.078 173.48 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 113' ' ' ALA . . . . . . . . . . . . . . . -84.25 78.46 9.78 Favored 'General case' 0 C--O 1.234 0.261 0 O-C-N 119.771 -1.83 . . . . 0.0 108.709 177.366 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 114' ' ' ASP . . . . . . . . . . . . . 1.9 p-10 -102.26 15.38 29.31 Favored 'General case' 0 C--N 1.328 -0.341 0 C-N-CA 124.098 0.959 . . . . 0.0 113.231 -170.759 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 115' ' ' LEU . . . . . . . . . . . . . 33.2 mt 65.9 4.91 3.17 Favored 'General case' 0 N--CA 1.467 0.397 0 C-N-CA 127.956 2.503 . . . . 0.0 114.229 177.005 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 116' ' ' MET . . . . . . . . . . . . . 7.8 tpt -97.21 93.47 6.55 Favored 'General case' 0 N--CA 1.45 -0.433 0 N-CA-C 107.085 -1.45 . . . . 0.0 107.085 179.618 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 117' ' ' ASN . . . . . . . . . . . . . 19.1 m-20 . . . . . 0 N--CA 1.467 0.412 0 O-C-N 121.581 -0.7 . . . . 0.0 110.783 -179.745 . . . . . . . . 0 0 . 1 . 003 nuclear build full ' A' A ' 1' ' ' MET . . . . . 0.413 ' O ' HG12 ' A' ' 2' ' ' VAL . 0.0 OUTLIER . . . . . 0 C--O 1.234 0.239 0 N-CA-C 114.106 1.15 . . . . 0.0 114.106 . . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 2' ' ' VAL . . . . . 0.413 HG12 ' O ' ' A' ' 1' ' ' MET 0.267 10.0 p 54.68 165.7 0.0 OUTLIER 'Isoleucine or valine' 0 CA--C 1.547 0.857 0 C-N-CA 129.588 3.155 . . . . 0.0 111.705 -170.223 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 3' ' ' THR . . . . . . . . . . . . . 25.3 p -130.01 155.77 80.14 Favored Pre-proline 0 CA--C 1.533 0.307 0 O-C-N 119.628 -1.92 . . . . 0.0 109.774 170.942 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 4' ' ' PRO . . . . . . . . . . . . . 58.2 Cg_endo -62.28 -33.11 81.66 Favored 'Trans proline' 0 C--N 1.345 0.386 0 C-N-CA 124.139 3.226 . . . . 0.0 112.221 178.217 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 5' ' ' GLU . . . . . . . . . . . . . 11.8 tt0 -51.68 -36.29 45.89 Favored 'General case' 0 C--N 1.318 -0.778 0 C-N-CA 125.2 1.4 . . . . 0.0 112.197 171.343 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 6' ' ' GLN . . . . . . . . . . . . . 26.4 mt-30 -73.04 10.67 0.86 Allowed 'General case' 0 CA--C 1.545 0.783 0 C-N-CA 123.7 0.8 . . . . 0.0 112.265 173.725 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 7' ' ' LEU . . . . . 0.52 HD22 ' CE2' ' A' ' 33' ' ' PHE . 97.7 mt -136.54 -50.61 0.68 Allowed 'General case' 0 C--O 1.223 -0.335 0 C-N-CA 125.103 1.361 . . . . 0.0 112.56 -172.503 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 8' ' ' GLN . . . . . . . . . . . . . 1.8 mt-30 -53.01 -8.32 0.1 Allowed 'General case' 0 N--CA 1.481 1.106 0 C-N-CA 126.163 1.785 . . . . 0.0 115.748 -174.993 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 9' ' ' HIS . . . . . . . . . . . . . 98.1 m-70 -131.09 7.14 4.63 Favored 'General case' 0 CA--C 1.537 0.48 0 C-N-CA 125.017 1.327 . . . . 0.0 112.763 177.581 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 10' ' ' HIS . . . . . . . . . . . . . 95.1 m-70 -130.57 116.8 18.64 Favored 'General case' 0 C--O 1.233 0.212 0 C-N-CA 125.247 1.419 . . . . 0.0 110.464 -169.537 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 11' ' ' ARG . . . . . . . . . . . . . 32.3 ttm-85 -70.15 155.12 41.08 Favored 'General case' 0 CA--C 1.518 -0.263 0 C-N-CA 124.406 1.082 . . . . 0.0 108.64 169.656 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 12' ' ' PHE . . . . . . . . . . . . . 74.9 m-85 -139.06 153.87 48.12 Favored 'General case' 0 CA--C 1.501 -0.923 0 CA-C-O 122.732 1.253 . . . . 0.0 109.233 163.809 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 13' ' ' VAL . . . . . . . . . . . . . 0.0 OUTLIER -130.3 135.13 61.37 Favored 'Isoleucine or valine' 0 CA--C 1.494 -1.187 0 CA-C-N 113.286 -1.779 . . . . 0.0 114.99 -173.81 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 14' ' ' LEU . . . . . . . . . . . . . 2.2 tt -65.09 110.84 2.65 Favored 'General case' 0 CA--C 1.497 -1.091 0 O-C-N 126.135 2.147 . . . . 0.0 109.135 -173.144 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 0.9 OUTLIER -94.3 -52.46 4.34 Favored 'General case' 0 N--CA 1.426 -1.665 0 O-C-N 125.576 1.797 . . . . 0.0 108.446 -168.913 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 16' ' ' SER . . . . . 0.448 ' HA ' ' HA ' ' A' ' 21' ' ' PRO . 87.1 p -139.94 150.41 44.5 Favored 'General case' 0 N--CA 1.444 -0.738 0 CA-C-N 115.523 -0.762 . . . . 0.0 110.569 166.536 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 17' ' ' VAL . . . . . 0.55 HG12 ' H ' ' A' ' 18' ' ' ASN . 2.7 t -83.8 178.35 0.55 Allowed 'Isoleucine or valine' 0 N--CA 1.443 -0.779 0 N-CA-C 107.251 -1.389 . . . . 0.0 107.251 176.334 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 18' ' ' ASN . . . . . 0.55 ' H ' HG12 ' A' ' 17' ' ' VAL . 0.0 OUTLIER -50.44 -28.65 8.63 Favored 'General case' 0 N--CA 1.464 0.273 0 N-CA-C 114.633 1.346 . . . . 0.0 114.633 -178.812 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . -104.31 -76.96 1.13 Allowed Glycine 0 N--CA 1.445 -0.712 0 N-CA-C 109.652 -1.379 . . . . 0.0 109.652 171.167 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 16.3 mttt -125.07 165.73 24.28 Favored Pre-proline 0 N--CA 1.466 0.345 0 C-N-CA 124.702 1.201 . . . . 0.0 112.318 -167.473 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 21' ' ' PRO . . . . . 0.448 ' HA ' ' HA ' ' A' ' 16' ' ' SER . 56.1 Cg_endo -61.8 167.85 9.59 Favored 'Trans proline' 0 N--CA 1.458 -0.617 0 C-N-CA 123.607 2.871 . . . . 0.0 113.142 170.126 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 22' ' ' VAL . . . . . . . . . . . . . 7.9 p -141.1 157.47 22.52 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.357 0 C-N-CA 127.733 2.413 . . . . 0.0 105.731 -178.419 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 23' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -145.89 91.82 2.13 Favored 'General case' 0 C--O 1.236 0.38 0 N-CA-C 108.571 -0.9 . . . . 0.0 108.571 176.539 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 24' ' ' SER . . . . . . . . . . . . . 61.1 m -77.64 49.2 0.73 Allowed 'General case' 0 CA--C 1.533 0.29 0 C-N-CA 125.284 1.434 . . . . 0.0 110.271 178.467 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 25' ' ' ASP . . . . . . . . . . . . . 0.7 OUTLIER 56.8 -84.46 0.02 OUTLIER 'General case' 0 CA--C 1.514 -0.408 0 C-N-CA 127.728 2.411 . . . . 0.0 110.536 -169.602 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 26' ' ' LYS . . . . . . . . . . . . . 35.5 tttt -142.74 3.91 1.47 Allowed 'General case' 0 C--N 1.325 -0.483 0 C-N-CA 127.957 2.503 . . . . 0.0 110.29 -168.342 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 27' ' ' ASN . . . . . . . . . . . . . 70.6 m-80 -122.05 62.98 15.77 Favored Pre-proline 0 N--CA 1.453 -0.281 0 C-N-CA 127.156 2.182 . . . . 0.0 107.207 -173.165 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 28' ' ' PRO . . . . . . . . . . . . . 65.7 Cg_endo -64.54 159.14 46.06 Favored 'Trans proline' 0 C--O 1.24 0.622 0 C-N-CA 122.615 2.21 . . . . 0.0 110.864 -172.657 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 29' ' ' PRO . . . . . . . . . . . . . 28.0 Cg_endo -71.99 63.99 3.31 Favored 'Trans proline' 0 N--CA 1.456 -0.682 0 C-N-CA 122.829 2.352 . . . . 0.0 110.048 166.818 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 30' ' ' GLU . . . . . . . . . . . . . 1.6 pt-20 -72.09 166.23 22.71 Favored 'General case' 0 CA--C 1.542 0.664 0 N-CA-C 108.31 -0.996 . . . . 0.0 108.31 177.439 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 31' ' ' ILE . . . . . . . . . . . . . 10.6 tt -138.31 150.66 24.45 Favored 'Isoleucine or valine' 0 N--CA 1.445 -0.711 0 N-CA-C 105.627 -1.99 . . . . 0.0 105.627 172.789 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 32' ' ' SER . . . . . . . . . . . . . 78.0 p -144.97 174.3 11.14 Favored 'General case' 0 N--CA 1.432 -1.359 0 CA-C-O 122.691 1.234 . . . . 0.0 108.907 165.919 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 33' ' ' PHE . . . . . 0.52 ' CE2' HD22 ' A' ' 7' ' ' LEU . 77.0 m-85 -136.31 164.43 28.11 Favored 'General case' 0 N--CA 1.434 -1.246 0 N-CA-C 106.372 -1.714 . . . . 0.0 106.372 -173.371 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 34' ' ' GLY . . . . . . . . . . . . . . . 165.08 -168.83 39.42 Favored Glycine 0 N--CA 1.445 -0.765 0 N-CA-C 110.073 -1.211 . . . . 0.0 110.073 176.918 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 35' ' ' GLU . . . . . . . . . . . . . 3.4 mt-10 63.69 -86.14 0.02 OUTLIER 'General case' 0 C--N 1.331 -0.202 0 C-N-CA 125.813 1.645 . . . . 0.0 110.064 -178.396 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 29.7 mtpt -154.42 72.31 0.86 Allowed 'General case' 0 N--CA 1.44 -0.965 0 C-N-CA 126.926 2.09 . . . . 0.0 110.67 -176.277 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 37' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER 55.72 26.68 9.69 Favored 'General case' 0 CA--C 1.539 0.543 0 C-N-CA 123.998 0.919 . . . . 0.0 109.428 -178.036 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 38' ' ' MET . . . . . . . . . . . . . 10.4 mtp -73.82 164.89 26.04 Favored 'General case' 0 N--CA 1.448 -0.557 0 N-CA-C 108.246 -1.02 . . . . 0.0 108.246 172.279 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 39' ' ' ILE . . . . . . . . . . . . . 34.1 mt -135.93 134.4 50.85 Favored 'Isoleucine or valine' 0 C--O 1.235 0.323 0 N-CA-C 108.163 -1.051 . . . . 0.0 108.163 -178.428 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 40' ' ' SER . . . . . . . . . . . . . 34.5 t -142.02 144.83 33.83 Favored 'General case' 0 CA--C 1.536 0.405 0 C-N-CA 125.051 1.34 . . . . 0.0 108.824 177.377 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 41' ' ' GLY . . . . . . . . . . . . . . . -177.64 -176.35 45.6 Favored Glycine 0 CA--C 1.528 0.845 0 N-CA-C 111.333 -0.707 . . . . 0.0 111.333 177.98 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 42' ' ' SER . . . . . . . . . . . . . 34.0 p -143.81 80.3 1.65 Allowed 'General case' 0 CA--C 1.538 0.497 0 C-N-CA 123.007 0.523 . . . . 0.0 111.829 -171.89 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 43' ' ' MET . . . . . . . . . . . . . 3.1 mmt -63.79 -59.75 4.16 Favored 'General case' 0 N--CA 1.472 0.662 0 O-C-N 121.107 -0.996 . . . . 0.0 109.918 173.76 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 44' ' ' CYS . . . . . 1.288 ' SG ' ' SG ' ' A' ' 70' ' ' CYS . 41.9 t -129.06 -66.0 0.84 Allowed 'General case' 0 N--CA 1.451 -0.383 0 N-CA-C 108.156 -1.053 . . . . 0.0 108.156 151.298 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 45' ' ' ASN . . . . . . . . . . . . . 0.6 OUTLIER -87.84 19.78 3.36 Favored 'General case' 0 C--N 1.33 -0.259 0 N-CA-C 114.215 1.191 . . . . 0.0 114.215 -152.242 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 46' ' ' ARG . . . . . . . . . . . . . 17.4 mmm-85 57.46 162.74 0.03 OUTLIER 'General case' 0 CA--C 1.52 -0.178 0 C-N-CA 128.823 2.849 . . . . 0.0 112.025 -158.385 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 47' ' ' PHE . . . . . . . . . . . . . 53.9 p90 -158.28 162.4 37.77 Favored 'General case' 0 C--O 1.242 0.678 0 C-N-CA 125.513 1.525 . . . . 0.0 107.163 172.361 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 48' ' ' SER . . . . . . . . . . . . . 2.5 p -167.87 142.24 3.55 Favored 'General case' 0 C--O 1.236 0.381 0 C-N-CA 123.747 0.819 . . . . 0.0 109.073 -178.01 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 49' ' ' GLY . . . . . . . . . . . . . . . -171.12 169.63 42.62 Favored Glycine 0 C--N 1.337 0.633 0 CA-C-N 119.979 1.263 . . . . 0.0 110.648 -177.661 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 50' ' ' GLU . . . . . . . . . . . . . 36.7 mt-10 -83.01 102.55 11.83 Favored 'General case' 0 N--CA 1.446 -0.632 0 N-CA-C 106.412 -1.699 . . . . 0.0 106.412 177.767 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 51' ' ' GLY . . . . . . . . . . . . . . . -64.16 167.08 27.8 Favored Glycine 0 CA--C 1.528 0.85 0 CA-C-O 122.705 1.169 . . . . 0.0 112.859 165.312 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 52' ' ' LYS . . . . . . . . . . . . . 60.6 tttm -152.97 140.36 19.62 Favored 'General case' 0 C--N 1.331 -0.232 0 N-CA-C 105.543 -2.021 . . . . 0.0 105.543 164.538 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 53' ' ' LEU . . . . . . . . . . . . . 15.2 tp -142.37 133.23 25.65 Favored 'General case' 0 CA--C 1.52 -0.173 0 C-N-CA 123.968 0.907 . . . . 0.0 108.745 179.09 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER -149.52 -38.62 0.15 Allowed 'General case' 0 CA--C 1.541 0.616 0 C-N-CA 125.54 1.536 . . . . 0.0 110.144 177.489 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 55' ' ' ASN . . . . . . . . . . . . . 2.6 t30 -124.38 7.0 8.36 Favored 'General case' 0 N--CA 1.471 0.583 0 N-CA-C 115.49 1.663 . . . . 0.0 115.49 -157.115 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 56' ' ' GLY . . . . . . . . . . . . . . . 90.22 13.16 60.67 Favored Glycine 0 N--CA 1.468 0.769 0 O-C-N 121.185 -0.947 . . . . 0.0 112.148 -166.013 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 57' ' ' GLU . . . . . . . . . . . . . 42.3 tt0 -130.16 144.4 51.34 Favored 'General case' 0 N--CA 1.446 -0.663 0 C-N-CA 124.652 1.181 . . . . 0.0 109.036 179.326 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 58' ' ' LEU . . . . . 0.435 ' HB2' HG21 ' A' ' 92' ' ' VAL . 5.1 tp -127.99 159.11 36.02 Favored 'General case' 0 N--CA 1.447 -0.618 0 C-N-CA 126.376 1.87 . . . . 0.0 108.788 178.878 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 59' ' ' THR . . . . . . . . . . . . . 0.7 OUTLIER -141.61 174.98 10.05 Favored 'General case' 0 C--N 1.321 -0.649 0 C-N-CA 125.936 1.695 . . . . 0.0 106.988 171.201 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 60' ' ' ALA . . . . . . . . . . . . . . . -134.39 99.91 4.51 Favored 'General case' 0 CA--C 1.516 -0.337 0 N-CA-C 108.043 -1.095 . . . . 0.0 108.043 160.085 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 61' ' ' LYS . . . . . 0.423 ' HE2' ' N ' ' A' ' 62' ' ' GLY . 0.2 OUTLIER -55.74 123.19 13.32 Favored 'General case' 0 C--O 1.234 0.27 0 N-CA-C 107.06 -1.459 . . . . 0.0 107.06 172.017 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 62' ' ' GLY . . . . . 0.423 ' N ' ' HE2' ' A' ' 61' ' ' LYS . . . 96.23 -59.67 1.37 Allowed Glycine 0 CA--C 1.525 0.664 0 C-N-CA 124.981 1.276 . . . . 0.0 111.586 166.109 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 63' ' ' LEU . . . . . 0.439 HD22 ' HA ' ' A' ' 83' ' ' SER . 0.5 OUTLIER 47.07 90.69 0.02 OUTLIER 'General case' 0 CA--C 1.537 0.447 0 C-N-CA 129.187 2.995 . . . . 0.0 114.425 -178.003 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 64' ' ' ALA . . . . . . . . . . . . . . . -88.48 104.53 16.89 Favored 'General case' 0 C--O 1.237 0.411 0 C-N-CA 124.126 0.97 . . . . 0.0 111.026 -178.462 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 65' ' ' MET . . . . . . . . . . . . . 54.8 mtp -97.48 176.47 5.85 Favored 'General case' 0 N--CA 1.471 0.599 0 C-N-CA 123.622 0.769 . . . . 0.0 110.188 172.487 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 66' ' ' THR . . . . . . . . . . . . 0.348 1.5 p -113.77 -164.92 0.96 Allowed 'General case' 0 CA--C 1.556 1.193 0 C-N-CA 124.101 0.96 . . . . 0.0 110.171 178.214 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 67' ' ' ARG . . . . . . . . . . . . . 16.2 mtt180 -136.52 30.94 2.86 Favored 'General case' 0 N--CA 1.489 1.476 0 CA-C-N 120.816 1.644 . . . . 0.0 114.429 -170.808 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 68' ' ' MET . . . . . . . . . . . . . 44.1 mtm -77.81 176.71 8.8 Favored 'General case' 0 CA--C 1.537 0.471 0 O-C-N 120.265 -1.522 . . . . 0.0 111.206 176.646 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 69' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -86.01 170.17 12.52 Favored 'General case' 0 C--O 1.243 0.758 0 C-N-CA 128.693 2.797 . . . . 0.0 108.479 165.842 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 70' ' ' CYS . . . . . 1.288 ' SG ' ' SG ' ' A' ' 44' ' ' CYS . 0.1 OUTLIER -110.02 -177.86 3.37 Favored 'General case' 0 N--CA 1.454 -0.267 0 C-N-CA 125.847 1.659 . . . . 0.0 112.83 -177.869 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 71' ' ' ALA . . . . . . . . . . . . . . . -104.24 -12.45 16.65 Favored 'General case' 0 N--CA 1.466 0.328 0 N-CA-C 112.163 0.431 . . . . 0.0 112.163 165.5 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 72' ' ' ASN . . . . . . . . . . . . . 52.7 t30 -156.07 143.12 13.64 Favored Pre-proline 0 N--CA 1.466 0.357 0 N-CA-C 107.503 -1.295 . . . . 0.0 107.503 -174.353 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 73' ' ' PRO . . . . . . . . . . . . . 38.9 Cg_endo -75.67 -33.52 3.9 Favored 'Trans proline' 0 C--N 1.345 0.342 0 C-N-CA 121.736 1.624 . . . . 0.0 111.447 -167.627 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 74' ' ' GLN . . . . . . . . . . . . . 20.7 tt0 -57.92 -32.91 68.23 Favored 'General case' 0 CA--C 1.535 0.377 0 C-N-CA 124.638 1.175 . . . . 0.0 112.065 177.952 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 75' ' ' LEU . . . . . 0.52 ' HB2' ' SG ' ' A' ' 70' ' ' CYS . 82.3 mt -70.03 -43.34 71.5 Favored 'General case' 0 N--CA 1.465 0.301 0 O-C-N 121.83 -0.544 . . . . 0.0 110.129 172.648 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 76' ' ' ASN . . . . . . . . . . . . . 3.3 t-20 -68.24 -8.02 35.59 Favored 'General case' 0 CA--C 1.532 0.278 0 C-N-CA 125.681 1.592 . . . . 0.0 112.017 -178.913 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 77' ' ' GLU . . . . . . . . . . . . . 32.8 tt0 -102.46 -48.13 4.25 Favored 'General case' 0 N--CA 1.45 -0.459 0 C-N-CA 127.227 2.211 . . . . 0.0 109.295 178.39 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 78' ' ' LEU . . . . . 0.469 HD21 HG13 ' A' ' 17' ' ' VAL . 0.9 OUTLIER -58.02 -25.04 60.61 Favored 'General case' 0 N--CA 1.468 0.443 0 C-N-CA 124.083 0.953 . . . . 0.0 112.762 171.095 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 79' ' ' ASP . . . . . . . . . . . . . 13.4 t70 -46.0 -54.98 7.47 Favored 'General case' 0 N--CA 1.443 -0.777 0 C-N-CA 126.464 1.906 . . . . 0.0 111.236 166.952 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 80' ' ' ASN . . . . . . . . . . . . . 76.8 m-20 -78.77 -34.44 45.62 Favored 'General case' 0 N--CA 1.453 -0.312 0 CA-C-O 118.743 -0.646 . . . . 0.0 109.499 -174.093 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 81' ' ' THR . . . . . . . . . . . . . 13.7 m -49.72 -59.32 3.92 Favored 'General case' 0 CA--C 1.535 0.391 0 C-N-CA 123.898 0.879 . . . . 0.0 110.334 171.088 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 82' ' ' ILE . . . . . . . . . . . . . 7.8 tp -63.49 -35.79 73.82 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.393 0 CA-C-N 119.608 1.095 . . . . 0.0 110.667 -174.291 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 83' ' ' SER . . . . . 0.439 ' HA ' HD22 ' A' ' 63' ' ' LEU . 0.5 OUTLIER -66.78 -12.56 59.29 Favored 'General case' 0 C--O 1.234 0.277 0 C-N-CA 127.345 2.258 . . . . 0.0 113.939 179.128 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 84' ' ' GLU . . . . . . . . . . . . . 89.3 tt0 -114.79 -22.47 9.65 Favored 'General case' 0 C--N 1.324 -0.512 0 C-N-CA 124.888 1.275 . . . . 0.0 111.351 179.902 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 85' ' ' MET . . . . . . . . . . . . . 87.9 mtp -73.04 -55.17 6.88 Favored 'General case' 0 C--O 1.23 0.056 0 CA-C-O 122.682 1.23 . . . . 0.0 108.81 178.375 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 86' ' ' LEU . . . . . . . . . . . . . 1.4 mm? -73.92 -17.56 61.01 Favored 'General case' 0 N--CA 1.454 -0.233 0 C-N-CA 124.979 1.312 . . . . 0.0 111.654 -167.791 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 87' ' ' LYS . . . . . . . . . . . . . 25.1 tttt -72.14 -48.79 41.02 Favored 'General case' 0 N--CA 1.447 -0.603 0 C-N-CA 124.201 1.0 . . . . 0.0 109.156 177.667 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 88' ' ' GLU . . . . . . . . . . . . . 1.9 mm-40 -69.84 -62.9 1.2 Allowed 'General case' 0 N--CA 1.448 -0.548 0 O-C-N 124.254 0.971 . . . . 0.0 108.426 -178.806 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 89' ' ' GLY . . . . . . . . . . . . . . . 144.72 110.27 0.69 Allowed Glycine 0 C--N 1.336 0.557 0 N-CA-C 109.179 -1.568 . . . . 0.0 109.179 -176.276 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 90' ' ' ALA . . . . . . . . . . . . . . . -91.45 142.99 27.08 Favored 'General case' 0 C--N 1.333 -0.119 0 C-N-CA 124.061 0.945 . . . . 0.0 109.06 -178.807 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 91' ' ' GLN . . . . . . . . . . . . . 6.8 mm-40 -74.49 142.33 44.85 Favored 'General case' 0 N--CA 1.443 -0.824 0 N-CA-C 105.752 -1.944 . . . . 0.0 105.752 161.098 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 92' ' ' VAL . . . . . 0.435 HG21 ' HB2' ' A' ' 58' ' ' LEU . 26.6 t -137.45 107.71 5.17 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.491 0 N-CA-C 105.068 -2.197 . . . . 0.0 105.068 -170.761 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 93' ' ' ASP . . . . . . . . . . . . . 2.1 t0 -127.19 97.61 4.99 Favored 'General case' 0 N--CA 1.448 -0.527 0 N-CA-C 108.085 -1.08 . . . . 0.0 108.085 -157.148 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 94' ' ' LEU . . . . . . . . . . . . . 55.9 tp -98.24 104.15 16.16 Favored 'General case' 0 CA--C 1.511 -0.535 0 CA-C-O 122.046 0.927 . . . . 0.0 109.247 -175.045 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 95' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -65.67 174.19 2.43 Favored 'General case' 0 C--N 1.319 -0.726 0 CA-C-N 113.633 -1.621 . . . . 0.0 109.569 167.605 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 96' ' ' ALA . . . . . . . . . . . . . . . -48.51 -33.24 9.18 Favored 'General case' 0 CA--C 1.539 0.55 0 O-C-N 120.826 -1.172 . . . . 0.0 113.856 -172.565 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 97' ' ' ASN . . . . . . . . . . . . . 23.8 p30 -151.41 17.94 0.73 Allowed 'General case' 0 CA--C 1.539 0.526 0 C-N-CA 125.145 1.378 . . . . 0.0 113.559 172.324 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 98' ' ' GLN . . . . . . . . . . . . . 21.5 tt0 -137.32 121.04 17.39 Favored 'General case' 0 N--CA 1.461 0.119 0 O-C-N 120.821 -1.174 . . . . 0.0 110.654 177.323 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 99' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -69.19 140.86 54.62 Favored 'General case' 0 N--CA 1.451 -0.408 0 C-N-CA 126.019 1.728 . . . . 0.0 109.183 169.479 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 100' ' ' THR . . . . . . . . . . . . . 2.5 m -133.65 130.65 38.55 Favored 'General case' 0 C--N 1.323 -0.567 0 N-CA-C 106.795 -1.558 . . . . 0.0 106.795 167.789 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 101' ' ' LEU . . . . . . . . . . . . . 2.6 mp -108.97 158.67 17.48 Favored 'General case' 0 CA--C 1.509 -0.609 0 C-N-CA 125.209 1.404 . . . . 0.0 110.458 174.856 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 102' ' ' ALA . . . . . . . . . . . . . . . -152.18 158.56 43.07 Favored 'General case' 0 C--N 1.327 -0.385 0 C-N-CA 124.559 1.144 . . . . 0.0 108.228 164.558 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 103' ' ' THR . . . . . 0.425 HG22 ' H ' ' A' ' 104' ' ' ALA . 1.3 m -157.24 -172.08 3.87 Favored 'General case' 0 N--CA 1.441 -0.916 0 C-N-CA 127.484 2.314 . . . . 0.0 105.659 167.141 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 104' ' ' ALA . . . . . 0.425 ' H ' HG22 ' A' ' 103' ' ' THR . . . -62.3 -35.48 79.17 Favored 'General case' 0 C--N 1.34 0.196 0 CA-C-N 119.918 1.235 . . . . 0.0 111.536 168.623 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 105' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -59.74 -79.83 0.03 OUTLIER 'General case' 0 C--N 1.339 0.123 0 C-N-CA 123.59 0.756 . . . . 0.0 110.712 -178.03 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 106' ' ' GLN . . . . . . . . . . . . . 84.6 mt-30 -151.53 -176.88 5.78 Favored 'General case' 0 CA--C 1.536 0.424 0 C-N-CA 125.89 1.676 . . . . 0.0 107.301 -169.672 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 107' ' ' THR . . . . . . . . . . . . . 0.1 OUTLIER -138.56 134.47 33.9 Favored 'General case' 0 N--CA 1.453 -0.314 0 C-N-CA 125.943 1.697 . . . . 0.0 106.571 -177.222 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 108' ' ' LEU . . . . . . . . . . . . . 1.5 mm? -125.75 158.48 34.81 Favored 'General case' 0 C--O 1.233 0.197 0 C-N-CA 124.345 1.058 . . . . 0.0 108.401 179.413 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 109' ' ' THR . . . . . . . . . . . . . 27.8 m -122.63 137.52 54.88 Favored 'General case' 0 C--O 1.236 0.356 0 N-CA-C 107.797 -1.186 . . . . 0.0 107.797 177.086 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 110' ' ' TYR . . . . . . . . . . . . . 4.4 m-85 -135.92 145.19 46.0 Favored 'General case' 0 CA--C 1.535 0.395 0 C-N-CA 124.107 0.963 . . . . 0.0 111.761 -178.815 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 111' ' ' LYS . . . . . . . . . . . . . 4.1 tppt? -90.23 150.78 21.82 Favored 'General case' 0 N--CA 1.474 0.764 0 O-C-N 120.82 -1.175 . . . . 0.0 110.806 -179.367 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 112' ' ' LEU . . . . . . . . . . . . . 35.7 tp -74.6 46.47 0.28 Allowed 'General case' 0 CA--C 1.541 0.626 0 C-N-CA 124.792 1.237 . . . . 0.0 109.881 158.653 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 113' ' ' ALA . . . . . . . . . . . . . . . -84.02 102.34 12.42 Favored 'General case' 0 N--CA 1.444 -0.775 0 N-CA-C 104.383 -2.451 . . . . 0.0 104.383 162.147 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 114' ' ' ASP . . . . . . . . . . . . . 57.2 t0 -120.93 64.06 0.86 Allowed 'General case' 0 CA--C 1.516 -0.331 0 CA-C-O 122.287 1.041 . . . . 0.0 109.495 170.278 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 115' ' ' LEU . . . . . . . . . . . . . 57.6 mt 57.51 4.53 0.24 Allowed 'General case' 0 C--O 1.234 0.254 0 C-N-CA 128.178 2.591 . . . . 0.0 114.964 179.28 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 116' ' ' MET . . . . . . . . . . . . . 6.9 ttp 55.97 76.52 0.28 Allowed 'General case' 0 CA--C 1.53 0.179 0 C-N-CA 124.878 1.271 . . . . 0.0 108.709 -159.179 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 117' ' ' ASN . . . . . . . . . . . . . 2.8 t30 . . . . . 0 C--O 1.242 0.659 0 C-N-CA 124.13 0.972 . . . . 0.0 110.05 -178.062 . . . . . . . . 0 0 . 1 . 004 nuclear build full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 10.0 tpt . . . . . 0 C--O 1.235 0.326 0 N-CA-C 107.325 -1.361 . . . . 0.0 107.325 . . . . . . . . . 0 0 . 1 . 004 nuclear build full ' A' A ' 2' ' ' VAL . . . . . . . . . . . . . 2.3 p -59.87 144.56 12.7 Favored 'Isoleucine or valine' 0 C--O 1.234 0.243 0 N-CA-C 108.399 -0.963 . . . . 0.0 108.399 170.227 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 3' ' ' THR . . . . . . . . . . . . . 0.6 OUTLIER -110.42 153.83 43.27 Favored Pre-proline 0 N--CA 1.445 -0.723 0 C-N-CA 123.163 0.585 . . . . 0.0 110.756 172.521 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 4' ' ' PRO . . . . . . . . . . . . . 52.7 Cg_endo -64.95 -33.73 50.66 Favored 'Trans proline' 0 N--CA 1.461 -0.386 0 C-N-CA 123.825 3.017 . . . . 0.0 111.91 -179.263 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 5' ' ' GLU . . . . . . . . . . . . . 65.3 tt0 -49.77 -35.32 22.08 Favored 'General case' 0 CA--C 1.549 0.928 0 C-N-CA 124.216 1.006 . . . . 0.0 111.647 169.759 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 6' ' ' GLN . . . . . . . . . . . . . 48.8 mt-30 -72.46 5.62 2.87 Favored 'General case' 0 CA--C 1.539 0.543 0 O-C-N 120.955 -1.091 . . . . 0.0 112.886 176.08 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 7' ' ' LEU . . . . . . . . . . . . . 93.6 mt -131.52 -54.91 1.02 Allowed 'General case' 0 C--O 1.225 -0.229 0 C-N-CA 125.533 1.533 . . . . 0.0 110.368 -171.615 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 8' ' ' GLN . . . . . . . . . . . . . 4.9 mt-30 -55.41 -6.72 0.19 Allowed 'General case' 0 N--CA 1.479 0.992 0 C-N-CA 127.686 2.394 . . . . 0.0 115.736 -172.815 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 9' ' ' HIS . . . . . . . . . . . . . 76.1 m-70 -139.38 30.31 2.16 Favored 'General case' 0 CA--C 1.54 0.558 0 C-N-CA 125.428 1.491 . . . . 0.0 111.491 178.394 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 10' ' ' HIS . . . . . . . . . . . . . 94.4 m-70 -140.87 142.18 34.55 Favored 'General case' 0 CA--C 1.534 0.344 0 C-N-CA 124.636 1.174 . . . . 0.0 110.917 176.891 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 11' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -88.5 149.03 23.85 Favored 'General case' 0 N--CA 1.463 0.19 0 C-N-CA 124.452 1.101 . . . . 0.0 108.824 167.669 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 12' ' ' PHE . . . . . . . . . . . . . 82.9 m-85 -139.91 154.57 47.27 Favored 'General case' 0 CA--C 1.494 -1.176 0 CA-C-O 122.525 1.155 . . . . 0.0 108.841 169.712 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 13' ' ' VAL . . . . . 0.461 ' CG2' ' HB3' ' A' ' 113' ' ' ALA . 0.0 OUTLIER -127.84 139.46 51.84 Favored 'Isoleucine or valine' 0 N--CA 1.434 -1.242 0 CA-C-N 113.983 -1.462 . . . . 0.0 107.059 -174.103 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 14' ' ' LEU . . . . . . . . . . . . . 19.1 tp -73.11 97.52 2.39 Favored 'General case' 0 N--CA 1.453 -0.321 0 N-CA-C 106.97 -1.493 . . . . 0.0 106.97 174.463 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 2.9 mm-40 -64.04 -54.88 27.28 Favored 'General case' 0 N--CA 1.451 -0.415 0 N-CA-C 108.434 -0.95 . . . . 0.0 108.434 176.962 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 10.1 m -156.14 153.24 28.99 Favored 'General case' 0 N--CA 1.451 -0.425 0 CA-C-O 121.927 0.87 . . . . 0.0 110.85 -174.011 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 17' ' ' VAL . . . . . . . . . . . . . 1.9 t -111.03 169.24 4.04 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.317 0 C-N-CA 126.097 1.759 . . . . 0.0 107.108 -171.832 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 18' ' ' ASN . . . . . . . . . . . . . 1.7 p-10 -57.32 -2.38 0.11 Allowed 'General case' 0 CA--C 1.54 0.578 0 N-CA-C 116.494 2.035 . . . . 0.0 116.494 179.949 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . -146.67 -2.64 0.55 Allowed Glycine 0 CA--C 1.527 0.793 0 CA-C-N 120.496 1.498 . . . . 0.0 115.8 -178.312 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 10.9 pttm 179.67 162.24 0.81 Allowed Pre-proline 0 N--CA 1.469 0.495 0 CA-C-N 119.952 1.876 . . . . 0.0 109.71 175.245 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 21' ' ' PRO . . . . . . . . . . . . . 55.3 Cg_endo -67.94 179.48 2.74 Favored 'Trans proline' 0 N--CA 1.459 -0.541 0 C-N-CA 123.753 2.969 . . . . 0.0 110.775 170.551 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 22' ' ' VAL . . . . . . . . . . . . . 90.1 t -110.15 153.5 11.91 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.384 0 N-CA-C 109.804 -0.443 . . . . 0.0 109.804 169.638 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 23' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -129.89 105.08 7.76 Favored 'General case' 0 CA--C 1.534 0.345 0 C-N-CA 126.548 1.939 . . . . 0.0 107.515 174.424 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 24' ' ' SER . . . . . . . . . . . . . 10.3 t -163.36 94.01 0.79 Allowed 'General case' 0 C--O 1.234 0.244 0 N-CA-C 108.55 -0.907 . . . . 0.0 108.55 168.633 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 25' ' ' ASP . . . . . . . . . . . . . 11.5 m-20 -79.24 -6.31 56.35 Favored 'General case' 0 CA--C 1.535 0.377 0 O-C-N 121.793 -0.567 . . . . 0.0 111.149 -172.748 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 26' ' ' LYS . . . . . . . . . . . . . 13.6 tttp -116.69 -32.88 5.02 Favored 'General case' 0 N--CA 1.471 0.59 0 CA-C-N 119.621 1.1 . . . . 0.0 113.225 -179.091 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 27' ' ' ASN . . . . . . . . . . . . . 1.4 p30 -138.3 77.41 35.68 Favored Pre-proline 0 C--N 1.323 -0.546 0 C-N-CA 123.848 0.859 . . . . 0.0 109.944 175.157 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 28' ' ' PRO . . . . . . . . . . . . . 70.6 Cg_endo -64.3 155.56 64.86 Favored 'Trans proline' 0 N--CA 1.455 -0.791 0 C-N-CA 121.689 1.592 . . . . 0.0 110.052 174.176 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 29' ' ' PRO . . . . . . . . . . . . . 18.1 Cg_endo -69.24 74.92 1.02 Allowed 'Trans proline' 0 N--CA 1.453 -0.883 0 C-N-CA 123.008 2.472 . . . . 0.0 108.505 159.606 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 30' ' ' GLU . . . . . 0.439 ' HA ' ' HA ' ' A' ' 13' ' ' VAL . 0.1 OUTLIER -87.86 163.98 16.12 Favored 'General case' 0 N--CA 1.446 -0.669 0 N-CA-C 108.391 -0.966 . . . . 0.0 108.391 168.445 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 31' ' ' ILE . . . . . . . . . . . . . 19.1 tt -130.69 142.4 43.76 Favored 'Isoleucine or valine' 0 N--CA 1.437 -1.082 0 C-N-CA 126.79 2.036 . . . . 0.0 105.534 172.658 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 32' ' ' SER . . . . . . . . . . . . . 19.9 m -138.65 163.91 30.87 Favored 'General case' 0 N--CA 1.443 -0.815 0 N-CA-C 106.294 -1.743 . . . . 0.0 106.294 171.347 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 33' ' ' PHE . . . . . . . . . . . . . 96.6 m-85 -144.64 143.28 30.68 Favored 'General case' 0 N--CA 1.439 -0.998 0 N-CA-C 106.043 -1.836 . . . . 0.0 106.043 -167.421 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 34' ' ' GLY . . . . . . . . . . . . . . . -166.39 152.22 21.11 Favored Glycine 0 CA--C 1.518 0.263 0 N-CA-C 109.746 -1.342 . . . . 0.0 109.746 160.958 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 35' ' ' GLU . . . . . . . . . . . . . 3.0 pt-20 44.94 145.93 0.0 OUTLIER 'General case' 0 C--O 1.219 -0.508 1 C-N-CA 134.756 5.222 . . . . 0.0 113.556 -171.864 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 52.8 mtpt 51.19 17.38 0.47 Allowed 'General case' 0 N--CA 1.475 0.818 0 O-C-N 120.002 -1.687 . . . . 0.0 114.852 170.387 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 37' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER 62.57 26.74 15.87 Favored 'General case' 0 CA--C 1.544 0.731 0 CA-C-N 120.432 1.469 . . . . 0.0 113.515 -167.837 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 38' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -63.01 158.75 18.63 Favored 'General case' 0 C--N 1.34 0.185 0 O-C-N 119.702 -1.873 . . . . 0.0 110.326 173.589 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 39' ' ' ILE . . . . . . . . . . . . . 37.8 mt -134.2 129.3 53.48 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.493 0 N-CA-C 107.261 -1.385 . . . . 0.0 107.261 -167.32 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 40' ' ' SER . . . . . . . . . . . . . 22.5 m -131.32 114.07 14.56 Favored 'General case' 0 N--CA 1.454 -0.251 0 C-N-CA 124.86 1.264 . . . . 0.0 107.928 176.181 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 41' ' ' GLY . . . . . . . . . . . . . . . -154.09 178.94 30.68 Favored Glycine 0 CA--C 1.523 0.576 0 N-CA-C 110.311 -1.116 . . . . 0.0 110.311 -179.226 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 42' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -161.47 92.86 0.91 Allowed 'General case' 0 N--CA 1.451 -0.376 0 O-C-N 121.302 -1.117 . . . . 0.0 108.961 -176.19 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 43' ' ' MET . . . . . . . . . . . . . 34.1 mmm -69.89 -53.0 19.97 Favored 'General case' 0 C--O 1.224 -0.238 0 N-CA-C 108.649 -0.871 . . . . 0.0 108.649 174.92 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 44' ' ' CYS . . . . . 1.287 ' SG ' ' SG ' ' A' ' 70' ' ' CYS . 11.6 t -152.79 -61.74 0.15 Allowed 'General case' 0 CA--C 1.517 -0.304 0 N-CA-C 107.959 -1.126 . . . . 0.0 107.959 176.336 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 45' ' ' ASN . . . . . . . . . . . . . 13.7 m120 -75.25 14.02 0.63 Allowed 'General case' 0 CA--C 1.536 0.41 0 C-N-CA 125.213 1.405 . . . . 0.0 113.109 -174.242 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 46' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER 53.35 169.15 0.02 OUTLIER 'General case' 0 N--CA 1.468 0.454 0 C-N-CA 127.278 2.231 . . . . 0.0 112.073 -157.675 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 47' ' ' PHE . . . . . . . . . . . . . 33.8 p90 -161.81 172.97 15.25 Favored 'General case' 0 C--O 1.24 0.579 0 C-N-CA 124.357 1.063 . . . . 0.0 110.922 164.162 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 48' ' ' SER . . . . . . . . . . . . . 1.7 p -179.89 150.07 0.37 Allowed 'General case' 0 N--CA 1.444 -0.733 0 C-N-CA 126.871 2.068 . . . . 0.0 109.086 178.142 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 49' ' ' GLY . . . . . . . . . . . . . . . 179.71 166.02 34.67 Favored Glycine 0 CA--C 1.525 0.697 0 N-CA-C 110.446 -1.062 . . . . 0.0 110.446 172.486 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 50' ' ' GLU . . . . . . . . . . . . . 19.2 mt-10 -80.17 97.26 6.83 Favored 'General case' 0 C--N 1.332 -0.18 0 C-N-CA 123.967 0.907 . . . . 0.0 108.97 176.451 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 51' ' ' GLY . . . . . . . . . . . . . . . -63.15 177.71 6.71 Favored Glycine 0 CA--C 1.53 0.983 0 C-N-CA 123.976 0.798 . . . . 0.0 112.263 163.689 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 52' ' ' LYS . . . . . . . . . . . . . 78.6 tttt -156.16 159.75 39.28 Favored 'General case' 0 CA--C 1.536 0.413 0 C-N-CA 125.026 1.33 . . . . 0.0 107.949 166.028 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 53' ' ' LEU . . . . . . . . . . . . . 18.6 tp -156.51 90.15 1.15 Allowed 'General case' 0 N--CA 1.466 0.337 0 C-N-CA 124.681 1.193 . . . . 0.0 109.127 175.306 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 16.3 t -139.53 35.46 2.03 Favored 'General case' 0 CA--C 1.534 0.363 0 C-N-CA 124.449 1.1 . . . . 0.0 108.726 -178.119 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 55' ' ' ASN . . . . . . . . . . . . . 3.7 p30 -165.11 -80.5 0.03 OUTLIER 'General case' 0 N--CA 1.452 -0.347 0 C-N-CA 127.597 2.359 . . . . 0.0 105.676 -167.549 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 56' ' ' GLY . . . . . . . . . . . . . . . 163.11 15.66 0.03 OUTLIER Glycine 0 CA--C 1.534 1.224 0 C-N-CA 128.966 3.174 . . . . 0.0 109.686 -173.124 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 57' ' ' GLU . . . . . . . . . . . . . 51.1 tt0 -135.33 131.57 36.58 Favored 'General case' 0 C--N 1.343 0.293 0 N-CA-C 108.026 -1.101 . . . . 0.0 108.026 -166.869 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 58' ' ' LEU . . . . . . . . . . . . . 65.5 tp -111.35 90.31 3.3 Favored 'General case' 0 CA--C 1.533 0.307 0 C-N-CA 126.692 1.997 . . . . 0.0 108.929 -177.102 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 59' ' ' THR . . . . . . . . . . . . . 17.7 p -95.37 131.36 41.58 Favored 'General case' 0 C--O 1.236 0.387 0 C-N-CA 124.29 1.036 . . . . 0.0 108.59 171.244 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 60' ' ' ALA . . . . . . . . . . . . . . . -76.87 137.34 39.1 Favored 'General case' 0 N--CA 1.454 -0.252 0 N-CA-C 108.742 -0.836 . . . . 0.0 108.742 167.27 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 61' ' ' LYS . . . . . . . . . . . . . 72.9 tttt -66.59 -22.86 66.13 Favored 'General case' 0 C--N 1.329 -0.304 0 O-C-N 121.913 -0.492 . . . . 0.0 112.003 172.622 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 62' ' ' GLY . . . . . . . . . . . . . . . 168.93 111.89 0.25 Allowed Glycine 0 C--N 1.332 0.316 0 N-CA-C 107.989 -2.044 . . . . 0.0 107.989 -178.523 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 63' ' ' LEU . . . . . 0.432 HD22 ' HA ' ' A' ' 83' ' ' SER . 0.3 OUTLIER -77.75 112.81 14.98 Favored 'General case' 0 N--CA 1.454 -0.239 0 N-CA-C 107.621 -1.251 . . . . 0.0 107.621 175.735 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 64' ' ' ALA . . . . . . . . . . . . . . . -90.31 90.77 8.21 Favored 'General case' 0 C--N 1.326 -0.456 0 C-N-CA 124.802 1.241 . . . . 0.0 111.25 168.408 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 65' ' ' MET . . . . . . . . . . . . . 51.7 mtp -94.58 -179.73 4.98 Favored 'General case' 0 CA--C 1.539 0.54 0 O-C-N 120.842 -1.161 . . . . 0.0 109.314 179.513 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 66' ' ' THR . . . . . . . . . . . . . 16.9 p -121.32 -164.51 1.14 Allowed 'General case' 0 CA--C 1.54 0.571 0 O-C-N 120.973 -1.08 . . . . 0.0 109.683 -172.211 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 67' ' ' ARG . . . . . . . . . . . . . 10.9 mmm180 -128.13 51.2 1.99 Allowed 'General case' 0 CA--C 1.542 0.645 0 C-N-CA 125.929 1.692 . . . . 0.0 109.732 -176.049 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 68' ' ' MET . . . . . . . . . . . . . 19.6 ptp -113.17 -176.44 2.9 Favored 'General case' 0 CA--C 1.54 0.563 0 C-N-CA 127.451 2.3 . . . . 0.0 111.292 -179.889 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 69' ' ' MET . . . . . . . . . . . . . 0.4 OUTLIER -140.9 175.67 9.43 Favored 'General case' 0 C--O 1.235 0.308 0 C-N-CA 126.717 2.007 . . . . 0.0 108.905 -178.942 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 70' ' ' CYS . . . . . 1.287 ' SG ' ' SG ' ' A' ' 44' ' ' CYS . 1.1 p -140.33 152.97 46.26 Favored 'General case' 0 C--N 1.33 -0.254 0 C-N-CA 126.544 1.938 . . . . 0.0 109.633 -168.179 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 71' ' ' ALA . . . . . . . . . . . . . . . -79.44 6.63 9.74 Favored 'General case' 0 CA--C 1.534 0.329 0 C-N-CA 124.747 1.219 . . . . 0.0 113.963 -178.202 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 72' ' ' ASN . . . . . . . . . . . . . 24.8 t30 -135.79 143.34 44.19 Favored Pre-proline 0 C--O 1.233 0.192 0 CA-C-N 119.885 1.221 . . . . 0.0 108.023 172.427 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 73' ' ' PRO . . . . . . . . . . . . . 36.7 Cg_endo -75.56 -34.94 3.03 Favored 'Trans proline' 0 N--CA 1.463 -0.314 0 C-N-CA 122.103 1.869 . . . . 0.0 113.071 -169.888 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 74' ' ' GLN . . . . . . . . . . . . . 34.8 tt0 -60.35 -37.34 80.39 Favored 'General case' 0 CA--C 1.537 0.475 0 C-N-CA 123.746 0.818 . . . . 0.0 110.61 175.788 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 75' ' ' LEU . . . . . . . . . . . . . 91.1 mt -59.09 -41.24 87.58 Favored 'General case' 0 N--CA 1.467 0.384 0 CA-C-N 119.421 1.01 . . . . 0.0 109.407 176.461 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 76' ' ' ASN . . . . . . . . . . . . . 0.1 OUTLIER -68.1 -22.11 64.92 Favored 'General case' 0 N--CA 1.466 0.366 0 C-N-CA 124.204 1.002 . . . . 0.0 111.683 -179.661 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 77' ' ' GLU . . . . . . . . . . . . . 1.6 mt-10 -80.36 -41.39 24.82 Favored 'General case' 0 CA--C 1.53 0.187 0 C-N-CA 123.704 0.802 . . . . 0.0 110.51 173.001 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 78' ' ' LEU . . . . . . . . . . . . . 27.5 mt -62.76 -13.01 27.92 Favored 'General case' 0 N--CA 1.464 0.258 0 C-N-CA 124.839 1.256 . . . . 0.0 113.204 -174.098 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 79' ' ' ASP . . . . . . . . . . . . . 4.6 t70 -44.59 -58.58 2.93 Favored 'General case' 0 C--O 1.232 0.135 0 C-N-CA 125.309 1.444 . . . . 0.0 111.18 162.653 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 80' ' ' ASN . . . . . . . . . . . . . 0.7 OUTLIER -68.7 -37.44 79.54 Favored 'General case' 0 CA--C 1.516 -0.36 0 C-N-CA 120.394 -0.522 . . . . 0.0 109.882 -175.469 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 81' ' ' THR . . . . . . . . . . . . . 7.1 m -58.5 -52.97 63.41 Favored 'General case' 0 N--CA 1.447 -0.625 0 N-CA-C 108.689 -0.856 . . . . 0.0 108.689 -175.958 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 82' ' ' ILE . . . . . . . . . . . . . 11.1 tp -68.85 -39.48 80.05 Favored 'Isoleucine or valine' 0 N--CA 1.456 -0.128 0 CA-C-N 119.107 0.867 . . . . 0.0 111.062 -177.319 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 83' ' ' SER . . . . . 0.432 ' HA ' HD22 ' A' ' 63' ' ' LEU . 5.4 t -60.42 -53.02 62.61 Favored 'General case' 0 N--CA 1.451 -0.378 0 N-CA-C 108.915 -0.772 . . . . 0.0 108.915 -175.138 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 84' ' ' GLU . . . . . . . . . . . . . 5.9 mm-40 -61.03 -44.79 96.87 Favored 'General case' 0 N--CA 1.446 -0.671 0 C-N-CA 124.835 1.254 . . . . 0.0 111.142 179.8 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 85' ' ' MET . . . . . . . . . . . . . 90.8 mtp -66.98 -17.51 64.95 Favored 'General case' 0 N--CA 1.451 -0.41 0 CA-C-N 118.023 0.374 . . . . 0.0 110.798 -175.269 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 86' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -105.79 -25.43 12.19 Favored 'General case' 0 N--CA 1.456 -0.137 0 C-N-CA 124.12 0.968 . . . . 0.0 111.754 -177.309 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 87' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -72.81 -55.38 6.79 Favored 'General case' 0 CA--C 1.518 -0.256 0 N-CA-C 108.466 -0.939 . . . . 0.0 108.466 172.456 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 88' ' ' GLU . . . . . . . . . . . . . 54.9 mt-10 -72.72 -28.13 62.47 Favored 'General case' 0 CA--C 1.53 0.184 0 C-N-CA 119.315 -0.954 . . . . 0.0 112.244 -170.788 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 89' ' ' GLY . . . . . . . . . . . . . . . 120.37 95.56 1.51 Allowed Glycine 0 C--N 1.338 0.681 0 C-N-CA 124.361 0.982 . . . . 0.0 110.685 173.996 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 90' ' ' ALA . . . . . . . . . . . . . . . -62.51 134.21 56.07 Favored 'General case' 0 N--CA 1.451 -0.392 0 CA-C-O 118.12 -0.943 . . . . 0.0 108.508 177.286 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 91' ' ' GLN . . . . . . . . . . . . . 11.6 mm-40 -73.87 140.94 46.05 Favored 'General case' 0 C--O 1.239 0.52 0 N-CA-C 104.801 -2.296 . . . . 0.0 104.801 154.998 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 92' ' ' VAL . . . . . . . . . . . . . 7.2 p -132.73 120.3 41.14 Favored 'Isoleucine or valine' 0 N--CA 1.448 -0.546 0 N-CA-C 105.522 -2.029 . . . . 0.0 105.522 -174.134 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 93' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -142.13 90.14 2.23 Favored 'General case' 0 C--N 1.332 -0.184 0 N-CA-C 107.284 -1.376 . . . . 0.0 107.284 -171.23 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 94' ' ' LEU . . . . . . . . . . . . . 1.1 tm? -97.79 110.36 22.94 Favored 'General case' 0 N--CA 1.464 0.252 0 N-CA-C 107.254 -1.387 . . . . 0.0 107.254 -179.29 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 95' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -76.91 -164.68 0.46 Allowed 'General case' 0 CA--C 1.542 0.669 0 C-N-CA 125.162 1.385 . . . . 0.0 109.278 175.313 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 96' ' ' ALA . . . . . . . . . . . . . . . -62.28 -7.25 4.0 Favored 'General case' 0 CA--C 1.541 0.624 0 O-C-N 119.864 -1.772 . . . . 0.0 115.266 -178.106 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 97' ' ' ASN . . . . . . . . . . . . . 2.0 p30 -173.9 4.49 0.01 OUTLIER 'General case' 0 N--CA 1.476 0.844 0 C-N-CA 125.904 1.681 . . . . 0.0 114.521 169.882 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 98' ' ' GLN . . . . . . . . . . . . . 8.6 tt0 -120.28 132.56 55.37 Favored 'General case' 0 N--CA 1.472 0.634 0 CA-C-N 121.011 1.732 . . . . 0.0 108.976 -178.877 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 99' ' ' LEU . . . . . 0.49 HD22 ' CD2' ' A' ' 101' ' ' LEU . 0.4 OUTLIER -98.91 116.25 30.72 Favored 'General case' 0 C--O 1.233 0.231 0 C-N-CA 124.529 1.132 . . . . 0.0 109.385 176.694 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 100' ' ' THR . . . . . . . . . . . . . 26.7 m -93.27 117.66 30.34 Favored 'General case' 0 C--N 1.322 -0.601 0 C-N-CA 125.386 1.474 . . . . 0.0 107.381 170.363 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 101' ' ' LEU . . . . . 0.49 ' CD2' HD22 ' A' ' 99' ' ' LEU . 3.2 mm? -111.19 120.32 41.9 Favored 'General case' 0 N--CA 1.464 0.239 0 N-CA-C 106.803 -1.554 . . . . 0.0 106.803 166.678 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 102' ' ' ALA . . . . . . . . . . . . . . . -123.82 145.9 48.74 Favored 'General case' 0 N--CA 1.467 0.378 0 C-N-CA 124.676 1.19 . . . . 0.0 109.37 169.375 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 103' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -150.99 174.51 13.06 Favored 'General case' 0 N--CA 1.448 -0.53 0 C-N-CA 125.063 1.345 . . . . 0.0 109.796 178.125 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 104' ' ' ALA . . . . . . . . . . . . . . . -51.34 -29.51 15.46 Favored 'General case' 0 CA--C 1.537 0.467 0 C-N-CA 124.948 1.299 . . . . 0.0 113.032 171.846 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 105' ' ' LYS . . . . . . . . . . . . . 3.7 mtpt -80.93 -73.67 0.36 Allowed 'General case' 0 C--N 1.342 0.258 0 O-C-N 121.343 -0.848 . . . . 0.0 110.721 173.95 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 106' ' ' GLN . . . . . . . . . . . . . 29.1 mt-30 -144.26 177.56 8.52 Favored 'General case' 0 C--N 1.329 -0.325 0 C-N-CA 124.103 0.961 . . . . 0.0 108.6 -156.692 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 107' ' ' THR . . . . . . . . . . . . . 1.0 OUTLIER -130.42 142.31 50.51 Favored 'General case' 0 CA--C 1.531 0.222 0 N-CA-C 108.132 -1.062 . . . . 0.0 108.132 170.332 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 108' ' ' LEU . . . . . . . . . . . . . 6.4 mp -126.61 161.89 27.0 Favored 'General case' 0 N--CA 1.447 -0.609 0 C-N-CA 127.657 2.383 . . . . 0.0 108.488 -179.357 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 109' ' ' THR . . . . . . . . . . . . . 1.3 m -131.51 110.06 10.71 Favored 'General case' 0 C--O 1.238 0.46 0 N-CA-C 108.07 -1.085 . . . . 0.0 108.07 174.732 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 110' ' ' TYR . . . . . . . . . . . . . 37.0 m-85 -98.15 163.98 12.51 Favored 'General case' 0 C--O 1.235 0.29 0 N-CA-C 109.143 -0.688 . . . . 0.0 109.143 174.093 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 111' ' ' LYS . . . . . . . . . . . . . 0.7 OUTLIER -131.05 137.61 49.23 Favored 'General case' 0 CA--C 1.521 -0.138 0 C-N-CA 125.371 1.468 . . . . 0.0 109.347 -173.898 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 112' ' ' LEU . . . . . . . . . . . . . 25.6 tp -67.84 62.84 0.08 Allowed 'General case' 0 CA--C 1.542 0.66 0 C-N-CA 128.309 2.644 . . . . 0.0 110.382 168.527 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 113' ' ' ALA . . . . . 0.461 ' HB3' ' CG2' ' A' ' 13' ' ' VAL . . . -88.46 79.75 7.58 Favored 'General case' 0 CA--C 1.528 0.134 0 N-CA-C 105.909 -1.886 . . . . 0.0 105.909 165.018 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 114' ' ' ASP . . . . . . . . . . . . . 23.4 t0 -82.33 19.07 1.28 Allowed 'General case' 0 CA--C 1.538 0.489 0 C-N-CA 125.324 1.45 . . . . 0.0 112.163 -167.807 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 115' ' ' LEU . . . . . . . . . . . . . 22.5 mt 60.14 17.08 6.52 Favored 'General case' 0 N--CA 1.467 0.388 0 C-N-CA 128.643 2.777 . . . . 0.0 112.626 -170.886 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 116' ' ' MET . . . . . . . . . . . . . 7.5 ttp -149.89 143.82 25.53 Favored 'General case' 0 N--CA 1.444 -0.728 0 N-CA-C 106.289 -1.745 . . . . 0.0 106.289 169.029 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 117' ' ' ASN . . . . . . . . . . . . . 70.9 m-80 . . . . . 0 C--O 1.233 0.212 0 CA-C-O 118.836 -0.602 . . . . 0.0 110.663 -175.008 . . . . . . . . 0 0 . 1 . 005 nuclear build full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 22.5 ttm . . . . . 0 C--O 1.237 0.424 0 N-CA-C 109.086 -0.709 . . . . 0.0 109.086 . . . . . . . . . 0 0 . 1 . 005 nuclear build full ' A' A ' 2' ' ' VAL . . . . . 0.405 HG23 ' HB3' ' A' ' 94' ' ' LEU . 11.3 p -67.47 146.21 13.24 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.419 0 N-CA-C 109.517 -0.549 . . . . 0.0 109.517 177.794 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 3' ' ' THR . . . . . . . . . . . . . 6.1 p -135.34 162.57 56.6 Favored Pre-proline 0 CA--C 1.53 0.205 0 O-C-N 121.99 -0.444 . . . . 0.0 110.989 -173.977 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 4' ' ' PRO . . . . . . . . . . . . . 6.2 Cg_endo -59.68 -51.0 6.76 Favored 'Trans proline' 0 N--CA 1.454 -0.814 0 C-N-CA 122.059 1.839 . . . . 0.0 112.886 175.141 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 5' ' ' GLU . . . . . . . . . . . . . 6.5 mt-10 -58.73 -28.51 65.92 Favored 'General case' 0 CA--C 1.534 0.363 0 N-CA-C 113.74 1.015 . . . . 0.0 113.74 -170.747 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 6' ' ' GLN . . . . . . . . . . . . . 17.5 pt20 -79.89 9.08 5.72 Favored 'General case' 0 CA--C 1.533 0.31 0 N-CA-C 113.622 0.971 . . . . 0.0 113.622 175.939 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 7' ' ' LEU . . . . . . . . . . . . . 78.5 mt -127.17 -50.06 1.43 Allowed 'General case' 0 CA--C 1.52 -0.188 0 CA-C-N 119.272 0.942 . . . . 0.0 109.971 -170.322 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 8' ' ' GLN . . . . . . . . . . . . . 2.2 mp0 -55.38 -17.04 4.2 Favored 'General case' 0 N--CA 1.47 0.538 0 N-CA-C 114.985 1.476 . . . . 0.0 114.985 -175.977 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 9' ' ' HIS . . . . . . . . . . . . . 5.8 m170 -124.65 8.11 8.24 Favored 'General case' 0 CA--C 1.54 0.582 0 C-N-CA 124.234 1.014 . . . . 0.0 110.849 -172.582 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 10' ' ' HIS . . . . . . . . . . . . . 73.7 m-70 -131.75 108.68 9.63 Favored 'General case' 0 CA--C 1.533 0.299 0 C-N-CA 125.465 1.506 . . . . 0.0 109.454 -168.564 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 11' ' ' ARG . . . . . . . . . . . . . 1.5 ttt85 -65.61 154.37 38.95 Favored 'General case' 0 N--CA 1.465 0.276 0 C-N-CA 123.156 0.582 . . . . 0.0 110.674 176.676 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 12' ' ' PHE . . . . . . . . . . . . . 59.4 m-85 -131.87 158.0 42.5 Favored 'General case' 0 N--CA 1.447 -0.594 0 C-N-CA 124.47 1.108 . . . . 0.0 109.731 167.882 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 13' ' ' VAL . . . . . 0.485 ' HA ' ' HA ' ' A' ' 30' ' ' GLU . 7.6 p -129.44 136.52 59.14 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.373 0 N-CA-C 108.876 -0.787 . . . . 0.0 108.876 171.128 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 14' ' ' LEU . . . . . . . . . . . . . 20.2 tp -71.26 85.78 0.78 Allowed 'General case' 0 C--O 1.232 0.162 0 N-CA-C 106.784 -1.561 . . . . 0.0 106.784 176.654 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 2.7 mm-40 -67.9 -47.26 69.3 Favored 'General case' 0 C--N 1.325 -0.48 0 C-N-CA 124.098 0.959 . . . . 0.0 109.277 179.059 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 69.8 m -154.08 140.86 19.08 Favored 'General case' 0 N--CA 1.452 -0.35 0 O-C-N 121.139 -0.976 . . . . 0.0 112.184 -176.762 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 17' ' ' VAL . . . . . . . . . . . . . 85.8 t -98.98 171.12 1.31 Allowed 'Isoleucine or valine' 0 C--N 1.328 -0.328 0 C-N-CA 125.952 1.701 . . . . 0.0 108.601 -174.082 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 18' ' ' ASN . . . . . . . . . . . . . 1.3 t30 -44.36 -49.98 9.33 Favored 'General case' 0 C--N 1.337 0.059 0 C-N-CA 125.81 1.644 . . . . 0.0 112.02 -178.551 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . -79.65 -69.14 1.42 Allowed Glycine 0 CA--C 1.526 0.725 0 O-C-N 123.856 0.722 . . . . 0.0 111.459 177.269 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 30.2 mttm -136.72 165.68 33.3 Favored Pre-proline 0 CA--C 1.529 0.142 0 C-N-CA 125.728 1.611 . . . . 0.0 111.035 -164.273 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 21' ' ' PRO . . . . . . . . . . . . . 91.9 Cg_endo -67.37 176.41 4.85 Favored 'Trans proline' 0 N--CA 1.454 -0.852 0 C-N-CA 121.596 1.53 . . . . 0.0 110.045 162.728 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 22' ' ' VAL . . . . . . . . . . . . . 7.7 p -131.47 162.31 39.6 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.513 0 C-N-CA 124.834 1.254 . . . . 0.0 108.336 177.429 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 23' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -141.9 142.46 33.06 Favored 'General case' 0 CA--C 1.535 0.392 0 CA-C-N 119.008 0.822 . . . . 0.0 108.794 172.568 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 24' ' ' SER . . . . . . . . . . . . . 16.2 m -146.06 35.25 1.0 Allowed 'General case' 0 CA--C 1.537 0.448 0 C-N-CA 125.64 1.576 . . . . 0.0 110.483 -175.647 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 25' ' ' ASP . . . . . . . . . . . . . 18.0 m-20 53.13 52.68 13.24 Favored 'General case' 0 N--CA 1.47 0.563 0 C-N-CA 125.088 1.355 . . . . 0.0 110.801 -179.715 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 26' ' ' LYS . . . . . . . . . . . . . 5.0 tmtt? 64.71 9.24 5.05 Favored 'General case' 0 N--CA 1.45 -0.437 0 C-N-CA 124.456 1.102 . . . . 0.0 112.406 178.227 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 27' ' ' ASN . . . . . . . . . . . . . 73.3 m-20 -113.55 58.4 0.74 Allowed Pre-proline 0 CA--C 1.542 0.664 0 C-N-CA 125.151 1.38 . . . . 0.0 110.428 172.524 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 28' ' ' PRO . . . . . . . . . . . . . 23.2 Cg_endo -76.76 171.66 17.6 Favored 'Trans proline' 0 CA--C 1.543 0.936 0 C-N-CA 124.502 3.468 . . . . 0.0 113.457 -166.84 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 29' ' ' PRO . . . . . . . . . . . . . 19.5 Cg_endo -66.02 64.91 0.45 Allowed 'Trans proline' 0 C--N 1.357 0.978 0 C-N-CA 124.974 3.783 . . . . 0.0 111.811 170.984 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 30' ' ' GLU . . . . . 0.485 ' HA ' ' HA ' ' A' ' 13' ' ' VAL . 1.9 pt-20 -70.15 164.54 23.97 Favored 'General case' 0 C--O 1.239 0.525 0 O-C-N 120.222 -1.549 . . . . 0.0 109.339 172.28 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 31' ' ' ILE . . . . . . . . . . . . . 12.9 tt -139.94 147.63 23.57 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.474 0 CA-C-O 122.336 1.065 . . . . 0.0 108.492 176.935 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 32' ' ' SER . . . . . . . . . . . . . 5.0 p -138.75 154.29 48.52 Favored 'General case' 0 N--CA 1.443 -0.775 0 N-CA-C 107.064 -1.458 . . . . 0.0 107.064 -179.276 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 33' ' ' PHE . . . . . . . . . . . . . 91.7 m-85 -126.37 168.38 14.25 Favored 'General case' 0 N--CA 1.446 -0.638 0 N-CA-C 106.84 -1.541 . . . . 0.0 106.84 178.03 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 34' ' ' GLY . . . . . . . . . . . . . . . 157.85 170.49 22.69 Favored Glycine 0 CA--C 1.522 0.524 0 N-CA-C 109.197 -1.561 . . . . 0.0 109.197 -178.284 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 35' ' ' GLU . . . . . . . . . . . . . 25.1 mt-10 43.57 88.38 0.01 OUTLIER 'General case' 0 N--CA 1.467 0.406 0 C-N-CA 126.796 2.038 . . . . 0.0 113.38 163.647 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 29.3 mttm 69.67 24.42 5.49 Favored 'General case' 0 N--CA 1.466 0.369 0 C-N-CA 125.429 1.492 . . . . 0.0 112.609 -177.224 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 37' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER 64.98 21.66 12.34 Favored 'General case' 0 CA--C 1.542 0.673 0 CA-C-N 120.178 1.353 . . . . 0.0 109.878 -177.828 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 38' ' ' MET . . . . . . . . . . . . . 14.9 mtp -62.42 157.49 19.92 Favored 'General case' 0 N--CA 1.45 -0.445 0 O-C-N 120.959 -1.088 . . . . 0.0 110.006 171.406 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 39' ' ' ILE . . . . . . . . . . . . . 7.3 mt -119.26 131.22 72.56 Favored 'Isoleucine or valine' 0 N--CA 1.447 -0.587 0 C-N-CA 125.443 1.497 . . . . 0.0 107.2 -177.988 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 40' ' ' SER . . . . . . . . . . . . . 55.5 m -129.0 116.02 18.69 Favored 'General case' 0 N--CA 1.452 -0.363 0 C-N-CA 126.377 1.871 . . . . 0.0 107.182 178.78 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 41' ' ' GLY . . . . . . . . . . . . . . . -167.75 179.47 41.09 Favored Glycine 0 CA--C 1.526 0.738 0 N-CA-C 109.631 -1.388 . . . . 0.0 109.631 -179.395 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 42' ' ' SER . . . . . . . . . . . . . 1.0 OUTLIER -154.54 103.28 2.46 Favored 'General case' 0 N--CA 1.453 -0.283 0 O-C-N 121.989 -0.712 . . . . 0.0 109.257 -176.605 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 43' ' ' MET . . . . . . . . . . . . . 6.9 mmt -71.25 -43.55 67.02 Favored 'General case' 0 C--O 1.223 -0.335 0 N-CA-C 108.998 -0.741 . . . . 0.0 108.998 175.248 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 44' ' ' CYS . . . . . 1.275 ' SG ' ' SG ' ' A' ' 70' ' ' CYS . 38.7 t -153.84 -75.32 0.12 Allowed 'General case' 0 N--CA 1.453 -0.284 0 N-CA-C 104.61 -2.367 . . . . 0.0 104.61 172.878 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 45' ' ' ASN . . . . . . . . . . . . . 2.7 m120 -78.48 17.66 0.64 Allowed 'General case' 0 C--N 1.329 -0.3 0 C-N-CA 126.463 1.905 . . . . 0.0 112.494 -163.703 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 46' ' ' ARG . . . . . . . . . . . . . 3.9 mmm180 55.48 158.94 0.01 OUTLIER 'General case' 0 N--CA 1.465 0.299 0 C-N-CA 128.248 2.619 . . . . 0.0 112.631 -161.744 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 47' ' ' PHE . . . . . . . . . . . . . 47.3 p90 -152.69 171.74 17.73 Favored 'General case' 0 N--CA 1.448 -0.556 0 C-N-CA 125.352 1.461 . . . . 0.0 108.199 165.835 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 48' ' ' SER . . . . . . . . . . . . . 7.0 p -163.6 158.87 21.12 Favored 'General case' 0 N--CA 1.444 -0.765 0 N-CA-C 107.031 -1.47 . . . . 0.0 107.031 176.258 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 49' ' ' GLY . . . . . . . . . . . . . . . 173.62 169.17 35.64 Favored Glycine 0 C--N 1.34 0.756 0 CA-C-N 119.951 1.251 . . . . 0.0 112.265 164.7 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 50' ' ' GLU . . . . . . . . . . . . . 23.1 mt-10 -72.84 96.8 2.13 Favored 'General case' 0 C--O 1.239 0.503 0 C-N-CA 125.395 1.478 . . . . 0.0 108.884 171.607 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 51' ' ' GLY . . . . . . . . . . . . . . . -71.97 176.55 40.03 Favored Glycine 0 CA--C 1.527 0.818 0 CA-C-N 115.414 -0.812 . . . . 0.0 111.255 156.965 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 52' ' ' LYS . . . . . . . . . . . . . 29.9 ttpt -167.25 150.33 6.31 Favored 'General case' 0 CA--C 1.529 0.15 0 C-N-CA 126.21 1.804 . . . . 0.0 107.605 179.688 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 53' ' ' LEU . . . . . . . . . . . . . 46.7 tp -155.26 120.53 4.93 Favored 'General case' 0 C--O 1.232 0.142 0 C-N-CA 123.667 0.787 . . . . 0.0 109.345 177.132 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 1.2 t -162.21 39.56 0.12 Allowed 'General case' 0 CA--C 1.538 0.507 0 C-N-CA 123.639 0.776 . . . . 0.0 108.992 174.176 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 55' ' ' ASN . . . . . . . . . . . . . 15.8 p-10 -174.01 -51.4 0.01 OUTLIER 'General case' 0 N--CA 1.462 0.162 0 C-N-CA 124.779 1.232 . . . . 0.0 111.372 -161.497 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 56' ' ' GLY . . . . . . . . . . . . . . . 131.57 10.18 2.42 Favored Glycine 0 CA--C 1.529 0.91 0 C-N-CA 125.102 1.334 . . . . 0.0 113.128 -176.694 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 57' ' ' GLU . . . . . . . . . . . . . 51.7 tt0 -132.05 134.89 46.04 Favored 'General case' 0 C--O 1.233 0.233 0 CA-C-N 118.657 1.228 . . . . 0.0 109.118 -175.019 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 58' ' ' LEU . . . . . . . . . . . . . 38.1 tp -115.71 82.19 1.72 Allowed 'General case' 0 CA--C 1.535 0.393 0 C-N-CA 126.221 1.809 . . . . 0.0 110.685 -171.928 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 59' ' ' THR . . . . . . . . . . . . . 16.9 p -82.45 141.23 32.89 Favored 'General case' 0 C--O 1.237 0.427 0 O-C-N 121.445 -0.784 . . . . 0.0 110.931 177.366 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 60' ' ' ALA . . . . . 0.463 ' HB2' ' HB3' ' A' ' 86' ' ' LEU . . . -89.87 117.05 28.41 Favored 'General case' 0 CA--C 1.517 -0.309 0 C-N-CA 125.011 1.325 . . . . 0.0 110.584 173.604 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 61' ' ' LYS . . . . . . . . . . . . . 16.2 tttt -67.11 -9.47 40.03 Favored 'General case' 0 CA--C 1.543 0.683 0 N-CA-C 113.453 0.908 . . . . 0.0 113.453 176.05 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 62' ' ' GLY . . . . . . . . . . . . . . . 159.25 116.08 0.43 Allowed Glycine 0 CA--C 1.523 0.535 0 N-CA-C 108.606 -1.798 . . . . 0.0 108.606 179.597 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 63' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -97.59 108.54 21.28 Favored 'General case' 0 N--CA 1.452 -0.367 0 C-N-CA 124.227 1.011 . . . . 0.0 110.396 -173.07 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 64' ' ' ALA . . . . . . . . . . . . . . . -96.18 108.71 21.2 Favored 'General case' 0 C--N 1.324 -0.517 0 CA-C-N 115.634 -0.712 . . . . 0.0 110.114 -177.083 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 65' ' ' MET . . . . . . . . . . . . . 50.4 mtp -111.43 -178.72 3.52 Favored 'General case' 0 C--O 1.241 0.61 0 C-N-CA 126.091 1.756 . . . . 0.0 109.972 -174.588 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 66' ' ' THR . . . . . . . . . . . . . 10.1 p -122.6 -175.25 3.1 Favored 'General case' 0 CA--C 1.537 0.444 0 C-N-CA 123.625 0.77 . . . . 0.0 112.94 178.937 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 67' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -124.68 74.05 1.31 Allowed 'General case' 0 C--O 1.237 0.418 0 C-N-CA 126.727 2.011 . . . . 0.0 110.044 -174.622 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 68' ' ' MET . . . . . . . . . . . . . 2.0 ptt? -142.93 158.37 43.67 Favored 'General case' 0 N--CA 1.452 -0.343 0 C-N-CA 124.638 1.175 . . . . 0.0 111.694 172.824 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 69' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -104.92 134.67 47.65 Favored 'General case' 0 N--CA 1.448 -0.566 0 C-N-CA 127.388 2.275 . . . . 0.0 109.234 179.827 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 70' ' ' CYS . . . . . 1.275 ' SG ' ' SG ' ' A' ' 44' ' ' CYS . 60.0 m -100.05 -6.72 25.97 Favored 'General case' 0 N--CA 1.467 0.408 0 C-N-CA 125.611 1.564 . . . . 0.0 114.499 -173.489 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 71' ' ' ALA . . . . . . . . . . . . . . . 67.81 -45.04 0.49 Allowed 'General case' 0 C--O 1.234 0.248 0 C-N-CA 127.324 2.25 . . . . 0.0 113.936 -168.29 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 72' ' ' ASN . . . . . 0.68 ' HB3' HD22 ' A' ' 75' ' ' LEU . 43.4 t30 -68.38 142.71 94.81 Favored Pre-proline 0 C--O 1.234 0.26 0 CA-C-O 117.503 -1.237 . . . . 0.0 108.697 -177.598 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 73' ' ' PRO . . . . . . . . . . . . . 44.3 Cg_endo -78.92 -41.32 0.24 Allowed 'Trans proline' 0 N--CA 1.455 -0.756 0 C-N-CA 121.957 1.772 . . . . 0.0 110.999 178.414 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 74' ' ' GLN . . . . . . . . . . . . . 23.7 tt0 -61.58 -44.98 96.02 Favored 'General case' 0 CA--C 1.534 0.358 0 C-N-CA 123.126 0.57 . . . . 0.0 110.76 -169.506 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 75' ' ' LEU . . . . . 0.68 HD22 ' HB3' ' A' ' 72' ' ' ASN . 0.0 OUTLIER -52.31 -52.65 51.78 Favored 'General case' 0 N--CA 1.447 -0.605 0 C-N-CA 125.139 1.376 . . . . 0.0 110.583 169.543 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 76' ' ' ASN . . . . . . . . . . . . . 1.2 m-20 -71.18 -0.89 10.8 Favored 'General case' 0 N--CA 1.47 0.53 0 C-N-CA 126.657 1.983 . . . . 0.0 113.144 -174.767 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 77' ' ' GLU . . . . . . . . . . . . . 3.3 mm-40 -101.93 -40.31 6.95 Favored 'General case' 0 C--O 1.235 0.328 0 C-N-CA 126.214 1.806 . . . . 0.0 109.708 171.075 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 78' ' ' LEU . . . . . . . . . . . . . 4.9 mp -67.49 -24.24 65.56 Favored 'General case' 0 N--CA 1.456 -0.167 0 C-N-CA 125.589 1.556 . . . . 0.0 112.103 -178.58 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 79' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -58.24 -34.35 70.35 Favored 'General case' 0 C--O 1.232 0.171 0 C-N-CA 123.4 0.68 . . . . 0.0 111.695 175.233 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 80' ' ' ASN . . . . . . . . . . . . . 91.1 m-20 -87.17 -36.41 18.05 Favored 'General case' 0 CA--C 1.512 -0.496 0 CA-C-O 117.893 -1.051 . . . . 0.0 109.862 177.753 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 81' ' ' THR . . . . . . . . . . . . . 3.8 m -52.38 -55.33 22.41 Favored 'General case' 0 CA--C 1.531 0.246 0 CA-C-N 118.646 0.657 . . . . 0.0 109.985 174.657 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 82' ' ' ILE . . . . . . . . . . . . . 9.8 tp -66.56 -37.61 79.93 Favored 'Isoleucine or valine' 0 N--CA 1.454 -0.27 0 C-N-CA 119.808 -0.757 . . . . 0.0 111.361 -174.382 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 83' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER -59.75 -49.55 77.29 Favored 'General case' 0 N--CA 1.443 -0.802 0 N-CA-C 109.283 -0.636 . . . . 0.0 109.283 179.495 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 84' ' ' GLU . . . . . . . . . . . . . 36.8 tt0 -66.41 -46.31 76.99 Favored 'General case' 0 N--CA 1.449 -0.5 0 C-N-CA 125.065 1.346 . . . . 0.0 111.219 -176.725 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 85' ' ' MET . . . . . . . . . . . . . 85.0 mtp -58.21 -52.26 66.31 Favored 'General case' 0 C--N 1.342 0.265 0 C-N-CA 124.413 1.085 . . . . 0.0 109.318 -177.766 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 86' ' ' LEU . . . . . 0.463 ' HB3' ' HB2' ' A' ' 60' ' ' ALA . 0.1 OUTLIER -75.27 -22.97 57.39 Favored 'General case' 0 N--CA 1.453 -0.311 0 CA-C-N 115.906 -0.588 . . . . 0.0 111.329 -171.41 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 87' ' ' LYS . . . . . . . . . . . . . 9.5 mttt -67.14 -47.05 72.26 Favored 'General case' 0 N--CA 1.456 -0.172 0 N-CA-C 108.164 -1.05 . . . . 0.0 108.164 -178.797 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 88' ' ' GLU . . . . . . . . . . . . . 69.5 mt-10 -72.07 -51.45 21.54 Favored 'General case' 0 N--CA 1.454 -0.255 0 O-C-N 123.738 0.649 . . . . 0.0 110.077 177.567 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 89' ' ' GLY . . . . . . . . . . . . . . . 134.26 97.57 0.59 Allowed Glycine 0 C--N 1.337 0.597 0 N-CA-C 108.509 -1.836 . . . . 0.0 108.509 -169.732 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 90' ' ' ALA . . . . . . . . . . . . . . . -74.11 130.72 40.34 Favored 'General case' 0 N--CA 1.451 -0.387 0 N-CA-C 107.423 -1.325 . . . . 0.0 107.423 171.813 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 91' ' ' GLN . . . . . . . . . . . . . 82.1 mm-40 -62.64 130.91 47.14 Favored 'General case' 0 N--CA 1.442 -0.833 0 N-CA-C 106.109 -1.812 . . . . 0.0 106.109 159.239 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 92' ' ' VAL . . . . . . . . . . . . . 4.2 p -118.27 124.67 73.46 Favored 'Isoleucine or valine' 0 N--CA 1.44 -0.927 0 N-CA-C 104.069 -2.567 . . . . 0.0 104.069 -179.008 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 93' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -138.69 138.48 37.78 Favored 'General case' 0 N--CA 1.444 -0.739 0 N-CA-C 106.316 -1.735 . . . . 0.0 106.316 173.37 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 94' ' ' LEU . . . . . 0.556 ' HB2' HD12 ' A' ' 99' ' ' LEU . 10.8 tp -133.23 116.22 15.93 Favored 'General case' 0 N--CA 1.445 -0.687 0 N-CA-C 106.543 -1.651 . . . . 0.0 106.543 -178.923 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 95' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -82.59 -164.62 0.87 Allowed 'General case' 0 C--N 1.322 -0.619 0 CA-C-N 114.417 -1.265 . . . . 0.0 110.112 172.62 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 96' ' ' ALA . . . . . . . . . . . . . . . -49.59 -40.82 40.12 Favored 'General case' 0 CA--C 1.538 0.501 0 C-N-CA 124.611 1.164 . . . . 0.0 113.079 -178.004 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 97' ' ' ASN . . . . . . . . . . . . . 42.8 p30 -156.38 23.47 0.35 Allowed 'General case' 0 CA--C 1.541 0.63 0 N-CA-C 113.683 0.994 . . . . 0.0 113.683 -178.876 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 98' ' ' GLN . . . . . . . . . . . . . 13.7 tt0 -137.11 122.79 19.83 Favored 'General case' 0 N--CA 1.467 0.381 0 C-N-CA 124.45 1.1 . . . . 0.0 108.568 -177.735 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 99' ' ' LEU . . . . . 0.556 HD12 ' HB2' ' A' ' 94' ' ' LEU . 3.7 tp -82.38 130.81 35.19 Favored 'General case' 0 C--O 1.235 0.306 0 N-CA-C 107.709 -1.219 . . . . 0.0 107.709 170.723 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 100' ' ' THR . . . . . . . . . . . . . 5.0 m -117.73 114.32 23.15 Favored 'General case' 0 C--N 1.325 -0.471 0 C-N-CA 126.506 1.923 . . . . 0.0 106.743 171.371 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 101' ' ' LEU . . . . . . . . . . . . . 0.7 OUTLIER -115.54 123.82 49.47 Favored 'General case' 0 CA--C 1.505 -0.777 0 N-CA-C 106.832 -1.544 . . . . 0.0 106.832 -179.073 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 102' ' ' ALA . . . . . . . . . . . . . . . -139.14 158.48 44.1 Favored 'General case' 0 C--N 1.325 -0.488 0 C-N-CA 123.655 0.782 . . . . 0.0 108.97 178.577 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 103' ' ' THR . . . . . . . . . . . . . 0.6 OUTLIER -154.61 -179.95 8.47 Favored 'General case' 0 N--CA 1.443 -0.815 0 C-N-CA 126.438 1.895 . . . . 0.0 106.214 176.838 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 104' ' ' ALA . . . . . . . . . . . . . . . -60.53 -26.24 66.72 Favored 'General case' 0 C--O 1.236 0.363 0 O-C-N 120.992 -1.067 . . . . 0.0 112.284 174.613 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 105' ' ' LYS . . . . . . . . . . . . . 13.0 mmtt -77.63 -71.7 0.4 Allowed 'General case' 0 CA--C 1.512 -0.504 0 O-C-N 121.962 -0.461 . . . . 0.0 111.048 -179.992 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 106' ' ' GLN . . . . . . . . . . . . . 1.4 tt0 -154.07 -169.87 3.38 Favored 'General case' 0 N--CA 1.45 -0.446 0 N-CA-C 109.719 -0.475 . . . . 0.0 109.719 -166.435 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 107' ' ' THR . . . . . . . . . . . . . 10.0 t -143.74 164.13 31.35 Favored 'General case' 0 C--O 1.24 0.601 0 C-N-CA 123.431 0.692 . . . . 0.0 110.281 -173.682 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 108' ' ' LEU . . . . . . . . . . . . . 75.6 mt -150.05 134.05 16.99 Favored 'General case' 0 CA--C 1.536 0.434 0 C-N-CA 128.399 2.679 . . . . 0.0 106.123 -170.688 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 109' ' ' THR . . . . . . . . . . . . . 82.6 m -115.21 116.21 27.97 Favored 'General case' 0 C--O 1.237 0.398 0 N-CA-C 107.022 -1.473 . . . . 0.0 107.022 174.721 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 110' ' ' TYR . . . . . . . . . . . . . 21.7 m-85 -106.99 168.57 9.11 Favored 'General case' 0 C--O 1.237 0.424 0 CA-C-O 121.637 0.732 . . . . 0.0 109.811 176.652 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 111' ' ' LYS . . . . . . . . . . . . . 0.9 OUTLIER -130.03 143.71 50.94 Favored 'General case' 0 CA--C 1.519 -0.225 0 C-N-CA 126.013 1.725 . . . . 0.0 108.343 -170.847 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 112' ' ' LEU . . . . . . . . . . . . . 21.2 tp -70.71 60.63 0.23 Allowed 'General case' 0 CA--C 1.54 0.581 0 C-N-CA 126.222 1.809 . . . . 0.0 111.575 171.152 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 113' ' ' ALA . . . . . . . . . . . . . . . -88.04 103.34 15.63 Favored 'General case' 0 N--CA 1.453 -0.303 0 N-CA-C 105.297 -2.112 . . . . 0.0 105.297 163.251 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 114' ' ' ASP . . . . . . . . . . . . . 46.5 t0 -133.67 45.82 2.62 Favored 'General case' 0 C--N 1.33 -0.241 0 CA-C-O 122.918 1.342 . . . . 0.0 109.39 174.357 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 115' ' ' LEU . . . . . . . . . . . . . 48.8 mt 57.23 4.84 0.22 Allowed 'General case' 0 C--O 1.237 0.408 0 C-N-CA 128.102 2.561 . . . . 0.0 115.676 179.289 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 116' ' ' MET . . . . . . . . . . . . . 7.1 ttp 54.12 81.66 0.1 Allowed 'General case' 0 C--O 1.236 0.347 0 C-N-CA 127.131 2.172 . . . . 0.0 108.505 -160.441 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 117' ' ' ASN . . . . . . . . . . . . . 7.5 t-20 . . . . . 0 C--O 1.234 0.284 0 C-N-CA 124.181 0.992 . . . . 0.0 112.238 -175.282 . . . . . . . . 0 0 . 1 . 006 nuclear build full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 21.1 ttm . . . . . 0 N--CA 1.455 -0.181 0 N-CA-C 108.321 -0.992 . . . . 0.0 108.321 . . . . . . . . . 0 0 . 1 . 006 nuclear build full ' A' A ' 2' ' ' VAL . . . . . 0.555 HG11 ' O ' ' A' ' 92' ' ' VAL . 8.2 p -57.64 142.3 13.51 Favored 'Isoleucine or valine' 0 CA--C 1.542 0.648 0 CA-C-N 115.951 -0.568 . . . . 0.0 110.251 173.237 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 3' ' ' THR . . . . . . . . . . . . . 21.5 p -123.03 163.9 30.61 Favored Pre-proline 0 C--O 1.226 -0.153 0 O-C-N 121.353 -0.842 . . . . 0.0 109.956 172.724 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 4' ' ' PRO . . . . . . . . . . . . . 31.1 Cg_endo -63.89 -36.63 49.05 Favored 'Trans proline' 0 N--CA 1.461 -0.427 0 C-N-CA 122.227 1.951 . . . . 0.0 112.183 174.377 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 5' ' ' GLU . . . . . . . . . . . . . 13.3 tt0 -57.27 -56.67 18.84 Favored 'General case' 0 CA--C 1.534 0.333 0 C-N-CA 123.524 0.729 . . . . 0.0 111.25 -172.721 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 6' ' ' GLN . . . . . . . . . . . . . 4.2 pt20 -64.05 18.3 0.01 OUTLIER 'General case' 0 CA--C 1.543 0.691 0 C-N-CA 128.174 2.59 . . . . 0.0 114.252 178.877 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 7' ' ' LEU . . . . . . . . . . . . . 72.9 mt -134.95 -50.3 0.76 Allowed 'General case' 0 N--CA 1.453 -0.313 0 C-N-CA 126.272 1.829 . . . . 0.0 109.58 -176.649 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 8' ' ' GLN . . . . . . . . . . . . . 5.4 mt-30 -57.65 -21.31 39.17 Favored 'General case' 0 N--CA 1.472 0.652 0 N-CA-C 114.114 1.153 . . . . 0.0 114.114 -177.182 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 9' ' ' HIS . . . . . . . . . . . . . 8.3 m170 -110.76 11.46 22.57 Favored 'General case' 0 CA--C 1.537 0.475 0 C-N-CA 123.421 0.688 . . . . 0.0 111.218 -179.916 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 10' ' ' HIS . . . . . . . . . . . . . 50.8 m80 -136.33 112.25 9.57 Favored 'General case' 0 CA--C 1.535 0.39 0 C-N-CA 124.686 1.195 . . . . 0.0 109.223 -165.754 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 11' ' ' ARG . . . . . . . . . . . . . 4.6 ttt85 -69.11 152.61 44.95 Favored 'General case' 0 N--CA 1.466 0.351 0 O-C-N 121.304 -0.873 . . . . 0.0 108.961 172.159 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 12' ' ' PHE . . . . . . . . . . . . . 21.3 m-85 -139.11 156.6 47.03 Favored 'General case' 0 CA--C 1.512 -0.513 0 N-CA-C 108.387 -0.968 . . . . 0.0 108.387 173.676 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 13' ' ' VAL . . . . . 0.688 ' CG1' ' HB3' ' A' ' 113' ' ' ALA . 1.8 p -140.5 128.68 24.59 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.583 0 N-CA-C 113.135 0.791 . . . . 0.0 113.135 -179.339 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 14' ' ' LEU . . . . . . . . . . . . . 6.4 tt -57.32 119.91 7.25 Favored 'General case' 0 CA--C 1.508 -0.666 0 N-CA-C 107.512 -1.292 . . . . 0.0 107.512 178.055 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 15' ' ' GLU . . . . . 0.456 ' HG3' ' HE2' ' A' ' 111' ' ' LYS . 0.1 OUTLIER -106.12 -45.23 4.38 Favored 'General case' 0 N--CA 1.439 -0.978 0 CA-C-N 115.092 -0.958 . . . . 0.0 108.996 -173.229 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -143.56 152.18 41.11 Favored 'General case' 0 N--CA 1.443 -0.79 0 CA-C-O 121.972 0.891 . . . . 0.0 111.406 174.242 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 17' ' ' VAL . . . . . . . . . . . . . 10.5 t -76.93 175.68 0.73 Allowed 'Isoleucine or valine' 0 C--O 1.242 0.673 0 N-CA-C 106.871 -1.529 . . . . 0.0 106.871 173.1 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 18' ' ' ASN . . . . . . . . . . . . . 0.2 OUTLIER -44.79 -34.49 2.32 Favored 'General case' 0 CA--C 1.535 0.374 0 C-N-CA 126.773 2.029 . . . . 0.0 113.103 169.6 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . -115.3 -54.31 0.38 Allowed Glycine 0 CA--C 1.525 0.687 0 CA-C-O 118.937 -0.924 . . . . 0.0 113.339 -168.198 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 12.9 mttm -134.07 160.76 67.3 Favored Pre-proline 0 N--CA 1.466 0.331 0 CA-C-N 118.694 1.247 . . . . 0.0 111.702 178.08 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 21' ' ' PRO . . . . . . . . . . . . . 59.8 Cg_endo -67.06 160.72 46.0 Favored 'Trans proline' 0 N--CA 1.45 -1.029 0 C-N-CA 122.012 1.808 . . . . 0.0 110.321 162.468 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 22' ' ' VAL . . . . . . . . . . . . . 13.3 p -139.74 165.52 22.16 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.41 0 C-N-CA 124.536 1.134 . . . . 0.0 109.166 -179.265 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 23' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -130.07 157.98 40.89 Favored 'General case' 0 C--O 1.235 0.338 0 CA-C-O 121.528 0.68 . . . . 0.0 111.465 -179.166 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 24' ' ' SER . . . . . 0.422 ' HB3' ' HA ' ' A' ' 28' ' ' PRO . 32.2 t -150.9 47.88 0.85 Allowed 'General case' 0 CA--C 1.536 0.435 0 C-N-CA 126.462 1.905 . . . . 0.0 106.624 -178.397 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 25' ' ' ASP . . . . . . . . . . . . . 32.6 m-20 44.54 54.59 6.33 Favored 'General case' 0 N--CA 1.469 0.506 0 C-N-CA 126.044 1.737 . . . . 0.0 112.466 -176.391 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 26' ' ' LYS . . . . . . . . . . . . . 7.1 tmtm? 69.99 -2.57 2.01 Favored 'General case' 0 N--CA 1.471 0.605 0 O-C-N 120.91 -1.119 . . . . 0.0 112.664 176.619 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 27' ' ' ASN . . . . . . . . . . . . . 82.5 m-20 -113.43 71.03 1.56 Allowed Pre-proline 0 CA--C 1.537 0.471 0 C-N-CA 125.761 1.624 . . . . 0.0 107.471 175.455 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 28' ' ' PRO . . . . . 0.422 ' HA ' ' HB3' ' A' ' 24' ' ' SER . 60.2 Cg_endo -67.99 170.35 14.48 Favored 'Trans proline' 0 C--N 1.349 0.6 0 C-N-CA 124.664 3.576 . . . . 0.0 113.412 -173.335 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 29' ' ' PRO . . . . . 0.479 ' HB3' ' HA ' ' A' ' 43' ' ' MET . 12.2 Cg_endo -61.46 69.49 0.1 OUTLIER 'Trans proline' 0 CA--C 1.544 1.013 0 C-N-CA 125.167 3.911 . . . . 0.0 112.042 164.569 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 30' ' ' GLU . . . . . . . . . . . . . 11.7 pt-20 -95.74 168.95 10.35 Favored 'General case' 0 C--N 1.327 -0.379 0 O-C-N 119.768 -1.833 . . . . 0.0 111.105 177.512 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 31' ' ' ILE . . . . . 0.418 HD11 ' CG2' ' A' ' 39' ' ' ILE . 14.4 tt -147.64 165.62 5.83 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.399 0 C-N-CA 124.392 1.077 . . . . 0.0 108.307 -168.854 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 32' ' ' SER . . . . . . . . . . . . . 5.9 p -145.92 161.67 39.53 Favored 'General case' 0 N--CA 1.443 -0.824 0 N-CA-C 107.985 -1.117 . . . . 0.0 107.985 165.884 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 33' ' ' PHE . . . . . . . . . . . . . 84.6 m-85 -127.57 167.43 16.35 Favored 'General case' 0 N--CA 1.442 -0.874 0 N-CA-C 106.619 -1.623 . . . . 0.0 106.619 175.357 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 34' ' ' GLY . . . . . . . . . . . . . . . 165.57 -167.28 38.92 Favored Glycine 0 N--CA 1.447 -0.596 0 N-CA-C 105.815 -2.914 . . . . 0.0 105.815 -177.189 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 35' ' ' GLU . . . . . . . . . . . . . 37.7 mt-10 44.38 72.51 0.19 Allowed 'General case' 0 C--N 1.33 -0.242 0 C-N-CA 124.952 1.301 . . . . 0.0 112.41 161.658 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 24.9 mtmt 60.33 28.31 17.92 Favored 'General case' 0 CA--C 1.541 0.633 0 CA-C-N 115.182 -0.917 . . . . 0.0 112.224 174.635 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 37' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER 75.23 15.92 2.81 Favored 'General case' 0 N--CA 1.469 0.521 0 C-N-CA 128.152 2.581 . . . . 0.0 112.649 -175.867 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 38' ' ' MET . . . . . . . . . . . . . 19.6 mtp -55.92 147.44 19.48 Favored 'General case' 0 C--O 1.237 0.395 0 O-C-N 120.697 -1.252 . . . . 0.0 110.664 167.451 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 39' ' ' ILE . . . . . 0.418 ' CG2' HD11 ' A' ' 31' ' ' ILE . 7.5 mt -108.61 135.47 47.33 Favored 'Isoleucine or valine' 0 N--CA 1.447 -0.588 0 N-CA-C 107.158 -1.423 . . . . 0.0 107.158 -177.428 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 40' ' ' SER . . . . . . . . . . . . . 4.4 m -136.18 135.57 39.27 Favored 'General case' 0 N--CA 1.452 -0.36 0 N-CA-C 107.584 -1.265 . . . . 0.0 107.584 171.757 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 41' ' ' GLY . . . . . . . . . . . . . . . -178.08 -175.46 45.25 Favored Glycine 0 C--O 1.237 0.325 0 CA-C-N 119.179 0.9 . . . . 0.0 111.114 -178.474 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 42' ' ' SER . . . . . . . . . . . . . 15.7 t -143.54 167.62 21.79 Favored 'General case' 0 N--CA 1.444 -0.75 0 N-CA-C 108.197 -1.038 . . . . 0.0 108.197 165.548 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 43' ' ' MET . . . . . 0.479 ' HA ' ' HB3' ' A' ' 29' ' ' PRO . 36.4 mmm -126.79 -45.33 1.61 Allowed 'General case' 0 N--CA 1.447 -0.614 0 N-CA-C 107.86 -1.163 . . . . 0.0 107.86 162.014 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 44' ' ' CYS . . . . . 1.283 ' SG ' ' SG ' ' A' ' 70' ' ' CYS . 41.6 t -149.16 -51.21 0.15 Allowed 'General case' 0 CA--C 1.542 0.664 0 C-N-CA 126.112 1.765 . . . . 0.0 108.009 167.706 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 45' ' ' ASN . . . . . . . . . . . . . 8.0 m-80 -88.95 10.34 21.74 Favored 'General case' 0 N--CA 1.467 0.4 0 N-CA-C 115.898 1.814 . . . . 0.0 115.898 -174.203 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 46' ' ' ARG . . . . . . . . . . . . . 0.4 OUTLIER 60.99 164.78 0.08 Allowed 'General case' 0 N--CA 1.474 0.774 0 C-N-CA 125.809 1.644 . . . . 0.0 111.661 -169.737 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 47' ' ' PHE . . . . . . . . . . . . . 51.6 p90 -162.76 169.09 20.5 Favored 'General case' 0 C--O 1.238 0.492 0 C-N-CA 124.954 1.301 . . . . 0.0 108.887 167.852 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 48' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -157.23 162.21 39.25 Favored 'General case' 0 CA--C 1.541 0.608 0 C-N-CA 124.656 1.182 . . . . 0.0 108.673 164.731 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 49' ' ' GLY . . . . . . . . . . . . . . . -179.1 167.96 38.45 Favored Glycine 0 CA--C 1.532 1.109 0 CA-C-N 120.572 1.533 . . . . 0.0 113.156 171.104 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 50' ' ' GLU . . . . . . . . . . . . . 40.4 mt-10 -68.81 95.35 0.67 Allowed 'General case' 0 CA--C 1.534 0.329 0 C-N-CA 125.013 1.325 . . . . 0.0 110.193 170.473 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 51' ' ' GLY . . . . . . . . . . . . . . . -76.85 165.01 53.4 Favored Glycine 0 CA--C 1.529 0.951 0 N-CA-C 110.296 -1.122 . . . . 0.0 110.296 161.242 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 52' ' ' LYS . . . . . . . . . . . . . 62.3 tttt -168.85 137.01 2.03 Favored 'General case' 0 CA--C 1.517 -0.289 0 C-N-CA 126.833 2.053 . . . . 0.0 106.036 174.837 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 53' ' ' LEU . . . . . 0.464 HD12 ' N ' ' A' ' 54' ' ' SER . 16.1 tp -130.77 128.96 41.81 Favored 'General case' 0 CA--C 1.517 -0.316 0 CA-C-O 122.317 1.055 . . . . 0.0 110.391 -177.441 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 54' ' ' SER . . . . . 0.464 ' N ' HD12 ' A' ' 53' ' ' LEU . 21.1 t -144.94 -37.18 0.29 Allowed 'General case' 0 N--CA 1.443 -0.796 0 C-N-CA 125.433 1.493 . . . . 0.0 109.903 174.729 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 55' ' ' ASN . . . . . . . . . . . . . 65.9 t30 -121.64 23.23 10.31 Favored 'General case' 0 CA--C 1.538 0.502 0 C-N-CA 124.175 0.99 . . . . 0.0 113.647 -164.66 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 56' ' ' GLY . . . . . . . . . . . . . . . 78.03 5.28 86.9 Favored Glycine 0 CA--C 1.532 1.095 0 O-C-N 120.606 -1.309 . . . . 0.0 113.512 -176.089 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 57' ' ' GLU . . . . . . . . . . . . . 40.3 tt0 -123.67 148.6 46.36 Favored 'General case' 0 C--O 1.237 0.399 0 CA-C-N 118.612 1.206 . . . . 0.0 108.589 -174.13 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 58' ' ' LEU . . . . . . . . . . . . . 8.4 tp -132.51 138.83 47.67 Favored 'General case' 0 C--N 1.33 -0.251 0 C-N-CA 125.364 1.466 . . . . 0.0 110.54 178.421 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 59' ' ' THR . . . . . . . . . . . . . 1.6 p -125.82 167.11 15.66 Favored 'General case' 0 C--O 1.237 0.429 0 C-N-CA 125.76 1.624 . . . . 0.0 111.17 -176.66 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 60' ' ' ALA . . . . . . . . . . . . . . . -139.45 107.32 5.67 Favored 'General case' 0 CA--C 1.53 0.18 0 C-N-CA 125.505 1.522 . . . . 0.0 111.706 168.381 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 61' ' ' LYS . . . . . . . . . . . . . 24.7 tttt -72.55 77.23 1.07 Allowed 'General case' 0 CA--C 1.542 0.636 0 C-N-CA 124.027 0.931 . . . . 0.0 111.027 178.273 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 62' ' ' GLY . . . . . . . . . . . . . . . 124.29 -65.29 0.54 Allowed Glycine 0 N--CA 1.466 0.674 0 C-N-CA 125.68 1.61 . . . . 0.0 111.397 172.801 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 63' ' ' LEU . . . . . . . . . . . . . 6.0 tt 65.51 103.39 0.04 OUTLIER 'General case' 0 CA--C 1.535 0.4 0 C-N-CA 128.578 2.751 . . . . 0.0 114.243 174.003 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 64' ' ' ALA . . . . . . . . . . . . . . . -84.22 97.48 9.42 Favored 'General case' 0 CA--C 1.533 0.32 0 C-N-CA 126.759 2.024 . . . . 0.0 112.635 -169.693 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 65' ' ' MET . . . . . . . . . . . . . 3.0 mtt -98.2 -179.66 4.45 Favored 'General case' 0 CA--C 1.543 0.675 0 C-N-CA 124.684 1.194 . . . . 0.0 111.127 176.064 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 66' ' ' THR . . . . . . . . . . . . . 9.2 p -118.2 -163.89 0.98 Allowed 'General case' 0 CA--C 1.552 1.028 0 C-N-CA 125.989 1.715 . . . . 0.0 111.822 -179.744 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 67' ' ' ARG . . . . . . . . . . . . . 28.9 mmt180 -133.21 49.12 2.33 Favored 'General case' 0 CA--C 1.553 1.089 0 C-N-CA 126.296 1.838 . . . . 0.0 111.474 172.985 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 68' ' ' MET . . . . . . . . . . . . . 59.4 mtm -84.12 -175.0 5.59 Favored 'General case' 0 CA--C 1.544 0.743 0 C-N-CA 128.113 2.565 . . . . 0.0 110.612 167.942 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 69' ' ' MET . . . . . . . . . . . . . 1.4 pmm? -151.01 173.83 13.86 Favored 'General case' 0 N--CA 1.466 0.341 0 C-N-CA 126.255 1.822 . . . . 0.0 111.449 171.058 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 70' ' ' CYS . . . . . 1.283 ' SG ' ' SG ' ' A' ' 44' ' ' CYS . 86.0 m -141.36 148.05 39.04 Favored 'General case' 0 C--O 1.234 0.263 0 CA-C-O 122.041 0.924 . . . . 0.0 112.028 -169.74 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 71' ' ' ALA . . . . . . . . . . . . . . . -71.9 26.92 0.05 OUTLIER 'General case' 0 CA--C 1.543 0.705 0 C-N-CA 128.374 2.669 . . . . 0.0 112.265 175.927 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 72' ' ' ASN . . . . . . . . . . . . . 53.3 t-20 -146.96 141.38 15.92 Favored Pre-proline 0 CA--C 1.535 0.4 0 N-CA-C 103.859 -2.645 . . . . 0.0 103.859 156.114 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 73' ' ' PRO . . . . . . . . . . . . . 56.1 Cg_endo -83.94 -26.84 1.79 Allowed 'Trans proline' 0 N--CA 1.465 -0.158 0 C-N-CA 122.271 1.981 . . . . 0.0 111.759 -176.968 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 74' ' ' GLN . . . . . . . . . . . . . 11.2 tt0 -63.14 -26.18 68.7 Favored 'General case' 0 CA--C 1.538 0.508 0 O-C-N 121.669 -0.645 . . . . 0.0 110.852 179.807 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 75' ' ' LEU . . . . . . . . . . . . . 62.1 mt -69.45 -32.14 70.9 Favored 'General case' 0 N--CA 1.47 0.542 0 C-N-CA 123.71 0.804 . . . . 0.0 111.728 173.121 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 76' ' ' ASN . . . . . . . . . . . . . 2.1 t-20 -79.79 -20.87 45.17 Favored 'General case' 0 CA--C 1.531 0.237 0 C-N-CA 124.177 0.991 . . . . 0.0 111.261 -177.555 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 77' ' ' GLU . . . . . . . . . . . . . 4.3 mm-40 -78.49 -34.08 47.76 Favored 'General case' 0 CA--C 1.536 0.41 0 C-N-CA 123.944 0.898 . . . . 0.0 110.114 169.591 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 78' ' ' LEU . . . . . 0.417 HD12 ' HE2' ' A' ' 43' ' ' MET . 0.9 OUTLIER -57.05 -24.83 56.66 Favored 'General case' 0 C--N 1.345 0.407 0 O-C-N 121.513 -0.742 . . . . 0.0 111.869 176.369 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 79' ' ' ASP . . . . . . . . . . . . . 69.3 m-20 -64.35 -27.32 68.94 Favored 'General case' 0 N--CA 1.454 -0.273 0 C-N-CA 122.977 0.511 . . . . 0.0 111.991 -176.708 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 80' ' ' ASN . . . . . . . . . . . . . 10.7 p30 -101.76 -29.82 11.66 Favored 'General case' 0 N--CA 1.437 -1.106 0 CA-C-O 116.613 -1.661 . . . . 0.0 111.77 174.961 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 81' ' ' THR . . . . . . . . . . . . . 25.2 m -44.94 -74.42 0.04 OUTLIER 'General case' 0 CA--C 1.535 0.403 0 CA-C-N 119.164 0.893 . . . . 0.0 108.82 161.818 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 82' ' ' ILE . . . . . . . . . . . . . 5.2 tp -66.62 -34.58 71.02 Favored 'Isoleucine or valine' 0 N--CA 1.455 -0.205 0 O-C-N 121.012 -1.055 . . . . 0.0 111.448 -167.589 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 83' ' ' SER . . . . . . . . . . . . . 4.3 m -61.91 -45.07 95.34 Favored 'General case' 0 N--CA 1.445 -0.701 0 O-C-N 122.155 -0.341 . . . . 0.0 110.646 -177.662 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 84' ' ' GLU . . . . . . . . . . . . . 31.9 tt0 -77.94 -34.51 51.16 Favored 'General case' 0 N--CA 1.446 -0.669 0 CA-C-O 118.03 -0.986 . . . . 0.0 110.173 -178.032 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 85' ' ' MET . . . . . . . . . . . . . 86.8 mtp -54.64 -48.64 72.03 Favored 'General case' 0 C--N 1.343 0.297 0 CA-C-O 121.956 0.884 . . . . 0.0 108.728 174.709 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 86' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -76.63 -26.62 55.11 Favored 'General case' 0 N--CA 1.45 -0.457 0 CA-C-O 118.612 -0.708 . . . . 0.0 111.566 -176.648 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 87' ' ' LYS . . . . . . . . . . . . . 31.5 mttt -70.89 -38.14 73.03 Favored 'General case' 0 CA--C 1.532 0.284 0 CA-C-N 119.94 1.245 . . . . 0.0 108.938 178.203 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 88' ' ' GLU . . . . . . . . . . . . . 31.8 mm-40 -66.47 -63.79 1.0 Allowed 'General case' 0 CA--C 1.532 0.283 0 C-N-CA 125.274 1.43 . . . . 0.0 109.494 173.168 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 89' ' ' GLY . . . . . . . . . . . . . . . 135.55 99.22 0.58 Allowed Glycine 0 C--N 1.335 0.523 0 N-CA-C 107.517 -2.233 . . . . 0.0 107.517 -161.873 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 90' ' ' ALA . . . . . . . . . . . . . . . -90.47 139.88 30.26 Favored 'General case' 0 N--CA 1.455 -0.221 0 N-CA-C 108.996 -0.742 . . . . 0.0 108.996 -179.327 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 91' ' ' GLN . . . . . . . . . . . . . 41.9 mm-40 -78.63 134.99 37.11 Favored 'General case' 0 N--CA 1.442 -0.865 0 N-CA-C 106.075 -1.824 . . . . 0.0 106.075 174.916 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 92' ' ' VAL . . . . . 0.555 ' O ' HG11 ' A' ' 2' ' ' VAL . 24.2 t -130.14 98.0 3.6 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.476 0 C-N-CA 127.444 2.297 . . . . 0.0 106.144 -167.133 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 93' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -116.71 94.19 4.51 Favored 'General case' 0 C--O 1.235 0.335 0 CA-C-O 121.225 0.536 . . . . 0.0 110.317 -175.736 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 94' ' ' LEU . . . . . . . . . . . . . 1.5 tm? -93.2 106.66 18.6 Favored 'General case' 0 C--O 1.233 0.213 0 N-CA-C 108.479 -0.934 . . . . 0.0 108.479 174.856 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 95' ' ' THR . . . . . . . . . . . . . 5.8 t -85.55 -164.81 1.07 Allowed 'General case' 0 CA--C 1.543 0.69 0 C-N-CA 125.932 1.693 . . . . 0.0 108.724 171.108 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 96' ' ' ALA . . . . . . . . . . . . . . . -55.33 -22.74 20.38 Favored 'General case' 0 CA--C 1.545 0.775 0 N-CA-C 115.638 1.718 . . . . 0.0 115.638 -172.953 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 97' ' ' ASN . . . . . . . . . . . . . 0.0 OUTLIER -152.83 2.63 0.31 Allowed 'General case' 0 N--CA 1.477 0.922 0 CA-C-N 120.313 1.415 . . . . 0.0 113.941 176.395 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 98' ' ' GLN . . . . . . . . . . . . . 6.5 tt0 -140.14 136.37 33.44 Favored 'General case' 0 CA--C 1.53 0.211 0 O-C-N 120.423 -1.423 . . . . 0.0 109.525 -163.551 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 99' ' ' LEU . . . . . . . . . . . . . 20.2 tp -113.99 115.3 27.41 Favored 'General case' 0 N--CA 1.464 0.272 0 C-N-CA 126.84 2.056 . . . . 0.0 108.455 -172.468 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 100' ' ' THR . . . . . . . . . . . . . 0.9 OUTLIER -89.73 149.68 22.63 Favored 'General case' 0 CA--C 1.541 0.61 0 N-CA-C 104.787 -2.301 . . . . 0.0 104.787 177.044 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 101' ' ' LEU . . . . . . . . . . . . . 1.2 mm? -120.74 117.29 27.1 Favored 'General case' 0 N--CA 1.455 -0.189 0 C-N-CA 127.211 2.204 . . . . 0.0 106.583 163.125 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 102' ' ' ALA . . . . . . . . . . . . . . . -129.17 140.78 51.38 Favored 'General case' 0 N--CA 1.464 0.233 0 CA-C-N 119.406 1.003 . . . . 0.0 109.603 174.526 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 103' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -160.33 175.49 12.77 Favored 'General case' 0 N--CA 1.448 -0.554 0 C-N-CA 126.636 1.975 . . . . 0.0 108.336 171.599 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 104' ' ' ALA . . . . . . . . . . . . . . . -47.64 -36.34 10.82 Favored 'General case' 0 N--CA 1.453 -0.283 0 CA-C-O 117.549 -1.215 . . . . 0.0 112.855 173.391 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 105' ' ' LYS . . . . . 0.523 ' HE3' ' HA ' ' A' ' 105' ' ' LYS . 0.0 OUTLIER -55.98 -69.04 0.16 Allowed 'General case' 0 C--N 1.344 0.355 0 CA-C-N 120.004 1.274 . . . . 0.0 111.588 178.716 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 106' ' ' GLN . . . . . . . . . . . . . 10.2 pt20 -176.62 -164.95 0.12 Allowed 'General case' 0 C--N 1.329 -0.325 0 C-N-CA 127.303 2.241 . . . . 0.0 106.526 -174.69 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 107' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -135.42 138.9 43.7 Favored 'General case' 0 N--CA 1.443 -0.786 0 N-CA-C 107.663 -1.236 . . . . 0.0 107.663 -163.459 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 108' ' ' LEU . . . . . . . . . . . . . 1.1 mm? -133.58 162.84 30.81 Favored 'General case' 0 C--N 1.331 -0.226 0 C-N-CA 125.73 1.612 . . . . 0.0 107.401 174.039 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 109' ' ' THR . . . . . . . . . . . . . 81.1 m -139.64 116.7 11.07 Favored 'General case' 0 C--O 1.237 0.435 0 N-CA-C 108.307 -0.998 . . . . 0.0 108.307 174.746 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 110' ' ' TYR . . . . . . . . . . . . . 0.8 OUTLIER -94.68 157.04 16.14 Favored 'General case' 0 CA--C 1.536 0.409 0 C-N-CA 126.498 1.919 . . . . 0.0 109.012 177.731 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 111' ' ' LYS . . . . . 0.456 ' HE2' ' HG3' ' A' ' 15' ' ' GLU . 3.7 tppt? -102.02 150.69 22.98 Favored 'General case' 0 C--O 1.237 0.41 0 C-N-CA 126.795 2.038 . . . . 0.0 108.994 176.05 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 112' ' ' LEU . . . . . . . . . . . . . 44.4 tp -72.95 59.34 0.5 Allowed 'General case' 0 CA--C 1.54 0.58 0 C-N-CA 124.968 1.307 . . . . 0.0 108.649 158.967 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 113' ' ' ALA . . . . . 0.688 ' HB3' ' CG1' ' A' ' 13' ' ' VAL . . . -96.63 83.83 3.54 Favored 'General case' 0 C--N 1.328 -0.351 0 N-CA-C 106.112 -1.811 . . . . 0.0 106.112 164.97 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 114' ' ' ASP . . . . . . . . . . . . . 3.2 p-10 -104.15 20.7 17.82 Favored 'General case' 0 CA--C 1.53 0.183 0 C-N-CA 125.271 1.429 . . . . 0.0 111.886 -176.89 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 115' ' ' LEU . . . . . . . . . . . . . 22.2 mt 70.63 13.82 7.26 Favored 'General case' 0 CA--C 1.541 0.608 0 C-N-CA 127.298 2.239 . . . . 0.0 112.886 177.267 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 116' ' ' MET . . . . . . . . . . . . . 5.5 ppp? -57.81 173.51 0.3 Allowed 'General case' 0 CA--C 1.531 0.236 0 C-N-CA 126.823 2.049 . . . . 0.0 114.395 175.919 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 117' ' ' ASN . . . . . . . . . . . . . 14.2 t30 . . . . . 0 C--O 1.234 0.26 0 C-N-CA 125.195 1.398 . . . . 0.0 108.418 168.208 . . . . . . . . 0 0 . 1 . 007 nuclear build full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 0.2 OUTLIER . . . . . 0 N--CA 1.451 -0.389 0 N-CA-C 109.099 -0.704 . . . . 0.0 109.099 . . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 2' ' ' VAL . . . . . . . . . . . . . 7.6 p -59.5 144.76 12.18 Favored 'Isoleucine or valine' 0 C--O 1.237 0.418 0 CA-C-O 120.879 0.371 . . . . 0.0 110.877 175.713 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 3' ' ' THR . . . . . . . . . . . . . 4.3 p -132.39 164.48 43.1 Favored Pre-proline 0 N--CA 1.453 -0.301 0 C-N-CA 124.508 1.123 . . . . 0.0 110.297 -178.064 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 4' ' ' PRO . . . . . . . . . . . . . 29.6 Cg_endo -66.15 -38.99 19.61 Favored 'Trans proline' 0 N--CA 1.462 -0.368 0 C-N-CA 122.559 2.173 . . . . 0.0 113.032 178.121 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 5' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -58.48 -47.48 83.92 Favored 'General case' 0 C--N 1.328 -0.353 0 C-N-CA 123.433 0.693 . . . . 0.0 110.907 -174.857 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 6' ' ' GLN . . . . . . . . . . . . . 3.8 pt20 -69.75 15.55 0.08 Allowed 'General case' 0 CA--C 1.541 0.603 0 C-N-CA 124.975 1.31 . . . . 0.0 114.048 176.161 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 7' ' ' LEU . . . . . . . . . . . . . 94.4 mt -130.3 -47.02 1.09 Allowed 'General case' 0 CA--C 1.529 0.17 0 C-N-CA 125.475 1.51 . . . . 0.0 110.882 -178.149 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 8' ' ' GLN . . . . . . . . . . . . . 7.1 mt-30 -60.77 -6.34 1.7 Allowed 'General case' 0 N--CA 1.479 1.012 0 N-CA-C 114.945 1.461 . . . . 0.0 114.945 -175.356 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 9' ' ' HIS . . . . . . . . . . . . . 10.7 m170 -126.94 13.29 7.32 Favored 'General case' 0 C--N 1.323 -0.554 0 C-N-CA 124.701 1.2 . . . . 0.0 111.359 -175.667 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 10' ' ' HIS . . . . . . . . . . . . . 73.8 m-70 -137.82 106.4 5.86 Favored 'General case' 0 CA--C 1.542 0.636 0 C-N-CA 124.466 1.107 . . . . 0.0 110.583 -161.341 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 11' ' ' ARG . . . . . . . . . . . . . 1.8 ttt180 -69.65 144.73 52.83 Favored 'General case' 0 N--CA 1.472 0.659 0 O-C-N 121.241 -0.912 . . . . 0.0 109.909 173.87 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 12' ' ' PHE . . . . . . . . . . . . . 39.4 m-85 -133.84 117.6 17.02 Favored 'General case' 0 N--CA 1.454 -0.26 0 C-N-CA 125.571 1.548 . . . . 0.0 107.709 177.584 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 13' ' ' VAL . . . . . 0.458 ' HA ' ' HA ' ' A' ' 30' ' ' GLU . 11.8 p -89.73 146.22 6.45 Favored 'Isoleucine or valine' 0 C--O 1.237 0.423 0 O-C-N 120.939 -1.101 . . . . 0.0 109.53 171.836 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 14' ' ' LEU . . . . . . . . . . . . . 25.0 tp -71.59 94.79 1.35 Allowed 'General case' 0 N--CA 1.453 -0.291 0 N-CA-C 107.572 -1.27 . . . . 0.0 107.572 173.078 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 4.3 mm-40 -61.89 -57.27 12.41 Favored 'General case' 0 N--CA 1.452 -0.327 0 N-CA-C 107.68 -1.23 . . . . 0.0 107.68 168.822 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 40.8 p -144.11 134.68 24.82 Favored 'General case' 0 N--CA 1.45 -0.457 0 N-CA-C 114.023 1.12 . . . . 0.0 114.023 -170.38 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 17' ' ' VAL . . . . . . . . . . . . . 65.9 t -72.52 165.07 3.16 Favored 'Isoleucine or valine' 0 C--O 1.24 0.577 0 N-CA-C 107.148 -1.427 . . . . 0.0 107.148 168.916 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 18' ' ' ASN . . . . . . . . . . . . . 0.0 OUTLIER -44.81 -39.56 5.4 Favored 'General case' 0 CA--C 1.534 0.33 0 C-N-CA 124.701 1.2 . . . . 0.0 112.185 174.776 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . -79.68 -81.11 0.76 Allowed Glycine 0 CA--C 1.526 0.734 0 C-N-CA 124.848 1.213 . . . . 0.0 110.609 177.565 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 37.7 mttt -141.99 166.29 22.46 Favored Pre-proline 0 CA--C 1.534 0.354 0 C-N-CA 127.057 2.143 . . . . 0.0 109.771 -173.517 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 21' ' ' PRO . . . . . . . . . . . . . 30.8 Cg_endo -58.14 168.54 3.54 Favored 'Trans proline' 0 N--CA 1.453 -0.865 0 C-N-CA 122.283 1.989 . . . . 0.0 113.042 172.58 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 22' ' ' VAL . . . . . . . . . . . . . 10.1 p -117.36 166.79 11.34 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.48 0 C-N-CA 127.31 2.244 . . . . 0.0 107.747 -179.45 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 23' ' ' THR . . . . . . . . . . . . . 39.7 m -131.14 156.35 45.42 Favored 'General case' 0 C--O 1.238 0.454 0 O-C-N 120.019 -1.676 . . . . 0.0 110.09 -177.772 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 24' ' ' SER . . . . . . . . . . . . . 1.7 p -154.98 136.15 13.94 Favored 'General case' 0 N--CA 1.435 -1.216 0 C-N-CA 125.806 1.642 . . . . 0.0 108.783 -162.379 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 25' ' ' ASP . . . . . . . . . . . . . 3.2 m-20 -71.14 63.33 0.33 Allowed 'General case' 0 C--N 1.32 -0.713 0 C-N-CA 124.936 1.295 . . . . 0.0 108.472 165.049 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 26' ' ' LYS . . . . . . . . . . . . . 31.0 tttp 62.79 4.9 1.57 Allowed 'General case' 0 CA--C 1.546 0.802 0 C-N-CA 124.329 1.052 . . . . 0.0 113.487 -179.554 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 27' ' ' ASN . . . . . . . . . . . . . 84.7 m-20 -127.2 76.54 76.26 Favored Pre-proline 0 C--O 1.239 0.525 0 C-N-CA 125.89 1.676 . . . . 0.0 108.306 -178.213 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 28' ' ' PRO . . . . . . . . . . . . . 85.4 Cg_endo -77.67 165.88 26.32 Favored 'Trans proline' 0 N--CA 1.461 -0.434 0 C-N-CA 124.078 3.186 . . . . 0.0 111.791 -176.42 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 29' ' ' PRO . . . . . . . . . . . . . 38.5 Cg_endo -66.89 83.41 0.32 Allowed 'Trans proline' 0 N--CA 1.452 -0.938 0 C-N-CA 122.789 2.326 . . . . 0.0 108.392 161.946 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 30' ' ' GLU . . . . . 0.458 ' HA ' ' HA ' ' A' ' 13' ' ' VAL . 12.9 pt-20 -91.67 163.73 13.99 Favored 'General case' 0 C--O 1.239 0.54 0 O-C-N 120.725 -1.235 . . . . 0.0 108.763 163.17 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 31' ' ' ILE . . . . . . . . . . . . . 12.1 tt -130.42 153.97 39.83 Favored 'Isoleucine or valine' 0 N--CA 1.449 -0.49 0 N-CA-C 106.06 -1.83 . . . . 0.0 106.06 171.806 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 32' ' ' SER . . . . . . . . . . . . . 3.6 t -144.86 172.46 13.0 Favored 'General case' 0 N--CA 1.445 -0.722 0 N-CA-C 107.074 -1.454 . . . . 0.0 107.074 167.765 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 33' ' ' PHE . . . . . . . . . . . . . 66.1 m-85 -136.12 163.07 31.19 Favored 'General case' 0 N--CA 1.445 -0.687 0 N-CA-C 107.027 -1.472 . . . . 0.0 107.027 -179.328 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 34' ' ' GLY . . . . . . . . . . . . . . . 167.54 113.95 0.29 Allowed Glycine 0 CA--C 1.495 -1.164 0 C-N-CA 118.226 -1.94 . . . . 0.0 114.639 172.263 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 35' ' ' GLU . . . . . . . . . . . . . 2.4 pt-20 77.12 140.57 0.07 Allowed 'General case' 0 N--CA 1.443 -0.787 1 C-N-CA 134.381 5.073 . . . . 0.0 106.845 -169.121 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 8.8 mtpm? 47.12 20.27 0.13 Allowed 'General case' 0 CA--C 1.544 0.733 0 N-CA-C 116.245 1.943 . . . . 0.0 116.245 176.167 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 37' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER 53.56 33.97 17.49 Favored 'General case' 0 C--N 1.331 -0.235 0 C-N-CA 126.418 1.887 . . . . 0.0 113.155 -167.964 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 38' ' ' MET . . . . . . . . . . . . . 0.1 OUTLIER -62.83 166.17 5.88 Favored 'General case' 0 N--CA 1.45 -0.451 0 N-CA-C 108.943 -0.762 . . . . 0.0 108.943 168.342 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 39' ' ' ILE . . . . . . . . . . . . . 9.1 mt -134.97 128.27 49.56 Favored 'Isoleucine or valine' 0 C--O 1.239 0.51 0 N-CA-C 107.471 -1.307 . . . . 0.0 107.471 -168.288 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 40' ' ' SER . . . . . . . . . . . . . 27.6 m -119.82 148.0 43.98 Favored 'General case' 0 CA--C 1.532 0.274 0 C-N-CA 124.735 1.214 . . . . 0.0 108.082 166.734 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 41' ' ' GLY . . . . . . . . . . . . . . . 173.23 178.61 43.34 Favored Glycine 0 CA--C 1.522 0.493 0 N-CA-C 109.725 -1.35 . . . . 0.0 109.725 -177.817 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 42' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -163.27 96.09 0.86 Allowed 'General case' 0 CA--C 1.536 0.418 0 O-C-N 121.942 -0.74 . . . . 0.0 110.863 -176.566 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 43' ' ' MET . . . . . . . . . . . . . 13.0 mmt -71.47 -68.73 0.43 Allowed 'General case' 0 N--CA 1.469 0.481 0 CA-C-N 118.456 0.571 . . . . 0.0 110.391 173.862 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 44' ' ' CYS . . . . . 1.286 ' SG ' ' SG ' ' A' ' 70' ' ' CYS . 45.6 t -135.59 -58.97 0.77 Allowed 'General case' 0 CA--C 1.527 0.089 0 N-CA-C 106.469 -1.678 . . . . 0.0 106.469 171.452 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 45' ' ' ASN . . . . . . . . . . . . . 25.7 m-20 -78.38 22.74 0.32 Allowed 'General case' 0 C--O 1.233 0.214 0 C-N-CA 126.811 2.044 . . . . 0.0 114.315 -175.118 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 46' ' ' ARG . . . . . . . . . . . . . 5.7 mpt_? 53.64 -173.85 0.04 OUTLIER 'General case' 0 C--O 1.225 -0.214 0 C-N-CA 124.028 0.931 . . . . 0.0 109.447 -163.737 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 47' ' ' PHE . . . . . . . . . . . . . 6.7 p90 -178.09 145.76 0.38 Allowed 'General case' 0 C--O 1.238 0.456 0 C-N-CA 126.399 1.88 . . . . 0.0 107.309 156.854 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 48' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -153.36 146.18 24.38 Favored 'General case' 0 C--N 1.324 -0.521 0 N-CA-C 107.749 -1.204 . . . . 0.0 107.749 177.23 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 49' ' ' GLY . . . . . . . . . . . . . . . -179.34 163.91 31.68 Favored Glycine 0 C--N 1.336 0.572 0 C-N-CA 120.398 -0.906 . . . . 0.0 112.615 179.133 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 50' ' ' GLU . . . . . . . . . . . . . 35.6 mt-10 -70.16 97.14 1.16 Allowed 'General case' 0 C--O 1.238 0.475 0 C-N-CA 124.809 1.244 . . . . 0.0 108.041 166.965 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 51' ' ' GLY . . . . . . . . . . . . . . . -72.08 175.58 41.97 Favored Glycine 0 CA--C 1.523 0.579 0 N-CA-C 110.416 -1.074 . . . . 0.0 110.416 155.888 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 52' ' ' LYS . . . . . . . . . . . . . 50.8 tttm -164.16 152.65 13.09 Favored 'General case' 0 C--N 1.332 -0.189 0 C-N-CA 125.795 1.638 . . . . 0.0 106.739 168.025 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 53' ' ' LEU . . . . . . . . . . . . . 46.2 tp -131.26 130.63 43.1 Favored 'General case' 0 C--O 1.232 0.179 0 C-N-CA 124.505 1.122 . . . . 0.0 109.169 170.813 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 40.1 t -139.37 -27.24 0.8 Allowed 'General case' 0 CA--C 1.535 0.399 0 C-N-CA 125.04 1.336 . . . . 0.0 111.292 177.832 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 55' ' ' ASN . . . . . . . . . . . . . 16.7 p-10 -146.41 17.96 1.34 Allowed 'General case' 0 CA--C 1.534 0.331 0 C-N-CA 124.486 1.114 . . . . 0.0 113.397 -153.319 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 56' ' ' GLY . . . . . . . . . . . . . . . 81.12 22.69 60.5 Favored Glycine 0 CA--C 1.525 0.692 0 CA-C-N 118.818 0.736 . . . . 0.0 112.958 -177.266 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 57' ' ' GLU . . . . . . . . . . . . . 35.8 tt0 -146.58 142.4 27.93 Favored 'General case' 0 C--O 1.237 0.425 0 C-N-CA 124.954 1.302 . . . . 0.0 109.183 -174.084 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 58' ' ' LEU . . . . . . . . . . . . . 57.9 tp -122.77 102.17 7.88 Favored 'General case' 0 CA--C 1.53 0.181 0 C-N-CA 127.115 2.166 . . . . 0.0 110.668 176.706 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 59' ' ' THR . . . . . . . . . . . . . 13.6 p -88.18 167.35 13.68 Favored 'General case' 0 CA--C 1.54 0.564 0 C-N-CA 124.611 1.164 . . . . 0.0 109.898 164.692 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 60' ' ' ALA . . . . . . . . . . . . . . . -132.23 107.54 8.65 Favored 'General case' 0 CA--C 1.528 0.131 0 C-N-CA 124.934 1.294 . . . . 0.0 109.574 163.069 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 61' ' ' LYS . . . . . . . . . . . . . 12.8 mttt -67.24 6.78 0.51 Allowed 'General case' 0 CA--C 1.54 0.585 0 N-CA-C 115.355 1.613 . . . . 0.0 115.355 -173.016 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 62' ' ' GLY . . . . . . . . . . . . . . . -150.35 -71.11 0.01 OUTLIER Glycine 0 CA--C 1.522 0.48 0 CA-C-N 120.818 1.645 . . . . 0.0 109.417 179.877 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 63' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER 60.55 89.75 0.07 Allowed 'General case' 0 N--CA 1.444 -0.728 0 C-N-CA 129.993 3.317 . . . . 0.0 113.261 179.304 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 64' ' ' ALA . . . . . . . . . . . . . . . -75.97 103.37 6.0 Favored 'General case' 0 C--O 1.236 0.393 0 C-N-CA 124.88 1.272 . . . . 0.0 111.239 -178.141 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 65' ' ' MET . . . . . . . . . . . . . 5.2 mtt -108.21 168.67 9.14 Favored 'General case' 0 N--CA 1.466 0.361 0 C-N-CA 124.0 0.92 . . . . 0.0 112.211 172.523 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 66' ' ' THR . . . . . . . . . . . . . 72.5 p -107.34 -163.96 0.94 Allowed 'General case' 0 CA--C 1.54 0.57 0 C-N-CA 126.392 1.877 . . . . 0.0 111.167 -176.474 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 67' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -141.01 84.26 1.92 Allowed 'General case' 0 N--CA 1.467 0.378 0 C-N-CA 124.282 1.033 . . . . 0.0 109.685 172.604 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 68' ' ' MET . . . . . . . . . . . . . 51.0 mtm -134.79 176.83 8.29 Favored 'General case' 0 C--N 1.324 -0.529 0 C-N-CA 129.566 3.147 . . . . 0.0 108.536 -178.641 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 69' ' ' MET . . . . . . . . . . . . . 1.6 pmm? -134.31 177.57 7.66 Favored 'General case' 0 N--CA 1.451 -0.392 0 C-N-CA 126.766 2.026 . . . . 0.0 109.872 170.114 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 70' ' ' CYS . . . . . 1.286 ' SG ' ' SG ' ' A' ' 44' ' ' CYS . 65.6 m -143.57 149.48 37.46 Favored 'General case' 0 C--N 1.33 -0.265 0 C-N-CA 126.37 1.868 . . . . 0.0 109.081 -170.037 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 71' ' ' ALA . . . . . . . . . . . . . . . -77.73 20.68 0.33 Allowed 'General case' 0 CA--C 1.539 0.524 0 N-CA-C 114.098 1.147 . . . . 0.0 114.098 -169.188 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 72' ' ' ASN . . . . . . . . . . . . . 21.8 t30 -147.22 142.26 16.73 Favored Pre-proline 0 C--O 1.236 0.393 0 N-CA-C 106.087 -1.82 . . . . 0.0 106.087 162.425 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 73' ' ' PRO . . . . . . . . . . . . . 30.4 Cg_endo -70.85 -21.98 27.71 Favored 'Trans proline' 0 C--N 1.346 0.399 0 C-N-CA 122.329 2.019 . . . . 0.0 112.621 -172.089 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 74' ' ' GLN . . . . . . . . . . . . . 39.0 tt0 -52.97 -38.3 62.04 Favored 'General case' 0 CA--C 1.534 0.332 0 C-N-CA 124.001 0.921 . . . . 0.0 111.581 -179.111 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 75' ' ' LEU . . . . . . . . . . . . . 32.5 mt -76.58 -31.37 57.46 Favored 'General case' 0 CA--C 1.533 0.312 0 C-N-CA 123.677 0.791 . . . . 0.0 111.732 -178.768 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 76' ' ' ASN . . . . . . . . . . . . . 3.2 t-20 -79.82 -14.34 58.75 Favored 'General case' 0 N--CA 1.469 0.52 0 C-N-CA 125.25 1.42 . . . . 0.0 110.991 179.975 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 77' ' ' GLU . . . . . . . . . . . . . 5.5 mm-40 -80.99 -44.83 17.53 Favored 'General case' 0 C--O 1.236 0.372 0 C-N-CA 126.265 1.826 . . . . 0.0 109.867 163.101 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 78' ' ' LEU . . . . . . . . . . . . . 23.9 mt -66.06 -36.21 82.61 Favored 'General case' 0 CA--C 1.51 -0.562 0 O-C-N 121.658 -0.651 . . . . 0.0 112.482 -171.822 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 79' ' ' ASP . . . . . . . . . . . . . 0.0 OUTLIER -61.65 -34.99 76.66 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-O 119.155 -0.45 . . . . 0.0 111.49 176.033 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 80' ' ' ASN . . . . . . . . . . . . . 11.2 t30 -75.61 -48.59 21.55 Favored 'General case' 0 N--CA 1.447 -0.591 0 N-CA-C 108.595 -0.891 . . . . 0.0 108.595 179.618 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 81' ' ' THR . . . . . . . . . . . . . 36.6 m -46.79 -59.8 2.82 Favored 'General case' 0 N--CA 1.449 -0.511 0 C-N-CA 125.175 1.39 . . . . 0.0 109.212 176.976 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 82' ' ' ILE . . . . . . . . . . . . . 4.6 tp -69.33 -34.77 64.25 Favored 'Isoleucine or valine' 0 C--O 1.237 0.407 0 O-C-N 121.615 -0.678 . . . . 0.0 111.914 -172.865 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 83' ' ' SER . . . . . . . . . . . . . 0.6 OUTLIER -58.94 -47.36 85.34 Favored 'General case' 0 N--CA 1.452 -0.365 0 N-CA-C 109.166 -0.679 . . . . 0.0 109.166 179.594 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 84' ' ' GLU . . . . . 0.443 ' OE1' ' HE2' ' A' ' 105' ' ' LYS . 16.8 tt0 -67.21 -42.8 83.51 Favored 'General case' 0 N--CA 1.447 -0.591 0 C-N-CA 124.453 1.101 . . . . 0.0 110.689 -179.163 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 85' ' ' MET . . . . . . . . . . . . . 48.4 mtp -59.66 -47.91 83.73 Favored 'General case' 0 C--N 1.343 0.317 0 CA-C-N 119.611 1.096 . . . . 0.0 110.115 -174.89 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 86' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -76.57 -20.3 56.96 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-O 118.824 -0.608 . . . . 0.0 112.114 -175.702 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 87' ' ' LYS . . . . . . . . . . . . . 3.3 tptt -71.93 -37.36 70.05 Favored 'General case' 0 N--CA 1.45 -0.43 0 N-CA-C 109.027 -0.731 . . . . 0.0 109.027 174.462 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 88' ' ' GLU . . . . . . . . . . . . . 89.2 mt-10 -89.24 -28.74 19.73 Favored 'General case' 0 C--O 1.233 0.218 0 CA-C-O 117.76 -1.114 . . . . 0.0 112.895 -173.106 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 89' ' ' GLY . . . . . . . . . . . . . . . 112.52 97.25 2.32 Favored Glycine 0 C--N 1.337 0.603 0 N-CA-C 109.483 -1.447 . . . . 0.0 109.483 -176.472 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 90' ' ' ALA . . . . . . . . . . . . . . . -78.89 128.86 33.88 Favored 'General case' 0 N--CA 1.449 -0.489 0 N-CA-C 108.02 -1.104 . . . . 0.0 108.02 174.514 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 91' ' ' GLN . . . . . . . . . . . . . 2.6 mp0 -62.8 140.65 58.78 Favored 'General case' 0 C--N 1.327 -0.402 0 N-CA-C 107.334 -1.358 . . . . 0.0 107.334 169.015 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 92' ' ' VAL . . . . . 0.464 ' HA ' HD22 ' A' ' 101' ' ' LEU . 25.4 t -126.45 114.6 38.85 Favored 'Isoleucine or valine' 0 N--CA 1.444 -0.753 0 C-N-CA 125.623 1.569 . . . . 0.0 108.14 -172.399 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 93' ' ' ASP . . . . . . . . . . . . . 14.4 m-20 -137.37 72.21 1.42 Allowed 'General case' 0 CA--C 1.538 0.486 0 C-N-CA 126.568 1.947 . . . . 0.0 106.709 -179.213 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 94' ' ' LEU . . . . . . . . . . . . . 0.9 OUTLIER -74.93 107.82 7.26 Favored 'General case' 0 N--CA 1.464 0.265 0 N-CA-C 106.694 -1.595 . . . . 0.0 106.694 168.311 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 95' ' ' THR . . . . . . . . . . . . . 2.2 t -71.93 -164.51 0.13 Allowed 'General case' 0 CA--C 1.54 0.564 0 C-N-CA 125.062 1.345 . . . . 0.0 108.313 172.127 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 96' ' ' ALA . . . . . . . . . . . . . . . -44.56 -49.26 10.2 Favored 'General case' 0 CA--C 1.543 0.68 0 O-C-N 121.26 -0.9 . . . . 0.0 112.725 -177.665 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 97' ' ' ASN . . . . . . . . . . . . . 31.3 p30 -157.66 28.44 0.28 Allowed 'General case' 0 CA--C 1.542 0.662 0 C-N-CA 125.707 1.603 . . . . 0.0 113.28 -174.529 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 98' ' ' GLN . . . . . . . . . . . . . 11.4 tt0 -137.72 121.91 18.05 Favored 'General case' 0 N--CA 1.466 0.329 0 C-N-CA 124.924 1.289 . . . . 0.0 107.953 173.822 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 99' ' ' LEU . . . . . . . . . . . . . 6.8 tp -69.43 123.63 21.77 Favored 'General case' 0 N--CA 1.451 -0.378 0 N-CA-C 105.793 -1.928 . . . . 0.0 105.793 172.666 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 100' ' ' THR . . . . . . . . . . . . . 3.7 m -121.64 113.82 20.29 Favored 'General case' 0 N--CA 1.452 -0.336 0 N-CA-C 105.698 -1.964 . . . . 0.0 105.698 172.478 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 101' ' ' LEU . . . . . 0.464 HD22 ' HA ' ' A' ' 92' ' ' VAL . 0.2 OUTLIER -121.01 150.76 40.64 Favored 'General case' 0 C--O 1.234 0.271 0 N-CA-C 107.345 -1.354 . . . . 0.0 107.345 -177.387 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 102' ' ' ALA . . . . . . . . . . . . . . . -144.86 161.37 39.47 Favored 'General case' 0 C--N 1.33 -0.277 0 C-N-CA 124.988 1.315 . . . . 0.0 108.595 172.745 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 103' ' ' THR . . . . . 0.452 HG22 ' H ' ' A' ' 104' ' ' ALA . 2.9 m -155.78 -168.14 2.7 Favored 'General case' 0 N--CA 1.446 -0.656 0 C-N-CA 127.404 2.282 . . . . 0.0 105.331 170.178 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 104' ' ' ALA . . . . . 0.452 ' H ' HG22 ' A' ' 103' ' ' THR . . . -57.42 -46.56 83.37 Favored 'General case' 0 CA--C 1.535 0.396 0 O-C-N 120.313 -1.492 . . . . 0.0 110.971 161.874 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 105' ' ' LYS . . . . . 0.443 ' HE2' ' OE1' ' A' ' 84' ' ' GLU . 3.3 tmtt? -49.61 -64.8 0.7 Allowed 'General case' 0 N--CA 1.465 0.298 0 C-N-CA 125.257 1.423 . . . . 0.0 113.056 -170.685 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 106' ' ' GLN . . . . . . . . . . . . . 3.5 pt20 -166.83 -167.78 1.02 Allowed 'General case' 0 CA--C 1.536 0.411 0 C-N-CA 126.092 1.757 . . . . 0.0 108.437 -175.838 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 107' ' ' THR . . . . . . . . . . . . . 0.5 OUTLIER -124.0 149.05 46.47 Favored 'General case' 0 CA--C 1.533 0.324 0 N-CA-C 107.504 -1.295 . . . . 0.0 107.504 168.672 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 108' ' ' LEU . . . . . . . . . . . . . 9.5 mp -120.35 157.16 29.84 Favored 'General case' 0 C--O 1.239 0.53 0 C-N-CA 126.362 1.865 . . . . 0.0 108.979 178.307 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 109' ' ' THR . . . . . . . . . . . . . 3.5 m -136.69 93.4 2.86 Favored 'General case' 0 C--O 1.238 0.479 0 N-CA-C 108.935 -0.765 . . . . 0.0 108.935 176.14 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 110' ' ' TYR . . . . . . . . . . . . . 34.5 m-85 -90.21 155.92 18.68 Favored 'General case' 0 CA--C 1.534 0.337 0 CA-C-O 121.168 0.509 . . . . 0.0 109.795 172.451 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 111' ' ' LYS . . . . . . . . . . . . . 0.3 OUTLIER -108.83 143.66 37.73 Favored 'General case' 0 CA--C 1.518 -0.271 0 C-N-CA 124.857 1.263 . . . . 0.0 108.145 178.426 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 112' ' ' LEU . . . . . . . . . . . . . 45.8 tp -70.45 68.17 0.36 Allowed 'General case' 0 CA--C 1.543 0.689 0 C-N-CA 125.155 1.382 . . . . 0.0 109.578 168.158 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 113' ' ' ALA . . . . . . . . . . . . . . . -100.26 75.24 1.8 Allowed 'General case' 0 N--CA 1.464 0.265 0 N-CA-C 106.571 -1.64 . . . . 0.0 106.571 -179.956 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 114' ' ' ASP . . . . . . . . . . . . . 42.6 t0 -107.16 32.97 4.23 Favored 'General case' 0 C--N 1.326 -0.414 0 CA-C-O 121.539 0.685 . . . . 0.0 110.802 -160.256 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 115' ' ' LEU . . . . . . . . . . . . . 29.3 mt 63.71 12.2 6.42 Favored 'General case' 0 CA--C 1.535 0.366 0 C-N-CA 126.28 1.832 . . . . 0.0 113.322 173.67 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 116' ' ' MET . . . . . . . . . . . . . 0.3 OUTLIER -96.65 5.0 51.58 Favored 'General case' 0 C--N 1.33 -0.245 0 C-N-CA 125.051 1.341 . . . . 0.0 113.384 -175.634 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 117' ' ' ASN . . . . . . . . . . . . . 8.2 t-20 . . . . . 0 C--O 1.232 0.162 0 C-N-CA 124.14 0.976 . . . . 0.0 109.837 -173.968 . . . . . . . . 0 0 . 1 . 008 nuclear build full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 1.4 pmm? . . . . . 0 CA--C 1.536 0.427 0 N-CA-C 109.437 -0.579 . . . . 0.0 109.437 . . . . . . . . . 0 0 . 1 . 008 nuclear build full ' A' A ' 2' ' ' VAL . . . . . . . . . . . . . 6.7 p -72.34 153.37 7.74 Favored 'Isoleucine or valine' 0 C--O 1.236 0.357 0 N-CA-C 109.363 -0.606 . . . . 0.0 109.363 174.202 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 3' ' ' THR . . . . . . . . . . . . . 0.5 OUTLIER -132.79 159.15 73.74 Favored Pre-proline 0 CA--C 1.532 0.25 0 C-N-CA 124.053 0.941 . . . . 0.0 109.976 171.829 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 4' ' ' PRO . . . . . . . . . . . . . 55.4 Cg_endo -64.77 -34.28 50.63 Favored 'Trans proline' 0 C--N 1.345 0.358 0 C-N-CA 123.102 2.534 . . . . 0.0 111.341 -176.728 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 5' ' ' GLU . . . . . . . . . . . . . 19.2 tt0 -52.21 -55.31 21.94 Favored 'General case' 0 N--CA 1.449 -0.476 0 C-N-CA 125.471 1.508 . . . . 0.0 110.146 175.636 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 6' ' ' GLN . . . . . . . . . . . . . 11.8 pt20 -70.14 20.79 0.04 OUTLIER 'General case' 0 CA--C 1.543 0.694 0 N-CA-C 114.243 1.201 . . . . 0.0 114.243 176.039 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 7' ' ' LEU . . . . . . . . . . . . . 76.0 mt -129.54 -56.1 1.15 Allowed 'General case' 0 N--CA 1.461 0.119 0 C-N-CA 124.87 1.268 . . . . 0.0 110.922 178.435 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 8' ' ' GLN . . . . . . . . . . . . . 28.2 mt-30 -44.59 -8.73 0.01 OUTLIER 'General case' 0 N--CA 1.474 0.759 0 C-N-CA 129.257 3.023 . . . . 0.0 117.969 -178.159 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 9' ' ' HIS . . . . . . . . . . . . . 19.4 p80 -148.88 35.72 0.77 Allowed 'General case' 0 C--N 1.325 -0.473 0 C-N-CA 123.531 0.733 . . . . 0.0 112.276 177.651 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 10' ' ' HIS . . . . . . . . . . . . . 91.5 m-70 -130.86 165.1 23.77 Favored 'General case' 0 C--O 1.235 0.3 0 CA-C-O 121.626 0.727 . . . . 0.0 110.695 174.972 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 11' ' ' ARG . . . . . . . . . . . . . 60.3 ttt180 -128.94 139.46 52.1 Favored 'General case' 0 C--O 1.235 0.317 0 C-N-CA 126.252 1.821 . . . . 0.0 107.057 -173.606 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 12' ' ' PHE . . . . . . . . . . . . . 45.0 m-85 -137.43 112.28 8.93 Favored 'General case' 0 N--CA 1.441 -0.883 0 C-N-CA 125.181 1.392 . . . . 0.0 107.341 -164.684 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 13' ' ' VAL . . . . . . . . . . . . . 2.8 t -103.67 144.31 14.31 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.482 0 N-CA-C 106.709 -1.589 . . . . 0.0 106.709 -174.401 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 14' ' ' LEU . . . . . . . . . . . . . 11.5 tp -79.08 96.08 5.71 Favored 'General case' 0 N--CA 1.449 -0.494 0 N-CA-C 109.513 -0.551 . . . . 0.0 109.513 -169.834 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 1.4 mm-40 -76.3 -39.14 54.95 Favored 'General case' 0 N--CA 1.452 -0.344 0 CA-C-O 118.46 -0.781 . . . . 0.0 111.292 -170.943 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 2.6 t -156.03 156.73 34.92 Favored 'General case' 0 C--O 1.237 0.417 0 CA-C-N 119.721 1.146 . . . . 0.0 111.126 161.126 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 17' ' ' VAL . . . . . . . . . . . . . 21.3 t -86.3 171.66 1.12 Allowed 'Isoleucine or valine' 0 CA--C 1.534 0.331 0 C-N-CA 126.017 1.727 . . . . 0.0 107.504 172.519 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 18' ' ' ASN . . . . . . . . . . . . . 20.6 t30 -53.16 -35.59 59.95 Favored 'General case' 0 CA--C 1.53 0.195 0 C-N-CA 124.304 1.041 . . . . 0.0 112.494 166.393 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . -93.97 -54.16 1.67 Allowed Glycine 0 CA--C 1.525 0.659 0 C-N-CA 123.755 0.693 . . . . 0.0 112.806 -170.336 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 16.6 ptpt -160.0 163.83 21.45 Favored Pre-proline 0 N--CA 1.465 0.307 0 C-N-CA 125.665 1.586 . . . . 0.0 108.806 -174.723 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 21' ' ' PRO . . . . . . . . . . . . . 59.1 Cg_endo -70.93 171.21 16.2 Favored 'Trans proline' 0 N--CA 1.454 -0.815 0 CA-C-N 120.806 1.324 . . . . 0.0 110.973 170.67 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 22' ' ' VAL . . . . . . . . . . . . . 2.7 p -135.56 136.31 50.73 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.369 0 C-N-CA 126.552 1.941 . . . . 0.0 107.155 -178.155 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 23' ' ' THR . . . . . . . . . . . . . 0.8 OUTLIER -144.92 123.99 12.83 Favored 'General case' 0 C--O 1.238 0.459 0 N-CA-C 107.005 -1.48 . . . . 0.0 107.005 -175.398 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 24' ' ' SER . . . . . . . . . . . . . 14.7 m -123.26 41.25 3.52 Favored 'General case' 0 C--O 1.235 0.333 0 C-N-CA 124.957 1.303 . . . . 0.0 110.146 -163.958 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 25' ' ' ASP . . . . . . . . . . . . . 38.7 m-20 62.45 -78.46 0.03 OUTLIER 'General case' 0 C--O 1.234 0.254 0 C-N-CA 127.972 2.509 . . . . 0.0 108.582 -167.953 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 26' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -131.4 -8.58 3.72 Favored 'General case' 0 CA--C 1.523 -0.067 0 N-CA-C 115.684 1.735 . . . . 0.0 115.684 178.198 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 27' ' ' ASN . . . . . . . . . . . . . 13.2 m120 -115.41 75.91 4.92 Favored Pre-proline 0 N--CA 1.471 0.595 0 CA-C-N 120.167 1.349 . . . . 0.0 111.328 -175.624 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 28' ' ' PRO . . . . . . . . . . . . . 49.0 Cg_endo -66.53 162.41 36.93 Favored 'Trans proline' 0 CA--C 1.539 0.769 0 C-N-CA 123.392 2.728 . . . . 0.0 113.051 -177.611 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 29' ' ' PRO . . . . . . . . . . . . . 19.5 Cg_endo -66.04 64.85 0.45 Allowed 'Trans proline' 0 CA--C 1.54 0.802 0 C-N-CA 125.088 3.859 . . . . 0.0 113.443 170.833 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 30' ' ' GLU . . . . . . . . . . . . . 10.8 pt-20 -76.38 169.77 17.62 Favored 'General case' 0 CA--C 1.544 0.733 0 O-C-N 119.709 -1.869 . . . . 0.0 111.301 177.779 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 31' ' ' ILE . . . . . . . . . . . . . 16.8 tt -139.04 159.77 29.54 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.406 0 C-N-CA 127.212 2.205 . . . . 0.0 107.013 170.96 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 32' ' ' SER . . . . . . . . . . . . . 45.4 p -149.33 177.02 10.04 Favored 'General case' 0 N--CA 1.444 -0.773 0 C-N-CA 125.747 1.619 . . . . 0.0 107.345 167.453 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 33' ' ' PHE . . . . . . . . . . . . . 39.8 m-85 -134.65 148.8 50.45 Favored 'General case' 0 N--CA 1.447 -0.575 0 N-CA-C 106.458 -1.682 . . . . 0.0 106.458 175.284 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 34' ' ' GLY . . . . . . . . . . . . . . . -163.68 -176.23 35.4 Favored Glycine 0 N--CA 1.445 -0.749 0 N-CA-C 107.453 -2.259 . . . . 0.0 107.453 178.419 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 35' ' ' GLU . . . . . . . . . . . . 0.275 1.9 mt-10 47.36 -162.95 0.03 OUTLIER 'General case' 0 CA--C 1.538 0.506 0 C-N-CA 124.569 1.148 . . . . 0.0 110.083 -171.329 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 6.6 mmpt? -69.29 56.15 0.11 Allowed 'General case' 0 CA--C 1.546 0.791 0 O-C-N 119.207 -2.183 . . . . 0.0 112.644 -174.499 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 37' ' ' MET . . . . . . . . . . . . . 79.4 mmm 46.89 86.69 0.02 OUTLIER 'General case' 0 CA--C 1.539 0.549 0 C-N-CA 126.055 1.742 . . . . 0.0 110.401 -156.698 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 38' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -123.6 4.29 8.94 Favored 'General case' 0 N--CA 1.476 0.836 0 N-CA-C 114.062 1.134 . . . . 0.0 114.062 -175.489 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 39' ' ' ILE . . . . . . . . . . . . . 24.2 mt 46.92 133.47 0.0 OUTLIER 'Isoleucine or valine' 0 CA--C 1.539 0.555 1 C-N-CA 133.135 4.574 . . . . 0.0 111.963 179.888 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 40' ' ' SER . . . . . . . . . . . . . 8.3 m -140.2 101.95 4.26 Favored 'General case' 0 C--N 1.329 -0.31 0 O-C-N 120.163 -1.585 . . . . 0.0 107.227 178.792 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 41' ' ' GLY . . . . . . . . . . . . . . . -145.2 174.2 25.33 Favored Glycine 0 C--N 1.336 0.579 0 CA-C-N 118.841 0.746 . . . . 0.0 112.558 179.286 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 42' ' ' SER . . . . . . . . . . . . . 13.3 p -149.79 85.44 1.42 Allowed 'General case' 0 N--CA 1.451 -0.388 0 C-N-CA 123.108 0.563 . . . . 0.0 110.665 -178.635 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 43' ' ' MET . . . . . . . . . . . . . 3.4 mmt -59.52 -46.5 88.66 Favored 'General case' 0 N--CA 1.462 0.158 0 CA-C-O 122.081 0.943 . . . . 0.0 108.61 167.675 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 44' ' ' CYS . . . . . 1.305 ' SG ' ' SG ' ' A' ' 70' ' ' CYS . 36.5 t -149.32 -66.87 0.22 Allowed 'General case' 0 N--CA 1.442 -0.869 0 C-N-CA 125.178 1.391 . . . . 0.0 107.311 161.363 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 45' ' ' ASN . . . . . . . . . . . . . 3.0 m120 -87.23 22.42 2.11 Favored 'General case' 0 C--N 1.327 -0.387 0 C-N-CA 124.244 1.018 . . . . 0.0 111.884 -155.792 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 46' ' ' ARG . . . . . . . . . . . . . 7.0 mmm180 51.41 162.26 0.0 OUTLIER 'General case' 0 N--CA 1.465 0.291 0 C-N-CA 127.461 2.304 . . . . 0.0 113.09 -162.853 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 47' ' ' PHE . . . . . . . . . . . . . 49.6 p90 -163.64 163.74 24.26 Favored 'General case' 0 C--N 1.324 -0.521 0 C-N-CA 124.826 1.251 . . . . 0.0 109.521 170.03 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 48' ' ' SER . . . . . . . . . . . . . 6.2 m -158.79 165.66 33.75 Favored 'General case' 0 N--CA 1.44 -0.94 0 C-N-CA 126.866 2.066 . . . . 0.0 108.113 173.134 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 49' ' ' GLY . . . . . . . . . . . . . . . -178.59 167.71 38.32 Favored Glycine 0 CA--C 1.519 0.31 0 N-CA-C 110.354 -1.098 . . . . 0.0 110.354 166.981 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 50' ' ' GLU . . . . . . . . . . . . . 32.6 mt-10 -61.69 98.46 0.09 Allowed 'General case' 0 C--N 1.33 -0.253 0 N-CA-C 109.3 -0.629 . . . . 0.0 109.3 176.621 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 51' ' ' GLY . . . . . . . . . . . . . . . -60.14 -67.91 1.93 Allowed Glycine 0 C--N 1.335 0.475 0 O-C-N 124.485 1.116 . . . . 0.0 110.998 -176.94 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 52' ' ' LYS . . . . . . . . . . . . . 0.4 OUTLIER 64.49 164.27 0.14 Allowed 'General case' 0 N--CA 1.453 -0.282 0 C-N-CA 125.173 1.389 . . . . 0.0 109.187 -166.73 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 53' ' ' LEU . . . . . . . . . . . . . 5.9 tp -164.58 111.08 1.02 Allowed 'General case' 0 N--CA 1.45 -0.435 0 N-CA-C 107.429 -1.322 . . . . 0.0 107.429 164.065 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 1.4 t -148.95 -11.59 0.32 Allowed 'General case' 0 C--O 1.234 0.282 0 CA-C-O 117.561 -1.209 . . . . 0.0 112.701 178.087 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 55' ' ' ASN . . . . . . . . . . . . . 0.8 OUTLIER -156.96 46.87 0.42 Allowed 'General case' 0 CA--C 1.538 0.501 0 C-N-CA 124.897 1.279 . . . . 0.0 109.347 -170.201 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 56' ' ' GLY . . . . . . . . . . . . . . . 66.65 5.87 32.87 Favored Glycine 0 CA--C 1.533 1.192 0 N-CA-C 115.968 1.147 . . . . 0.0 115.968 170.425 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 57' ' ' GLU . . . . . . . . . . . . . 18.3 tt0 -132.6 110.61 10.56 Favored 'General case' 0 C--O 1.239 0.504 0 CA-C-N 118.579 1.189 . . . . 0.0 109.183 -164.633 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 58' ' ' LEU . . . . . . . . . . . . . 27.2 tp -89.69 104.44 17.0 Favored 'General case' 0 C--O 1.234 0.267 0 C-N-CA 126.364 1.866 . . . . 0.0 108.148 177.912 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 59' ' ' THR . . . . . . . . . . . . . 0.8 OUTLIER -91.72 168.91 11.14 Favored 'General case' 0 C--N 1.327 -0.393 0 CA-C-O 121.809 0.814 . . . . 0.0 110.302 169.706 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 60' ' ' ALA . . . . . . . . . . . . . . . -123.52 131.62 53.68 Favored 'General case' 0 N--CA 1.45 -0.426 0 N-CA-C 107.173 -1.417 . . . . 0.0 107.173 148.593 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 61' ' ' LYS . . . . . . . . . . . . . 24.3 ttmt -79.54 82.6 5.64 Favored 'General case' 0 N--CA 1.454 -0.24 0 N-CA-C 107.841 -1.17 . . . . 0.0 107.841 173.909 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 62' ' ' GLY . . . . . . . . . . . . . . . 103.99 -48.68 0.98 Allowed Glycine 0 CA--C 1.529 0.958 0 CA-C-O 118.827 -0.985 . . . . 0.0 113.044 174.402 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 63' ' ' LEU . . . . . . . . . . . . . 3.5 tp 64.88 106.29 0.03 OUTLIER 'General case' 0 N--CA 1.442 -0.86 0 C-N-CA 130.804 3.642 . . . . 0.0 113.777 -176.789 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 64' ' ' ALA . . . . . . . . . . . . . . . -77.69 146.25 36.13 Favored 'General case' 0 CA--C 1.533 0.291 0 N-CA-C 108.961 -0.755 . . . . 0.0 108.961 171.206 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 65' ' ' MET . . . . . . . . . . . . . 76.0 mtp -140.83 -164.91 1.83 Allowed 'General case' 0 CA--C 1.542 0.668 0 C-N-CA 126.58 1.952 . . . . 0.0 108.491 179.261 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 66' ' ' THR . . . . . . . . . . . . . 27.2 p -130.76 -165.89 1.62 Allowed 'General case' 0 N--CA 1.472 0.625 0 CA-C-N 120.062 1.301 . . . . 0.0 109.909 168.149 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 67' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -136.55 76.92 1.62 Allowed 'General case' 0 C--O 1.233 0.188 0 C-N-CA 126.167 1.787 . . . . 0.0 108.822 -179.199 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 68' ' ' MET . . . . . . . . . . . . . 15.3 ptp -124.51 158.23 33.41 Favored 'General case' 0 CA--C 1.533 0.323 0 C-N-CA 124.297 1.039 . . . . 0.0 111.97 -177.028 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 69' ' ' MET . . . . . . . . . . . . . 0.1 OUTLIER -73.97 162.31 29.18 Favored 'General case' 0 CA--C 1.533 0.305 0 C-N-CA 123.643 0.777 . . . . 0.0 109.424 171.432 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 70' ' ' CYS . . . . . 1.305 ' SG ' ' SG ' ' A' ' 44' ' ' CYS . 1.2 m -119.01 -179.53 3.85 Favored 'General case' 0 CA--C 1.537 0.476 0 C-N-CA 126.284 1.834 . . . . 0.0 108.692 161.551 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 71' ' ' ALA . . . . . . . . . . . . . . . -82.79 -26.6 31.65 Favored 'General case' 0 CA--C 1.535 0.393 0 C-N-CA 124.555 1.142 . . . . 0.0 111.615 166.012 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 72' ' ' ASN . . . . . . . . . . . . . 1.2 m-20 -119.97 152.67 54.43 Favored Pre-proline 0 N--CA 1.467 0.397 0 C-N-CA 123.962 0.905 . . . . 0.0 110.474 -172.167 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 73' ' ' PRO . . . . . . . . . . . . . 49.0 Cg_endo -70.39 -46.2 1.04 Allowed 'Trans proline' 0 N--CA 1.458 -0.585 0 C-N-CA 124.008 3.138 . . . . 0.0 111.198 173.146 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 74' ' ' GLN . . . . . . . . . . . . . 64.3 tt0 -51.31 -35.34 37.38 Favored 'General case' 0 C--O 1.221 -0.424 0 C-N-CA 123.569 0.748 . . . . 0.0 110.85 -174.172 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 75' ' ' LEU . . . . . 0.402 ' HB3' ' HB2' ' A' ' 44' ' ' CYS . 87.5 mt -66.33 -38.88 88.7 Favored 'General case' 0 CA--C 1.538 0.519 0 C-N-CA 123.686 0.794 . . . . 0.0 111.701 -177.373 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 76' ' ' ASN . . . . . . . . . . . . . 3.0 m-80 -79.07 -20.46 48.74 Favored 'General case' 0 N--CA 1.475 0.791 0 CA-C-N 119.506 1.048 . . . . 0.0 111.478 174.994 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 77' ' ' GLU . . . . . . . . . . . . . 0.7 OUTLIER -65.48 -38.18 89.02 Favored 'General case' 0 CA--C 1.545 0.766 0 O-C-N 121.056 -1.027 . . . . 0.0 109.48 164.918 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 78' ' ' LEU . . . . . . . . . . . . . 32.4 mt -80.34 -17.62 51.47 Favored 'General case' 0 N--CA 1.453 -0.3 0 CA-C-O 118.039 -0.982 . . . . 0.0 113.364 -174.847 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 79' ' ' ASP . . . . . . . . . . . . . 4.8 t70 -46.72 -57.52 4.76 Favored 'General case' 0 N--CA 1.469 0.476 0 C-N-CA 125.165 1.386 . . . . 0.0 109.406 162.511 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 80' ' ' ASN . . . . . . . . . . . . . 69.8 m-80 -74.48 -36.8 63.3 Favored 'General case' 0 N--CA 1.448 -0.544 0 CA-C-N 115.258 -0.883 . . . . 0.0 108.973 -171.818 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 81' ' ' THR . . . . . . . . . . . . . 28.0 m -54.49 -51.03 66.36 Favored 'General case' 0 CA--C 1.54 0.579 0 C-N-CA 124.052 0.941 . . . . 0.0 110.117 177.679 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 82' ' ' ILE . . . . . . . . . . . . . 7.0 tp -73.86 -33.27 36.7 Favored 'Isoleucine or valine' 0 C--N 1.345 0.385 0 CA-C-N 119.719 1.145 . . . . 0.0 111.015 -179.251 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 83' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -58.4 -53.24 60.58 Favored 'General case' 0 C--O 1.236 0.371 0 N-CA-C 108.832 -0.803 . . . . 0.0 108.832 178.713 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 84' ' ' GLU . . . . . . . . . . . . . 14.2 tp10 -75.6 -3.01 31.97 Favored 'General case' 0 CA--C 1.542 0.64 0 C-N-CA 124.873 1.269 . . . . 0.0 112.07 -174.667 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 85' ' ' MET . . . . . . . . . . . . . 84.7 mtp -107.45 -5.16 17.83 Favored 'General case' 0 CA--C 1.535 0.383 0 C-N-CA 124.338 1.055 . . . . 0.0 113.212 174.307 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 86' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -105.55 -22.86 12.9 Favored 'General case' 0 N--CA 1.475 0.802 0 CA-C-N 120.639 1.563 . . . . 0.0 111.628 173.818 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 87' ' ' LYS . . . . . . . . . . . . . 8.1 tttm -68.36 -44.6 74.88 Favored 'General case' 0 CA--C 1.543 0.707 0 N-CA-C 110.172 -0.307 . . . . 0.0 110.172 -169.035 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 88' ' ' GLU . . . . . . . . . . . . . 35.4 mt-10 -82.36 -14.67 54.89 Favored 'General case' 0 N--CA 1.468 0.425 0 C-N-CA 126.562 1.945 . . . . 0.0 112.265 177.581 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 89' ' ' GLY . . . . . . . . . . . . . . . 98.54 105.03 2.49 Favored Glycine 0 C--N 1.337 0.617 0 N-CA-C 110.572 -1.011 . . . . 0.0 110.572 -175.934 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 90' ' ' ALA . . . . . . . . . . . . . . . -74.16 138.08 43.58 Favored 'General case' 0 C--O 1.232 0.15 0 N-CA-C 108.596 -0.89 . . . . 0.0 108.596 171.57 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 91' ' ' GLN . . . . . . . . . . . . . 0.4 OUTLIER -64.81 129.05 38.3 Favored 'General case' 0 C--O 1.239 0.542 0 N-CA-C 105.231 -2.137 . . . . 0.0 105.231 161.039 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 92' ' ' VAL . . . . . . . . . . . . . 7.6 p -125.53 107.69 18.31 Favored 'Isoleucine or valine' 0 N--CA 1.447 -0.588 0 N-CA-C 106.762 -1.57 . . . . 0.0 106.762 -170.235 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 93' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -122.17 81.63 1.86 Allowed 'General case' 0 C--N 1.324 -0.521 0 N-CA-C 106.716 -1.587 . . . . 0.0 106.716 -179.213 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 94' ' ' LEU . . . . . . . . . . . . . 2.3 tm? -82.9 98.52 9.24 Favored 'General case' 0 CA--C 1.51 -0.572 0 N-CA-C 106.034 -1.839 . . . . 0.0 106.034 166.961 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 95' ' ' THR . . . . . . . . . . . . . 3.1 m -83.05 170.87 14.38 Favored 'General case' 0 C--N 1.316 -0.868 0 CA-C-N 112.195 -2.275 . . . . 0.0 106.182 172.501 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 96' ' ' ALA . . . . . . . . . . . . . . . -44.84 -32.63 1.64 Allowed 'General case' 0 CA--C 1.545 0.761 0 N-CA-C 116.395 1.998 . . . . 0.0 116.395 -160.877 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 97' ' ' ASN . . . . . . . . . . . . . 0.2 OUTLIER -141.11 9.69 2.12 Favored 'General case' 0 N--CA 1.472 0.665 0 CA-C-N 120.74 1.609 . . . . 0.0 113.035 173.16 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 98' ' ' GLN . . . . . . . . . . . . . 12.9 tt0 -143.5 129.79 19.87 Favored 'General case' 0 CA--C 1.52 -0.182 0 O-C-N 120.484 -1.385 . . . . 0.0 109.216 -169.874 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 99' ' ' LEU . . . . . 0.677 HD22 ' CD2' ' A' ' 101' ' ' LEU . 0.4 OUTLIER -91.34 123.12 34.54 Favored 'General case' 0 N--CA 1.444 -0.765 0 C-N-CA 125.298 1.439 . . . . 0.0 109.045 179.642 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 100' ' ' THR . . . . . . . . . . . . . 79.7 m -98.87 115.87 29.82 Favored 'General case' 0 C--N 1.323 -0.584 0 C-N-CA 125.883 1.673 . . . . 0.0 106.495 165.83 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 101' ' ' LEU . . . . . 0.677 ' CD2' HD22 ' A' ' 99' ' ' LEU . 1.4 mm? -110.7 126.22 54.31 Favored 'General case' 0 CA--C 1.501 -0.924 0 N-CA-C 106.649 -1.612 . . . . 0.0 106.649 171.356 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 102' ' ' ALA . . . . . . . . . . . . . . . -138.02 153.21 49.4 Favored 'General case' 0 C--N 1.323 -0.545 0 O-C-N 124.396 1.06 . . . . 0.0 109.807 174.171 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 103' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -160.51 174.08 14.59 Favored 'General case' 0 N--CA 1.443 -0.78 0 C-N-CA 126.026 1.731 . . . . 0.0 108.04 177.526 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 104' ' ' ALA . . . . . . . . . . . . . . . -53.09 -34.6 57.35 Favored 'General case' 0 C--O 1.231 0.079 0 C-N-CA 123.662 0.785 . . . . 0.0 112.731 173.915 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 105' ' ' LYS . . . . . . . . . . . . . 1.6 mmpm? -62.84 -80.57 0.03 OUTLIER 'General case' 0 N--CA 1.455 -0.179 0 CA-C-N 118.545 0.611 . . . . 0.0 111.178 172.635 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 106' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -150.38 -172.73 4.25 Favored 'General case' 0 N--CA 1.453 -0.304 0 C-N-CA 125.812 1.645 . . . . 0.0 108.241 -164.523 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 107' ' ' THR . . . . . . . . . . . . . 15.3 t -144.36 145.78 32.16 Favored 'General case' 0 N--CA 1.451 -0.389 0 C-N-CA 124.826 1.25 . . . . 0.0 108.303 -174.895 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 108' ' ' LEU . . . . . . . . . . . . . 4.2 mp -134.4 162.16 32.99 Favored 'General case' 0 N--CA 1.449 -0.491 0 C-N-CA 128.018 2.527 . . . . 0.0 108.725 -165.788 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 109' ' ' THR . . . . . . . . . . . . . 57.8 m -133.66 110.3 9.77 Favored 'General case' 0 C--N 1.329 -0.315 0 N-CA-C 107.744 -1.206 . . . . 0.0 107.744 171.455 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 110' ' ' TYR . . . . . . . . . . . . . 95.2 m-85 -98.93 161.4 13.65 Favored 'General case' 0 N--CA 1.453 -0.301 0 N-CA-C 108.608 -0.886 . . . . 0.0 108.608 167.787 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 111' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -123.06 133.36 54.32 Favored 'General case' 0 CA--C 1.517 -0.316 0 CA-C-O 117.964 -1.017 . . . . 0.0 108.338 -175.614 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 112' ' ' LEU . . . . . . . . . . . . . 28.0 tp -58.8 103.47 0.17 Allowed 'General case' 0 C--O 1.232 0.175 0 N-CA-C 107.018 -1.475 . . . . 0.0 107.018 167.567 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 113' ' ' ALA . . . . . . . . . . . . . . . -147.17 77.03 1.44 Allowed 'General case' 0 C--N 1.33 -0.275 0 N-CA-C 107.267 -1.383 . . . . 0.0 107.267 -175.577 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 114' ' ' ASP . . . . . . . . . . . . 0.251 56.9 p30 -103.46 58.21 0.75 Allowed 'General case' 0 C--N 1.331 -0.199 0 CA-C-O 124.205 1.955 . . . . 0.0 112.02 -173.927 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 115' ' ' LEU . . . . . 0.415 ' H ' HD23 ' A' ' 115' ' ' LEU . 0.0 OUTLIER -64.6 3.83 0.46 Allowed 'General case' 0 CA--C 1.535 0.403 0 C-N-CA 128.659 2.784 . . . . 0.0 113.861 170.875 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 116' ' ' MET . . . . . . . . . . . . . 7.5 ttp -166.08 143.84 5.51 Favored 'General case' 0 N--CA 1.443 -0.824 0 C-N-CA 130.545 3.538 . . . . 0.0 105.571 176.63 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 117' ' ' ASN . . . . . . . . . . . . . 0.7 OUTLIER . . . . . 0 CA--C 1.532 0.279 0 C-N-CA 124.602 1.161 . . . . 0.0 109.865 -175.95 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 11.6 ttp . . . . . 0 CA--C 1.534 0.346 0 N-CA-C 113.226 0.825 . . . . 0.0 113.226 . . . . . . . . . 0 0 . 1 . 009 nuclear build full ' A' A ' 2' ' ' VAL . . . . . 0.432 HG22 HD11 ' A' ' 7' ' ' LEU . 7.1 p 42.96 66.85 0.12 Allowed 'Isoleucine or valine' 0 C--N 1.334 -0.109 0 C-N-CA 124.744 1.218 . . . . 0.0 111.233 145.581 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 3' ' ' THR . . . . . . . . . . . . . 71.5 p -79.86 161.72 65.12 Favored Pre-proline 0 C--N 1.328 -0.363 0 C-N-CA 118.034 -1.466 . . . . 0.0 108.976 -167.599 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 4' ' ' PRO . . . . . . . . . . . . . 15.7 Cg_endo -54.37 -42.3 68.94 Favored 'Trans proline' 0 CA--C 1.532 0.411 0 C-N-CA 122.236 1.957 . . . . 0.0 112.644 175.066 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 5' ' ' GLU . . . . . . . . . . . . . 1.2 tm-20 -51.13 -60.61 2.91 Favored 'General case' 0 C--N 1.329 -0.322 0 C-N-CA 126.068 1.747 . . . . 0.0 111.539 -175.951 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 6' ' ' GLN . . . . . . . . . . . . . 18.1 pt20 -66.03 15.42 0.03 OUTLIER 'General case' 0 CA--C 1.54 0.558 0 C-N-CA 127.333 2.253 . . . . 0.0 114.242 -177.711 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 7' ' ' LEU . . . . . 0.432 HD11 HG22 ' A' ' 2' ' ' VAL . 67.3 mt -133.93 -48.03 0.8 Allowed 'General case' 0 CA--C 1.522 -0.115 0 C-N-CA 125.345 1.458 . . . . 0.0 111.254 -172.57 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 8' ' ' GLN . . . . . . . . . . . . . 17.5 mt-30 -57.74 -4.1 0.26 Allowed 'General case' 0 CA--C 1.543 0.701 0 N-CA-C 115.681 1.734 . . . . 0.0 115.681 -179.54 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 9' ' ' HIS . . . . . . . . . . . . . 9.4 m-70 -133.26 15.4 4.15 Favored 'General case' 0 CA--C 1.538 0.511 0 C-N-CA 124.569 1.148 . . . . 0.0 112.624 174.333 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 10' ' ' HIS . . . . . . . . . . . . . 63.8 m-70 -130.55 109.99 11.09 Favored 'General case' 0 CA--C 1.539 0.554 0 C-N-CA 125.136 1.374 . . . . 0.0 109.885 -169.118 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 11' ' ' ARG . . . . . . . . . . . . . 32.3 ttt180 -68.64 150.69 47.66 Favored 'General case' 0 N--CA 1.474 0.732 0 C-N-CA 125.231 1.412 . . . . 0.0 110.765 175.127 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 12' ' ' PHE . . . . . . . . . . . . . 23.0 m-85 -136.48 157.55 46.52 Favored 'General case' 0 N--CA 1.451 -0.411 0 CA-C-O 121.693 0.758 . . . . 0.0 109.3 169.351 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 13' ' ' VAL . . . . . . . . . . . . . 11.4 p -132.97 150.59 33.04 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.336 0 O-C-N 120.992 -1.068 . . . . 0.0 109.958 175.754 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 14' ' ' LEU . . . . . . . . . . . . . 30.6 tp -80.1 97.57 6.91 Favored 'General case' 0 N--CA 1.454 -0.258 0 N-CA-C 108.001 -1.111 . . . . 0.0 108.001 177.53 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 3.1 mm-40 -68.24 -55.96 10.38 Favored 'General case' 0 C--N 1.323 -0.546 0 C-N-CA 125.184 1.393 . . . . 0.0 109.584 172.737 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 6.1 p -148.56 164.53 33.96 Favored 'General case' 0 N--CA 1.449 -0.478 0 CA-C-O 122.445 1.117 . . . . 0.0 110.219 -175.75 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 17' ' ' VAL . . . . . 0.463 HG12 ' H ' ' A' ' 18' ' ' ASN . 1.7 t -109.78 -164.64 0.21 Allowed 'Isoleucine or valine' 0 N--CA 1.445 -0.681 0 N-CA-C 104.892 -2.262 . . . . 0.0 104.892 -172.07 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 18' ' ' ASN . . . . . 0.463 ' H ' HG12 ' A' ' 17' ' ' VAL . 2.0 p-10 -44.47 -38.48 4.12 Favored 'General case' 0 CA--C 1.538 0.482 0 C-N-CA 126.902 2.081 . . . . 0.0 113.485 -171.465 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . -141.78 -44.89 0.06 OUTLIER Glycine 0 CA--C 1.523 0.543 0 C-N-CA 125.22 1.39 . . . . 0.0 110.539 169.616 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 0.5 OUTLIER -81.14 158.07 70.2 Favored Pre-proline 0 CA--C 1.534 0.336 0 C-N-CA 123.857 0.863 . . . . 0.0 111.472 -170.11 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 21' ' ' PRO . . . . . . . . . . . . . 80.2 Cg_endo -79.21 172.58 14.52 Favored 'Trans proline' 0 N--CA 1.457 -0.655 0 C-N-CA 123.223 2.615 . . . . 0.0 110.954 178.803 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 22' ' ' VAL . . . . . . . . . . . . . 88.7 t -94.81 157.17 3.08 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.422 0 N-CA-C 107.691 -1.226 . . . . 0.0 107.691 162.938 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 23' ' ' THR . . . . . . . . . . . . . 7.5 p -134.58 87.83 2.39 Favored 'General case' 0 N--CA 1.444 -0.75 0 N-CA-C 107.35 -1.352 . . . . 0.0 107.35 166.513 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 24' ' ' SER . . . . . 0.458 ' HB3' ' HA ' ' A' ' 28' ' ' PRO . 0.6 OUTLIER -159.89 135.19 8.16 Favored 'General case' 0 N--CA 1.447 -0.612 0 N-CA-C 105.669 -1.975 . . . . 0.0 105.669 172.234 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 25' ' ' ASP . . . . . . . . . . . . . 54.9 t0 -136.41 -42.18 0.63 Allowed 'General case' 0 C--N 1.324 -0.523 0 C-N-CA 126.678 1.991 . . . . 0.0 108.959 -174.086 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 26' ' ' LYS . . . . . . . . . . . . . 17.9 pttt -48.45 -45.98 37.25 Favored 'General case' 0 CA--C 1.516 -0.349 0 C-N-CA 125.496 1.518 . . . . 0.0 111.797 177.79 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 27' ' ' ASN . . . . . . . . . . . . . 0.2 OUTLIER -162.14 87.07 1.49 Allowed Pre-proline 0 C--N 1.325 -0.486 0 C-N-CA 130.022 3.329 . . . . 0.0 107.443 174.319 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 28' ' ' PRO . . . . . 0.458 ' HA ' ' HB3' ' A' ' 24' ' ' SER . 17.0 Cg_endo -60.03 162.2 17.1 Favored 'Trans proline' 0 C--N 1.349 0.583 0 C-N-CA 122.972 2.448 . . . . 0.0 113.737 177.154 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 29' ' ' PRO . . . . . . . . . . . . . 17.9 Cg_endo -60.69 103.15 0.21 Allowed 'Trans proline' 0 N--CA 1.445 -1.359 0 C-N-CA 122.104 1.869 . . . . 0.0 108.401 152.388 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 30' ' ' GLU . . . . . . . . . . . . . 20.2 pt-20 -126.11 170.27 11.94 Favored 'General case' 0 C--N 1.323 -0.584 0 C-N-CA 125.578 1.551 . . . . 0.0 109.708 -179.905 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 31' ' ' ILE . . . . . 0.501 HD11 ' CG2' ' A' ' 39' ' ' ILE . 15.7 tt -141.15 157.02 22.24 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.412 0 N-CA-C 107.883 -1.154 . . . . 0.0 107.883 177.66 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 32' ' ' SER . . . . . . . . . . . . . 8.2 t -149.84 171.92 15.99 Favored 'General case' 0 C--N 1.323 -0.572 0 N-CA-C 106.64 -1.615 . . . . 0.0 106.64 166.2 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 33' ' ' PHE . . . . . . . . . . . . . 67.5 m-85 -141.07 168.21 20.34 Favored 'General case' 0 N--CA 1.447 -0.583 0 C-N-CA 124.004 0.921 . . . . 0.0 109.415 -173.895 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 34' ' ' GLY . . . . . . . . . . . . . . . -168.6 -165.0 25.26 Favored Glycine 0 C--N 1.332 0.345 0 C-N-CA 125.549 1.547 . . . . 0.0 109.332 168.092 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 35' ' ' GLU . . . . . . . . . . . . . 1.1 tm-20 -47.33 156.89 0.23 Allowed 'General case' 0 C--N 1.326 -0.445 0 C-N-CA 126.961 2.104 . . . . 0.0 112.96 -171.222 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 29.6 mtmm 52.59 26.52 4.39 Favored 'General case' 0 CA--C 1.531 0.221 0 C-N-CA 124.606 1.162 . . . . 0.0 112.015 -164.193 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 37' ' ' MET . . . . . . . . . . . . . 10.4 mmm 56.91 26.45 11.73 Favored 'General case' 0 CA--C 1.54 0.594 0 C-N-CA 124.3 1.04 . . . . 0.0 109.885 178.873 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 38' ' ' MET . . . . . . . . . . . . . 19.0 mtp -54.67 151.47 8.15 Favored 'General case' 0 N--CA 1.45 -0.437 0 C-N-CA 123.798 0.839 . . . . 0.0 110.113 176.473 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 39' ' ' ILE . . . . . 0.501 ' CG2' HD11 ' A' ' 31' ' ' ILE . 9.8 mt -134.13 116.22 22.5 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.465 0 N-CA-C 105.101 -2.185 . . . . 0.0 105.101 -176.664 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 40' ' ' SER . . . . . . . . . . . . . 66.8 m -141.7 119.63 11.96 Favored 'General case' 0 C--N 1.328 -0.33 0 N-CA-C 108.418 -0.956 . . . . 0.0 108.418 -172.479 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 41' ' ' GLY . . . . . . . . . . . . . . . -156.84 -165.36 14.73 Favored Glycine 0 CA--C 1.525 0.663 0 C-N-CA 124.42 1.009 . . . . 0.0 111.565 -171.111 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 42' ' ' SER . . . . . . . . . . . . . 28.7 t -157.43 123.37 4.74 Favored 'General case' 0 CA--C 1.511 -0.524 0 O-C-N 121.808 -0.819 . . . . 0.0 108.942 165.792 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 43' ' ' MET . . . . . . . . . . . . . 5.1 mmm -86.65 -43.15 12.86 Favored 'General case' 0 N--CA 1.45 -0.448 0 O-C-N 124.15 0.906 . . . . 0.0 111.18 160.142 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 44' ' ' CYS . . . . . 1.28 ' SG ' ' SG ' ' A' ' 70' ' ' CYS . 54.0 t -157.15 -71.23 0.1 Allowed 'General case' 0 CA--C 1.534 0.346 0 N-CA-C 107.413 -1.329 . . . . 0.0 107.413 177.907 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 45' ' ' ASN . . . . . . . . . . . . . 33.2 m-80 -77.66 26.81 0.17 Allowed 'General case' 0 N--CA 1.472 0.653 0 C-N-CA 127.488 2.315 . . . . 0.0 113.19 -179.054 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 46' ' ' ARG . . . . . . . . . . . . . 34.3 mtp85 53.08 -170.15 0.04 OUTLIER 'General case' 0 C--N 1.332 -0.194 0 C-N-CA 125.972 1.709 . . . . 0.0 108.973 -169.51 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 47' ' ' PHE . . . . . . . . . . . . . 29.6 p90 -178.99 153.11 0.6 Allowed 'General case' 0 C--O 1.238 0.493 0 C-N-CA 126.764 2.025 . . . . 0.0 108.516 160.753 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 48' ' ' SER . . . . . . . . . . . . . 6.3 p -163.93 143.13 7.85 Favored 'General case' 0 N--CA 1.449 -0.518 0 CA-C-O 117.695 -1.145 . . . . 0.0 110.669 179.184 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 49' ' ' GLY . . . . . . . . . . . . . . . -177.6 163.66 32.26 Favored Glycine 0 C--N 1.337 0.614 0 CA-C-N 119.647 1.112 . . . . 0.0 110.864 177.541 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 50' ' ' GLU . . . . . . . . . . . . . 38.1 mt-10 -75.84 100.45 4.78 Favored 'General case' 0 C--O 1.235 0.315 0 N-CA-C 109.241 -0.651 . . . . 0.0 109.241 173.902 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 51' ' ' GLY . . . . . . . . . . . . . . . -66.17 166.81 36.66 Favored Glycine 0 CA--C 1.529 0.921 0 CA-C-O 121.87 0.706 . . . . 0.0 112.343 170.199 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 52' ' ' LYS . . . . . . . . . . . . . 0.5 OUTLIER -132.71 143.16 49.43 Favored 'General case' 0 C--N 1.328 -0.356 0 C-N-CA 126.422 1.889 . . . . 0.0 107.301 165.982 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 53' ' ' LEU . . . . . . . . . . . . . 32.8 tp -156.66 151.77 26.3 Favored 'General case' 0 C--O 1.235 0.292 0 C-N-CA 126.286 1.834 . . . . 0.0 107.508 176.144 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 11.7 t -161.66 -24.26 0.05 Allowed 'General case' 0 CA--C 1.538 0.5 0 C-N-CA 124.818 1.247 . . . . 0.0 111.424 173.72 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 55' ' ' ASN . . . . . . . . . . . . . 17.8 p-10 -153.71 28.53 0.48 Allowed 'General case' 0 CA--C 1.54 0.562 0 C-N-CA 126.332 1.853 . . . . 0.0 112.304 -148.367 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 56' ' ' GLY . . . . . . . . . . . . . . . 71.89 27.12 71.2 Favored Glycine 0 CA--C 1.534 1.221 0 O-C-N 120.918 -1.114 . . . . 0.0 112.271 -177.721 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 57' ' ' GLU . . . . . . . . . . . . . 29.8 tt0 -135.02 142.83 46.5 Favored 'General case' 0 CA--C 1.533 0.303 0 N-CA-C 107.929 -1.138 . . . . 0.0 107.929 173.403 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 58' ' ' LEU . . . . . . . . . . . . . 31.7 tp -134.33 101.66 5.08 Favored 'General case' 0 C--O 1.234 0.287 0 C-N-CA 125.805 1.642 . . . . 0.0 109.403 -172.467 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 59' ' ' THR . . . . . . . . . . . . . 4.4 p -106.02 145.22 31.65 Favored 'General case' 0 C--N 1.328 -0.342 0 C-N-CA 124.345 1.058 . . . . 0.0 109.854 175.213 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 60' ' ' ALA . . . . . . . . . . . . . . . -95.41 130.06 42.34 Favored 'General case' 0 CA--C 1.531 0.225 0 C-N-CA 124.548 1.139 . . . . 0.0 110.202 169.781 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 61' ' ' LYS . . . . . . . . . . . . . 18.4 tttt -79.8 -15.23 57.85 Favored 'General case' 0 N--CA 1.473 0.684 0 N-CA-C 113.852 1.056 . . . . 0.0 113.852 177.853 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 62' ' ' GLY . . . . . . . . . . . . . . . 169.75 123.64 0.69 Allowed Glycine 0 C--N 1.332 0.33 0 N-CA-C 108.579 -1.808 . . . . 0.0 108.579 -178.86 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 63' ' ' LEU . . . . . . . . . . . . . 0.9 OUTLIER -128.26 94.24 3.85 Favored 'General case' 0 N--CA 1.45 -0.45 0 C-N-CA 124.769 1.228 . . . . 0.0 110.599 -151.971 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 64' ' ' ALA . . . . . . . . . . . . . . . -78.74 109.39 12.93 Favored 'General case' 0 C--O 1.236 0.361 0 C-N-CA 124.136 0.975 . . . . 0.0 111.601 -172.018 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 65' ' ' MET . . . . . . . . . . . . . 67.3 mtp -120.63 159.62 24.92 Favored 'General case' 0 CA--C 1.537 0.459 0 C-N-CA 124.24 1.016 . . . . 0.0 110.217 176.993 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 66' ' ' THR . . . . . . . . . . . . . 28.3 p -100.09 -164.89 1.16 Allowed 'General case' 0 CA--C 1.543 0.704 0 C-N-CA 125.444 1.498 . . . . 0.0 111.953 -169.379 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 67' ' ' ARG . . . . . . . . . . . . . 5.7 mmm180 -133.36 68.3 1.5 Allowed 'General case' 0 N--CA 1.471 0.597 0 C-N-CA 125.467 1.507 . . . . 0.0 109.968 -178.855 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 68' ' ' MET . . . . . . . . . . . . . 27.2 ptm -133.53 -172.22 2.91 Favored 'General case' 0 CA--C 1.538 0.506 0 C-N-CA 127.147 2.179 . . . . 0.0 110.369 -175.307 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 69' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -138.69 176.87 8.32 Favored 'General case' 0 C--O 1.236 0.35 0 C-N-CA 125.575 1.55 . . . . 0.0 110.061 -173.815 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 70' ' ' CYS . . . . . 1.28 ' SG ' ' SG ' ' A' ' 44' ' ' CYS . 60.2 m -138.05 4.88 2.53 Favored 'General case' 0 CA--C 1.54 0.582 0 N-CA-C 114.409 1.263 . . . . 0.0 114.409 -175.392 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 71' ' ' ALA . . . . . . . . . . . . . . . 58.61 3.98 0.33 Allowed 'General case' 0 N--CA 1.472 0.665 0 C-N-CA 125.743 1.617 . . . . 0.0 113.983 -177.057 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 72' ' ' ASN . . . . . . . . . . . . . 43.3 t-20 -143.19 142.05 20.75 Favored Pre-proline 0 C--O 1.238 0.498 0 N-CA-C 106.684 -1.599 . . . . 0.0 106.684 172.645 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 73' ' ' PRO . . . . . . . . . . . . . 37.3 Cg_endo -78.71 -27.65 4.77 Favored 'Trans proline' 0 C--O 1.221 -0.363 0 C-N-CA 121.564 1.509 . . . . 0.0 113.041 -169.189 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 74' ' ' GLN . . . . . . . . . . . . . 41.0 tt0 -51.43 -46.44 62.96 Favored 'General case' 0 N--CA 1.47 0.569 0 CA-C-N 119.501 1.046 . . . . 0.0 111.486 -177.435 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 75' ' ' LEU . . . . . . . . . . . . . 49.9 mt -70.02 -36.83 75.38 Favored 'General case' 0 C--N 1.329 -0.309 0 C-N-CA 124.914 1.286 . . . . 0.0 110.906 -178.286 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 76' ' ' ASN . . . . . . . . . . . . . 1.0 OUTLIER -78.9 2.11 21.28 Favored 'General case' 0 CA--C 1.541 0.599 0 C-N-CA 127.179 2.191 . . . . 0.0 112.325 178.046 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 77' ' ' GLU . . . . . . . . . . . . . 1.5 mm-40 -109.47 -39.82 5.06 Favored 'General case' 0 C--N 1.331 -0.212 0 C-N-CA 127.421 2.288 . . . . 0.0 108.338 173.819 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 78' ' ' LEU . . . . . . . . . . . . . 55.8 mt -56.29 -27.4 55.31 Favored 'General case' 0 C--N 1.343 0.319 0 C-N-CA 122.881 0.472 . . . . 0.0 110.653 168.285 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 79' ' ' ASP . . . . . . . . . . . . . 0.0 OUTLIER -63.76 -13.57 44.95 Favored 'General case' 0 CA--C 1.539 0.541 0 C-N-CA 126.3 1.84 . . . . 0.0 112.653 177.369 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 80' ' ' ASN . . . . . . . . . . . . . 67.8 m-20 -105.54 -44.84 4.59 Favored 'General case' 0 N--CA 1.465 0.277 0 C-N-CA 124.478 1.111 . . . . 0.0 109.962 169.452 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 81' ' ' THR . . . . . . . . . . . . . 85.9 m -44.59 -70.16 0.11 Allowed 'General case' 0 CA--C 1.535 0.38 0 C-N-CA 125.836 1.654 . . . . 0.0 111.273 -179.143 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 82' ' ' ILE . . . . . . . . . . . . . 8.2 tp -72.37 -29.72 32.5 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.347 0 O-C-N 121.428 -0.795 . . . . 0.0 111.088 -167.072 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 83' ' ' SER . . . . . . . . . . . . . 30.0 t -52.68 -60.09 3.67 Favored 'General case' 0 C--O 1.236 0.38 0 C-N-CA 124.735 1.214 . . . . 0.0 109.409 171.096 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 84' ' ' GLU . . . . . . . . . . . . . 30.8 tp10 -67.97 -39.03 83.42 Favored 'General case' 0 N--CA 1.449 -0.482 0 CA-C-O 118.209 -0.901 . . . . 0.0 110.875 -173.216 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 85' ' ' MET . . . . . . . . . . . . . 78.6 mtp -60.58 -42.78 97.4 Favored 'General case' 0 N--CA 1.464 0.275 0 CA-C-O 122.402 1.096 . . . . 0.0 109.309 -176.136 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 86' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -75.95 -23.71 55.4 Favored 'General case' 0 C--N 1.33 -0.257 0 C-N-CA 124.262 1.025 . . . . 0.0 111.722 -178.643 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 87' ' ' LYS . . . . . . . . . . . . . 3.0 tppt? -75.96 -52.29 10.58 Favored 'General case' 0 N--CA 1.441 -0.886 0 C-N-CA 124.589 1.156 . . . . 0.0 109.188 177.847 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 88' ' ' GLU . . . . . . . . . . . . . 17.3 pt-20 -64.95 -38.78 92.1 Favored 'General case' 0 CA--C 1.539 0.546 0 CA-C-O 118.927 -0.559 . . . . 0.0 110.536 178.124 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 89' ' ' GLY . . . . . . . . . . . . . . . 120.15 105.75 2.08 Favored Glycine 0 C--N 1.339 0.746 0 C-N-CA 126.743 2.116 . . . . 0.0 108.732 173.161 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 90' ' ' ALA . . . . . 0.426 ' HB1' HD13 ' A' ' 101' ' ' LEU . . . -77.18 133.29 38.97 Favored 'General case' 0 N--CA 1.448 -0.541 0 CA-C-O 118.457 -0.783 . . . . 0.0 109.566 -176.072 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 91' ' ' GLN . . . . . . . . . . . . . 59.1 mm-40 -65.21 139.2 58.63 Favored 'General case' 0 C--O 1.239 0.503 0 N-CA-C 105.099 -2.185 . . . . 0.0 105.099 152.533 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 92' ' ' VAL . . . . . . . . . . . . . 10.4 p -135.78 134.48 51.25 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.56 0 N-CA-C 106.154 -1.795 . . . . 0.0 106.154 -176.448 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 93' ' ' ASP . . . . . . . . . . . . . 0.7 OUTLIER -142.09 91.88 2.38 Favored 'General case' 0 N--CA 1.452 -0.373 0 N-CA-C 107.911 -1.144 . . . . 0.0 107.911 -170.442 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 94' ' ' LEU . . . . . 0.403 ' H ' ' HB ' ' A' ' 2' ' ' VAL . 0.4 OUTLIER -96.91 109.49 22.2 Favored 'General case' 0 C--O 1.235 0.31 0 N-CA-C 106.922 -1.51 . . . . 0.0 106.922 174.395 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 95' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -70.13 -163.77 0.07 Allowed 'General case' 0 CA--C 1.542 0.664 0 N-CA-C 108.173 -1.047 . . . . 0.0 108.173 166.139 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 96' ' ' ALA . . . . . . . . . . . . . . . -56.97 -27.86 61.73 Favored 'General case' 0 CA--C 1.536 0.437 0 O-C-N 119.291 -2.131 . . . . 0.0 113.138 -178.616 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 97' ' ' ASN . . . . . . . . . . . . . 28.4 p30 -167.41 18.69 0.03 OUTLIER 'General case' 0 CA--C 1.539 0.538 0 C-N-CA 124.072 0.949 . . . . 0.0 112.705 -168.766 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 98' ' ' GLN . . . . . . . . . . . . . 2.3 tt0 -130.93 124.35 30.88 Favored 'General case' 0 N--CA 1.47 0.527 0 CA-C-N 120.297 1.408 . . . . 0.0 107.724 169.997 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 99' ' ' LEU . . . . . 0.433 ' HB3' ' HB2' ' A' ' 110' ' ' TYR . 15.3 tp -86.13 139.89 30.69 Favored 'General case' 0 C--O 1.233 0.185 0 C-N-CA 124.238 1.015 . . . . 0.0 109.519 170.109 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 100' ' ' THR . . . . . . . . . . . . . 15.8 m -123.38 126.17 46.34 Favored 'General case' 0 C--N 1.322 -0.592 0 C-N-CA 126.308 1.843 . . . . 0.0 107.127 171.346 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 101' ' ' LEU . . . . . 0.426 HD13 ' HB1' ' A' ' 90' ' ' ALA . 0.7 OUTLIER -114.23 135.45 54.04 Favored 'General case' 0 C--N 1.334 -0.071 0 C-N-CA 127.502 2.321 . . . . 0.0 106.04 167.9 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 102' ' ' ALA . . . . . . . . . . . . . . . -157.23 82.5 0.92 Allowed 'General case' 0 CA--C 1.536 0.417 0 CA-C-N 120.057 1.299 . . . . 0.0 111.325 178.852 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 103' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -98.87 171.01 8.34 Favored 'General case' 0 C--O 1.236 0.374 0 C-N-CA 125.947 1.699 . . . . 0.0 110.392 179.867 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 104' ' ' ALA . . . . . . . . . . . . . . . -56.16 -28.14 56.93 Favored 'General case' 0 C--O 1.233 0.213 0 CA-C-O 118.466 -0.778 . . . . 0.0 112.239 176.705 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 105' ' ' LYS . . . . . . . . . . . . . 32.8 mmtt -58.81 -80.5 0.02 OUTLIER 'General case' 0 CA--C 1.531 0.24 0 CA-C-N 119.244 0.929 . . . . 0.0 110.927 165.345 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 106' ' ' GLN . . . . . . . . . . . . . 7.1 mt-30 -157.0 -170.36 3.26 Favored 'General case' 0 CA--C 1.536 0.428 0 C-N-CA 125.098 1.359 . . . . 0.0 109.803 -173.136 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 107' ' ' THR . . . . . . . . . . . . . 3.4 t -130.32 140.4 50.64 Favored 'General case' 0 CA--C 1.537 0.444 0 C-N-CA 126.376 1.87 . . . . 0.0 108.29 -174.949 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 108' ' ' LEU . . . . . . . . . . . . . 4.8 mp -134.09 153.16 51.99 Favored 'General case' 0 C--O 1.235 0.325 0 C-N-CA 130.097 3.359 . . . . 0.0 108.461 -172.665 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 109' ' ' THR . . . . . . . . . . . . . 7.1 m -138.6 96.97 3.25 Favored 'General case' 0 CA--C 1.539 0.534 0 N-CA-C 109.419 -0.586 . . . . 0.0 109.419 -175.771 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 110' ' ' TYR . . . . . 0.433 ' HB2' ' HB3' ' A' ' 99' ' ' LEU . 66.9 m-85 -99.08 155.83 17.25 Favored 'General case' 0 N--CA 1.464 0.259 0 C-N-CA 124.056 0.943 . . . . 0.0 110.712 -175.244 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 111' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -114.5 145.21 42.19 Favored 'General case' 0 C--N 1.331 -0.199 0 C-N-CA 125.703 1.601 . . . . 0.0 108.758 -171.487 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 112' ' ' LEU . . . . . . . . . . . . . 54.4 tp -75.62 60.98 1.29 Allowed 'General case' 0 CA--C 1.534 0.36 0 C-N-CA 127.957 2.503 . . . . 0.0 108.396 175.558 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 113' ' ' ALA . . . . . . . . . . . . . . . -93.31 94.69 8.89 Favored 'General case' 0 N--CA 1.448 -0.544 0 N-CA-C 106.189 -1.782 . . . . 0.0 106.189 177.299 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 114' ' ' ASP . . . . . . . . . . . . . 37.9 t0 -128.35 45.57 2.74 Favored 'General case' 0 CA--C 1.515 -0.39 0 CA-C-O 121.62 0.724 . . . . 0.0 110.993 -178.927 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 115' ' ' LEU . . . . . . . . . . . . . 19.0 mt 60.15 13.01 3.57 Favored 'General case' 0 CA--C 1.534 0.334 0 C-N-CA 124.817 1.247 . . . . 0.0 113.008 167.88 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 116' ' ' MET . . . . . . . . . . . . . 0.5 OUTLIER -114.88 112.03 22.11 Favored 'General case' 0 N--CA 1.449 -0.49 0 C-N-CA 125.058 1.343 . . . . 0.0 107.797 -172.221 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 117' ' ' ASN . . . . . . . . . . . . . 55.2 m-20 . . . . . 0 C--O 1.234 0.288 0 C-N-CA 124.222 1.009 . . . . 0.0 110.45 -169.774 . . . . . . . . 0 0 . 1 . 010 nuclear build full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 4.4 ptm . . . . . 0 CA--C 1.535 0.391 0 CA-C-O 121.471 0.653 . . . . 0.0 111.065 . . . . . . . . . 0 0 . 1 . 010 nuclear build full ' A' A ' 2' ' ' VAL . . . . . . . . . . . . . 14.6 p -61.92 155.24 4.73 Favored 'Isoleucine or valine' 0 CA--C 1.54 0.561 0 C-N-CA 125.622 1.569 . . . . 0.0 111.127 175.575 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 3' ' ' THR . . . . . 0.41 ' HB ' ' HD2' ' A' ' 4' ' ' PRO . 31.5 p -124.45 163.8 34.26 Favored Pre-proline 0 CA--C 1.535 0.368 0 C-N-CA 124.292 1.037 . . . . 0.0 108.64 173.269 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 4' ' ' PRO . . . . . 0.41 ' HD2' ' HB ' ' A' ' 3' ' ' THR . 57.9 Cg_endo -67.38 -34.8 25.7 Favored 'Trans proline' 0 N--CA 1.459 -0.5 0 C-N-CA 121.524 1.483 . . . . 0.0 111.046 170.066 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 5' ' ' GLU . . . . . . . . . . . . . 28.6 tt0 -56.14 -54.64 42.69 Favored 'General case' 0 C--N 1.328 -0.338 0 C-N-CA 125.005 1.322 . . . . 0.0 109.992 -174.918 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 6' ' ' GLN . . . . . . . . . . . . . 7.8 pt20 -63.87 6.4 0.17 Allowed 'General case' 0 CA--C 1.536 0.412 0 C-N-CA 125.318 1.447 . . . . 0.0 114.314 -179.48 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 7' ' ' LEU . . . . . 0.631 HD21 HD22 ' A' ' 94' ' ' LEU . 95.4 mt -123.77 -50.91 1.83 Allowed 'General case' 0 N--CA 1.451 -0.416 0 C-N-CA 125.895 1.678 . . . . 0.0 110.02 -177.763 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 8' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -61.37 -6.22 2.13 Favored 'General case' 0 N--CA 1.468 0.471 0 N-CA-C 113.967 1.099 . . . . 0.0 113.967 -169.794 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 9' ' ' HIS . . . . . . . . . . . . . 0.8 OUTLIER -124.6 9.68 8.38 Favored 'General case' 0 CA--C 1.543 0.705 0 C-N-CA 127.078 2.151 . . . . 0.0 110.301 -171.002 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 10' ' ' HIS . . . . . . . . . . . . . 94.5 m-70 -132.99 154.97 49.99 Favored 'General case' 0 C--O 1.236 0.389 0 CA-C-N 119.438 1.017 . . . . 0.0 111.614 -175.771 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 11' ' ' ARG . . . . . . . . . . . . . 63.4 ttt180 -96.9 147.03 24.38 Favored 'General case' 0 CA--C 1.513 -0.445 0 C-N-CA 124.525 1.13 . . . . 0.0 108.694 173.821 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 12' ' ' PHE . . . . . . . . . . . . . 60.2 m-85 -126.24 161.4 27.84 Favored 'General case' 0 N--CA 1.45 -0.468 0 N-CA-C 108.953 -0.758 . . . . 0.0 108.953 165.487 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 13' ' ' VAL . . . . . . . . . . . . . 8.8 p -129.6 155.48 41.36 Favored 'Isoleucine or valine' 0 CA--C 1.545 0.782 0 C-N-CA 125.333 1.453 . . . . 0.0 109.797 166.889 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 14' ' ' LEU . . . . . 0.53 ' HG ' HG21 ' A' ' 22' ' ' VAL . 1.3 tp -85.75 100.61 12.14 Favored 'General case' 0 N--CA 1.47 0.527 0 C-N-CA 125.519 1.528 . . . . 0.0 108.909 -175.673 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 4.9 tm-20 -88.45 -36.21 16.62 Favored 'General case' 0 CA--C 1.534 0.329 0 C-N-CA 122.653 0.381 . . . . 0.0 110.056 -174.006 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -152.12 146.26 25.36 Favored 'General case' 0 C--O 1.234 0.247 0 CA-C-O 122.656 1.217 . . . . 0.0 109.97 -177.907 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 17' ' ' VAL . . . . . 0.629 HG12 ' H ' ' A' ' 18' ' ' ASN . 3.0 t -79.65 -164.64 0.07 OUTLIER 'Isoleucine or valine' 0 CA--C 1.546 0.807 0 C-N-CA 126.071 1.748 . . . . 0.0 107.597 172.095 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 18' ' ' ASN . . . . . 0.629 ' H ' HG12 ' A' ' 17' ' ' VAL . 40.3 t30 -51.83 -9.54 0.09 Allowed 'General case' 0 CA--C 1.547 0.853 0 C-N-CA 127.731 2.413 . . . . 0.0 115.648 170.207 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . 156.9 32.2 0.02 OUTLIER Glycine 0 CA--C 1.524 0.594 0 O-C-N 120.92 -1.113 . . . . 0.0 112.373 -179.122 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 26.0 mttp -150.73 156.02 35.95 Favored Pre-proline 0 C--O 1.236 0.387 0 C-N-CA 126.975 2.11 . . . . 0.0 108.05 176.18 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 21' ' ' PRO . . . . . . . . . . . . . 72.7 Cg_endo -86.06 172.5 7.39 Favored 'Trans proline' 0 N--CA 1.448 -1.195 0 C-N-CA 122.212 1.942 . . . . 0.0 111.426 -179.498 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 22' ' ' VAL . . . . . 0.53 HG21 ' HG ' ' A' ' 14' ' ' LEU . 54.4 t -115.18 127.39 72.76 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.342 0 C-N-CA 125.192 1.397 . . . . 0.0 109.449 -166.76 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 23' ' ' THR . . . . . . . . . . . . . 2.5 p -105.61 95.71 6.0 Favored 'General case' 0 CA--C 1.534 0.351 0 C-N-CA 125.219 1.407 . . . . 0.0 111.506 -167.637 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 24' ' ' SER . . . . . . . . . . . . . 34.7 t -163.4 135.34 5.06 Favored 'General case' 0 N--CA 1.449 -0.476 0 N-CA-C 108.069 -1.086 . . . . 0.0 108.069 172.714 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 25' ' ' ASP . . . . . . . . . . . . . 13.6 m-20 -107.26 -3.47 19.72 Favored 'General case' 0 N--CA 1.472 0.666 0 C-N-CA 124.567 1.147 . . . . 0.0 112.111 166.478 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 26' ' ' LYS . . . . . . . . . . . . . 92.2 mttt -142.97 129.5 20.15 Favored 'General case' 0 C--N 1.345 0.376 0 O-C-N 120.162 -1.586 . . . . 0.0 110.04 -176.667 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 27' ' ' ASN . . . . . . . . . . . . . 2.4 m-80 45.53 68.07 3.67 Favored Pre-proline 0 CA--C 1.535 0.382 0 C-N-CA 125.634 1.574 . . . . 0.0 109.443 -179.979 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 28' ' ' PRO . . . . . . . . . . . . . 18.0 Cg_endo -63.79 172.76 5.41 Favored 'Trans proline' 0 C--O 1.236 0.387 0 C-N-CA 123.314 2.676 . . . . 0.0 112.37 -173.361 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 29' ' ' PRO . . . . . . . . . . . . . 42.2 Cg_endo -74.05 62.71 5.03 Favored 'Trans proline' 0 N--CA 1.454 -0.826 0 C-N-CA 121.333 1.355 . . . . 0.0 110.435 166.497 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 30' ' ' GLU . . . . . . . . . . . . . 0.3 OUTLIER -81.37 169.85 16.72 Favored 'General case' 0 CA--C 1.536 0.42 0 O-C-N 120.581 -1.325 . . . . 0.0 108.897 174.812 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 31' ' ' ILE . . . . . . . . . . . . . 7.5 tt -146.17 105.86 0.66 Allowed 'Isoleucine or valine' 0 N--CA 1.452 -0.328 0 N-CA-C 105.665 -1.976 . . . . 0.0 105.665 169.6 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 32' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER -80.45 129.66 34.65 Favored 'General case' 0 N--CA 1.445 -0.706 0 N-CA-C 106.604 -1.628 . . . . 0.0 106.604 160.17 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 33' ' ' PHE . . . . . . . . . . . . . 59.7 m-85 -93.42 156.44 16.77 Favored 'General case' 0 C--O 1.239 0.512 0 N-CA-C 106.803 -1.554 . . . . 0.0 106.803 158.673 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 34' ' ' GLY . . . . . . . . . . . . . . . -167.53 122.34 1.03 Allowed Glycine 0 C--O 1.219 -0.803 0 CA-C-O 117.107 -1.941 . . . . 0.0 109.713 -177.221 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 35' ' ' GLU . . . . . . . . . . . . . 1.8 tm-20 70.24 114.46 0.05 OUTLIER 'General case' 0 CA--C 1.542 0.659 0 CA-C-N 120.341 2.071 . . . . 0.0 111.436 178.986 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 44.9 mtmt 63.91 -50.21 0.26 Allowed 'General case' 0 N--CA 1.477 0.913 0 C-N-CA 130.578 3.551 . . . . 0.0 116.478 176.751 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 37' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER 171.27 8.18 0.0 OUTLIER 'General case' 0 CA--C 1.543 0.676 1 C-N-CA 132.347 4.259 . . . . 0.0 111.342 177.173 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 38' ' ' MET . . . . . . . . . . . . . 65.5 mmm -57.02 157.32 5.92 Favored 'General case' 0 N--CA 1.473 0.683 0 CA-C-N 120.667 1.576 . . . . 0.0 111.596 -169.478 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 39' ' ' ILE . . . . . . . . . . . . . 52.9 mt -124.57 124.91 69.23 Favored 'Isoleucine or valine' 0 C--O 1.235 0.327 0 C-N-CA 126.641 1.976 . . . . 0.0 106.662 -166.687 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 40' ' ' SER . . . . . . . . . . . . . 59.8 p -138.21 123.39 19.23 Favored 'General case' 0 C--O 1.241 0.635 0 C-N-CA 125.309 1.444 . . . . 0.0 108.334 177.554 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 41' ' ' GLY . . . . . . . . . . . . . . . -171.93 178.44 44.16 Favored Glycine 0 CA--C 1.529 0.926 0 CA-C-N 119.974 1.261 . . . . 0.0 112.959 -173.677 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 42' ' ' SER . . . . . . . . . . . . . 20.6 t -154.47 109.98 3.15 Favored 'General case' 0 C--O 1.236 0.393 0 O-C-N 121.622 -0.929 . . . . 0.0 109.859 169.012 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 43' ' ' MET . . . . . . . . . . . . . 15.3 mmt -65.91 -64.58 0.83 Allowed 'General case' 0 N--CA 1.455 -0.185 0 N-CA-C 106.998 -1.482 . . . . 0.0 106.998 159.597 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 44' ' ' CYS . . . . . 1.296 ' SG ' ' SG ' ' A' ' 70' ' ' CYS . 19.7 t -146.37 -61.99 0.31 Allowed 'General case' 0 N--CA 1.454 -0.253 0 N-CA-C 108.807 -0.812 . . . . 0.0 108.807 -178.245 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 45' ' ' ASN . . . . . . . . . . . . . 2.9 m120 -77.24 15.95 0.66 Allowed 'General case' 0 CA--C 1.544 0.738 0 C-N-CA 125.731 1.612 . . . . 0.0 113.139 -175.371 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 46' ' ' ARG . . . . . . . . . . . . . 1.2 mtt180 56.94 164.93 0.03 OUTLIER 'General case' 0 N--CA 1.472 0.644 0 C-N-CA 126.765 2.026 . . . . 0.0 113.164 -156.421 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 47' ' ' PHE . . . . . . . . . . . . . 39.1 p90 -160.65 166.04 29.54 Favored 'General case' 0 C--O 1.234 0.249 0 C-N-CA 124.152 0.981 . . . . 0.0 110.416 153.873 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 48' ' ' SER . . . . . . . . . . . . . 0.2 OUTLIER -167.92 162.41 13.47 Favored 'General case' 0 C--O 1.236 0.366 0 C-N-CA 124.305 1.042 . . . . 0.0 109.457 174.545 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 49' ' ' GLY . . . . . . . . . . . . . . . -176.66 173.74 46.51 Favored Glycine 0 CA--C 1.53 1.021 0 CA-C-N 119.925 1.239 . . . . 0.0 113.23 175.573 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 50' ' ' GLU . . . . . . . . . . . . . 47.1 mt-10 -79.31 94.09 5.41 Favored 'General case' 0 C--O 1.238 0.452 0 C-N-CA 125.008 1.323 . . . . 0.0 107.771 167.263 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 51' ' ' GLY . . . . . . . . . . . . . . . -69.59 164.39 51.02 Favored Glycine 0 C--O 1.238 0.375 0 N-CA-C 110.995 -0.842 . . . . 0.0 110.995 168.455 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 52' ' ' LYS . . . . . . . . . . . . . 2.0 tttp -162.6 151.34 14.82 Favored 'General case' 0 N--CA 1.457 -0.084 0 C-N-CA 123.378 0.671 . . . . 0.0 110.06 169.915 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 53' ' ' LEU . . . . . . . . . . . . . 23.6 tp -148.68 135.13 19.54 Favored 'General case' 0 C--N 1.333 -0.12 0 N-CA-C 107.04 -1.467 . . . . 0.0 107.04 174.731 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 2.8 t -157.42 11.57 0.21 Allowed 'General case' 0 CA--C 1.543 0.687 0 CA-C-N 118.435 0.562 . . . . 0.0 111.929 170.123 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 55' ' ' ASN . . . . . . . . . . . . . 40.1 p30 -151.83 -2.02 0.3 Allowed 'General case' 0 N--CA 1.471 0.61 0 N-CA-C 114.232 1.197 . . . . 0.0 114.232 -172.572 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 56' ' ' GLY . . . . . . . . . . . . . . . 107.39 -2.24 34.75 Favored Glycine 0 CA--C 1.532 1.139 0 C-N-CA 125.437 1.494 . . . . 0.0 113.574 -175.049 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 57' ' ' GLU . . . . . . . . . . . . . 28.0 tt0 -119.25 142.79 47.73 Favored 'General case' 0 CA--C 1.539 0.524 0 CA-C-N 118.678 1.239 . . . . 0.0 109.542 -177.215 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 58' ' ' LEU . . . . . . . . . . . . . 57.2 tp -117.6 122.84 44.68 Favored 'General case' 0 C--O 1.232 0.175 0 C-N-CA 126.086 1.754 . . . . 0.0 109.713 175.919 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 59' ' ' THR . . . . . . . . . . . . . 63.5 p -109.24 166.24 11.0 Favored 'General case' 0 CA--C 1.534 0.331 0 C-N-CA 124.223 1.009 . . . . 0.0 110.782 165.103 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 60' ' ' ALA . . . . . . . . . . . . . . . -129.76 86.32 2.4 Favored 'General case' 0 C--O 1.235 0.301 0 CA-C-O 122.415 1.102 . . . . 0.0 108.67 150.266 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 61' ' ' LYS . . . . . . . . . . . . . 74.7 tttt -74.85 100.02 3.95 Favored 'General case' 0 C--O 1.236 0.38 0 N-CA-C 107.601 -1.259 . . . . 0.0 107.601 168.18 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 62' ' ' GLY . . . . . . . . . . . . . . . 111.87 48.18 0.69 Allowed Glycine 0 CA--C 1.525 0.716 0 C-N-CA 124.105 0.859 . . . . 0.0 111.744 -176.638 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 63' ' ' LEU . . . . . . . . . . . . . 4.0 tp -67.33 168.57 10.37 Favored 'General case' 0 CA--C 1.539 0.542 0 C-N-CA 125.071 1.348 . . . . 0.0 110.516 172.654 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 64' ' ' ALA . . . . . . . . . . . . . . . -143.4 160.92 39.68 Favored 'General case' 0 C--N 1.329 -0.316 0 O-C-N 119.885 -1.76 . . . . 0.0 107.395 159.731 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 65' ' ' MET . . . . . . . . . . . . . 68.3 mtp -152.82 -171.39 3.92 Favored 'General case' 0 CA--C 1.54 0.56 0 C-N-CA 126.848 2.059 . . . . 0.0 107.777 179.38 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 66' ' ' THR . . . . . . . . . . . . . 0.9 OUTLIER -131.86 -164.87 1.5 Allowed 'General case' 0 CA--C 1.545 0.755 0 C-N-CA 124.239 1.016 . . . . 0.0 109.36 164.993 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 67' ' ' ARG . . . . . . . . . . . . . 3.1 ppt_? -125.11 52.56 1.58 Allowed 'General case' 0 N--CA 1.466 0.347 0 C-N-CA 124.964 1.306 . . . . 0.0 110.931 176.916 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 68' ' ' MET . . . . . . . . . . . . . 22.5 ptp -102.56 163.08 12.43 Favored 'General case' 0 CA--C 1.52 -0.207 0 O-C-N 121.29 -0.881 . . . . 0.0 109.205 167.007 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 69' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -124.42 155.67 38.45 Favored 'General case' 0 C--N 1.323 -0.582 0 C-N-CA 126.772 2.029 . . . . 0.0 108.316 -170.639 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 70' ' ' CYS . . . . . 1.296 ' SG ' ' SG ' ' A' ' 44' ' ' CYS . 1.6 p -116.67 160.59 20.49 Favored 'General case' 0 C--N 1.324 -0.541 0 C-N-CA 125.528 1.531 . . . . 0.0 110.097 -174.984 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 71' ' ' ALA . . . . . . . . . . . . . . . -78.96 16.86 0.82 Allowed 'General case' 0 CA--C 1.54 0.591 0 C-N-CA 124.29 1.036 . . . . 0.0 112.097 176.548 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 72' ' ' ASN . . . . . . . . . . . . . 17.3 t-20 -136.17 143.62 44.63 Favored Pre-proline 0 CA--C 1.534 0.348 0 O-C-N 120.509 -1.369 . . . . 0.0 108.464 -173.589 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 73' ' ' PRO . . . . . . . . . . . . . 48.4 Cg_endo -71.72 -52.63 0.2 Allowed 'Trans proline' 0 C--N 1.349 0.587 0 C-N-CA 122.965 2.443 . . . . 0.0 111.455 179.721 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 74' ' ' GLN . . . . . . . . . . . . . 12.1 tt0 -57.83 -45.31 86.36 Favored 'General case' 0 C--O 1.22 -0.498 0 C-N-CA 124.277 1.031 . . . . 0.0 109.798 -175.691 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 75' ' ' LEU . . . . . . . . . . . . . 98.2 mt -61.29 -39.16 89.43 Favored 'General case' 0 CA--C 1.535 0.371 0 CA-C-N 118.966 0.803 . . . . 0.0 111.106 -177.331 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 76' ' ' ASN . . . . . . . . . . . . . 0.2 OUTLIER -64.46 -50.47 67.37 Favored 'General case' 0 N--CA 1.468 0.426 0 C-N-CA 124.554 1.142 . . . . 0.0 110.018 174.749 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 77' ' ' GLU . . . . . . . . . . . . . 18.5 tt0 -54.08 -34.75 60.97 Favored 'General case' 0 CA--C 1.539 0.542 0 C-N-CA 126.0 1.72 . . . . 0.0 111.145 175.082 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 78' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -73.88 -20.74 60.32 Favored 'General case' 0 N--CA 1.446 -0.655 0 CA-C-O 116.836 -1.554 . . . . 0.0 112.696 -175.116 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 79' ' ' ASP . . . . . . . . . . . . . 0.0 OUTLIER -54.49 -45.45 73.25 Favored 'General case' 0 N--CA 1.471 0.617 0 CA-C-N 120.474 1.488 . . . . 0.0 110.433 176.23 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 80' ' ' ASN . . . . . . . . . . . . . 3.1 p30 -99.15 -23.78 15.11 Favored 'General case' 0 N--CA 1.441 -0.887 0 C-N-CA 124.402 1.081 . . . . 0.0 109.811 -168.013 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 81' ' ' THR . . . . . . . . . . . . . 15.3 m -57.44 -57.24 13.55 Favored 'General case' 0 CA--C 1.541 0.618 0 N-CA-C 109.157 -0.683 . . . . 0.0 109.157 161.539 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 82' ' ' ILE . . . . . . . . . . . . . 10.8 tp -66.38 -37.94 80.72 Favored 'Isoleucine or valine' 0 C--N 1.345 0.372 0 CA-C-N 119.855 1.207 . . . . 0.0 111.089 -172.107 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 83' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -57.21 -46.63 82.73 Favored 'General case' 0 CA--C 1.533 0.319 0 CA-C-N 119.236 0.926 . . . . 0.0 110.529 -176.053 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 84' ' ' GLU . . . . . . . . . . . . . 4.0 mt-10 -81.56 -5.24 57.81 Favored 'General case' 0 N--CA 1.448 -0.547 0 CA-C-O 118.448 -0.787 . . . . 0.0 112.864 179.536 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 85' ' ' MET . . . . . . . . . . . . . 90.0 mtp -90.71 -4.21 56.89 Favored 'General case' 0 CA--C 1.537 0.445 0 CA-C-N 120.07 1.305 . . . . 0.0 111.985 164.8 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 86' ' ' LEU . . . . . . . . . . . . . 3.4 mm? -113.13 -32.36 6.35 Favored 'General case' 0 C--N 1.333 -0.112 0 O-C-N 121.231 -0.918 . . . . 0.0 112.071 178.043 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 87' ' ' LYS . . . . . . . . . . . . . 76.9 mttt -72.14 -49.4 36.22 Favored 'General case' 0 N--CA 1.448 -0.554 0 CA-C-N 118.817 0.735 . . . . 0.0 110.501 -177.408 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 88' ' ' GLU . . . . . . . . . . . . . 7.3 mm-40 -80.81 -3.31 50.65 Favored 'General case' 0 CA--C 1.54 0.591 0 C-N-CA 126.097 1.759 . . . . 0.0 112.642 -174.87 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 89' ' ' GLY . . . . . . . . . . . . . . . 84.5 106.04 0.6 Allowed Glycine 0 CA--C 1.524 0.656 0 CA-C-N 120.137 1.335 . . . . 0.0 110.916 -179.762 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 90' ' ' ALA . . . . . . . . . . . . . . . -79.87 152.25 29.76 Favored 'General case' 0 CA--C 1.516 -0.33 0 N-CA-C 109.014 -0.736 . . . . 0.0 109.014 170.632 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 91' ' ' GLN . . . . . . . . . . . . . 93.2 mm-40 -73.62 141.75 46.55 Favored 'General case' 0 N--CA 1.442 -0.858 0 N-CA-C 105.398 -2.075 . . . . 0.0 105.398 156.206 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 92' ' ' VAL . . . . . . . . . . . . . 7.4 p -128.9 108.8 17.74 Favored 'Isoleucine or valine' 0 N--CA 1.443 -0.821 0 N-CA-C 104.967 -2.234 . . . . 0.0 104.967 -179.502 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 93' ' ' ASP . . . . . . . . . . . . . 0.7 OUTLIER -124.81 75.48 1.43 Allowed 'General case' 0 C--N 1.327 -0.37 0 N-CA-C 106.444 -1.687 . . . . 0.0 106.444 -167.552 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 94' ' ' LEU . . . . . 0.631 HD22 HD21 ' A' ' 7' ' ' LEU . 42.0 tp -77.45 121.52 23.93 Favored 'General case' 0 C--O 1.234 0.254 0 N-CA-C 107.923 -1.14 . . . . 0.0 107.923 -178.188 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 95' ' ' THR . . . . . . . . . . . . . 1.4 m -86.65 -167.22 1.8 Allowed 'General case' 0 C--N 1.319 -0.743 0 C-N-CA 126.496 1.918 . . . . 0.0 108.057 168.238 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 96' ' ' ALA . . . . . . . . . . . . . . . -50.55 -37.87 41.87 Favored 'General case' 0 CA--C 1.543 0.676 0 O-C-N 119.563 -1.96 . . . . 0.0 113.729 -171.647 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 97' ' ' ASN . . . . . . . . . . . . . 1.3 p30 -157.3 18.48 0.29 Allowed 'General case' 0 CA--C 1.54 0.577 0 C-N-CA 125.783 1.633 . . . . 0.0 111.479 -173.363 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 98' ' ' GLN . . . . . . . . . . . . . 12.3 tt0 -136.03 116.87 14.11 Favored 'General case' 0 C--N 1.339 0.149 0 O-C-N 121.137 -0.977 . . . . 0.0 109.813 -177.673 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 99' ' ' LEU . . . . . 0.467 ' HB3' ' HB2' ' A' ' 110' ' ' TYR . 7.5 tp -77.2 117.94 19.22 Favored 'General case' 0 C--O 1.237 0.421 0 C-N-CA 127.509 2.324 . . . . 0.0 108.02 176.854 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 100' ' ' THR . . . . . . . . . . . . . 8.8 m -94.63 106.76 18.76 Favored 'General case' 0 CA--C 1.537 0.462 0 N-CA-C 106.758 -1.571 . . . . 0.0 106.758 165.192 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 101' ' ' LEU . . . . . . . . . . . . . 1.6 mm? -95.18 116.77 29.17 Favored 'General case' 0 CA--C 1.515 -0.373 0 N-CA-C 107.534 -1.284 . . . . 0.0 107.534 167.006 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 102' ' ' ALA . . . . . . . . . . . . . . . -126.71 139.47 53.12 Favored 'General case' 0 C--O 1.233 0.196 0 C-N-CA 123.499 0.719 . . . . 0.0 109.578 176.365 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 103' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -155.25 171.75 19.31 Favored 'General case' 0 N--CA 1.444 -0.755 0 C-N-CA 126.296 1.839 . . . . 0.0 107.959 178.346 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 104' ' ' ALA . . . . . . . . . . . . . . . -64.27 -22.14 66.84 Favored 'General case' 0 CA--C 1.539 0.536 0 N-CA-C 112.911 0.708 . . . . 0.0 112.911 178.025 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 105' ' ' LYS . . . . . . . . . . . . . 0.3 OUTLIER -67.61 -75.25 0.1 Allowed 'General case' 0 C--N 1.345 0.391 0 CA-C-N 119.19 0.905 . . . . 0.0 109.687 174.491 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 106' ' ' GLN . . . . . . . . . . . . . 7.8 mt-30 -147.29 178.5 8.36 Favored 'General case' 0 CA--C 1.536 0.431 0 C-N-CA 127.47 2.308 . . . . 0.0 107.825 -177.119 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 107' ' ' THR . . . . . . . . . . . . . 1.0 OUTLIER -128.7 158.22 39.19 Favored 'General case' 0 CA--C 1.542 0.636 0 C-N-CA 125.672 1.589 . . . . 0.0 107.467 171.333 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 108' ' ' LEU . . . . . . . . . . . . . 87.1 mt -145.76 162.56 37.34 Favored 'General case' 0 N--CA 1.468 0.455 0 C-N-CA 126.085 1.754 . . . . 0.0 110.491 -170.901 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 109' ' ' THR . . . . . . . . . . . . . 99.5 m -122.13 115.43 22.42 Favored 'General case' 0 C--O 1.238 0.456 0 C-N-CA 125.203 1.401 . . . . 0.0 108.196 172.293 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 110' ' ' TYR . . . . . 0.467 ' HB2' ' HB3' ' A' ' 99' ' ' LEU . 95.6 m-85 -109.68 143.32 39.61 Favored 'General case' 0 C--O 1.232 0.16 0 N-CA-C 109.617 -0.512 . . . . 0.0 109.617 171.461 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 111' ' ' LYS . . . . . . . . . . . . . 11.0 tppt? -99.08 142.97 29.89 Favored 'General case' 0 C--O 1.234 0.248 0 C-N-CA 123.954 0.902 . . . . 0.0 109.064 -178.134 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 112' ' ' LEU . . . . . . . . . . . . . 15.6 tp -73.95 60.01 0.73 Allowed 'General case' 0 CA--C 1.536 0.435 0 C-N-CA 125.275 1.43 . . . . 0.0 108.731 167.343 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 113' ' ' ALA . . . . . . . . . . . . . . . -81.8 75.43 8.74 Favored 'General case' 0 N--CA 1.449 -0.51 0 N-CA-C 106.863 -1.532 . . . . 0.0 106.863 167.67 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 114' ' ' ASP . . . . . . . . . . . . 0.269 19.5 p-10 -94.52 55.15 1.91 Allowed 'General case' 0 CA--C 1.522 -0.102 0 CA-C-O 123.085 1.421 . . . . 0.0 112.307 -178.773 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 115' ' ' LEU . . . . . 0.471 ' H ' HD23 ' A' ' 115' ' ' LEU . 0.1 OUTLIER -64.51 3.66 0.47 Allowed 'General case' 0 CA--C 1.538 0.493 0 C-N-CA 126.959 2.104 . . . . 0.0 113.774 172.706 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 116' ' ' MET . . . . . . . . . . . . . 8.1 tpt -66.19 108.29 2.23 Favored 'General case' 0 N--CA 1.451 -0.417 0 C-N-CA 126.493 1.917 . . . . 0.0 108.733 -172.268 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 117' ' ' ASN . . . . . . . . . . . . . 8.0 m120 . . . . . 0 C--O 1.233 0.214 0 CA-C-O 121.189 0.518 . . . . 0.0 110.741 -176.654 . . . . . . . . 0 0 . 1 . 011 nuclear build full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 20.8 ttt . . . . . 0 CA--C 1.536 0.427 0 CA-C-O 121.396 0.617 . . . . 0.0 110.878 . . . . . . . . . 0 0 . 1 . 011 nuclear build full ' A' A ' 2' ' ' VAL . . . . . 0.449 HG11 HG12 ' A' ' 92' ' ' VAL . 14.7 p -52.77 158.12 0.48 Allowed 'Isoleucine or valine' 0 CA--C 1.545 0.777 0 C-N-CA 128.088 2.555 . . . . 0.0 112.271 171.906 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 3' ' ' THR . . . . . . . . . . . . . 57.1 p -133.82 164.99 40.06 Favored Pre-proline 0 N--CA 1.467 0.425 0 O-C-N 121.24 -0.913 . . . . 0.0 111.071 178.367 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 4' ' ' PRO . . . . . . . . . . . . . 37.9 Cg_endo -62.84 -38.94 44.92 Favored 'Trans proline' 0 C--N 1.344 0.311 0 C-N-CA 123.565 2.843 . . . . 0.0 113.058 170.243 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 5' ' ' GLU . . . . . . . . . . . . . 8.7 tt0 -63.92 -44.73 92.02 Favored 'General case' 0 C--N 1.329 -0.284 0 C-N-CA 122.583 0.353 . . . . 0.0 111.019 -173.757 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 6' ' ' GLN . . . . . . . . . . . . . 13.5 pt20 -71.95 13.81 0.26 Allowed 'General case' 0 CA--C 1.541 0.611 0 C-N-CA 123.53 0.732 . . . . 0.0 112.744 179.542 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 7' ' ' LEU . . . . . . . . . . . . . 95.6 mt -126.52 -51.36 1.49 Allowed 'General case' 0 N--CA 1.452 -0.361 0 C-N-CA 125.928 1.691 . . . . 0.0 110.441 -176.58 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 8' ' ' GLN . . . . . . . . . . . . 0.267 2.8 pt20 -54.97 -12.07 0.76 Allowed 'General case' 0 N--CA 1.478 0.929 0 N-CA-C 115.098 1.518 . . . . 0.0 115.098 -173.303 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 9' ' ' HIS . . . . . . . . . . . . . 3.1 m80 -125.63 13.84 8.09 Favored 'General case' 0 N--CA 1.443 -0.815 0 C-N-CA 125.44 1.496 . . . . 0.0 110.469 -169.509 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 10' ' ' HIS . . . . . . . . . . . . . 81.2 m-70 -141.42 126.02 17.86 Favored 'General case' 0 CA--C 1.538 0.483 0 C-N-CA 124.844 1.258 . . . . 0.0 112.162 -175.196 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 11' ' ' ARG . . . . . . . . . . . . . 39.3 ttt180 -68.66 149.63 48.88 Favored 'General case' 0 N--CA 1.467 0.417 0 C-N-CA 123.7 0.8 . . . . 0.0 110.004 165.63 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 12' ' ' PHE . . . . . . . . . . . . . 30.9 m-85 -129.64 167.07 18.53 Favored 'General case' 0 CA--C 1.538 0.489 0 C-N-CA 124.314 1.046 . . . . 0.0 109.66 163.417 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 13' ' ' VAL . . . . . 0.409 ' HA ' ' HA ' ' A' ' 30' ' ' GLU . 12.7 p -135.44 147.15 28.99 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.619 0 O-C-N 121.053 -1.029 . . . . 0.0 110.313 176.346 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 14' ' ' LEU . . . . . . . . . . . . . 43.6 tp -73.17 97.58 2.43 Favored 'General case' 0 N--CA 1.456 -0.155 0 N-CA-C 107.763 -1.199 . . . . 0.0 107.763 172.011 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 4.9 mm-40 -79.36 -50.64 10.54 Favored 'General case' 0 C--N 1.324 -0.503 0 N-CA-C 108.983 -0.747 . . . . 0.0 108.983 173.527 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 77.5 p -147.72 165.38 30.67 Favored 'General case' 0 C--O 1.236 0.365 0 CA-C-O 122.236 1.017 . . . . 0.0 112.595 -176.643 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 17' ' ' VAL . . . . . . . . . . . . . 13.3 t -132.83 161.85 40.91 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.53 0 C-N-CA 127.04 2.136 . . . . 0.0 107.16 -164.73 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 18' ' ' ASN . . . . . 0.403 ' HB2' ' H ' ' A' ' 107' ' ' THR . 30.9 t30 -56.41 -36.45 68.96 Favored 'General case' 0 N--CA 1.468 0.436 0 C-N-CA 124.272 1.029 . . . . 0.0 113.424 -177.379 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . -94.09 -31.73 7.9 Favored Glycine 0 C--N 1.335 0.473 0 CA-C-O 118.593 -1.115 . . . . 0.0 113.919 -167.521 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 1.3 pttt 174.47 154.85 0.31 Allowed Pre-proline 0 N--CA 1.465 0.317 0 C-N-CA 127.922 2.489 . . . . 0.0 107.012 -177.636 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 21' ' ' PRO . . . . . . . . . . . . . 72.0 Cg_endo -71.29 177.29 6.79 Favored 'Trans proline' 0 N--CA 1.454 -0.816 0 C-N-CA 121.537 1.492 . . . . 0.0 111.289 -179.13 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 22' ' ' VAL . . . . . . . . . . . . . 7.0 p -129.8 164.67 31.84 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.408 0 C-N-CA 125.403 1.481 . . . . 0.0 108.497 -172.792 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 23' ' ' THR . . . . . . . . . . . . . 0.6 OUTLIER -146.64 129.56 16.32 Favored 'General case' 0 CA--C 1.534 0.342 0 N-CA-C 107.11 -1.441 . . . . 0.0 107.11 174.671 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 24' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER -152.29 84.85 1.26 Allowed 'General case' 0 C--N 1.328 -0.347 0 N-CA-C 104.448 -2.427 . . . . 0.0 104.448 171.134 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 25' ' ' ASP . . . . . . . . . . . . . 0.8 OUTLIER -51.51 -40.7 60.11 Favored 'General case' 0 C--N 1.33 -0.25 0 C-N-CA 123.976 0.91 . . . . 0.0 109.492 175.441 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 26' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -91.4 107.18 19.03 Favored 'General case' 0 N--CA 1.449 -0.492 0 C-N-CA 125.829 1.652 . . . . 0.0 108.893 177.99 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 27' ' ' ASN . . . . . . . . . . . . . 73.9 m-80 47.75 73.37 1.01 Allowed Pre-proline 0 CA--C 1.537 0.456 0 C-N-CA 127.356 2.262 . . . . 0.0 112.116 173.228 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 28' ' ' PRO . . . . . . . . . . . . . 52.2 Cg_endo -66.59 170.76 11.83 Favored 'Trans proline' 0 C--O 1.242 0.678 0 C-N-CA 122.839 2.359 . . . . 0.0 112.615 -176.545 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 29' ' ' PRO . . . . . . . . . . . . . 43.6 Cg_endo -71.22 63.64 2.69 Favored 'Trans proline' 0 CA--C 1.538 0.705 0 C-N-CA 123.747 2.964 . . . . 0.0 111.615 173.411 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 30' ' ' GLU . . . . . 0.409 ' HA ' ' HA ' ' A' ' 13' ' ' VAL . 16.4 pt-20 -81.64 166.49 20.13 Favored 'General case' 0 C--O 1.24 0.557 0 O-C-N 120.461 -1.399 . . . . 0.0 109.927 174.275 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 31' ' ' ILE . . . . . . . . . . . . . 12.7 tt -139.57 138.23 39.6 Favored 'Isoleucine or valine' 0 N--CA 1.455 -0.224 0 N-CA-C 107.632 -1.247 . . . . 0.0 107.632 -179.969 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 32' ' ' SER . . . . . . . . . . . . . 36.8 p -124.01 120.97 33.99 Favored 'General case' 0 N--CA 1.445 -0.689 0 N-CA-C 106.627 -1.62 . . . . 0.0 106.627 176.882 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 33' ' ' PHE . . . . . . . . . . . . . 75.3 m-85 -86.88 137.55 32.29 Favored 'General case' 0 N--CA 1.448 -0.536 0 N-CA-C 105.035 -2.209 . . . . 0.0 105.035 171.97 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 34' ' ' GLY . . . . . . . . . . . . . . . -156.97 163.95 32.53 Favored Glycine 0 C--N 1.335 0.504 0 O-C-N 121.063 -1.023 . . . . 0.0 110.663 178.46 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 35' ' ' GLU . . . . . . . . . . . . . 3.9 tt0 63.73 -161.98 0.28 Allowed 'General case' 0 N--CA 1.452 -0.363 0 CA-C-N 118.675 1.238 . . . . 0.0 110.525 175.432 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 2.8 mtpt -59.32 71.71 0.01 OUTLIER 'General case' 0 CA--C 1.539 0.557 0 C-N-CA 127.046 2.139 . . . . 0.0 111.503 -177.005 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 37' ' ' MET . . . . . . . . . . . . 0.297 0.0 OUTLIER 50.71 19.36 0.59 Allowed 'General case' 0 N--CA 1.445 -0.688 0 C-N-CA 128.19 2.596 . . . . 0.0 115.449 -169.52 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' A' A ' 38' ' ' MET . . . . . . . . . . . . . 0.7 OUTLIER -67.34 165.4 16.47 Favored 'General case' 0 N--CA 1.443 -0.777 0 O-C-N 120.877 -1.139 . . . . 0.0 110.757 -174.772 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 39' ' ' ILE . . . . . . . . . . . . . 5.2 mt -135.11 126.46 46.32 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.368 0 N-CA-C 105.75 -1.944 . . . . 0.0 105.75 -169.754 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 40' ' ' SER . . . . . . . . . . . . . 7.4 m -129.92 151.59 50.31 Favored 'General case' 0 CA--C 1.531 0.235 0 N-CA-C 107.819 -1.178 . . . . 0.0 107.819 169.039 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 41' ' ' GLY . . . . . . . . . . . . . . . 178.46 173.91 44.25 Favored Glycine 0 C--O 1.237 0.316 0 N-CA-C 109.599 -1.4 . . . . 0.0 109.599 -178.34 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 42' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -147.38 83.61 1.55 Allowed 'General case' 0 N--CA 1.451 -0.405 0 O-C-N 122.226 -0.573 . . . . 0.0 111.134 179.982 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 43' ' ' MET . . . . . . . . . . . . . 6.1 mmt -47.82 -55.71 9.12 Favored 'General case' 0 C--N 1.342 0.266 0 C-N-CA 123.68 0.792 . . . . 0.0 109.006 169.14 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 44' ' ' CYS . . . . . 1.293 ' SG ' ' SG ' ' A' ' 70' ' ' CYS . 18.0 p -163.26 -27.38 0.04 OUTLIER 'General case' 0 N--CA 1.443 -0.819 0 C-N-CA 125.115 1.366 . . . . 0.0 110.989 176.093 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 45' ' ' ASN . . . . . . . . . . . . . 0.5 OUTLIER -121.38 20.23 11.26 Favored 'General case' 0 N--CA 1.47 0.559 0 C-N-CA 126.265 1.826 . . . . 0.0 112.217 -167.107 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 46' ' ' ARG . . . . . . . . . . . . . 34.3 mtm180 48.35 166.88 0.0 OUTLIER 'General case' 0 C--N 1.329 -0.312 0 C-N-CA 127.011 2.124 . . . . 0.0 111.661 -155.124 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 47' ' ' PHE . . . . . . . . . . . . . 6.0 p90 -164.41 147.93 9.29 Favored 'General case' 0 C--N 1.317 -0.819 0 N-CA-C 106.127 -1.805 . . . . 0.0 106.127 166.029 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 48' ' ' SER . . . . . . . . . . . . . 1.5 p -160.75 151.79 18.82 Favored 'General case' 0 C--N 1.314 -0.954 0 N-CA-C 107.304 -1.369 . . . . 0.0 107.304 179.529 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 49' ' ' GLY . . . . . . . . . . . . . . . -172.51 163.05 35.01 Favored Glycine 0 CA--C 1.524 0.635 0 N-CA-C 106.574 -2.61 . . . . 0.0 106.574 165.852 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 50' ' ' GLU . . . . . . . . . . . . . 25.8 mt-10 -64.27 115.68 5.28 Favored 'General case' 0 C--O 1.238 0.498 0 N-CA-C 107.781 -1.192 . . . . 0.0 107.781 172.109 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 51' ' ' GLY . . . . . . . . . . . . . . . -61.42 161.36 26.48 Favored Glycine 0 CA--C 1.531 1.064 0 O-C-N 123.628 0.58 . . . . 0.0 113.388 174.545 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 52' ' ' LYS . . . . . . . . . . . . . 25.9 ttpt -133.4 135.53 44.71 Favored 'General case' 0 N--CA 1.464 0.227 0 O-C-N 121.692 -0.887 . . . . 0.0 109.219 165.894 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 53' ' ' LEU . . . . . . . . . . . . . 9.6 tp -160.47 93.76 1.04 Allowed 'General case' 0 N--CA 1.453 -0.31 0 C-N-CA 123.511 0.724 . . . . 0.0 109.881 -176.356 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 2.5 t -136.74 -12.45 1.75 Allowed 'General case' 0 C--N 1.326 -0.445 0 C-N-CA 123.721 0.808 . . . . 0.0 111.047 168.765 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 55' ' ' ASN . . . . . . . . . . . . . 4.3 t30 -136.6 24.67 3.14 Favored 'General case' 0 CA--C 1.541 0.602 0 C-N-CA 127.114 2.165 . . . . 0.0 109.944 -171.851 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 56' ' ' GLY . . . . . . . . . . . . . . . 73.66 -3.55 33.8 Favored Glycine 0 CA--C 1.532 1.096 0 O-C-N 120.584 -1.322 . . . . 0.0 114.716 -175.968 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 57' ' ' GLU . . . . . . . . . . . . . 30.9 tt0 -110.45 105.28 14.2 Favored 'General case' 0 N--CA 1.452 -0.363 0 CA-C-N 118.747 1.274 . . . . 0.0 110.159 -161.539 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 58' ' ' LEU . . . . . 0.612 ' HB2' HG21 ' A' ' 92' ' ' VAL . 21.2 tp -75.99 93.83 3.32 Favored 'General case' 0 CA--C 1.536 0.408 0 C-N-CA 125.222 1.409 . . . . 0.0 112.251 176.84 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 59' ' ' THR . . . . . . . . . . . . . 14.9 p -108.02 127.74 54.04 Favored 'General case' 0 N--CA 1.474 0.742 0 C-N-CA 124.815 1.246 . . . . 0.0 109.955 172.916 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 60' ' ' ALA . . . . . . . . . . . . . . . -132.0 87.34 2.43 Favored 'General case' 0 N--CA 1.454 -0.226 0 C-N-CA 124.443 1.097 . . . . 0.0 109.504 173.571 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 61' ' ' LYS . . . . . . . . . . . . . 47.6 tttm -44.89 -62.4 1.24 Allowed 'General case' 0 C--N 1.331 -0.209 0 C-N-CA 125.817 1.647 . . . . 0.0 110.082 167.745 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 62' ' ' GLY . . . . . . . . . . . . . . . -79.38 45.57 2.87 Favored Glycine 0 CA--C 1.521 0.441 0 C-N-CA 125.251 1.405 . . . . 0.0 112.725 -176.52 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 63' ' ' LEU . . . . . . . . . . . . . 5.7 tp -63.56 142.6 58.34 Favored 'General case' 0 N--CA 1.441 -0.879 0 CA-C-N 118.474 1.137 . . . . 0.0 108.248 166.641 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 64' ' ' ALA . . . . . . . . . . . . . . . -128.88 93.11 3.53 Favored 'General case' 0 N--CA 1.455 -0.223 0 C-N-CA 124.727 1.211 . . . . 0.0 109.741 -173.351 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 65' ' ' MET . . . . . . . . . . . . . 74.9 mtp -115.64 156.36 26.01 Favored 'General case' 0 N--CA 1.467 0.406 0 C-N-CA 124.717 1.207 . . . . 0.0 110.346 -177.377 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 66' ' ' THR . . . . . . . . . . . . . 34.7 p -88.73 -172.06 3.57 Favored 'General case' 0 CA--C 1.544 0.717 0 C-N-CA 123.933 0.893 . . . . 0.0 109.736 173.245 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 67' ' ' ARG . . . . . . . . . . . . . 34.0 mtm180 -130.45 14.34 5.52 Favored 'General case' 0 N--CA 1.47 0.564 0 C-N-CA 124.005 0.922 . . . . 0.0 112.97 170.614 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 68' ' ' MET . . . . . . . . . . . . . 4.0 mpp? -61.5 166.53 4.0 Favored 'General case' 0 CA--C 1.532 0.254 0 O-C-N 120.033 -1.667 . . . . 0.0 111.688 178.367 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 69' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -58.02 111.08 1.06 Allowed 'General case' 0 N--CA 1.445 -0.677 0 C-N-CA 125.96 1.704 . . . . 0.0 108.291 171.305 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 70' ' ' CYS . . . . . 1.293 ' SG ' ' SG ' ' A' ' 44' ' ' CYS . 69.7 m -62.12 -14.09 33.34 Favored 'General case' 0 C--O 1.231 0.111 0 CA-C-O 118.485 -0.769 . . . . 0.0 112.86 170.585 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 71' ' ' ALA . . . . . . . . . . . . . . . 61.03 3.98 0.76 Allowed 'General case' 0 CA--C 1.533 0.295 0 C-N-CA 126.69 1.996 . . . . 0.0 115.38 163.941 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 72' ' ' ASN . . . . . . . . . . . . . 7.4 t30 -142.73 143.4 25.72 Favored Pre-proline 0 N--CA 1.466 0.373 0 N-CA-C 107.775 -1.194 . . . . 0.0 107.775 158.315 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 73' ' ' PRO . . . . . . . . . . . . . 19.0 Cg_endo -63.83 -47.02 7.54 Favored 'Trans proline' 0 C--N 1.346 0.411 0 C-N-CA 123.148 2.565 . . . . 0.0 111.815 -165.963 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 74' ' ' GLN . . . . . . . . . . . . . 48.2 tt0 -59.79 -38.65 82.5 Favored 'General case' 0 CA--C 1.532 0.272 0 CA-C-O 119.238 -0.41 . . . . 0.0 110.616 -179.052 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 75' ' ' LEU . . . . . 0.425 ' HB3' ' HB3' ' A' ' 44' ' ' CYS . 36.7 mt -72.24 -41.99 66.17 Favored 'General case' 0 CA--C 1.533 0.301 0 N-CA-C 109.269 -0.641 . . . . 0.0 109.269 -178.115 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 76' ' ' ASN . . . . . 0.416 ' CB ' ' HB2' ' A' ' 70' ' ' CYS . 4.1 t-20 -63.14 -37.85 88.86 Favored 'General case' 0 N--CA 1.469 0.494 0 C-N-CA 123.104 0.562 . . . . 0.0 111.188 -179.721 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 77' ' ' GLU . . . . . . . . . . . . . 0.7 OUTLIER -60.53 -24.33 65.28 Favored 'General case' 0 CA--C 1.542 0.647 0 N-CA-C 113.331 0.863 . . . . 0.0 113.331 175.257 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 78' ' ' LEU . . . . . . . . . . . . . 94.3 mt -89.37 -15.42 33.36 Favored 'General case' 0 CA--C 1.522 -0.128 0 CA-C-O 118.352 -0.832 . . . . 0.0 111.585 -176.375 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 79' ' ' ASP . . . . . . . . . . . . . 35.5 t70 -55.9 -42.26 75.74 Favored 'General case' 0 CA--C 1.518 -0.26 0 C-N-CA 124.952 1.301 . . . . 0.0 111.895 175.58 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 80' ' ' ASN . . . . . . . . . . . . . 71.6 m-20 -77.16 -55.49 5.39 Favored 'General case' 0 N--CA 1.451 -0.398 0 N-CA-C 107.47 -1.307 . . . . 0.0 107.47 -179.104 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 81' ' ' THR . . . . . . . . . . . . . 22.5 m -45.23 -54.95 6.34 Favored 'General case' 0 CA--C 1.536 0.405 0 C-N-CA 126.241 1.816 . . . . 0.0 110.938 -176.931 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 82' ' ' ILE . . . . . . . . . . . . . 9.5 tp -64.93 -40.74 90.08 Favored 'Isoleucine or valine' 0 C--O 1.236 0.362 0 CA-C-N 119.089 0.859 . . . . 0.0 111.373 -175.529 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 83' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -64.86 -38.63 91.61 Favored 'General case' 0 N--CA 1.449 -0.513 0 N-CA-C 109.083 -0.71 . . . . 0.0 109.083 -175.893 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 84' ' ' GLU . . . . . . . . . . . . . 94.7 mt-10 -74.75 -34.1 62.46 Favored 'General case' 0 N--CA 1.446 -0.631 0 C-N-CA 126.705 2.002 . . . . 0.0 111.374 -177.402 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 85' ' ' MET . . . . . . . . . . . . . 84.3 mtp -67.31 -55.09 15.29 Favored 'General case' 0 C--N 1.34 0.192 0 CA-C-O 122.131 0.967 . . . . 0.0 108.556 -179.678 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 86' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -66.6 -20.79 66.09 Favored 'General case' 0 C--N 1.333 -0.122 0 C-N-CA 123.657 0.783 . . . . 0.0 111.98 -173.93 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 87' ' ' LYS . . . . . . . . . . . . . 2.5 tptt -71.19 -40.49 71.16 Favored 'General case' 0 N--CA 1.453 -0.321 0 CA-C-O 117.668 -1.158 . . . . 0.0 111.303 179.153 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 88' ' ' GLU . . . . . . . . . . . . . 0.6 OUTLIER -84.54 -37.94 20.62 Favored 'General case' 0 C--N 1.341 0.225 0 O-C-N 124.282 0.989 . . . . 0.0 112.169 -175.615 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 89' ' ' GLY . . . . . . . . . . . . . . . 122.09 84.94 0.75 Allowed Glycine 0 CA--C 1.503 -0.7 0 N-CA-C 109.937 -1.265 . . . . 0.0 109.937 -174.031 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 90' ' ' ALA . . . . . . . . . . . . . . . -67.33 139.43 57.23 Favored 'General case' 0 N--CA 1.447 -0.616 0 N-CA-C 108.441 -0.948 . . . . 0.0 108.441 175.336 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 91' ' ' GLN . . . . . . . . . . . . . 6.9 mp0 -67.33 141.94 56.97 Favored 'General case' 0 N--CA 1.439 -1.01 0 N-CA-C 105.305 -2.109 . . . . 0.0 105.305 164.897 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 92' ' ' VAL . . . . . 0.612 HG21 ' HB2' ' A' ' 58' ' ' LEU . 79.5 t -130.01 117.76 41.91 Favored 'Isoleucine or valine' 0 N--CA 1.447 -0.607 0 N-CA-C 105.561 -2.015 . . . . 0.0 105.561 178.597 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 93' ' ' ASP . . . . . . . . . . . . . 31.4 m-20 -128.0 84.79 2.28 Favored 'General case' 0 C--N 1.327 -0.375 0 C-N-CA 127.065 2.146 . . . . 0.0 105.309 -171.764 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 94' ' ' LEU . . . . . . . . . . . . . 57.8 tp -85.2 109.17 18.12 Favored 'General case' 0 CA--C 1.516 -0.359 0 CA-C-O 122.336 1.065 . . . . 0.0 108.568 173.131 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 95' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -77.75 179.27 6.74 Favored 'General case' 0 C--N 1.315 -0.933 0 C-N-CA 127.022 2.129 . . . . 0.0 109.115 169.086 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 96' ' ' ALA . . . . . . . . . . . . . . . -44.52 -41.94 6.81 Favored 'General case' 0 CA--C 1.535 0.373 0 C-N-CA 125.021 1.328 . . . . 0.0 114.026 -163.918 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 97' ' ' ASN . . . . . . . . . . . . . 17.0 p30 -150.96 31.55 0.62 Allowed 'General case' 0 CA--C 1.535 0.376 0 C-N-CA 125.352 1.461 . . . . 0.0 111.993 170.92 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 98' ' ' GLN . . . . . . . . . . . . . 13.7 tt0 -147.8 125.57 11.89 Favored 'General case' 0 N--CA 1.457 -0.122 0 O-C-N 121.484 -0.76 . . . . 0.0 109.83 -178.62 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 99' ' ' LEU . . . . . . . . . . . . . 22.5 tp -90.22 129.64 36.45 Favored 'General case' 0 C--N 1.327 -0.399 0 C-N-CA 126.615 1.966 . . . . 0.0 110.448 -177.007 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 100' ' ' THR . . . . . . . . . . . . . 74.5 m -104.58 128.64 52.63 Favored 'General case' 0 N--CA 1.454 -0.271 0 C-N-CA 123.815 0.846 . . . . 0.0 109.593 158.931 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 101' ' ' LEU . . . . . . . . . . . . . 1.0 OUTLIER -98.13 141.93 30.45 Favored 'General case' 0 CA--C 1.519 -0.222 0 C-N-CA 126.175 1.79 . . . . 0.0 107.126 159.881 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 102' ' ' ALA . . . . . . . . . . . . . . . -143.76 148.13 35.18 Favored 'General case' 0 C--N 1.328 -0.362 0 C-N-CA 124.814 1.246 . . . . 0.0 107.831 172.015 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 103' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -162.54 173.42 14.01 Favored 'General case' 0 N--CA 1.442 -0.838 0 C-N-CA 126.89 2.076 . . . . 0.0 107.651 173.591 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 104' ' ' ALA . . . . . . . . . . . . . . . -51.17 -36.64 42.11 Favored 'General case' 0 CA--C 1.531 0.214 0 C-N-CA 123.803 0.841 . . . . 0.0 112.146 173.868 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 105' ' ' LYS . . . . . . . . . . . . . 12.5 mmtp -63.33 -74.61 0.09 Allowed 'General case' 0 C--N 1.339 0.113 0 CA-C-O 118.683 -0.675 . . . . 0.0 111.162 174.706 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 106' ' ' GLN . . . . . . . . . . . . . 2.6 pt20 -152.73 -172.04 4.12 Favored 'General case' 0 CA--C 1.534 0.355 0 CA-C-N 118.625 0.648 . . . . 0.0 111.667 -176.261 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 107' ' ' THR . . . . . 0.403 ' H ' ' HB2' ' A' ' 18' ' ' ASN . 1.8 t -128.58 135.81 49.87 Favored 'General case' 0 CA--C 1.534 0.345 0 C-N-CA 126.321 1.848 . . . . 0.0 107.875 177.498 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 108' ' ' LEU . . . . . 0.401 HD23 ' CE1' ' A' ' 110' ' ' TYR . 5.9 mp -123.78 149.83 45.17 Favored 'General case' 0 C--O 1.233 0.229 0 C-N-CA 128.346 2.658 . . . . 0.0 107.604 -173.838 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 109' ' ' THR . . . . . . . . . . . . . 1.3 m -132.08 102.19 5.71 Favored 'General case' 0 C--O 1.238 0.45 0 CA-C-O 121.746 0.784 . . . . 0.0 109.469 -176.367 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 110' ' ' TYR . . . . . 0.401 ' CE1' HD23 ' A' ' 108' ' ' LEU . 51.5 m-85 -103.26 144.61 31.11 Favored 'General case' 0 N--CA 1.453 -0.318 0 C-N-CA 124.925 1.29 . . . . 0.0 110.375 -173.893 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 111' ' ' LYS . . . . . . . . . . . . . 0.8 OUTLIER -98.81 142.65 30.07 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-O 117.739 -1.124 . . . . 0.0 109.398 -176.769 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 112' ' ' LEU . . . . . . . . . . . . . 39.1 tp -74.14 56.91 0.63 Allowed 'General case' 0 CA--C 1.542 0.644 0 C-N-CA 124.017 0.927 . . . . 0.0 109.214 162.586 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 113' ' ' ALA . . . . . . . . . . . . . . . -92.22 63.68 4.34 Favored 'General case' 0 C--O 1.236 0.368 0 CA-C-O 122.487 1.137 . . . . 0.0 108.456 -177.625 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 114' ' ' ASP . . . . . . . . . . . . . 5.1 p-10 -90.17 16.21 8.92 Favored 'General case' 0 C--N 1.326 -0.43 0 CA-C-N 114.633 -1.167 . . . . 0.0 113.203 -157.202 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 115' ' ' LEU . . . . . . . . . . . . . 46.7 mt 75.6 11.16 3.3 Favored 'General case' 0 C--O 1.23 0.062 0 C-N-CA 130.999 3.719 . . . . 0.0 114.573 -171.024 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 116' ' ' MET . . . . . . . . . . . . . 6.9 tpt 75.4 148.76 0.1 Allowed 'General case' 0 N--CA 1.463 0.2 0 C-N-CA 126.666 1.986 . . . . 0.0 109.497 -174.997 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 117' ' ' ASN . . . . . . . . . . . . . 10.9 t-20 . . . . . 0 C--O 1.237 0.413 0 C-N-CA 126.291 1.836 . . . . 0.0 113.755 -156.599 . . . . . . . . 0 0 . 1 . 012 nuclear build full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 53.0 ttp . . . . . 0 N--CA 1.452 -0.371 0 N-CA-C 108.853 -0.795 . . . . 0.0 108.853 . . . . . . . . . 0 0 . 1 . 012 nuclear build full ' A' A ' 2' ' ' VAL . . . . . 0.426 HG23 ' HB3' ' A' ' 94' ' ' LEU . 13.4 p -67.44 160.46 4.31 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.366 0 C-N-CA 123.986 0.914 . . . . 0.0 111.177 175.117 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 3' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -124.66 156.52 67.99 Favored Pre-proline 0 CA--C 1.541 0.616 0 C-N-CA 125.601 1.56 . . . . 0.0 111.093 163.885 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 4' ' ' PRO . . . . . . . . . . . . . 93.9 Cg_endo -72.72 -33.15 8.53 Favored 'Trans proline' 0 C--N 1.347 0.493 0 C-N-CA 124.001 3.134 . . . . 0.0 111.704 -174.943 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 5' ' ' GLU . . . . . . . . . . . . . 49.6 tt0 -44.51 -44.91 8.97 Favored 'General case' 0 CA--C 1.537 0.443 0 C-N-CA 124.304 1.041 . . . . 0.0 109.277 169.847 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 6' ' ' GLN . . . . . . . . . . . . . 37.8 mt-30 -70.35 4.88 2.0 Favored 'General case' 0 CA--C 1.538 0.503 0 N-CA-C 114.364 1.246 . . . . 0.0 114.364 -179.351 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 7' ' ' LEU . . . . . . . . . . . . . 19.7 mt -125.75 -48.98 1.63 Allowed 'General case' 0 C--N 1.333 -0.123 0 C-N-CA 125.712 1.605 . . . . 0.0 110.299 -174.922 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 8' ' ' GLN . . . . . . . . . . . . . 14.4 mt-30 -58.21 -2.73 0.2 Allowed 'General case' 0 CA--C 1.54 0.573 0 C-N-CA 127.395 2.278 . . . . 0.0 115.682 -171.708 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 9' ' ' HIS . . . . . . . . . . . . . 56.3 m-70 -141.15 8.07 2.03 Favored 'General case' 0 CA--C 1.537 0.461 0 C-N-CA 125.204 1.402 . . . . 0.0 112.809 173.296 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 10' ' ' HIS . . . . . . . . . . . . . 95.8 m-70 -122.6 120.17 32.97 Favored 'General case' 0 CA--C 1.529 0.152 0 CA-C-N 119.339 0.972 . . . . 0.0 109.937 -169.798 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 11' ' ' ARG . . . . . 0.464 HH21 ' CD ' ' A' ' 30' ' ' GLU . 1.2 ttt85 -81.76 150.79 27.76 Favored 'General case' 0 CA--C 1.517 -0.317 0 C-N-CA 124.049 0.94 . . . . 0.0 111.226 -179.577 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 12' ' ' PHE . . . . . 0.439 ' HB3' ' HB3' ' A' ' 110' ' ' TYR . 95.7 m-85 -139.11 159.08 43.0 Favored 'General case' 0 N--CA 1.438 -1.026 0 C-N-CA 125.829 1.652 . . . . 0.0 108.634 174.539 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 13' ' ' VAL . . . . . 0.411 ' HA ' ' HA ' ' A' ' 30' ' ' GLU . 0.0 OUTLIER -136.02 140.06 44.69 Favored 'Isoleucine or valine' 0 C--N 1.312 -1.025 0 C-N-CA 128.346 2.658 . . . . 0.0 106.391 -170.236 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' A' A ' 14' ' ' LEU . . . . . . . . . . . . . 15.2 tp -77.48 77.82 4.0 Favored 'General case' 0 N--CA 1.465 0.287 0 CA-C-O 122.407 1.099 . . . . 0.0 110.376 -177.958 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 7.3 tp10 -63.79 -41.01 98.02 Favored 'General case' 0 C--N 1.324 -0.536 0 C-N-CA 127.03 2.132 . . . . 0.0 110.655 -174.241 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 2.6 p -154.78 147.55 24.39 Favored 'General case' 0 CA--C 1.535 0.365 0 N-CA-C 113.949 1.092 . . . . 0.0 113.949 167.811 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 17' ' ' VAL . . . . . . . . . . . . . 13.7 t -95.9 166.96 1.75 Allowed 'Isoleucine or valine' 0 N--CA 1.462 0.157 0 C-N-CA 125.467 1.507 . . . . 0.0 108.177 176.842 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 18' ' ' ASN . . . . . . . . . . . . . 15.0 t30 -44.8 -23.54 0.14 Allowed 'General case' 0 CA--C 1.536 0.409 0 C-N-CA 128.476 2.71 . . . . 0.0 114.857 168.846 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . -112.01 -54.88 0.48 Allowed Glycine 0 C--N 1.335 0.498 0 C-N-CA 124.256 0.932 . . . . 0.0 112.789 179.761 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -153.99 161.92 28.07 Favored Pre-proline 0 CA--C 1.533 0.3 0 C-N-CA 124.696 1.198 . . . . 0.0 108.821 -166.856 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 21' ' ' PRO . . . . . . . . . . . . . 59.4 Cg_endo -71.95 173.54 12.66 Favored 'Trans proline' 0 N--CA 1.456 -0.688 0 C-N-CA 121.772 1.648 . . . . 0.0 110.995 175.165 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 22' ' ' VAL . . . . . . . . . . . . . 3.9 t -119.9 145.38 26.25 Favored 'Isoleucine or valine' 0 C--O 1.233 0.223 0 N-CA-C 106.917 -1.512 . . . . 0.0 106.917 175.465 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 23' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -145.37 117.55 8.38 Favored 'General case' 0 C--N 1.324 -0.527 0 N-CA-C 108.112 -1.07 . . . . 0.0 108.112 172.959 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 24' ' ' SER . . . . . . . . . . . . . 70.4 p -117.2 4.24 12.65 Favored 'General case' 0 N--CA 1.462 0.169 0 O-C-N 120.971 -1.081 . . . . 0.0 112.746 175.932 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 25' ' ' ASP . . . . . . . . . . . . . 1.7 t70 62.21 -37.61 0.13 Allowed 'General case' 0 N--CA 1.475 0.791 0 C-N-CA 131.183 3.793 . . . . 0.0 114.464 -179.209 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 26' ' ' LYS . . . . . . . . . . . . . 7.0 tptp -134.98 155.45 50.73 Favored 'General case' 0 N--CA 1.438 -1.072 0 C-N-CA 128.223 2.609 . . . . 0.0 105.468 171.435 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 27' ' ' ASN . . . . . . . . . . . . . 76.6 m-20 49.13 68.07 3.88 Favored Pre-proline 0 C--N 1.325 -0.469 0 C-N-CA 126.232 1.813 . . . . 0.0 110.28 177.382 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 28' ' ' PRO . . . . . . . . . . . . . 54.7 Cg_endo -64.51 155.1 68.28 Favored 'Trans proline' 0 N--CA 1.455 -0.738 0 C-N-CA 122.559 2.172 . . . . 0.0 110.633 177.108 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 29' ' ' PRO . . . . . . . . . . . . . 30.1 Cg_endo -69.13 78.95 0.77 Allowed 'Trans proline' 0 N--CA 1.455 -0.776 0 C-N-CA 123.045 2.496 . . . . 0.0 108.841 166.155 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 30' ' ' GLU . . . . . 0.464 ' CD ' HH21 ' A' ' 11' ' ' ARG . 8.4 pt-20 -106.49 150.03 26.5 Favored 'General case' 0 C--N 1.319 -0.735 0 C-N-CA 127.66 2.384 . . . . 0.0 106.38 -178.829 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 31' ' ' ILE . . . . . . . . . . . . . 16.6 tt -132.14 144.8 36.03 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.467 0 N-CA-C 107.001 -1.481 . . . . 0.0 107.001 -173.752 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 32' ' ' SER . . . . . . . . . . . . . 65.6 p -138.5 164.69 28.76 Favored 'General case' 0 N--CA 1.447 -0.602 0 N-CA-C 107.199 -1.408 . . . . 0.0 107.199 172.71 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 33' ' ' PHE . . . . . . . . . . . . . 59.2 m-85 -125.78 163.68 22.33 Favored 'General case' 0 N--CA 1.447 -0.623 0 N-CA-C 109.018 -0.734 . . . . 0.0 109.018 176.505 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 34' ' ' GLY . . . . . . . . . . . . . . . -151.4 -171.85 19.74 Favored Glycine 0 N--CA 1.451 -0.301 0 N-CA-C 109.033 -1.627 . . . . 0.0 109.033 172.748 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 35' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -44.34 150.69 0.29 Allowed 'General case' 0 CA--C 1.531 0.24 0 C-N-CA 126.374 1.87 . . . . 0.0 111.106 -175.577 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 36' ' ' LYS . . . . . 0.433 ' HE3' ' HA ' ' A' ' 36' ' ' LYS . 0.0 OUTLIER 57.1 26.83 12.52 Favored 'General case' 0 CA--C 1.533 0.316 0 C-N-CA 124.496 1.118 . . . . 0.0 111.0 -169.486 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' A' A ' 37' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER 51.6 28.66 4.85 Favored 'General case' 0 CA--C 1.542 0.658 0 C-N-CA 125.587 1.555 . . . . 0.0 111.573 -178.126 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 38' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -57.6 141.64 47.43 Favored 'General case' 0 N--CA 1.444 -0.761 0 C-N-CA 125.536 1.534 . . . . 0.0 109.633 -179.606 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 39' ' ' ILE . . . . . . . . . . . . . 18.8 mt -112.37 126.09 69.73 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.703 0 C-N-CA 126.429 1.892 . . . . 0.0 106.504 -170.099 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 40' ' ' SER . . . . . . . . . . . . . 69.4 m -135.71 135.7 40.26 Favored 'General case' 0 C--O 1.236 0.357 0 C-N-CA 124.213 1.005 . . . . 0.0 110.749 -178.964 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 41' ' ' GLY . . . . . . . . . . . . . . . 167.88 176.87 38.8 Favored Glycine 0 CA--C 1.534 1.245 0 C-N-CA 124.139 0.876 . . . . 0.0 112.225 -174.868 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 42' ' ' SER . . . . . . . . . . . . . 39.9 t -147.52 109.19 4.38 Favored 'General case' 0 N--CA 1.445 -0.725 0 C-N-CA 126.761 2.024 . . . . 0.0 107.901 169.873 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 43' ' ' MET . . . . . . . . . . . . . 11.8 mmt -62.17 -45.03 95.22 Favored 'General case' 0 C--O 1.222 -0.361 0 C-N-CA 120.603 -0.439 . . . . 0.0 110.804 164.339 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 44' ' ' CYS . . . . . 1.304 ' SG ' ' SG ' ' A' ' 70' ' ' CYS . 2.7 t -157.27 -60.87 0.09 Allowed 'General case' 0 CA--C 1.513 -0.444 0 N-CA-C 105.022 -2.214 . . . . 0.0 105.022 -172.32 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 45' ' ' ASN . . . . . . . . . . . . . 1.9 m-20 -101.34 12.85 36.69 Favored 'General case' 0 C--N 1.328 -0.328 0 C-N-CA 125.53 1.532 . . . . 0.0 114.746 -164.541 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 46' ' ' ARG . . . . . . . . . . . . . 18.1 mmm-85 61.38 152.26 0.03 OUTLIER 'General case' 0 C--O 1.218 -0.56 0 C-N-CA 128.191 2.596 . . . . 0.0 112.979 -164.512 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 47' ' ' PHE . . . . . . . . . . . . . 2.9 p90 -158.38 170.86 21.28 Favored 'General case' 0 CA--C 1.515 -0.401 0 C-N-CA 124.62 1.168 . . . . 0.0 107.919 169.639 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 48' ' ' SER . . . . . . . . . . . . . 19.4 m -160.62 163.34 32.67 Favored 'General case' 0 C--N 1.317 -0.824 0 N-CA-C 106.128 -1.804 . . . . 0.0 106.128 179.616 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 49' ' ' GLY . . . . . . . . . . . . . . . -175.91 170.07 42.9 Favored Glycine 0 N--CA 1.445 -0.755 0 CA-C-N 120.532 1.515 . . . . 0.0 110.739 155.487 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 50' ' ' GLU . . . . . . . . . . . . . 27.0 tt0 -74.17 111.68 9.57 Favored 'General case' 0 N--CA 1.441 -0.88 0 N-CA-C 107.266 -1.383 . . . . 0.0 107.266 162.79 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 51' ' ' GLY . . . . . . . . . . . . . . . -82.24 179.93 53.04 Favored Glycine 0 CA--C 1.536 1.377 0 C-N-CA 123.765 0.698 . . . . 0.0 112.927 158.317 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 52' ' ' LYS . . . . . . . . . . . . . 37.9 tttt -162.74 156.83 20.85 Favored 'General case' 0 N--CA 1.473 0.714 0 C-N-CA 126.554 1.941 . . . . 0.0 107.689 168.304 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 53' ' ' LEU . . . . . . . . . . . . . 1.2 tm? -123.89 115.47 21.35 Favored 'General case' 0 C--O 1.234 0.283 0 C-N-CA 124.143 0.977 . . . . 0.0 109.044 176.411 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 28.5 t -134.92 -54.25 0.81 Allowed 'General case' 0 CA--C 1.534 0.365 0 CA-C-O 118.429 -0.796 . . . . 0.0 111.19 175.541 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 55' ' ' ASN . . . . . . . . . . . . . 4.7 p30 -110.6 13.07 22.64 Favored 'General case' 0 N--CA 1.475 0.781 0 N-CA-C 113.55 0.944 . . . . 0.0 113.55 -178.237 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 56' ' ' GLY . . . . . . . . . . . . . . . 91.18 4.86 68.25 Favored Glycine 0 CA--C 1.528 0.887 0 C-N-CA 124.283 0.944 . . . . 0.0 111.911 -172.653 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 57' ' ' GLU . . . . . . . . . . . . . 39.5 tt0 -113.97 109.36 18.36 Favored 'General case' 0 N--CA 1.451 -0.394 0 C-N-CA 124.513 1.125 . . . . 0.0 108.672 -166.13 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 58' ' ' LEU . . . . . . . . . . . . . 35.7 tp -80.42 95.97 6.58 Favored 'General case' 0 N--CA 1.454 -0.257 0 C-N-CA 124.571 1.148 . . . . 0.0 109.074 173.609 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 59' ' ' THR . . . . . . . . . . . . . 1.2 p -95.11 146.86 24.0 Favored 'General case' 0 C--O 1.238 0.461 0 C-N-CA 123.749 0.82 . . . . 0.0 109.805 168.281 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 60' ' ' ALA . . . . . . . . . . . . . . . -68.84 170.28 9.9 Favored 'General case' 0 CA--C 1.537 0.477 0 CA-C-O 121.912 0.863 . . . . 0.0 110.955 163.931 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 61' ' ' LYS . . . . . . . . . . . . . 23.6 tttt -155.02 -9.76 0.12 Allowed 'General case' 0 CA--C 1.535 0.402 0 C-N-CA 128.191 2.596 . . . . 0.0 112.231 179.685 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 62' ' ' GLY . . . . . . . . . . . . . . . 171.03 77.34 0.04 OUTLIER Glycine 0 C--N 1.334 0.464 0 N-CA-C 106.279 -2.728 . . . . 0.0 106.279 -172.827 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 63' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -115.32 146.98 41.0 Favored 'General case' 0 N--CA 1.449 -0.512 0 C-N-CA 124.963 1.305 . . . . 0.0 109.326 -171.915 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 64' ' ' ALA . . . . . . . . . . . . . . . -120.87 167.13 12.87 Favored 'General case' 0 N--CA 1.45 -0.472 0 C-N-CA 125.025 1.33 . . . . 0.0 109.226 -175.01 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 65' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -150.85 -178.66 6.71 Favored 'General case' 0 C--O 1.238 0.456 0 C-N-CA 126.327 1.851 . . . . 0.0 107.223 171.354 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 66' ' ' THR . . . . . . . . . . . . . 4.0 p -129.83 179.53 5.79 Favored 'General case' 0 CA--C 1.538 0.515 0 CA-C-N 119.181 0.9 . . . . 0.0 110.206 164.268 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 67' ' ' ARG . . . . . . . . . . . . . 10.0 mmt85 -127.55 81.29 2.01 Favored 'General case' 0 CA--C 1.529 0.152 0 C-N-CA 125.953 1.701 . . . . 0.0 108.088 179.599 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 68' ' ' MET . . . . . . . . . . . . . 61.5 mtm -118.06 -174.4 2.64 Favored 'General case' 0 CA--C 1.538 0.501 0 C-N-CA 129.242 3.017 . . . . 0.0 109.389 170.933 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 69' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -104.69 173.1 6.45 Favored 'General case' 0 N--CA 1.465 0.284 0 C-N-CA 127.821 2.448 . . . . 0.0 108.709 168.244 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 70' ' ' CYS . . . . . 1.304 ' SG ' ' SG ' ' A' ' 44' ' ' CYS . 68.1 m -142.53 150.01 39.86 Favored 'General case' 0 C--O 1.233 0.214 0 C-N-CA 123.87 0.868 . . . . 0.0 110.265 174.854 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 71' ' ' ALA . . . . . . . . . . . . . . . -84.3 36.7 0.59 Allowed 'General case' 0 CA--C 1.538 0.489 0 C-N-CA 124.149 0.98 . . . . 0.0 111.398 179.074 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 72' ' ' ASN . . . . . . . . . . . . . 4.0 t30 -166.6 150.15 6.52 Favored Pre-proline 0 N--CA 1.465 0.324 0 C-N-CA 124.298 1.039 . . . . 0.0 108.821 159.302 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 73' ' ' PRO . . . . . . . . . . . . . 96.2 Cg_endo -84.2 -33.64 0.3 Allowed 'Trans proline' 0 N--CA 1.461 -0.424 0 C-N-CA 122.352 2.035 . . . . 0.0 113.288 -171.128 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 74' ' ' GLN . . . . . . . . . . . . . 43.2 tt0 -60.88 -37.4 82.06 Favored 'General case' 0 N--CA 1.465 0.317 0 O-C-N 121.671 -0.643 . . . . 0.0 111.541 -175.644 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 75' ' ' LEU . . . . . . . . . . . . . 50.2 mt -53.58 -43.61 68.67 Favored 'General case' 0 CA--C 1.535 0.382 0 C-N-CA 124.968 1.307 . . . . 0.0 108.678 173.186 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 76' ' ' ASN . . . . . . . . . . . . . 0.7 OUTLIER -77.85 5.07 10.33 Favored 'General case' 0 N--CA 1.47 0.528 0 C-N-CA 128.137 2.575 . . . . 0.0 112.4 -174.518 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 77' ' ' GLU . . . . . . . . . . . . . 0.2 OUTLIER -101.72 -46.02 5.06 Favored 'General case' 0 CA--C 1.535 0.394 0 C-N-CA 126.754 2.021 . . . . 0.0 107.79 168.901 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 78' ' ' LEU . . . . . . . . . . . . . 15.3 mt -65.41 -29.03 69.68 Favored 'General case' 0 CA--C 1.53 0.202 0 C-N-CA 124.977 1.311 . . . . 0.0 111.284 176.937 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 79' ' ' ASP . . . . . . . . . . . . . 0.0 OUTLIER -61.56 -6.48 2.47 Favored 'General case' 0 N--CA 1.469 0.498 0 C-N-CA 126.463 1.905 . . . . 0.0 114.467 168.835 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 80' ' ' ASN . . . . . . . . . . . . . 85.6 m-20 -106.95 -40.31 5.5 Favored 'General case' 0 CA--C 1.531 0.242 0 C-N-CA 124.614 1.166 . . . . 0.0 111.223 164.345 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 81' ' ' THR . . . . . . . . . . . . . 6.9 m -55.43 -65.02 0.66 Allowed 'General case' 0 C--N 1.347 0.493 0 CA-C-N 119.997 1.271 . . . . 0.0 111.524 -176.689 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 82' ' ' ILE . . . . . 0.501 HG13 HD12 ' A' ' 86' ' ' LEU . 9.4 tp -60.43 -37.08 73.36 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.297 0 CA-C-N 119.324 0.965 . . . . 0.0 110.345 -168.455 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 83' ' ' SER . . . . . . . . . . . . . 4.4 m -58.17 -46.82 85.05 Favored 'General case' 0 N--CA 1.446 -0.64 0 C-N-CA 124.891 1.276 . . . . 0.0 110.156 -178.857 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 84' ' ' GLU . . . . . . . . . . . . . 29.3 tt0 -76.8 -41.27 45.14 Favored 'General case' 0 N--CA 1.445 -0.704 0 C-N-CA 126.023 1.729 . . . . 0.0 110.368 -176.781 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 85' ' ' MET . . . . . . . . . . . . . 6.3 ptm -66.74 -40.28 88.27 Favored 'General case' 0 CA--C 1.516 -0.357 0 C-N-CA 123.923 0.889 . . . . 0.0 108.614 -176.59 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 86' ' ' LEU . . . . . 0.501 HD12 HG13 ' A' ' 82' ' ' ILE . 0.3 OUTLIER -71.32 -31.54 67.52 Favored 'General case' 0 N--CA 1.447 -0.577 0 C-N-CA 118.292 -1.363 . . . . 0.0 111.696 -171.138 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' A' A ' 87' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -55.92 -49.89 72.23 Favored 'General case' 0 N--CA 1.45 -0.468 0 N-CA-C 107.859 -1.163 . . . . 0.0 107.859 177.953 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 88' ' ' GLU . . . . . . . . . . . . . 28.0 mt-10 -69.12 -26.58 64.97 Favored 'General case' 0 N--CA 1.445 -0.699 0 CA-C-O 117.235 -1.364 . . . . 0.0 112.544 174.978 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 89' ' ' GLY . . . . . . . . . . . . . . . 94.25 104.23 1.81 Allowed Glycine 0 CA--C 1.499 -0.935 0 CA-C-N 120.474 1.488 . . . . 0.0 109.395 -171.865 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 90' ' ' ALA . . . . . . . . . . . . . . . -80.22 136.04 36.38 Favored 'General case' 0 N--CA 1.445 -0.724 0 N-CA-C 108.668 -0.864 . . . . 0.0 108.668 173.346 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 91' ' ' GLN . . . . . . . . . . . . . 86.3 mm-40 -65.89 138.54 57.93 Favored 'General case' 0 N--CA 1.448 -0.57 0 N-CA-C 106.205 -1.776 . . . . 0.0 106.205 163.558 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 92' ' ' VAL . . . . . . . . . . . . . 76.1 t -131.62 119.8 43.42 Favored 'Isoleucine or valine' 0 N--CA 1.445 -0.692 0 N-CA-C 105.746 -1.946 . . . . 0.0 105.746 -178.975 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 93' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -136.62 94.67 3.02 Favored 'General case' 0 N--CA 1.446 -0.629 0 CA-C-O 122.62 1.2 . . . . 0.0 108.796 170.589 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 94' ' ' LEU . . . . . 0.426 ' HB3' HG23 ' A' ' 2' ' ' VAL . 0.4 OUTLIER -65.93 108.73 2.27 Favored 'General case' 0 N--CA 1.446 -0.656 0 N-CA-C 106.661 -1.607 . . . . 0.0 106.661 165.85 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' A' A ' 95' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -71.21 -178.32 2.0 Allowed 'General case' 0 C--N 1.317 -0.811 0 C-N-CA 126.286 1.834 . . . . 0.0 106.862 168.987 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 96' ' ' ALA . . . . . . . . . . . . . . . -44.93 -34.22 2.31 Favored 'General case' 0 CA--C 1.542 0.668 0 N-CA-C 114.328 1.233 . . . . 0.0 114.328 -179.432 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 97' ' ' ASN . . . . . . . . . . . . . 14.2 p30 -152.02 22.43 0.67 Allowed 'General case' 0 N--CA 1.47 0.547 0 N-CA-C 114.459 1.281 . . . . 0.0 114.459 170.788 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 98' ' ' GLN . . . . . . . . . . . . . 1.5 tt0 -141.3 119.27 11.92 Favored 'General case' 0 N--CA 1.465 0.323 0 O-C-N 120.716 -1.24 . . . . 0.0 111.192 -175.56 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 99' ' ' LEU . . . . . 0.439 ' HB3' ' HB2' ' A' ' 110' ' ' TYR . 8.5 tp -70.85 107.29 3.95 Favored 'General case' 0 C--O 1.237 0.408 0 C-N-CA 126.957 2.103 . . . . 0.0 108.489 177.675 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 100' ' ' THR . . . . . . . . . . . . . 3.2 m -88.37 117.29 27.19 Favored 'General case' 0 C--N 1.327 -0.371 0 N-CA-C 106.0 -1.852 . . . . 0.0 106.0 172.778 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 101' ' ' LEU . . . . . . . . . . . . . 1.1 mm? -110.09 147.67 33.19 Favored 'General case' 0 CA--C 1.515 -0.367 0 N-CA-C 108.822 -0.807 . . . . 0.0 108.822 171.424 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 102' ' ' ALA . . . . . . . . . . . . . . . -149.09 161.27 42.29 Favored 'General case' 0 CA--C 1.53 0.209 0 C-N-CA 124.023 0.929 . . . . 0.0 109.654 166.289 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 103' ' ' THR . . . . . . . . . . . . . 1.6 p -147.7 177.19 9.49 Favored 'General case' 0 C--N 1.327 -0.385 0 C-N-CA 127.76 2.424 . . . . 0.0 107.358 159.682 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 104' ' ' ALA . . . . . . . . . . . . . . . -56.11 -25.04 44.18 Favored 'General case' 0 CA--C 1.534 0.334 0 CA-C-O 118.796 -0.621 . . . . 0.0 112.532 162.258 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 105' ' ' LYS . . . . . . . . . . . . . 24.5 mmtt -71.3 -82.41 0.04 OUTLIER 'General case' 0 N--CA 1.456 -0.141 0 C-N-CA 123.476 0.71 . . . . 0.0 109.392 170.835 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 106' ' ' GLN . . . . . . . . . . . . . 14.7 pt20 -156.29 176.6 12.47 Favored 'General case' 0 C--O 1.236 0.358 0 CA-C-O 121.401 0.619 . . . . 0.0 112.635 -171.057 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 107' ' ' THR . . . . . . . . . . . . . 0.8 OUTLIER -120.78 134.99 55.27 Favored 'General case' 0 C--O 1.232 0.172 0 C-N-CA 127.775 2.43 . . . . 0.0 108.848 -168.288 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 108' ' ' LEU . . . . . . . . . . . . . 2.4 mm? -117.29 151.22 37.41 Favored 'General case' 0 C--O 1.236 0.383 0 N-CA-C 107.843 -1.169 . . . . 0.0 107.843 176.904 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 109' ' ' THR . . . . . . . . . . . . . 0.1 OUTLIER -119.29 107.48 13.45 Favored 'General case' 0 C--N 1.324 -0.503 0 N-CA-C 103.564 -2.754 . . . . 0.0 103.564 179.614 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 110' ' ' TYR . . . . . 0.439 ' HB2' ' HB3' ' A' ' 99' ' ' LEU . 67.1 m-85 -110.77 134.05 52.82 Favored 'General case' 0 N--CA 1.447 -0.611 0 N-CA-C 108.645 -0.872 . . . . 0.0 108.645 173.555 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 111' ' ' LYS . . . . . . . . . . . . . 2.5 tmtt? -94.21 142.63 27.18 Favored 'General case' 0 C--N 1.322 -0.628 0 N-CA-C 108.246 -1.02 . . . . 0.0 108.246 -178.387 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 112' ' ' LEU . . . . . . . . . . . . . 56.8 tp -66.27 105.74 1.5 Allowed 'General case' 0 C--N 1.329 -0.31 0 N-CA-C 107.547 -1.279 . . . . 0.0 107.547 169.064 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 113' ' ' ALA . . . . . . . . . . . . . . . -137.72 98.38 3.66 Favored 'General case' 0 CA--C 1.516 -0.353 0 N-CA-C 107.038 -1.467 . . . . 0.0 107.038 177.846 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 114' ' ' ASP . . . . . . . . . . . . . 30.9 t0 -96.65 44.61 1.06 Allowed 'General case' 0 C--N 1.325 -0.494 0 CA-C-O 123.67 1.7 . . . . 0.0 111.244 -169.115 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 115' ' ' LEU . . . . . . . . . . . . . 13.2 mt -70.37 8.38 0.82 Allowed 'General case' 0 N--CA 1.451 -0.406 0 C-N-CA 129.235 3.014 . . . . 0.0 111.23 -176.065 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 116' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -54.28 -34.79 61.64 Favored 'General case' 0 N--CA 1.454 -0.23 0 C-N-CA 124.747 1.219 . . . . 0.0 113.36 -158.029 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 117' ' ' ASN . . . . . . . . . . . . . 50.1 t-20 . . . . . 0 C--O 1.238 0.479 0 C-N-CA 125.111 1.365 . . . . 0.0 110.637 -171.241 . . . . . . . . 0 0 . 1 . 013 nuclear build full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 18.9 ttt . . . . . 0 C--O 1.236 0.385 0 N-CA-C 109.311 -0.626 . . . . 0.0 109.311 . . . . . . . . . 0 0 . 1 . 013 nuclear build full ' A' A ' 2' ' ' VAL . . . . . . . . . . . . . 7.5 p -55.12 129.51 16.48 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.439 0 N-CA-C 109.397 -0.594 . . . . 0.0 109.397 175.78 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 3' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -122.64 159.93 50.93 Favored Pre-proline 0 N--CA 1.449 -0.487 0 N-CA-C 109.867 -0.42 . . . . 0.0 109.867 -179.164 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 4' ' ' PRO . . . . . . . . . . . . . 36.6 Cg_endo -70.67 -37.03 7.47 Favored 'Trans proline' 0 N--CA 1.464 -0.262 0 C-N-CA 122.472 2.115 . . . . 0.0 112.799 -173.757 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 5' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -57.84 -54.17 49.97 Favored 'General case' 0 C--N 1.328 -0.365 0 C-N-CA 125.788 1.635 . . . . 0.0 109.67 -179.289 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 6' ' ' GLN . . . . . . . . . . . . . 3.5 pt20 -67.02 25.34 0.02 OUTLIER 'General case' 0 CA--C 1.545 0.772 0 C-N-CA 126.24 1.816 . . . . 0.0 114.779 177.917 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 7' ' ' LEU . . . . . . . . . . . . . 97.4 mt -141.74 -49.41 0.39 Allowed 'General case' 0 N--CA 1.451 -0.398 0 C-N-CA 127.249 2.219 . . . . 0.0 108.869 -177.761 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 8' ' ' GLN . . . . . . . . . . . . . 3.1 mt-30 -46.94 -6.3 0.01 OUTLIER 'General case' 0 N--CA 1.471 0.623 0 C-N-CA 130.119 3.367 . . . . 0.0 118.215 -177.914 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 9' ' ' HIS . . . . . . . . . . . . . 32.0 p80 -145.77 10.84 1.22 Allowed 'General case' 0 C--N 1.325 -0.463 0 CA-C-N 119.641 1.109 . . . . 0.0 112.972 174.798 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 10' ' ' HIS . . . . . . . . . . . . . 32.0 m-70 -100.69 163.96 12.09 Favored 'General case' 0 C--O 1.238 0.489 0 C-N-CA 123.711 0.804 . . . . 0.0 109.733 -176.631 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 11' ' ' ARG . . . . . 0.407 HH21 ' CD ' ' A' ' 30' ' ' GLU . 4.4 ttt85 -126.96 145.69 50.6 Favored 'General case' 0 CA--C 1.514 -0.407 0 C-N-CA 125.456 1.502 . . . . 0.0 107.811 173.184 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 12' ' ' PHE . . . . . . . . . . . . . 42.4 m-85 -136.21 148.13 47.96 Favored 'General case' 0 N--CA 1.445 -0.724 0 N-CA-C 105.717 -1.957 . . . . 0.0 105.717 179.478 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 13' ' ' VAL . . . . . . . . . . . . . 2.5 t -122.2 148.99 25.55 Favored 'Isoleucine or valine' 0 C--O 1.24 0.583 0 C-N-CA 125.413 1.485 . . . . 0.0 108.492 178.981 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 14' ' ' LEU . . . . . . . . . . . . . 7.5 tp -77.37 80.74 3.86 Favored 'General case' 0 N--CA 1.447 -0.596 0 O-C-N 124.418 1.074 . . . . 0.0 109.835 -178.471 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -61.08 -34.97 75.77 Favored 'General case' 0 CA--C 1.534 0.341 0 C-N-CA 123.969 0.908 . . . . 0.0 110.047 -179.961 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 3.2 m -165.83 143.69 5.71 Favored 'General case' 0 CA--C 1.535 0.373 0 O-C-N 121.35 -0.844 . . . . 0.0 111.717 176.368 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 17' ' ' VAL . . . . . . . . . . . . . 2.8 t -97.31 161.13 2.86 Favored 'Isoleucine or valine' 0 CA--C 1.542 0.644 0 C-N-CA 126.396 1.878 . . . . 0.0 108.25 -177.371 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 18' ' ' ASN . . . . . . . . . . . . . 19.9 t30 -51.85 -32.12 30.67 Favored 'General case' 0 N--CA 1.473 0.692 0 C-N-CA 123.438 0.695 . . . . 0.0 112.416 167.4 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . -78.66 -54.48 4.23 Favored Glycine 0 N--CA 1.445 -0.736 0 CA-C-O 119.039 -0.867 . . . . 0.0 111.842 -178.36 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 8.5 mtmt -168.87 166.35 6.49 Favored Pre-proline 0 N--CA 1.466 0.331 0 C-N-CA 126.709 2.003 . . . . 0.0 110.444 -168.703 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 21' ' ' PRO . . . . . . . . . . . . . 36.3 Cg_endo -58.29 161.93 12.98 Favored 'Trans proline' 0 N--CA 1.457 -0.648 0 C-N-CA 121.57 1.514 . . . . 0.0 111.151 163.572 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 22' ' ' VAL . . . . . . . . . . . . . 11.6 p -141.7 127.9 19.25 Favored 'Isoleucine or valine' 0 CA--C 1.529 0.162 0 C-N-CA 124.014 0.926 . . . . 0.0 108.677 175.267 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 23' ' ' THR . . . . . . . . . . . . . 0.6 OUTLIER -136.41 130.94 33.47 Favored 'General case' 0 N--CA 1.451 -0.377 0 N-CA-C 106.678 -1.601 . . . . 0.0 106.678 171.842 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 24' ' ' SER . . . . . . . . . . . . . 0.5 OUTLIER -126.74 67.59 1.25 Allowed 'General case' 0 N--CA 1.453 -0.315 0 N-CA-C 106.886 -1.524 . . . . 0.0 106.886 178.673 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 25' ' ' ASP . . . . . . . . . . . . . 2.0 t70 65.38 -70.69 0.09 Allowed 'General case' 0 C--O 1.233 0.2 0 C-N-CA 128.772 2.829 . . . . 0.0 113.878 173.003 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 26' ' ' LYS . . . . . . . . . . . . . 16.1 ttmt -145.88 -7.86 0.56 Allowed 'General case' 0 CA--C 1.531 0.217 0 C-N-CA 126.414 1.886 . . . . 0.0 111.928 175.07 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 27' ' ' ASN . . . . . . . . . . . . . 80.0 m-20 -124.18 73.33 57.64 Favored Pre-proline 0 C--O 1.232 0.135 0 C-N-CA 124.607 1.163 . . . . 0.0 108.424 -174.303 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 28' ' ' PRO . . . . . . . . . . . . . 55.5 Cg_endo -69.72 173.21 11.27 Favored 'Trans proline' 0 N--CA 1.457 -0.645 0 C-N-CA 123.259 2.639 . . . . 0.0 112.728 179.115 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 29' ' ' PRO . . . . . . . . . . . . . 34.8 Cg_endo -65.7 64.83 0.4 Allowed 'Trans proline' 0 CA--C 1.537 0.637 0 C-N-CA 125.145 3.897 . . . . 0.0 112.301 166.517 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 30' ' ' GLU . . . . . 0.407 ' CD ' HH21 ' A' ' 11' ' ' ARG . 4.5 pt-20 -79.99 169.68 17.52 Favored 'General case' 0 CA--C 1.538 0.489 0 O-C-N 120.592 -1.318 . . . . 0.0 110.218 175.203 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 31' ' ' ILE . . . . . . . . . . . . . 9.1 tt -145.48 143.5 21.84 Favored 'Isoleucine or valine' 0 C--O 1.238 0.45 0 N-CA-C 106.676 -1.602 . . . . 0.0 106.676 -179.058 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 32' ' ' SER . . . . . . . . . . . . . 80.4 p -140.08 150.5 44.41 Favored 'General case' 0 C--O 1.236 0.368 0 N-CA-C 108.762 -0.829 . . . . 0.0 108.762 174.139 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 33' ' ' PHE . . . . . . . . . . . . . 9.0 m-30 -127.66 133.11 49.63 Favored 'General case' 0 CA--C 1.535 0.385 0 C-N-CA 127.063 2.145 . . . . 0.0 105.237 -169.669 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 34' ' ' GLY . . . . . . . . . . . . . . . -112.43 -166.74 17.34 Favored Glycine 0 N--CA 1.471 0.999 0 C-N-CA 124.761 1.172 . . . . 0.0 111.642 -179.371 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 35' ' ' GLU . . . . . . . . . . . . . 16.8 tt0 -69.93 32.67 0.04 OUTLIER 'General case' 0 CA--C 1.546 0.823 0 C-N-CA 127.931 2.492 . . . . 0.0 116.143 -164.802 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 1.1 mmtm -157.16 10.98 0.21 Allowed 'General case' 0 N--CA 1.44 -0.959 0 C-N-CA 127.919 2.488 . . . . 0.0 116.609 -166.209 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 37' ' ' MET . . . . . . . . . . . . . 41.1 mmm 53.66 21.02 2.4 Favored 'General case' 0 CA--C 1.555 1.153 0 CA-C-N 120.129 1.332 . . . . 0.0 112.106 -161.576 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 38' ' ' MET . . . . . . . . . . . . . 11.0 mmm -69.76 165.6 21.05 Favored 'General case' 0 C--O 1.227 -0.127 0 O-C-N 120.178 -1.576 . . . . 0.0 110.979 177.765 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 39' ' ' ILE . . . . . . . . . . . . . 58.5 mt -137.27 138.03 45.66 Favored 'Isoleucine or valine' 0 C--O 1.237 0.411 0 O-C-N 121.85 -0.531 . . . . 0.0 109.749 -176.401 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 40' ' ' SER . . . . . . . . . . . . . 9.3 p -143.85 118.52 9.81 Favored 'General case' 0 CA--C 1.539 0.55 0 C-N-CA 125.194 1.398 . . . . 0.0 109.465 171.728 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 41' ' ' GLY . . . . . . . . . . . . . . . -157.48 -173.93 26.53 Favored Glycine 0 CA--C 1.533 1.187 0 C-N-CA 125.169 1.366 . . . . 0.0 111.138 178.114 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 42' ' ' SER . . . . . . . . . . . . . 74.0 p -157.39 94.2 1.36 Allowed 'General case' 0 C--O 1.223 -0.297 0 C-N-CA 124.208 1.003 . . . . 0.0 110.311 178.754 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 43' ' ' MET . . . . . . . . . . . . . 2.2 mmt -67.01 -40.98 87.4 Favored 'General case' 0 CA--C 1.534 0.331 0 CA-C-O 120.978 0.418 . . . . 0.0 110.868 176.622 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 44' ' ' CYS . . . . . 1.285 ' SG ' ' SG ' ' A' ' 70' ' ' CYS . 33.1 t -151.12 -63.24 0.19 Allowed 'General case' 0 N--CA 1.448 -0.554 0 N-CA-C 104.808 -2.293 . . . . 0.0 104.808 158.457 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 45' ' ' ASN . . . . . . . . . . . . . 71.4 m-20 -83.67 30.0 0.51 Allowed 'General case' 0 CA--C 1.528 0.134 0 C-N-CA 126.47 1.908 . . . . 0.0 114.328 -168.798 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 46' ' ' ARG . . . . . . . . . . . . . 61.7 mtt180 59.25 167.56 0.06 Allowed 'General case' 0 N--CA 1.472 0.649 0 C-N-CA 126.117 1.767 . . . . 0.0 110.965 -171.668 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 47' ' ' PHE . . . . . . . . . . . . . 34.8 p90 -159.31 167.2 29.49 Favored 'General case' 0 C--O 1.239 0.55 0 N-CA-C 108.506 -0.924 . . . . 0.0 108.506 154.122 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 48' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -162.1 137.03 7.07 Favored 'General case' 0 C--O 1.238 0.48 0 N-CA-C 108.352 -0.981 . . . . 0.0 108.352 177.529 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 49' ' ' GLY . . . . . . . . . . . . . . . -170.9 162.48 35.43 Favored Glycine 0 C--N 1.339 0.703 0 N-CA-C 110.209 -1.157 . . . . 0.0 110.209 172.152 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 50' ' ' GLU . . . . . . . . . . . . . 40.3 mt-10 -74.13 101.33 3.9 Favored 'General case' 0 C--O 1.237 0.407 0 C-N-CA 124.323 1.049 . . . . 0.0 108.442 170.258 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 51' ' ' GLY . . . . . . . . . . . . . . . -68.63 -179.46 19.4 Favored Glycine 0 CA--C 1.535 1.341 0 C-N-CA 123.542 0.592 . . . . 0.0 112.561 164.269 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 52' ' ' LYS . . . . . . . . . . . . . 13.9 ttmt -156.0 161.26 40.5 Favored 'General case' 0 CA--C 1.535 0.373 0 C-N-CA 126.373 1.869 . . . . 0.0 108.835 176.257 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 53' ' ' LEU . . . . . 0.406 HD13 ' N ' ' A' ' 54' ' ' SER . 1.2 tm? -146.67 129.59 16.32 Favored 'General case' 0 CA--C 1.519 -0.214 0 N-CA-C 105.597 -2.001 . . . . 0.0 105.597 174.162 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 54' ' ' SER . . . . . 0.406 ' N ' HD13 ' A' ' 53' ' ' LEU . 2.2 t -152.25 -33.84 0.13 Allowed 'General case' 0 CA--C 1.536 0.426 0 CA-C-N 117.642 0.201 . . . . 0.0 111.258 162.9 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 55' ' ' ASN . . . . . . . . . . . . . 20.0 p-10 -131.33 31.15 4.4 Favored 'General case' 0 CA--C 1.534 0.36 0 C-N-CA 128.052 2.541 . . . . 0.0 111.2 -164.761 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 56' ' ' GLY . . . . . . . . . . . . . . . 60.56 31.65 75.51 Favored Glycine 0 CA--C 1.532 1.1 0 O-C-N 121.591 -0.693 . . . . 0.0 111.645 -176.72 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 57' ' ' GLU . . . . . . . . . . . . . 33.5 tt0 -134.15 139.6 45.98 Favored 'General case' 0 C--O 1.237 0.426 0 N-CA-C 107.631 -1.248 . . . . 0.0 107.631 177.528 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 58' ' ' LEU . . . . . . . . . . . . . 56.6 tp -120.59 95.92 4.92 Favored 'General case' 0 CA--C 1.534 0.349 0 C-N-CA 127.806 2.442 . . . . 0.0 108.843 -176.198 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 59' ' ' THR . . . . . . . . . . . . . 15.6 p -98.48 137.61 36.91 Favored 'General case' 0 C--O 1.237 0.434 0 C-N-CA 124.982 1.313 . . . . 0.0 110.671 174.719 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 60' ' ' ALA . . . . . . . . . . . . . . . -123.32 85.46 2.42 Favored 'General case' 0 CA--C 1.536 0.411 0 C-N-CA 125.145 1.378 . . . . 0.0 111.476 171.888 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 61' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -53.19 -15.45 0.91 Allowed 'General case' 0 N--CA 1.455 -0.189 0 C-N-CA 128.82 2.848 . . . . 0.0 117.151 -178.903 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 62' ' ' GLY . . . . . . . . . . . . . . . -148.8 45.66 0.7 Allowed Glycine 0 CA--C 1.52 0.392 0 C-N-CA 124.734 1.159 . . . . 0.0 110.985 -174.379 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 63' ' ' LEU . . . . . . . . . . . . . 9.3 tp -55.91 139.82 44.85 Favored 'General case' 0 N--CA 1.446 -0.649 0 N-CA-C 108.831 -0.803 . . . . 0.0 108.831 168.171 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 64' ' ' ALA . . . . . . . . . . . . . . . -127.13 162.02 27.1 Favored 'General case' 0 C--N 1.327 -0.373 0 N-CA-C 108.17 -1.048 . . . . 0.0 108.17 166.35 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 65' ' ' MET . . . . . . . . . . . . . 0.1 OUTLIER -150.5 177.09 10.34 Favored 'General case' 0 CA--C 1.538 0.507 0 C-N-CA 126.468 1.907 . . . . 0.0 108.591 -175.571 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 66' ' ' THR . . . . . . . . . . . . . 25.4 p -118.0 -178.21 3.45 Favored 'General case' 0 N--CA 1.469 0.524 0 C-N-CA 125.141 1.376 . . . . 0.0 111.12 -178.401 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 67' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -126.2 87.27 2.65 Favored 'General case' 0 C--O 1.236 0.353 0 C-N-CA 123.858 0.863 . . . . 0.0 110.477 172.955 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 68' ' ' MET . . . . . . . . . . . . . 37.0 mtm -132.16 -166.13 1.69 Allowed 'General case' 0 CA--C 1.537 0.471 0 C-N-CA 128.161 2.584 . . . . 0.0 108.534 174.424 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 69' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -145.57 173.95 11.6 Favored 'General case' 0 CA--C 1.539 0.531 0 C-N-CA 125.183 1.393 . . . . 0.0 109.645 174.692 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 70' ' ' CYS . . . . . 1.285 ' SG ' ' SG ' ' A' ' 44' ' ' CYS . 73.0 m -130.48 14.08 5.5 Favored 'General case' 0 C--O 1.234 0.284 0 N-CA-C 114.174 1.176 . . . . 0.0 114.174 -172.707 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 71' ' ' ALA . . . . . . . . . . . . . . . 60.8 10.4 2.68 Favored 'General case' 0 CA--C 1.534 0.338 0 C-N-CA 124.943 1.297 . . . . 0.0 113.271 178.419 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 72' ' ' ASN . . . . . . . . . . . . . 0.2 OUTLIER -133.46 164.96 40.25 Favored Pre-proline 0 CA--C 1.547 0.828 0 C-N-CA 125.213 1.405 . . . . 0.0 107.26 168.667 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 73' ' ' PRO . . . . . . . . . . . . . 60.7 Cg_endo -82.25 -45.91 0.07 OUTLIER 'Trans proline' 0 N--CA 1.46 -0.454 0 C-N-CA 123.71 2.94 . . . . 0.0 111.917 175.157 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 74' ' ' GLN . . . . . . . . . . . . . 58.7 tt0 -47.95 -53.93 14.43 Favored 'General case' 0 C--O 1.223 -0.29 0 C-N-CA 126.394 1.878 . . . . 0.0 110.615 -171.55 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 75' ' ' LEU . . . . . . . . . . . . . 55.0 mt -60.28 -37.18 79.67 Favored 'General case' 0 CA--C 1.535 0.403 0 C-N-CA 125.764 1.626 . . . . 0.0 110.875 -178.567 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 76' ' ' ASN . . . . . . . . . . . . . 1.7 t-20 -73.03 -4.68 33.95 Favored 'General case' 0 N--CA 1.469 0.483 0 C-N-CA 126.198 1.799 . . . . 0.0 111.938 177.926 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 77' ' ' GLU . . . . . . . . . . . . . 1.0 OUTLIER -113.65 -24.4 9.22 Favored 'General case' 0 CA--C 1.535 0.394 0 C-N-CA 125.265 1.426 . . . . 0.0 110.439 170.609 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 78' ' ' LEU . . . . . . . . . . . . . 6.2 mp -63.99 -36.66 84.7 Favored 'General case' 0 N--CA 1.464 0.253 0 O-C-N 120.842 -1.161 . . . . 0.0 109.861 170.453 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 79' ' ' ASP . . . . . . . . . . . . . 0.0 OUTLIER -56.95 -32.69 66.27 Favored 'General case' 0 CA--C 1.53 0.182 0 C-N-CA 123.816 0.846 . . . . 0.0 111.38 173.958 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 80' ' ' ASN . . . . . . . . . . . . . 12.2 m-20 -91.22 -28.57 17.73 Favored 'General case' 0 N--CA 1.452 -0.356 0 C-N-CA 123.017 0.527 . . . . 0.0 110.529 178.558 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 81' ' ' THR . . . . . . . . . . . . . 29.7 m -54.02 -65.14 0.62 Allowed 'General case' 0 CA--C 1.534 0.348 0 C-N-CA 124.926 1.29 . . . . 0.0 108.7 171.27 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 82' ' ' ILE . . . . . . . . . . . . . 10.4 tp -64.18 -35.1 72.8 Favored 'Isoleucine or valine' 0 C--O 1.234 0.284 0 O-C-N 121.84 -0.537 . . . . 0.0 111.011 -171.539 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 83' ' ' SER . . . . . . . . . . . . . 8.6 m -64.3 -40.92 96.92 Favored 'General case' 0 N--CA 1.443 -0.804 0 CA-C-O 118.305 -0.855 . . . . 0.0 111.983 -170.605 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 84' ' ' GLU . . . . . 0.48 ' OE1' ' HE2' ' A' ' 105' ' ' LYS . 4.6 mt-10 -77.86 -39.5 43.15 Favored 'General case' 0 N--CA 1.45 -0.432 0 CA-C-O 118.497 -0.763 . . . . 0.0 110.963 175.421 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 85' ' ' MET . . . . . . . . . . . . . 96.0 mtp -57.88 -49.15 77.68 Favored 'General case' 0 N--CA 1.463 0.201 0 CA-C-O 121.919 0.866 . . . . 0.0 108.725 -173.147 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 86' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -71.7 -25.49 62.11 Favored 'General case' 0 N--CA 1.453 -0.32 0 C-N-CA 123.714 0.806 . . . . 0.0 112.861 -177.197 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 87' ' ' LYS . . . . . . . . . . . . . 6.5 tptm -73.81 -49.74 23.84 Favored 'General case' 0 CA--C 1.516 -0.328 0 N-CA-C 108.338 -0.986 . . . . 0.0 108.338 -178.292 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 88' ' ' GLU . . . . . . . . . . . . . 5.6 mm-40 -69.83 -38.86 76.66 Favored 'General case' 0 N--CA 1.447 -0.616 0 O-C-N 124.449 1.093 . . . . 0.0 110.254 -177.177 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 89' ' ' GLY . . . . . . . . . . . . . . . 126.09 92.27 0.85 Allowed Glycine 0 C--N 1.339 0.695 0 N-CA-C 109.125 -1.59 . . . . 0.0 109.125 -179.594 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 90' ' ' ALA . . . . . . . . . . . . . . . -69.66 136.38 51.05 Favored 'General case' 0 N--CA 1.452 -0.341 0 N-CA-C 106.983 -1.488 . . . . 0.0 106.983 178.388 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 91' ' ' GLN . . . . . . . . . . . . . 4.9 mp0 -68.78 136.43 52.76 Favored 'General case' 0 N--CA 1.442 -0.845 0 N-CA-C 104.385 -2.45 . . . . 0.0 104.385 167.617 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 92' ' ' VAL . . . . . . . . . . . . . 4.0 p -127.47 122.58 59.74 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.392 0 N-CA-C 105.88 -1.896 . . . . 0.0 105.88 -177.27 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 93' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -139.23 92.4 2.59 Favored 'General case' 0 C--N 1.33 -0.277 0 N-CA-C 108.475 -0.935 . . . . 0.0 108.475 178.914 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 94' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -89.54 107.37 19.04 Favored 'General case' 0 C--N 1.333 -0.14 0 N-CA-C 106.809 -1.552 . . . . 0.0 106.809 174.125 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 95' ' ' THR . . . . . . . . . . . . . 13.4 t -67.8 -163.22 0.03 OUTLIER 'General case' 0 CA--C 1.536 0.424 0 C-N-CA 125.822 1.649 . . . . 0.0 108.767 169.588 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 96' ' ' ALA . . . . . . . . . . . . . . . -44.62 -40.95 6.21 Favored 'General case' 0 CA--C 1.544 0.714 0 O-C-N 120.288 -1.507 . . . . 0.0 112.421 178.929 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 97' ' ' ASN . . . . . . . . . . . . . 9.9 p30 -157.12 4.02 0.14 Allowed 'General case' 0 CA--C 1.541 0.619 0 N-CA-C 114.839 1.422 . . . . 0.0 114.839 -170.135 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 98' ' ' GLN . . . . . . . . . . . . . 8.5 tt0 -126.96 129.89 49.02 Favored 'General case' 0 N--CA 1.464 0.257 0 CA-C-N 120.361 1.437 . . . . 0.0 109.649 -176.809 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 99' ' ' LEU . . . . . 0.439 ' HB3' ' HB2' ' A' ' 110' ' ' TYR . 9.9 tp -81.32 133.56 35.45 Favored 'General case' 0 N--CA 1.449 -0.482 0 C-N-CA 123.864 0.866 . . . . 0.0 109.275 175.584 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 100' ' ' THR . . . . . . . . . . . . . 1.1 m -115.13 128.15 56.02 Favored 'General case' 0 C--N 1.323 -0.575 0 N-CA-C 105.223 -2.14 . . . . 0.0 105.223 171.247 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 101' ' ' LEU . . . . . . . . . . . . . 8.5 mp -112.74 163.96 13.95 Favored 'General case' 0 CA--C 1.512 -0.49 0 N-CA-C 110.073 -0.343 . . . . 0.0 110.073 163.311 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 102' ' ' ALA . . . . . . . . . . . . . . . -151.81 160.68 43.48 Favored 'General case' 0 C--N 1.325 -0.488 0 C-N-CA 126.764 2.026 . . . . 0.0 106.187 158.418 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 103' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -165.84 178.63 6.4 Favored 'General case' 0 N--CA 1.444 -0.73 0 C-N-CA 129.17 2.988 . . . . 0.0 106.208 164.134 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 104' ' ' ALA . . . . . . . . . . . . . . . -46.86 -45.06 20.06 Favored 'General case' 0 CA--C 1.533 0.292 0 O-C-N 121.417 -0.802 . . . . 0.0 111.089 169.511 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 105' ' ' LYS . . . . . 0.48 ' HE2' ' OE1' ' A' ' 84' ' ' GLU . 22.0 mttm -58.04 -74.32 0.06 Allowed 'General case' 0 C--N 1.343 0.284 0 N-CA-C 112.202 0.445 . . . . 0.0 112.202 179.955 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 106' ' ' GLN . . . . . . . . . . . . . 4.1 pt20 -163.0 -174.46 3.89 Favored 'General case' 0 C--N 1.33 -0.274 0 C-N-CA 123.247 0.619 . . . . 0.0 109.743 -173.368 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 107' ' ' THR . . . . . . . . . . . . . 2.1 t -105.51 166.2 10.6 Favored 'General case' 0 CA--C 1.539 0.55 0 C-N-CA 125.6 1.56 . . . . 0.0 107.924 168.746 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 108' ' ' LEU . . . . . . . . . . . . . 76.6 mt -139.92 150.43 44.55 Favored 'General case' 0 C--O 1.237 0.436 0 C-N-CA 126.556 1.942 . . . . 0.0 106.517 169.425 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 109' ' ' THR . . . . . . . . . . . . . 4.9 m -123.48 108.47 12.7 Favored 'General case' 0 C--O 1.238 0.497 0 N-CA-C 107.92 -1.141 . . . . 0.0 107.92 176.152 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 110' ' ' TYR . . . . . 0.439 ' HB2' ' HB3' ' A' ' 99' ' ' LEU . 75.2 m-85 -110.17 156.06 21.13 Favored 'General case' 0 N--CA 1.453 -0.282 0 N-CA-C 109.684 -0.487 . . . . 0.0 109.684 179.302 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 111' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -127.93 134.59 49.33 Favored 'General case' 0 C--O 1.236 0.377 0 CA-C-O 118.0 -1.0 . . . . 0.0 108.582 -172.394 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 112' ' ' LEU . . . . . . . . . . . . . 64.1 tp -60.63 82.28 0.01 OUTLIER 'General case' 0 CA--C 1.534 0.344 0 C-N-CA 127.911 2.484 . . . . 0.0 110.653 177.568 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 113' ' ' ALA . . . . . . . . . . . . . . . -115.39 83.0 1.85 Allowed 'General case' 0 C--N 1.33 -0.262 0 N-CA-C 106.015 -1.846 . . . . 0.0 106.015 172.673 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 114' ' ' ASP . . . . . . . . . . . . . 3.0 p-10 -98.2 38.55 1.31 Allowed 'General case' 0 C--N 1.332 -0.155 0 C-N-CA 123.809 0.844 . . . . 0.0 110.848 -176.382 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 115' ' ' LEU . . . . . . . . . . . . . 37.0 mt 55.34 18.04 2.38 Favored 'General case' 0 N--CA 1.468 0.466 0 C-N-CA 127.306 2.242 . . . . 0.0 113.348 179.871 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 116' ' ' MET . . . . . . . . . . . . . 4.6 ptm -61.12 6.17 0.05 Allowed 'General case' 0 CA--C 1.544 0.731 0 C-N-CA 128.574 2.75 . . . . 0.0 115.199 179.768 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 117' ' ' ASN . . . . . . . . . . . . . 22.4 t-20 . . . . . 0 C--O 1.234 0.258 0 O-C-N 120.508 -1.37 . . . . 0.0 110.937 172.761 . . . . . . . . 0 0 . 1 . 014 nuclear build full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 CA--C 1.534 0.36 0 CA-C-O 121.827 0.823 . . . . 0.0 110.837 . . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 2' ' ' VAL . . . . . . . . . . . . . 8.7 p -57.11 152.09 2.83 Favored 'Isoleucine or valine' 0 CA--C 1.544 0.737 0 C-N-CA 126.672 1.989 . . . . 0.0 110.521 164.115 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 3' ' ' THR . . . . . . . . . . . . . 29.6 p -128.03 162.32 50.62 Favored Pre-proline 0 CA--C 1.537 0.467 0 O-C-N 120.993 -1.067 . . . . 0.0 110.594 176.573 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 4' ' ' PRO . . . . . . . . . . . . . 18.1 Cg_endo -65.99 -41.48 13.45 Favored 'Trans proline' 0 C--N 1.345 0.394 0 C-N-CA 122.436 2.091 . . . . 0.0 112.54 175.117 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 5' ' ' GLU . . . . . . . . . . . . . 2.9 mt-10 -57.33 -50.03 74.23 Favored 'General case' 0 C--N 1.329 -0.286 0 C-N-CA 124.163 0.985 . . . . 0.0 111.016 -176.425 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 6' ' ' GLN . . . . . . . . . . . . . 5.5 pt20 -71.7 14.56 0.19 Allowed 'General case' 0 CA--C 1.541 0.604 0 N-CA-C 114.649 1.351 . . . . 0.0 114.649 -170.951 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 7' ' ' LEU . . . . . . . . . . . . . 94.1 mt -126.22 -52.51 1.51 Allowed 'General case' 0 CA--C 1.516 -0.344 0 C-N-CA 126.358 1.863 . . . . 0.0 109.27 -170.555 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 8' ' ' GLN . . . . . . . . . . . . . 2.0 mt-30 -44.9 -20.67 0.04 OUTLIER 'General case' 0 CA--C 1.539 0.538 0 C-N-CA 127.829 2.452 . . . . 0.0 116.701 -176.187 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 9' ' ' HIS . . . . . . . . . . . . . 33.2 p80 -138.66 19.33 2.69 Favored 'General case' 0 CA--C 1.537 0.446 0 C-N-CA 123.825 0.85 . . . . 0.0 113.245 177.769 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 10' ' ' HIS . . . . . . . . . . . . . 78.1 m-70 -118.6 118.46 31.74 Favored 'General case' 0 CA--C 1.531 0.246 0 C-N-CA 124.104 0.961 . . . . 0.0 108.438 179.22 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 11' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -74.5 140.85 44.83 Favored 'General case' 0 N--CA 1.465 0.284 0 N-CA-C 108.692 -0.855 . . . . 0.0 108.692 175.916 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 12' ' ' PHE . . . . . . . . . . . . . 3.3 m-85 -121.19 162.25 20.47 Favored 'General case' 0 N--CA 1.446 -0.633 0 CA-C-O 124.749 2.214 . . . . 0.0 108.762 163.98 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 13' ' ' VAL . . . . . . . . . . . . . 0.0 OUTLIER -136.79 145.98 29.25 Favored 'Isoleucine or valine' 0 C--N 1.31 -1.112 0 C-N-CA 130.143 3.377 . . . . 0.0 106.873 -179.218 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 14' ' ' LEU . . . . . . . . . . . . . 0.8 OUTLIER -69.75 140.92 53.5 Favored 'General case' 0 CA--C 1.504 -0.805 0 N-CA-C 106.532 -1.655 . . . . 0.0 106.532 166.555 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -117.29 -55.7 2.3 Favored 'General case' 0 N--CA 1.44 -0.952 0 O-C-N 124.222 0.951 . . . . 0.0 108.859 177.017 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 55.3 p -133.43 113.22 12.28 Favored 'General case' 0 N--CA 1.447 -0.616 0 CA-C-O 122.364 1.078 . . . . 0.0 109.841 -173.548 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 17' ' ' VAL . . . . . . . . . . . . . 3.2 t -74.25 160.0 5.4 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.45 0 C-N-CA 125.485 1.514 . . . . 0.0 107.648 179.639 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 18' ' ' ASN . . . . . . . . . . . . . 0.2 OUTLIER -44.75 -35.99 2.97 Favored 'General case' 0 N--CA 1.466 0.371 0 C-N-CA 125.536 1.534 . . . . 0.0 113.773 174.795 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . -107.4 -8.84 30.28 Favored Glycine 0 CA--C 1.528 0.855 0 CA-C-O 116.88 -2.067 . . . . 0.0 115.392 -173.519 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 20' ' ' LYS . . . . . 0.428 ' HB2' ' HD2' ' A' ' 21' ' ' PRO . 16.0 ptpt 174.62 165.21 0.35 Allowed Pre-proline 0 N--CA 1.476 0.833 0 CA-C-N 120.497 2.149 . . . . 0.0 112.146 178.742 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 21' ' ' PRO . . . . . 0.428 ' HD2' ' HB2' ' A' ' 20' ' ' LYS . 45.5 Cg_endo -62.12 173.69 3.04 Favored 'Trans proline' 0 CA--C 1.534 0.499 0 C-N-CA 123.284 2.656 . . . . 0.0 111.856 164.064 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 22' ' ' VAL . . . . . . . . . . . . . 9.0 p -145.6 150.99 15.16 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.508 0 CA-C-O 121.66 0.743 . . . . 0.0 111.013 168.428 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 23' ' ' THR . . . . . . . . . . . . . 14.6 p -115.47 103.96 11.28 Favored 'General case' 0 N--CA 1.452 -0.326 0 C-N-CA 126.458 1.903 . . . . 0.0 107.338 172.743 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 24' ' ' SER . . . . . . . . . . . . . 14.9 m -127.72 75.73 1.62 Allowed 'General case' 0 C--N 1.332 -0.154 0 N-CA-C 106.88 -1.526 . . . . 0.0 106.88 -179.07 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 25' ' ' ASP . . . . . . . . . . . . . 97.2 m-20 -81.79 14.3 2.75 Favored 'General case' 0 N--CA 1.468 0.431 0 C-N-CA 123.917 0.887 . . . . 0.0 111.873 -169.927 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 26' ' ' LYS . . . . . . . . . . . . . 32.8 ttpt -148.88 114.8 5.72 Favored 'General case' 0 N--CA 1.45 -0.447 0 N-CA-C 105.881 -1.896 . . . . 0.0 105.881 179.947 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 27' ' ' ASN . . . . . . . . . . . . . 0.0 OUTLIER 43.6 73.76 0.89 Allowed Pre-proline 0 CA--C 1.546 0.804 0 C-N-CA 127.73 2.412 . . . . 0.0 109.788 -172.724 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 28' ' ' PRO . . . . . . . . . . . . . 9.3 Cg_endo -60.0 164.53 11.98 Favored 'Trans proline' 0 CA--C 1.538 0.677 0 CA-C-N 120.952 1.376 . . . . 0.0 111.988 -176.091 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 29' ' ' PRO . . . . . . . . . . . . . 61.5 Cg_endo -63.9 92.89 0.18 Allowed 'Trans proline' 0 N--CA 1.452 -0.934 0 N-CA-C 106.972 -1.972 . . . . 0.0 106.972 161.045 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 30' ' ' GLU . . . . . . . . . . . . . 7.9 pt-20 -123.24 157.81 32.28 Favored 'General case' 0 C--N 1.32 -0.715 0 C-N-CA 124.652 1.181 . . . . 0.0 108.112 -168.199 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 31' ' ' ILE . . . . . 0.503 HD11 HG23 ' A' ' 39' ' ' ILE . 16.3 tt -143.48 109.83 1.51 Allowed 'Isoleucine or valine' 0 N--CA 1.453 -0.293 0 N-CA-C 108.223 -1.029 . . . . 0.0 108.223 178.596 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 32' ' ' SER . . . . . . . . . . . . . 22.9 t -88.31 171.77 9.92 Favored 'General case' 0 N--CA 1.445 -0.684 0 N-CA-C 107.341 -1.355 . . . . 0.0 107.341 159.684 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 33' ' ' PHE . . . . . . . . . . . . . 92.0 m-85 -133.73 -170.09 2.43 Favored 'General case' 0 N--CA 1.441 -0.893 0 C-N-CA 125.467 1.507 . . . . 0.0 107.327 178.08 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 34' ' ' GLY . . . . . . . . . . . . . . . 170.87 -163.43 36.5 Favored Glycine 0 N--CA 1.444 -0.771 0 N-CA-C 109.57 -1.412 . . . . 0.0 109.57 172.142 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 35' ' ' GLU . . . . . . . . . . . . . 2.2 tt0 -55.76 157.09 4.44 Favored 'General case' 0 CA--C 1.534 0.334 0 C-N-CA 124.229 1.012 . . . . 0.0 112.096 -162.378 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 30.2 mtmt 52.74 20.83 1.69 Allowed 'General case' 0 CA--C 1.537 0.448 0 C-N-CA 124.235 1.014 . . . . 0.0 113.109 -168.94 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 37' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER 61.93 29.07 17.71 Favored 'General case' 0 CA--C 1.542 0.666 0 C-N-CA 125.475 1.51 . . . . 0.0 110.638 -175.967 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 38' ' ' MET . . . . . . . . . . . . . 0.7 OUTLIER -60.32 162.05 6.53 Favored 'General case' 0 C--O 1.233 0.232 0 O-C-N 120.794 -1.191 . . . . 0.0 111.633 172.957 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 39' ' ' ILE . . . . . 0.503 HG23 HD11 ' A' ' 31' ' ' ILE . 19.7 mt -122.96 135.21 63.78 Favored 'Isoleucine or valine' 0 C--O 1.237 0.401 0 C-N-CA 126.123 1.769 . . . . 0.0 107.217 -174.262 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 40' ' ' SER . . . . . . . . . . . . . 56.8 m -137.49 114.53 10.74 Favored 'General case' 0 C--O 1.226 -0.156 0 N-CA-C 108.019 -1.104 . . . . 0.0 108.019 170.983 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 41' ' ' GLY . . . . . . . . . . . . . . . -146.96 174.65 26.7 Favored Glycine 0 C--N 1.335 0.495 0 CA-C-N 119.335 0.97 . . . . 0.0 112.53 177.288 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 42' ' ' SER . . . . . 0.409 ' HA ' ' HA ' ' A' ' 46' ' ' ARG . 8.4 t -150.75 70.7 1.01 Allowed 'General case' 0 C--O 1.226 -0.137 0 C-N-CA 123.567 0.747 . . . . 0.0 110.55 -172.009 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 43' ' ' MET . . . . . . . . . . . . . 82.8 mmm -54.71 -62.82 1.41 Allowed 'General case' 0 C--N 1.344 0.336 0 N-CA-C 108.324 -0.991 . . . . 0.0 108.324 173.475 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 44' ' ' CYS . . . . . 1.283 ' SG ' ' SG ' ' A' ' 70' ' ' CYS . 8.8 t -139.33 -50.43 0.51 Allowed 'General case' 0 N--CA 1.451 -0.387 0 C-N-CA 123.625 0.77 . . . . 0.0 110.548 165.664 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 45' ' ' ASN . . . . . . . . . . . . . 48.6 m-80 -103.69 19.35 20.03 Favored 'General case' 0 N--CA 1.472 0.649 0 CA-C-N 119.973 1.26 . . . . 0.0 113.342 -171.309 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 46' ' ' ARG . . . . . 0.409 ' HA ' ' HA ' ' A' ' 42' ' ' SER . 0.0 OUTLIER 66.04 152.47 0.06 Allowed 'General case' 0 N--CA 1.464 0.253 0 C-N-CA 125.431 1.493 . . . . 0.0 111.043 -177.848 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' A' A ' 47' ' ' PHE . . . . . . . . . . . . . 25.0 p90 -154.54 168.36 26.98 Favored 'General case' 0 N--CA 1.447 -0.611 0 CA-C-O 122.768 1.27 . . . . 0.0 108.621 171.26 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 48' ' ' SER . . . . . . . . . . . . . 3.9 p -152.15 171.94 17.13 Favored 'General case' 0 N--CA 1.44 -0.973 0 CA-C-N 113.889 -1.505 . . . . 0.0 108.027 177.597 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 49' ' ' GLY . . . . . . . . . . . . . . . 179.25 163.78 30.76 Favored Glycine 0 N--CA 1.445 -0.73 0 N-CA-C 109.337 -1.505 . . . . 0.0 109.337 164.628 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 50' ' ' GLU . . . . . . . . . . . . . 13.5 pt-20 -82.99 95.37 7.99 Favored 'General case' 0 N--CA 1.44 -0.939 0 N-CA-C 105.572 -2.011 . . . . 0.0 105.572 165.032 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 51' ' ' GLY . . . . . . . . . . . . . . . -70.13 169.93 45.38 Favored Glycine 0 N--CA 1.447 -0.62 0 N-CA-C 109.781 -1.328 . . . . 0.0 109.781 167.85 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 52' ' ' LYS . . . . . . . . . . . . . 2.1 tppm? -153.27 146.42 24.66 Favored 'General case' 0 N--CA 1.452 -0.344 0 N-CA-C 107.72 -1.215 . . . . 0.0 107.72 169.585 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 53' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -121.33 82.39 1.93 Allowed 'General case' 0 CA--C 1.515 -0.385 0 N-CA-C 106.236 -1.765 . . . . 0.0 106.236 -178.992 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 1.5 t -103.91 -53.53 2.74 Favored 'General case' 0 N--CA 1.448 -0.567 0 N-CA-C 108.222 -1.029 . . . . 0.0 108.222 178.502 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 55' ' ' ASN . . . . . . . . . . . . . 17.6 p-10 -132.39 28.88 4.32 Favored 'General case' 0 CA--C 1.537 0.474 0 C-N-CA 125.889 1.676 . . . . 0.0 112.749 -163.954 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 56' ' ' GLY . . . . . . . . . . . . . . . 69.26 30.25 71.69 Favored Glycine 0 CA--C 1.53 1.007 0 O-C-N 121.146 -0.971 . . . . 0.0 111.806 -179.077 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 57' ' ' GLU . . . . . . . . . . . . . 42.8 tt0 -131.84 126.27 33.85 Favored 'General case' 0 N--CA 1.449 -0.5 0 N-CA-C 107.28 -1.378 . . . . 0.0 107.28 -178.176 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 58' ' ' LEU . . . . . 0.502 ' HB2' HG21 ' A' ' 92' ' ' VAL . 49.5 tp -102.6 103.62 13.94 Favored 'General case' 0 C--O 1.234 0.274 0 C-N-CA 124.073 0.949 . . . . 0.0 109.163 173.109 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 59' ' ' THR . . . . . . . . . . . . . 2.8 p -93.04 153.44 18.7 Favored 'General case' 0 CA--C 1.532 0.273 0 C-N-CA 122.883 0.473 . . . . 0.0 110.478 168.439 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 60' ' ' ALA . . . . . . . . . . . . . . . -155.34 106.3 2.55 Favored 'General case' 0 C--O 1.234 0.256 0 C-N-CA 125.58 1.552 . . . . 0.0 108.399 153.852 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 61' ' ' LYS . . . . . . . . . . . . . 29.1 ttpt -79.48 -25.3 41.91 Favored 'General case' 0 CA--C 1.535 0.365 0 C-N-CA 123.226 0.611 . . . . 0.0 110.638 168.157 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 62' ' ' GLY . . . . . . . . . . . . . . . -83.83 37.45 2.82 Favored Glycine 0 C--N 1.334 0.434 0 C-N-CA 126.443 1.973 . . . . 0.0 112.852 -176.399 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 63' ' ' LEU . . . . . 0.457 HD22 ' HA ' ' A' ' 83' ' ' SER . 0.5 OUTLIER -82.03 81.33 8.02 Favored 'General case' 0 N--CA 1.444 -0.729 0 CA-C-O 121.857 0.837 . . . . 0.0 111.7 -164.096 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' A' A ' 64' ' ' ALA . . . . . . . . . . . . . . . -72.46 131.43 42.55 Favored 'General case' 0 C--N 1.327 -0.402 0 CA-C-N 115.278 -0.874 . . . . 0.0 108.98 176.09 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 65' ' ' MET . . . . . . . . . . . . . 54.9 mtp -130.97 -178.22 4.72 Favored 'General case' 0 CA--C 1.543 0.691 0 C-N-CA 128.239 2.616 . . . . 0.0 109.832 179.666 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 66' ' ' THR . . . . . . . . . . . . . 18.2 p -116.68 -168.93 1.54 Allowed 'General case' 0 N--CA 1.472 0.643 0 C-N-CA 125.339 1.456 . . . . 0.0 111.834 -179.171 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 67' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -138.35 79.97 1.77 Allowed 'General case' 0 N--CA 1.452 -0.36 0 C-N-CA 126.556 1.943 . . . . 0.0 107.014 -177.024 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 68' ' ' MET . . . . . . . . . . . . . 76.1 mtm -131.72 -160.31 1.04 Allowed 'General case' 0 C--N 1.325 -0.475 0 C-N-CA 126.804 2.042 . . . . 0.0 107.575 178.962 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 69' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -143.53 155.96 44.47 Favored 'General case' 0 N--CA 1.445 -0.685 0 C-N-CA 124.993 1.317 . . . . 0.0 110.205 160.382 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 70' ' ' CYS . . . . . 1.283 ' SG ' ' SG ' ' A' ' 44' ' ' CYS . 1.6 p -92.0 -9.01 44.47 Favored 'General case' 0 C--N 1.321 -0.663 0 C-N-CA 126.946 2.099 . . . . 0.0 112.001 171.006 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 71' ' ' ALA . . . . . . . . . . . . . . . 59.64 5.99 0.77 Allowed 'General case' 0 CA--C 1.538 0.503 0 C-N-CA 126.675 1.99 . . . . 0.0 114.183 -167.636 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 72' ' ' ASN . . . . . . . . . . . . . 21.2 t-20 -111.24 144.66 30.91 Favored Pre-proline 0 CA--C 1.533 0.301 0 C-N-CA 124.828 1.251 . . . . 0.0 108.567 174.362 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 73' ' ' PRO . . . . . . . . . . . . . 87.5 Cg_endo -77.48 -47.05 0.13 Allowed 'Trans proline' 0 CA--C 1.534 0.513 0 C-N-CA 122.652 2.235 . . . . 0.0 111.912 -178.471 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 74' ' ' GLN . . . . . . . . . . . . . 15.4 tt0 -59.12 -45.75 90.11 Favored 'General case' 0 N--CA 1.452 -0.361 0 C-N-CA 127.381 2.272 . . . . 0.0 110.175 -171.749 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 75' ' ' LEU . . . . . . . . . . . . . 98.6 mt -65.06 -42.99 93.71 Favored 'General case' 0 N--CA 1.452 -0.344 0 C-N-CA 125.138 1.375 . . . . 0.0 110.498 177.687 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 76' ' ' ASN . . . . . . . . . . . . . 0.6 OUTLIER -60.55 -44.99 95.53 Favored 'General case' 0 N--CA 1.468 0.473 0 C-N-CA 123.854 0.861 . . . . 0.0 111.679 177.977 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 77' ' ' GLU . . . . . . . . . . . . . 21.3 tp10 -63.99 -34.5 78.15 Favored 'General case' 0 CA--C 1.536 0.435 0 C-N-CA 123.699 0.8 . . . . 0.0 111.23 175.077 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 78' ' ' LEU . . . . . . . . . . . . . 21.7 mt -64.2 -20.49 66.06 Favored 'General case' 0 CA--C 1.533 0.3 0 CA-C-O 118.166 -0.921 . . . . 0.0 112.259 178.682 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 79' ' ' ASP . . . . . . . . . . . . . 67.6 m-20 -65.1 -27.67 68.92 Favored 'General case' 0 N--CA 1.467 0.406 0 CA-C-N 119.641 1.109 . . . . 0.0 111.39 172.153 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 80' ' ' ASN . . . . . . . . . . . . . 5.2 m-20 -76.12 -52.93 9.09 Favored 'General case' 0 N--CA 1.455 -0.214 0 N-CA-C 107.749 -1.204 . . . . 0.0 107.749 175.85 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 81' ' ' THR . . . . . . . . . . . . . 28.9 m -47.98 -57.27 5.97 Favored 'General case' 0 CA--C 1.535 0.391 0 C-N-CA 124.066 0.946 . . . . 0.0 110.468 178.482 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 82' ' ' ILE . . . . . . . . . . . . . 10.7 tp -58.13 -39.98 75.26 Favored 'Isoleucine or valine' 0 C--O 1.233 0.193 0 CA-C-N 119.538 1.063 . . . . 0.0 111.401 -172.851 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 83' ' ' SER . . . . . 0.457 ' HA ' HD22 ' A' ' 63' ' ' LEU . 28.6 t -60.65 -53.9 51.88 Favored 'General case' 0 N--CA 1.446 -0.645 0 C-N-CA 123.572 0.749 . . . . 0.0 109.008 -177.459 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 84' ' ' GLU . . . . . . . . . . . . . 9.7 tt0 -76.34 -16.21 59.8 Favored 'General case' 0 CA--C 1.539 0.53 0 N-CA-C 112.765 0.654 . . . . 0.0 112.765 -175.765 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 85' ' ' MET . . . . . . . . . . . . . 77.6 mtp -67.41 -61.18 2.03 Favored 'General case' 0 C--N 1.34 0.175 0 CA-C-N 120.175 1.352 . . . . 0.0 107.499 166.657 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 86' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -63.45 -29.09 70.43 Favored 'General case' 0 C--N 1.33 -0.249 0 C-N-CA 124.63 1.172 . . . . 0.0 112.025 -172.614 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 87' ' ' LYS . . . . . . . . . . . . . 10.9 mttt -64.4 -34.88 79.2 Favored 'General case' 0 C--N 1.333 -0.116 0 CA-C-N 118.752 0.706 . . . . 0.0 110.735 179.703 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 88' ' ' GLU . . . . . . . . . . . . . 9.4 mm-40 -105.07 0.56 27.66 Favored 'General case' 0 CA--C 1.53 0.2 0 C-N-CA 124.669 1.188 . . . . 0.0 111.845 -167.876 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 89' ' ' GLY . . . . . . . . . . . . . . . 86.77 96.68 0.84 Allowed Glycine 0 C--N 1.336 0.545 0 N-CA-C 108.797 -1.721 . . . . 0.0 108.797 -177.432 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 90' ' ' ALA . . . . . . . . . . . . . . . -78.29 135.23 37.49 Favored 'General case' 0 N--CA 1.449 -0.481 0 N-CA-C 109.074 -0.713 . . . . 0.0 109.074 175.759 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 91' ' ' GLN . . . . . . . . . . . . . 2.4 mp0 -72.76 112.14 8.53 Favored 'General case' 0 N--CA 1.449 -0.481 0 N-CA-C 105.548 -2.019 . . . . 0.0 105.548 176.125 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 92' ' ' VAL . . . . . 0.502 HG21 ' HB2' ' A' ' 58' ' ' LEU . 55.4 t -104.15 105.94 19.4 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.35 0 N-CA-C 106.551 -1.648 . . . . 0.0 106.551 -178.731 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 93' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER -121.58 91.49 3.53 Favored 'General case' 0 CA--C 1.516 -0.36 0 N-CA-C 108.478 -0.934 . . . . 0.0 108.478 176.72 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 94' ' ' LEU . . . . . . . . . . . . . 44.0 tp -76.73 134.34 39.22 Favored 'General case' 0 N--CA 1.451 -0.408 0 N-CA-C 107.527 -1.286 . . . . 0.0 107.527 167.519 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 95' ' ' THR . . . . . . . . . . . . . 1.2 t -117.7 178.36 4.43 Favored 'General case' 0 C--N 1.319 -0.746 0 N-CA-C 104.969 -2.234 . . . . 0.0 104.969 169.581 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 96' ' ' ALA . . . . . . . . . . . . . . . -44.78 -21.15 0.05 OUTLIER 'General case' 0 CA--C 1.545 0.758 0 N-CA-C 118.542 2.793 . . . . 0.0 118.542 -157.617 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 97' ' ' ASN . . . . . . . . . . . . . 0.4 OUTLIER -160.35 14.72 0.12 Allowed 'General case' 0 CA--C 1.542 0.643 0 C-N-CA 125.257 1.423 . . . . 0.0 111.68 162.693 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 98' ' ' GLN . . . . . . . . . . . . . 16.4 tt0 -130.57 124.95 32.97 Favored 'General case' 0 N--CA 1.466 0.326 0 O-C-N 120.466 -1.396 . . . . 0.0 109.197 -176.388 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 99' ' ' LEU . . . . . 0.492 ' HB3' ' HB2' ' A' ' 110' ' ' TYR . 12.6 tp -79.06 148.22 32.53 Favored 'General case' 0 C--N 1.326 -0.441 0 C-N-CA 125.875 1.67 . . . . 0.0 109.052 172.676 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 100' ' ' THR . . . . . . . . . . . . . 22.8 m -122.07 129.27 52.25 Favored 'General case' 0 N--CA 1.454 -0.228 0 N-CA-C 106.973 -1.491 . . . . 0.0 106.973 152.077 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 101' ' ' LEU . . . . . . . . . . . . . 1.5 mm? -102.2 100.39 10.59 Favored 'General case' 0 CA--C 1.517 -0.313 0 N-CA-C 105.716 -1.957 . . . . 0.0 105.716 160.703 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 102' ' ' ALA . . . . . . . . . . . . . . . -94.42 151.03 19.7 Favored 'General case' 0 CA--C 1.532 0.286 0 N-CA-C 107.863 -1.162 . . . . 0.0 107.863 167.793 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 103' ' ' THR . . . . . 0.426 HG22 ' H ' ' A' ' 104' ' ' ALA . 0.2 OUTLIER -161.82 177.76 9.58 Favored 'General case' 0 N--CA 1.443 -0.809 0 C-N-CA 126.209 1.803 . . . . 0.0 108.177 166.524 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' A' A ' 104' ' ' ALA . . . . . 0.426 ' H ' HG22 ' A' ' 103' ' ' THR . . . -50.86 -37.87 45.93 Favored 'General case' 0 N--CA 1.447 -0.589 0 C-N-CA 123.418 0.687 . . . . 0.0 112.715 174.05 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 105' ' ' LYS . . . . . . . . . . . . . 0.3 OUTLIER -60.85 -71.99 0.13 Allowed 'General case' 0 C--N 1.342 0.255 0 N-CA-C 112.604 0.594 . . . . 0.0 112.604 178.928 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 106' ' ' GLN . . . . . . . . . . . . . 73.3 mt-30 -150.75 176.86 10.64 Favored 'General case' 0 C--N 1.329 -0.307 0 C-N-CA 127.573 2.349 . . . . 0.0 106.76 -171.956 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 107' ' ' THR . . . . . . . . . . . . . 5.8 t -114.13 149.6 35.39 Favored 'General case' 0 N--CA 1.448 -0.555 0 N-CA-C 106.523 -1.658 . . . . 0.0 106.523 161.697 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 108' ' ' LEU . . . . . . . . . . . . . 78.9 mt -140.59 123.22 16.19 Favored 'General case' 0 C--O 1.237 0.403 0 N-CA-C 106.773 -1.566 . . . . 0.0 106.773 -175.6 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 109' ' ' THR . . . . . . . . . . . . . 24.4 m -89.65 122.27 32.62 Favored 'General case' 0 C--O 1.24 0.566 0 N-CA-C 107.286 -1.376 . . . . 0.0 107.286 176.974 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 110' ' ' TYR . . . . . 0.492 ' HB2' ' HB3' ' A' ' 99' ' ' LEU . 95.4 m-85 -114.32 157.52 22.68 Favored 'General case' 0 N--CA 1.453 -0.324 0 N-CA-C 108.717 -0.846 . . . . 0.0 108.717 174.045 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 111' ' ' LYS . . . . . . . . . . . . . 0.8 OUTLIER -122.38 141.02 52.02 Favored 'General case' 0 C--N 1.332 -0.163 0 C-N-CA 124.029 0.932 . . . . 0.0 109.016 -173.271 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 112' ' ' LEU . . . . . . . . . . . . . 25.3 tp -73.86 54.19 0.49 Allowed 'General case' 0 CA--C 1.534 0.343 0 C-N-CA 128.347 2.659 . . . . 0.0 108.875 171.857 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 113' ' ' ALA . . . . . . . . . . . . . . . -93.64 79.75 4.28 Favored 'General case' 0 N--CA 1.448 -0.526 0 N-CA-C 105.26 -2.126 . . . . 0.0 105.26 174.808 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 114' ' ' ASP . . . . . . . . . . . . . 20.4 t0 -87.44 62.29 7.06 Favored 'General case' 0 C--N 1.327 -0.384 0 CA-C-O 123.745 1.736 . . . . 0.0 109.99 -170.153 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 115' ' ' LEU . . . . . . . . . . . . . 32.5 mt -82.03 10.96 5.64 Favored 'General case' 0 C--N 1.327 -0.387 0 CA-C-N 113.751 -1.568 . . . . 0.0 111.318 -170.992 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 116' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER 53.13 -159.42 0.14 Allowed 'General case' 0 CA--C 1.545 0.755 0 N-CA-C 108.972 -0.751 . . . . 0.0 108.972 -165.399 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 117' ' ' ASN . . . . . . . . . . . . . 9.2 t30 . . . . . 0 C--O 1.235 0.33 0 O-C-N 120.111 -1.618 . . . . 0.0 111.262 -167.674 . . . . . . . . 0 0 . 1 . 015 nuclear build full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 4.6 ttp . . . . . 0 C--O 1.234 0.269 0 N-CA-C 108.195 -1.039 . . . . 0.0 108.195 . . . . . . . . . 0 0 . 1 . 015 nuclear build full ' A' A ' 2' ' ' VAL . . . . . . . . . . . . . 54.2 t -61.89 156.32 4.07 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.446 0 C-N-CA 124.573 1.149 . . . . 0.0 109.861 179.781 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 3' ' ' THR . . . . . 0.419 ' HB ' ' HD2' ' A' ' 4' ' ' PRO . 62.2 p -134.16 165.66 35.05 Favored Pre-proline 0 CA--C 1.53 0.209 0 O-C-N 121.844 -0.535 . . . . 0.0 111.919 170.277 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 4' ' ' PRO . . . . . 0.419 ' HD2' ' HB ' ' A' ' 3' ' ' THR . 29.9 Cg_endo -63.38 -35.96 58.51 Favored 'Trans proline' 0 N--CA 1.459 -0.53 0 C-N-CA 123.116 2.544 . . . . 0.0 113.791 170.951 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 5' ' ' GLU . . . . . . . . . . . . . 57.2 tt0 -57.37 -49.63 75.55 Favored 'General case' 0 C--N 1.325 -0.48 0 C-N-CA 123.217 0.607 . . . . 0.0 111.116 -171.935 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 6' ' ' GLN . . . . . . . . . . . . . 3.9 pt20 -68.56 14.22 0.08 Allowed 'General case' 0 CA--C 1.537 0.447 0 C-N-CA 127.374 2.27 . . . . 0.0 114.491 -178.259 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 7' ' ' LEU . . . . . . . . . . . . . 72.1 mt -134.7 -49.54 0.77 Allowed 'General case' 0 N--CA 1.456 -0.129 0 C-N-CA 124.449 1.1 . . . . 0.0 112.372 -170.726 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 8' ' ' GLN . . . . . . . . . . . . . 5.2 mt-30 -52.65 -1.35 0.02 OUTLIER 'General case' 0 N--CA 1.466 0.362 0 C-N-CA 128.518 2.727 . . . . 0.0 117.902 -172.771 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 9' ' ' HIS . . . . . . . . . . . . . 91.8 m-70 -143.55 10.94 1.66 Allowed 'General case' 0 CA--C 1.535 0.393 0 CA-C-N 120.269 1.395 . . . . 0.0 111.695 172.538 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 10' ' ' HIS . . . . . . . . . . . . . 81.7 m-70 -108.42 115.26 29.77 Favored 'General case' 0 N--CA 1.452 -0.346 0 C-N-CA 124.909 1.284 . . . . 0.0 108.563 -167.892 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 11' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -70.38 142.08 52.13 Favored 'General case' 0 N--CA 1.464 0.27 0 N-CA-C 107.777 -1.194 . . . . 0.0 107.777 169.726 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 12' ' ' PHE . . . . . . . . . . . . . 41.9 m-85 -125.47 164.61 20.09 Favored 'General case' 0 N--CA 1.444 -0.76 0 C-N-CA 125.623 1.569 . . . . 0.0 107.874 162.459 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 13' ' ' VAL . . . . . . . . . . . . . 4.3 t -134.29 146.91 30.44 Favored 'Isoleucine or valine' 0 C--O 1.236 0.345 0 N-CA-C 107.784 -1.191 . . . . 0.0 107.784 -178.794 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 14' ' ' LEU . . . . . . . . . . . . . 27.2 tp -75.18 91.28 2.6 Favored 'General case' 0 N--CA 1.454 -0.252 0 O-C-N 123.787 0.679 . . . . 0.0 109.402 -175.301 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 0.7 OUTLIER -66.44 -42.38 87.74 Favored 'General case' 0 C--O 1.237 0.397 0 C-N-CA 124.656 1.182 . . . . 0.0 109.514 -177.134 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -161.9 152.95 18.02 Favored 'General case' 0 N--CA 1.449 -0.51 0 CA-C-O 121.737 0.78 . . . . 0.0 111.174 -174.146 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 17' ' ' VAL . . . . . . . . . . . . . 2.0 t -116.72 161.29 15.58 Favored 'Isoleucine or valine' 0 C--O 1.235 0.324 0 N-CA-C 107.011 -1.477 . . . . 0.0 107.011 -179.53 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 18' ' ' ASN . . . . . . . . . . . . . 17.9 t30 -51.17 -42.2 60.68 Favored 'General case' 0 N--CA 1.46 0.07 0 C-N-CA 123.147 0.579 . . . . 0.0 111.902 176.846 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . -62.54 -72.89 0.58 Allowed Glycine 0 CA--C 1.525 0.697 0 N-CA-C 110.159 -1.176 . . . . 0.0 110.159 174.265 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 17.0 mttt -165.74 166.88 9.58 Favored Pre-proline 0 C--N 1.332 -0.176 0 C-N-CA 128.239 2.616 . . . . 0.0 108.405 -171.445 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 21' ' ' PRO . . . . . . . . . . . . . 56.8 Cg_endo -58.96 169.43 3.51 Favored 'Trans proline' 0 N--CA 1.455 -0.751 0 CA-C-N 120.389 1.175 . . . . 0.0 110.679 172.389 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 22' ' ' VAL . . . . . . . . . . . . . 2.7 t -105.97 162.4 5.06 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.396 0 N-CA-C 107.067 -1.457 . . . . 0.0 107.067 174.922 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 23' ' ' THR . . . . . . . . . . . . . 0.6 OUTLIER -136.96 81.0 1.85 Allowed 'General case' 0 C--N 1.329 -0.289 0 C-N-CA 124.3 1.04 . . . . 0.0 108.533 -172.868 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 24' ' ' SER . . . . . . . . . . . . . 27.7 m -128.88 100.51 5.71 Favored 'General case' 0 C--N 1.325 -0.458 0 C-N-CA 125.701 1.6 . . . . 0.0 107.179 -175.637 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 25' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER -75.1 -16.06 60.58 Favored 'General case' 0 N--CA 1.467 0.405 0 C-N-CA 125.765 1.626 . . . . 0.0 112.151 -174.164 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 26' ' ' LYS . . . . . . . . . . . . . 20.4 tttp -143.4 136.72 28.09 Favored 'General case' 0 N--CA 1.448 -0.554 0 N-CA-C 105.748 -1.945 . . . . 0.0 105.748 -174.679 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 27' ' ' ASN . . . . . . . . . . . . . 42.8 m-20 44.93 66.62 4.96 Favored Pre-proline 0 CA--C 1.547 0.839 0 C-N-CA 125.844 1.657 . . . . 0.0 110.862 178.895 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 28' ' ' PRO . . . . . . . . . . . . . 56.2 Cg_endo -65.87 173.82 6.48 Favored 'Trans proline' 0 C--N 1.346 0.413 0 C-N-CA 123.988 3.125 . . . . 0.0 112.751 -176.275 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 29' ' ' PRO . . . . . . . . . . . . . 70.3 Cg_endo -72.82 93.79 0.79 Allowed 'Trans proline' 0 N--CA 1.446 -1.272 0 N-CA-C 108.397 -1.424 . . . . 0.0 108.397 157.359 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 30' ' ' GLU . . . . . . . . . . . . . 0.2 OUTLIER -98.38 177.64 5.29 Favored 'General case' 0 C--N 1.327 -0.403 0 O-C-N 120.546 -1.346 . . . . 0.0 109.686 167.754 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 31' ' ' ILE . . . . . . . . . . . . . 9.0 tt -147.54 114.33 0.98 Allowed 'Isoleucine or valine' 0 N--CA 1.451 -0.378 0 N-CA-C 106.952 -1.499 . . . . 0.0 106.952 171.348 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 32' ' ' SER . . . . . . . . . . . . . 15.1 m -116.11 159.61 21.5 Favored 'General case' 0 C--O 1.238 0.477 0 N-CA-C 108.902 -0.777 . . . . 0.0 108.902 174.441 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 33' ' ' PHE . . . . . . . . . . . . . 29.0 m-85 -130.55 152.55 49.8 Favored 'General case' 0 N--CA 1.448 -0.555 0 N-CA-C 108.364 -0.976 . . . . 0.0 108.364 175.862 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 34' ' ' GLY . . . . . . . . . . . . . . . -117.98 -178.44 17.26 Favored Glycine 0 C--N 1.332 0.317 0 N-CA-C 109.568 -1.413 . . . . 0.0 109.568 171.13 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 35' ' ' GLU . . . . . . . . . . . . . 3.8 pt-20 -63.22 -26.17 68.67 Favored 'General case' 0 C--N 1.324 -0.513 0 C-N-CA 128.671 2.788 . . . . 0.0 112.527 -158.359 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 0.3 OUTLIER -85.2 13.44 6.35 Favored 'General case' 0 N--CA 1.437 -1.121 0 C-N-CA 129.296 3.038 . . . . 0.0 114.308 173.352 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 37' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER 60.8 14.78 5.38 Favored 'General case' 0 CA--C 1.55 0.946 0 C-N-CA 127.394 2.278 . . . . 0.0 112.522 -168.305 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 38' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -54.58 160.51 1.77 Allowed 'General case' 0 N--CA 1.467 0.416 0 O-C-N 119.912 -1.742 . . . . 0.0 110.623 177.658 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 39' ' ' ILE . . . . . . . . . . . . . 17.9 mt -132.12 120.7 44.53 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.514 0 N-CA-C 105.555 -2.017 . . . . 0.0 105.555 -177.546 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 40' ' ' SER . . . . . . . . . . . . . 17.3 m -129.18 89.1 2.8 Favored 'General case' 0 CA--C 1.535 0.378 0 C-N-CA 126.131 1.772 . . . . 0.0 108.607 -174.674 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 41' ' ' GLY . . . . . . . . . . . . . . . -135.61 -167.91 11.42 Favored Glycine 0 CA--C 1.538 1.487 0 C-N-CA 124.304 0.954 . . . . 0.0 110.95 -173.735 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 42' ' ' SER . . . . . . . . . . . . . 23.6 t -171.91 93.02 0.14 Allowed 'General case' 0 CA--C 1.535 0.379 0 C-N-CA 128.247 2.619 . . . . 0.0 108.525 177.497 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 43' ' ' MET . . . . . . . . . . . . . 2.6 mmt -63.74 -51.1 66.46 Favored 'General case' 0 C--O 1.231 0.107 0 N-CA-C 108.651 -0.87 . . . . 0.0 108.651 170.761 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 44' ' ' CYS . . . . . 1.302 ' SG ' ' SG ' ' A' ' 70' ' ' CYS . 48.9 t -148.79 -66.06 0.23 Allowed 'General case' 0 CA--C 1.514 -0.427 0 N-CA-C 108.182 -1.044 . . . . 0.0 108.182 169.023 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 45' ' ' ASN . . . . . . . . . . . . . 4.4 m-20 -75.93 17.36 0.33 Allowed 'General case' 0 CA--C 1.534 0.347 0 C-N-CA 127.835 2.454 . . . . 0.0 112.549 -172.612 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 46' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER 61.68 161.32 0.07 Allowed 'General case' 0 N--CA 1.463 0.207 0 C-N-CA 125.855 1.662 . . . . 0.0 111.545 -163.952 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 47' ' ' PHE . . . . . . . . . . . . . 35.0 p90 -158.81 159.78 35.5 Favored 'General case' 0 C--N 1.329 -0.308 0 N-CA-C 107.541 -1.281 . . . . 0.0 107.541 153.348 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 48' ' ' SER . . . . . . . . . . . . . 1.4 m -151.91 158.47 43.22 Favored 'General case' 0 C--O 1.237 0.427 0 N-CA-C 108.561 -0.903 . . . . 0.0 108.561 161.075 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 49' ' ' GLY . . . . . . . . . . . . . . . -177.76 166.68 37.12 Favored Glycine 0 CA--C 1.52 0.389 0 N-CA-C 110.136 -1.186 . . . . 0.0 110.136 179.578 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 50' ' ' GLU . . . . . . . . . . . . . 43.4 mt-10 -88.51 98.26 11.54 Favored 'General case' 0 N--CA 1.449 -0.488 0 N-CA-C 107.575 -1.268 . . . . 0.0 107.575 -176.832 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 51' ' ' GLY . . . . . . . . . . . . . . . -59.61 169.87 6.54 Favored Glycine 0 CA--C 1.531 1.083 0 CA-C-N 115.737 -0.665 . . . . 0.0 112.424 172.106 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 52' ' ' LYS . . . . . . . . . . . . . 35.6 ttpt -155.02 147.03 23.6 Favored 'General case' 0 C--O 1.235 0.327 0 O-C-N 121.549 -0.971 . . . . 0.0 111.142 169.606 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 53' ' ' LEU . . . . . . . . . . . . . 24.2 tp -134.77 139.73 45.37 Favored 'General case' 0 N--CA 1.453 -0.324 0 C-N-CA 127.575 2.35 . . . . 0.0 107.484 170.148 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 54' ' ' SER . . . . . 0.411 ' H ' ' H ' ' A' ' 55' ' ' ASN . 1.3 t -162.21 -14.77 0.04 OUTLIER 'General case' 0 CA--C 1.541 0.606 0 C-N-CA 125.574 1.55 . . . . 0.0 110.39 163.917 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 55' ' ' ASN . . . . . 0.411 ' H ' ' H ' ' A' ' 54' ' ' SER . 43.9 m-20 -123.44 14.12 9.54 Favored 'General case' 0 CA--C 1.541 0.601 0 C-N-CA 124.761 1.224 . . . . 0.0 113.099 -170.407 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 56' ' ' GLY . . . . . . . . . . . . . . . 72.09 19.7 78.61 Favored Glycine 0 CA--C 1.533 1.183 0 CA-C-N 120.429 1.468 . . . . 0.0 112.672 -172.24 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 57' ' ' GLU . . . . . . . . . . . . . 19.7 tt0 -130.01 149.84 51.55 Favored 'General case' 0 CA--C 1.541 0.607 0 C-N-CA 125.187 1.395 . . . . 0.0 107.958 -176.726 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 58' ' ' LEU . . . . . . . . . . . . . 66.2 tp -114.72 124.74 52.57 Favored 'General case' 0 N--CA 1.465 0.291 0 CA-C-N 119.603 1.092 . . . . 0.0 109.066 177.516 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 59' ' ' THR . . . . . . . . . . . . . 11.8 p -123.01 159.47 28.32 Favored 'General case' 0 C--N 1.326 -0.42 0 C-N-CA 126.171 1.788 . . . . 0.0 110.15 169.531 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 60' ' ' ALA . . . . . 0.618 ' HB2' ' HB3' ' A' ' 86' ' ' LEU . . . -80.54 169.62 17.44 Favored 'General case' 0 N--CA 1.451 -0.423 0 C-N-CA 126.191 1.796 . . . . 0.0 113.468 162.532 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 61' ' ' LYS . . . . . . . . . . . . . 77.6 tttt -135.79 121.51 19.66 Favored 'General case' 0 N--CA 1.441 -0.876 0 N-CA-C 105.211 -2.144 . . . . 0.0 105.211 147.212 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 62' ' ' GLY . . . . . . . . . . . . . . . 104.41 -61.25 0.41 Allowed Glycine 0 CA--C 1.526 0.73 0 CA-C-O 118.575 -1.125 . . . . 0.0 113.775 160.569 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 63' ' ' LEU . . . . . . . . . . . . . 2.5 tp 44.85 87.79 0.02 OUTLIER 'General case' 0 CA--C 1.54 0.578 0 C-N-CA 128.305 2.642 . . . . 0.0 113.591 -175.499 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 64' ' ' ALA . . . . . . . . . . . . . . . -71.57 147.44 47.63 Favored 'General case' 0 C--N 1.33 -0.25 0 N-CA-C 107.094 -1.446 . . . . 0.0 107.094 162.05 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 65' ' ' MET . . . . . . . . . . . . . 63.9 mtp -147.06 -171.11 3.7 Favored 'General case' 0 CA--C 1.542 0.666 0 C-N-CA 126.806 2.042 . . . . 0.0 107.625 174.679 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 66' ' ' THR . . . . . . . . . . . . . 3.9 p -139.15 -168.82 2.52 Favored 'General case' 0 CA--C 1.546 0.812 0 C-N-CA 124.494 1.118 . . . . 0.0 109.847 176.785 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 67' ' ' ARG . . . . . . . . . . . . . 16.6 mmt85 -119.18 28.44 8.24 Favored 'General case' 0 N--CA 1.473 0.716 0 C-N-CA 127.322 2.249 . . . . 0.0 111.935 177.934 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 68' ' ' MET . . . . . . . . . . . . . 77.4 mtm -74.98 -169.7 0.96 Allowed 'General case' 0 CA--C 1.541 0.621 0 O-C-N 120.632 -1.293 . . . . 0.0 109.698 178.651 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 69' ' ' MET . . . . . . . . . . . . . 1.0 OUTLIER -149.63 176.68 10.44 Favored 'General case' 0 CA--C 1.522 -0.134 0 C-N-CA 125.531 1.532 . . . . 0.0 109.626 174.321 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 70' ' ' CYS . . . . . 1.302 ' SG ' ' SG ' ' A' ' 44' ' ' CYS . 75.9 m -133.8 15.38 3.96 Favored 'General case' 0 CA--C 1.537 0.461 0 C-N-CA 124.225 1.01 . . . . 0.0 111.658 179.986 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 71' ' ' ALA . . . . . . . . . . . . . . . 60.6 -25.75 0.04 OUTLIER 'General case' 0 CA--C 1.537 0.455 0 C-N-CA 130.184 3.394 . . . . 0.0 115.308 -171.212 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 72' ' ' ASN . . . . . . . . . . . . . 19.8 t30 -96.42 144.56 28.04 Favored Pre-proline 0 C--O 1.236 0.347 0 C-N-CA 124.116 0.967 . . . . 0.0 110.366 -176.552 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 73' ' ' PRO . . . . . . . . . . . . . 53.5 Cg_endo -73.72 -38.19 2.55 Favored 'Trans proline' 0 N--CA 1.46 -0.447 0 C-N-CA 122.044 1.829 . . . . 0.0 112.284 -174.6 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 74' ' ' GLN . . . . . . . . . . . . . 63.1 tt0 -52.48 -46.25 66.5 Favored 'General case' 0 C--O 1.224 -0.277 0 CA-C-N 118.973 0.806 . . . . 0.0 110.661 -178.378 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 75' ' ' LEU . . . . . . . . . . . . . 90.0 mt -66.12 -37.65 86.26 Favored 'General case' 0 CA--C 1.534 0.347 0 O-C-N 121.873 -0.517 . . . . 0.0 111.623 -179.557 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 76' ' ' ASN . . . . . . . . . . . . . 0.8 OUTLIER -76.05 -28.92 57.84 Favored 'General case' 0 N--CA 1.467 0.38 0 CA-C-N 118.936 0.789 . . . . 0.0 111.691 -178.483 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 77' ' ' GLU . . . . . . . . . . . . . 3.3 tp10 -65.75 -36.64 84.14 Favored 'General case' 0 CA--C 1.533 0.321 0 C-N-CA 125.047 1.339 . . . . 0.0 109.008 166.729 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 78' ' ' LEU . . . . . . . . . . . . . 5.2 mp -70.63 -13.17 61.98 Favored 'General case' 0 N--CA 1.453 -0.298 0 O-C-N 121.121 -0.987 . . . . 0.0 113.55 -177.429 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 79' ' ' ASP . . . . . . . . . . . . . 13.4 t70 -52.99 -58.28 7.51 Favored 'General case' 0 C--O 1.231 0.12 0 C-N-CA 124.725 1.21 . . . . 0.0 110.696 163.273 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 80' ' ' ASN . . . . . . . . . . . . . 13.4 p30 -75.33 -35.7 61.15 Favored 'General case' 0 N--CA 1.444 -0.731 0 N-CA-C 109.605 -0.517 . . . . 0.0 109.605 -173.525 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 81' ' ' THR . . . . . . . . . . . . . 32.6 m -48.43 -53.15 18.86 Favored 'General case' 0 N--CA 1.447 -0.606 0 C-N-CA 125.29 1.436 . . . . 0.0 110.349 174.29 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 82' ' ' ILE . . . . . . . . . . . . . 8.9 tp -77.2 -38.31 27.15 Favored 'Isoleucine or valine' 0 C--N 1.341 0.231 0 CA-C-N 120.069 1.304 . . . . 0.0 111.586 -178.686 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 83' ' ' SER . . . . . . . . . . . . . 4.2 t -50.46 -50.96 51.0 Favored 'General case' 0 C--O 1.238 0.467 0 C-N-CA 123.679 0.791 . . . . 0.0 109.851 -179.904 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 84' ' ' GLU . . . . . . . . . . . . . 0.5 OUTLIER -67.41 -44.64 78.31 Favored 'General case' 0 N--CA 1.45 -0.444 0 C-N-CA 124.46 1.104 . . . . 0.0 112.006 -178.451 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 85' ' ' MET . . . . . . . . . . . . . 90.2 mtp -66.8 -23.41 66.05 Favored 'General case' 0 C--O 1.232 0.16 0 CA-C-O 121.864 0.84 . . . . 0.0 110.7 -166.667 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 86' ' ' LEU . . . . . 0.618 ' HB3' ' HB2' ' A' ' 60' ' ' ALA . 2.8 mm? -98.02 -31.42 12.16 Favored 'General case' 0 N--CA 1.446 -0.664 0 C-N-CA 125.301 1.44 . . . . 0.0 110.413 -177.814 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 87' ' ' LYS . . . . . . . . . . . . . 54.0 mttt -66.6 -49.91 64.77 Favored 'General case' 0 N--CA 1.439 -0.986 0 N-CA-C 107.438 -1.319 . . . . 0.0 107.438 179.16 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 88' ' ' GLU . . . . . . . . . . . . . 31.2 mt-10 -89.15 -8.44 53.68 Favored 'General case' 0 CA--C 1.532 0.265 0 N-CA-C 113.169 0.804 . . . . 0.0 113.169 -168.115 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 89' ' ' GLY . . . . . . . . . . . . . . . 83.54 138.91 3.63 Favored Glycine 0 C--N 1.337 0.588 0 C-N-CA 124.358 0.98 . . . . 0.0 112.423 175.45 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 90' ' ' ALA . . . . . . . . . . . . . . . -131.48 154.03 49.16 Favored 'General case' 0 CA--C 1.514 -0.426 0 N-CA-C 114.127 1.158 . . . . 0.0 114.127 -165.275 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 91' ' ' GLN . . . . . . . . . . . . . 9.0 mp0 -70.36 129.22 38.71 Favored 'General case' 0 N--CA 1.445 -0.709 0 N-CA-C 104.242 -2.503 . . . . 0.0 104.242 163.1 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 92' ' ' VAL . . . . . . . . . . . . . 3.3 p -128.6 77.32 0.55 Allowed 'Isoleucine or valine' 0 C--N 1.325 -0.489 0 N-CA-C 106.512 -1.662 . . . . 0.0 106.512 -177.135 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 93' ' ' ASP . . . . . . . . . . . . . 2.4 m-20 -72.32 147.65 46.12 Favored 'General case' 0 N--CA 1.448 -0.546 0 N-CA-C 107.206 -1.405 . . . . 0.0 107.206 172.537 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 94' ' ' LEU . . . . . . . . . . . . . 61.1 tp -142.07 102.73 4.18 Favored 'General case' 0 N--CA 1.448 -0.534 0 N-CA-C 107.909 -1.145 . . . . 0.0 107.909 171.283 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 95' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -70.67 179.48 2.58 Favored 'General case' 0 N--CA 1.442 -0.855 0 CA-C-N 114.771 -1.104 . . . . 0.0 108.825 168.486 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 96' ' ' ALA . . . . . . . . . . . . . . . -47.07 -33.01 4.53 Favored 'General case' 0 CA--C 1.535 0.401 0 C-N-CA 126.273 1.829 . . . . 0.0 115.173 -169.955 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 97' ' ' ASN . . . . . . . . . . . . . 0.0 OUTLIER -148.35 6.8 0.76 Allowed 'General case' 0 CA--C 1.537 0.445 0 C-N-CA 126.325 1.85 . . . . 0.0 110.69 -173.897 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 98' ' ' GLN . . . . . . . . . . . . . 24.7 tt0 -143.46 111.41 6.09 Favored 'General case' 0 CA--C 1.529 0.156 0 CA-C-N 119.566 1.076 . . . . 0.0 109.899 -164.9 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 99' ' ' LEU . . . . . 0.446 ' HB3' ' HB2' ' A' ' 110' ' ' TYR . 10.9 tp -66.79 147.37 53.35 Favored 'General case' 0 C--O 1.235 0.321 0 C-N-CA 125.63 1.572 . . . . 0.0 107.745 170.744 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 100' ' ' THR . . . . . . . . . . . . . 85.3 m -143.46 100.69 3.65 Favored 'General case' 0 C--N 1.326 -0.439 0 N-CA-C 106.638 -1.615 . . . . 0.0 106.638 169.506 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 101' ' ' LEU . . . . . . . . . . . . . 3.2 mm? -81.37 146.33 30.38 Favored 'General case' 0 CA--C 1.517 -0.303 0 N-CA-C 107.651 -1.241 . . . . 0.0 107.651 175.571 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 102' ' ' ALA . . . . . . . . . . . . . . . -143.46 152.03 41.04 Favored 'General case' 0 C--O 1.235 0.336 0 C-N-CA 123.679 0.792 . . . . 0.0 109.7 164.126 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 103' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -151.61 173.92 14.07 Favored 'General case' 0 C--N 1.326 -0.448 0 C-N-CA 126.93 2.092 . . . . 0.0 108.735 179.631 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 104' ' ' ALA . . . . . . . . . . . . . . . -49.85 -19.19 0.62 Allowed 'General case' 0 CA--C 1.536 0.419 0 N-CA-C 115.44 1.644 . . . . 0.0 115.44 164.392 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 105' ' ' LYS . . . . . . . . . . . . . 23.8 mmtt -87.95 -74.15 0.46 Allowed 'General case' 0 N--CA 1.455 -0.19 0 CA-C-N 119.775 1.171 . . . . 0.0 109.245 172.67 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 106' ' ' GLN . . . . . . . . . . . . . 71.3 mt-30 -150.34 179.76 7.86 Favored 'General case' 0 N--CA 1.462 0.151 0 C-N-CA 124.644 1.178 . . . . 0.0 109.835 -160.862 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 107' ' ' THR . . . . . . . . . . . . . 3.5 t -135.22 125.51 26.36 Favored 'General case' 0 CA--C 1.538 0.506 0 C-N-CA 124.587 1.155 . . . . 0.0 109.699 177.777 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 108' ' ' LEU . . . . . . . . . . . . . 8.5 mp -119.44 149.02 42.56 Favored 'General case' 0 C--O 1.234 0.245 0 C-N-CA 126.746 2.018 . . . . 0.0 109.337 -172.257 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 109' ' ' THR . . . . . . . . . . . . . 32.2 m -121.27 124.69 45.24 Favored 'General case' 0 N--CA 1.451 -0.419 0 N-CA-C 108.338 -0.986 . . . . 0.0 108.338 -173.022 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 110' ' ' TYR . . . . . 0.446 ' HB2' ' HB3' ' A' ' 99' ' ' LEU . 32.3 m-85 -124.39 163.86 20.88 Favored 'General case' 0 CA--C 1.518 -0.272 0 N-CA-C 109.482 -0.562 . . . . 0.0 109.482 -179.98 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 111' ' ' LYS . . . . . 0.511 ' HE2' ' HB2' ' A' ' 113' ' ' ALA . 0.5 OUTLIER -128.0 140.08 52.18 Favored 'General case' 0 CA--C 1.514 -0.405 0 CA-C-O 117.54 -1.219 . . . . 0.0 108.883 -171.734 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' A' A ' 112' ' ' LEU . . . . . . . . . . . . . 28.9 tp -71.85 47.01 0.13 Allowed 'General case' 0 CA--C 1.54 0.592 0 C-N-CA 127.386 2.275 . . . . 0.0 110.079 175.078 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 113' ' ' ALA . . . . . 0.511 ' HB2' ' HE2' ' A' ' 111' ' ' LYS . . . -78.96 82.32 5.15 Favored 'General case' 0 N--CA 1.446 -0.644 0 N-CA-C 106.489 -1.671 . . . . 0.0 106.489 166.225 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 114' ' ' ASP . . . . . . . . . . . . . 45.1 t0 -89.07 88.59 7.62 Favored 'General case' 0 CA--C 1.506 -0.73 0 N-CA-C 107.421 -1.325 . . . . 0.0 107.421 173.908 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 115' ' ' LEU . . . . . . . . . . . . . 23.1 mt -108.76 4.83 24.11 Favored 'General case' 0 C--N 1.323 -0.545 0 CA-C-N 113.634 -1.621 . . . . 0.0 110.94 -175.374 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 116' ' ' MET . . . . . . . . . . . . . 9.1 ttp -175.82 156.53 1.83 Allowed 'General case' 0 C--O 1.238 0.46 0 C-N-CA 125.069 1.348 . . . . 0.0 110.084 -175.388 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 117' ' ' ASN . . . . . . . . . . . . . 0.9 OUTLIER . . . . . 0 N--CA 1.469 0.523 0 O-C-N 121.411 -0.806 . . . . 0.0 110.961 171.168 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 C--O 1.237 0.424 0 N-CA-C 110.069 -0.345 . . . . 0.0 110.069 . . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 2' ' ' VAL . . . . . . . . . . . . . 7.3 p -55.63 142.89 9.54 Favored 'Isoleucine or valine' 0 N--CA 1.447 -0.59 0 C-N-CA 124.133 0.973 . . . . 0.0 109.331 175.377 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 3' ' ' THR . . . . . . . . . . . . . 0.8 OUTLIER -130.74 162.88 52.44 Favored Pre-proline 0 C--N 1.327 -0.403 0 C-N-CA 124.953 1.301 . . . . 0.0 109.196 -176.939 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 4' ' ' PRO . . . . . . . . . . . . . 30.7 Cg_endo -65.53 -34.52 42.25 Favored 'Trans proline' 0 N--CA 1.457 -0.636 0 C-N-CA 122.275 1.984 . . . . 0.0 111.731 -178.579 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 5' ' ' GLU . . . . . . . . . . . . . 55.1 tt0 -58.63 -55.13 39.02 Favored 'General case' 0 C--N 1.322 -0.61 0 C-N-CA 124.731 1.212 . . . . 0.0 110.656 -177.156 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 6' ' ' GLN . . . . . . . . . . . . . 7.4 pt20 -66.35 12.65 0.06 Allowed 'General case' 0 CA--C 1.541 0.635 0 C-N-CA 125.348 1.459 . . . . 0.0 113.793 177.829 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 7' ' ' LEU . . . . . . . . . . . . . 82.4 mt -124.46 -47.19 1.86 Allowed 'General case' 0 N--CA 1.454 -0.238 0 C-N-CA 126.378 1.871 . . . . 0.0 110.456 177.815 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 8' ' ' GLN . . . . . . . . . . . . 0.259 3.3 pt20 -56.34 -14.53 2.98 Favored 'General case' 0 N--CA 1.472 0.66 0 N-CA-C 114.874 1.435 . . . . 0.0 114.874 -176.361 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 9' ' ' HIS . . . . . . . . . . . . . 8.8 m80 -124.92 16.64 8.58 Favored 'General case' 0 C--N 1.32 -0.685 0 C-N-CA 124.489 1.116 . . . . 0.0 111.274 -174.811 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 10' ' ' HIS . . . . . . . . . . . . . 97.8 m-70 -142.53 121.3 12.67 Favored 'General case' 0 CA--C 1.541 0.63 0 C-N-CA 125.711 1.604 . . . . 0.0 110.805 -179.879 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 11' ' ' ARG . . . . . . . . . . . . . 4.4 ptm85 -78.67 160.18 27.64 Favored 'General case' 0 N--CA 1.467 0.397 0 C-N-CA 124.853 1.261 . . . . 0.0 109.578 174.164 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 12' ' ' PHE . . . . . . . . . . . . . 34.2 m-85 -140.03 134.74 31.84 Favored 'General case' 0 C--N 1.329 -0.286 0 C-N-CA 123.926 0.891 . . . . 0.0 110.664 -179.171 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 13' ' ' VAL . . . . . . . . . . . . . 11.0 p -120.88 144.21 30.55 Favored 'Isoleucine or valine' 0 C--O 1.233 0.226 0 O-C-N 121.192 -0.942 . . . . 0.0 110.149 -179.213 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 14' ' ' LEU . . . . . . . . . . . . . 35.0 tp -79.42 86.56 5.11 Favored 'General case' 0 C--N 1.332 -0.193 0 C-N-CA 124.959 1.304 . . . . 0.0 110.598 -169.383 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 4.0 mm-40 -55.44 -42.3 74.02 Favored 'General case' 0 C--O 1.235 0.322 0 C-N-CA 124.527 1.131 . . . . 0.0 111.022 176.169 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 22.3 t -155.11 142.98 19.98 Favored 'General case' 0 N--CA 1.452 -0.369 0 CA-C-O 121.918 0.866 . . . . 0.0 110.962 174.571 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 17' ' ' VAL . . . . . . . . . . . . . 44.3 t -67.2 171.15 0.85 Allowed 'Isoleucine or valine' 0 C--O 1.24 0.594 0 N-CA-C 107.235 -1.394 . . . . 0.0 107.235 159.42 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 18' ' ' ASN . . . . . . . . . . . . . 0.2 OUTLIER -46.65 -44.47 18.44 Favored 'General case' 0 CA--C 1.528 0.129 0 C-N-CA 124.245 1.018 . . . . 0.0 111.503 170.888 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . -86.73 -58.57 1.9 Allowed Glycine 0 N--CA 1.446 -0.649 0 O-C-N 124.223 0.952 . . . . 0.0 110.988 -166.421 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 24.3 mttt -149.42 166.15 15.95 Favored Pre-proline 0 C--O 1.238 0.493 0 C-N-CA 126.286 1.834 . . . . 0.0 110.449 -173.178 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 21' ' ' PRO . . . . . . . . . . . . . 42.4 Cg_endo -56.11 171.27 0.86 Allowed 'Trans proline' 0 N--CA 1.455 -0.793 0 C-N-CA 122.082 1.854 . . . . 0.0 111.897 164.329 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 22' ' ' VAL . . . . . . . . . . . . . 4.1 p -128.37 147.15 32.94 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.341 0 C-N-CA 124.775 1.23 . . . . 0.0 108.415 -178.757 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 23' ' ' THR . . . . . . . . . . . . . 1.4 p -110.61 145.57 37.64 Favored 'General case' 0 N--CA 1.452 -0.358 0 C-N-CA 124.734 1.214 . . . . 0.0 109.38 179.172 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 24' ' ' SER . . . . . . . . . . . . . 23.3 t -150.27 137.91 19.88 Favored 'General case' 0 N--CA 1.437 -1.096 0 C-N-CA 127.5 2.32 . . . . 0.0 105.247 176.483 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 25' ' ' ASP . . . . . . . . . . . . . 37.4 t70 -49.74 -59.27 3.97 Favored 'General case' 0 C--N 1.32 -0.706 0 C-N-CA 124.098 0.959 . . . . 0.0 111.905 171.875 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 26' ' ' LYS . . . . . . . . . . . . . 11.2 tttt -153.47 -3.58 0.2 Allowed 'General case' 0 N--CA 1.47 0.542 0 N-CA-C 113.946 1.091 . . . . 0.0 113.946 -175.97 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 27' ' ' ASN . . . . . . . . . . . . . 43.4 m-80 -127.02 83.36 66.2 Favored Pre-proline 0 C--O 1.234 0.263 0 N-CA-C 107.543 -1.28 . . . . 0.0 107.543 -176.249 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 28' ' ' PRO . . . . . . . . . . . . . 49.2 Cg_endo -65.77 162.86 32.86 Favored 'Trans proline' 0 N--CA 1.453 -0.909 0 C-N-CA 121.817 1.678 . . . . 0.0 110.633 -176.559 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 29' ' ' PRO . . . . . . . . . . . . . 30.0 Cg_endo -65.29 84.8 0.2 Allowed 'Trans proline' 0 N--CA 1.449 -1.131 0 C-N-CA 122.437 2.091 . . . . 0.0 108.512 162.913 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 30' ' ' GLU . . . . . . . . . . . . . 11.6 pt-20 -105.49 162.21 13.67 Favored 'General case' 0 C--O 1.241 0.622 0 C-N-CA 124.337 1.055 . . . . 0.0 108.31 169.709 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 31' ' ' ILE . . . . . . . . . . . . . 20.2 tt -138.53 137.19 43.63 Favored 'Isoleucine or valine' 0 N--CA 1.447 -0.622 0 C-N-CA 127.606 2.363 . . . . 0.0 105.501 177.894 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 32' ' ' SER . . . . . . . . . . . . . 1.5 m -131.39 163.72 27.26 Favored 'General case' 0 N--CA 1.447 -0.622 0 N-CA-C 107.974 -1.121 . . . . 0.0 107.974 174.159 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 33' ' ' PHE . . . . . . . . . . . . . 35.3 m-85 -131.65 166.6 21.1 Favored 'General case' 0 N--CA 1.445 -0.679 0 N-CA-C 107.097 -1.446 . . . . 0.0 107.097 -179.698 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 34' ' ' GLY . . . . . . . . . . . . . . . 166.93 141.15 3.07 Favored Glycine 0 CA--C 1.503 -0.659 0 N-CA-C 108.208 -1.957 . . . . 0.0 108.208 -174.966 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 35' ' ' GLU . . . . . . . . . . . . . 90.8 mt-10 59.64 108.83 0.02 OUTLIER 'General case' 0 C--O 1.222 -0.348 0 C-N-CA 127.698 2.399 . . . . 0.0 110.675 -176.612 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 35.5 mtpt 61.48 12.31 4.33 Favored 'General case' 0 N--CA 1.473 0.701 0 N-CA-C 115.312 1.597 . . . . 0.0 115.312 169.486 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 37' ' ' MET . . . . . . . . . . . . . 13.5 mmm 58.06 49.84 10.97 Favored 'General case' 0 CA--C 1.537 0.479 0 C-N-CA 124.35 1.06 . . . . 0.0 112.488 -161.097 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 38' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -63.27 167.13 5.48 Favored 'General case' 0 N--CA 1.452 -0.346 0 O-C-N 120.624 -1.298 . . . . 0.0 109.279 150.017 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 39' ' ' ILE . . . . . . . . . . . . . 10.3 mt -132.61 133.46 59.53 Favored 'Isoleucine or valine' 0 C--O 1.238 0.477 0 C-N-CA 125.503 1.521 . . . . 0.0 107.214 -179.223 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 40' ' ' SER . . . . . . . . . . . . . 16.4 m -131.47 151.84 51.22 Favored 'General case' 0 C--N 1.33 -0.268 0 N-CA-C 106.887 -1.523 . . . . 0.0 106.887 156.361 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 41' ' ' GLY . . . . . . . . . . . . . . . -178.06 178.42 48.51 Favored Glycine 0 N--CA 1.446 -0.699 0 N-CA-C 109.767 -1.333 . . . . 0.0 109.767 174.158 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 42' ' ' SER . . . . . . . . . . . . . 6.1 p -151.95 84.53 1.28 Allowed 'General case' 0 N--CA 1.445 -0.687 0 N-CA-C 108.978 -0.749 . . . . 0.0 108.978 -169.673 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 43' ' ' MET . . . . . . . . . . . . . 17.5 mmm -60.81 -46.38 90.73 Favored 'General case' 0 C--N 1.341 0.228 0 N-CA-C 108.43 -0.952 . . . . 0.0 108.43 169.726 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 44' ' ' CYS . . . . . 1.282 ' SG ' ' SG ' ' A' ' 70' ' ' CYS . 2.2 t -159.84 -66.93 0.07 Allowed 'General case' 0 N--CA 1.433 -1.319 0 N-CA-C 105.14 -2.17 . . . . 0.0 105.14 165.559 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 45' ' ' ASN . . . . . . . . . . . . . 5.0 m-80 -74.63 10.96 1.14 Allowed 'General case' 0 N--CA 1.471 0.595 0 C-N-CA 125.633 1.573 . . . . 0.0 114.682 -166.89 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 46' ' ' ARG . . . . . . . . . . . . . 6.7 mmm-85 56.46 164.79 0.02 OUTLIER 'General case' 0 C--N 1.332 -0.195 0 C-N-CA 126.671 1.988 . . . . 0.0 112.695 -169.329 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 47' ' ' PHE . . . . . . . . . . . . . 53.0 p90 -167.05 165.21 15.84 Favored 'General case' 0 C--N 1.325 -0.496 0 C-N-CA 125.561 1.544 . . . . 0.0 107.727 178.403 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 48' ' ' SER . . . . . . . . . . . . . 0.5 OUTLIER -168.54 141.37 2.93 Favored 'General case' 0 C--N 1.329 -0.303 0 C-N-CA 125.611 1.564 . . . . 0.0 107.742 171.688 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 49' ' ' GLY . . . . . . . . . . . . . . . -152.94 163.33 30.44 Favored Glycine 0 CA--C 1.53 1.028 0 N-CA-C 111.019 -0.832 . . . . 0.0 111.019 175.21 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 50' ' ' GLU . . . . . . . . . . . . . 9.9 pt-20 -63.76 83.18 0.03 OUTLIER 'General case' 0 CA--C 1.538 0.504 0 C-N-CA 128.258 2.623 . . . . 0.0 110.038 172.432 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 51' ' ' GLY . . . . . . . . . . . . . . . -63.8 -76.79 0.26 Allowed Glycine 0 N--CA 1.466 0.635 0 O-C-N 121.386 -0.821 . . . . 0.0 113.355 -166.754 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 52' ' ' LYS . . . . . . . . . . . . . 3.4 ttpm? 57.33 126.94 0.0 OUTLIER 'General case' 0 C--N 1.331 -0.208 0 C-N-CA 130.631 3.573 . . . . 0.0 112.797 176.518 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 53' ' ' LEU . . . . . . . . . . . . . 32.4 tp -125.07 119.45 28.67 Favored 'General case' 0 N--CA 1.467 0.405 0 O-C-N 121.643 -0.661 . . . . 0.0 110.339 -174.341 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 10.0 t -145.1 -17.09 0.5 Allowed 'General case' 0 CA--C 1.539 0.551 0 C-N-CA 125.185 1.394 . . . . 0.0 110.692 178.703 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 55' ' ' ASN . . . . . . . . . . . . . 6.6 m-20 -129.3 6.65 5.33 Favored 'General case' 0 CA--C 1.536 0.416 0 CA-C-N 119.331 0.969 . . . . 0.0 112.275 -159.734 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 56' ' ' GLY . . . . . . . . . . . . . . . 75.06 4.66 73.25 Favored Glycine 0 CA--C 1.532 1.124 0 O-C-N 121.451 -0.781 . . . . 0.0 112.237 -165.792 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 57' ' ' GLU . . . . . . . . . . . . . 33.2 tt0 -121.03 131.24 54.16 Favored 'General case' 0 C--O 1.234 0.28 0 CA-C-N 118.443 1.121 . . . . 0.0 108.698 -169.052 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 58' ' ' LEU . . . . . . . . . . . . . 47.0 tp -116.65 98.64 6.64 Favored 'General case' 0 C--O 1.236 0.352 0 C-N-CA 124.814 1.246 . . . . 0.0 108.864 173.713 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 59' ' ' THR . . . . . . . . . . . . . 2.1 p -85.34 169.73 13.44 Favored 'General case' 0 C--N 1.327 -0.379 0 C-N-CA 123.961 0.904 . . . . 0.0 111.945 172.492 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 60' ' ' ALA . . . . . . . . . . . . . . . -142.94 103.76 4.22 Favored 'General case' 0 N--CA 1.455 -0.18 0 C-N-CA 125.995 1.718 . . . . 0.0 109.437 148.567 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 61' ' ' LYS . . . . . . . . . . . . . 45.5 tttt -69.23 -18.45 63.88 Favored 'General case' 0 CA--C 1.542 0.672 0 CA-C-O 118.892 -0.575 . . . . 0.0 111.988 173.598 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 62' ' ' GLY . . . . . . . . . . . . . . . -102.84 -83.85 1.75 Allowed Glycine 0 CA--C 1.526 0.73 0 C-N-CA 124.521 1.058 . . . . 0.0 110.764 176.382 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 63' ' ' LEU . . . . . . . . . . . . . 2.4 tp 65.03 79.06 0.26 Allowed 'General case' 0 N--CA 1.448 -0.546 0 C-N-CA 129.442 3.097 . . . . 0.0 114.379 -178.003 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 64' ' ' ALA . . . . . . . . . . . . . . . -70.09 92.65 0.76 Allowed 'General case' 0 CA--C 1.539 0.525 0 C-N-CA 125.121 1.368 . . . . 0.0 112.367 178.591 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 65' ' ' MET . . . . . . . . . . . . . 52.8 mtp -99.22 173.81 6.61 Favored 'General case' 0 N--CA 1.472 0.628 0 C-N-CA 124.649 1.18 . . . . 0.0 111.45 176.205 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 66' ' ' THR . . . . . . . . . . . . . 5.5 p -115.76 -164.84 0.98 Allowed 'General case' 0 CA--C 1.547 0.836 0 C-N-CA 124.725 1.21 . . . . 0.0 112.104 -178.429 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 67' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -141.26 31.53 1.73 Allowed 'General case' 0 N--CA 1.474 0.772 0 C-N-CA 126.449 1.9 . . . . 0.0 112.332 -173.265 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 68' ' ' MET . . . . . . . . . . . . . 76.6 mtm -76.71 179.97 5.72 Favored 'General case' 0 CA--C 1.545 0.785 0 C-N-CA 125.302 1.441 . . . . 0.0 109.969 173.079 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 69' ' ' MET . . . . . . . . . . . . . 1.5 mpp? -110.91 168.63 9.34 Favored 'General case' 0 C--O 1.237 0.417 0 C-N-CA 128.415 2.686 . . . . 0.0 109.702 172.915 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 70' ' ' CYS . . . . . 1.282 ' SG ' ' SG ' ' A' ' 44' ' ' CYS . 1.7 m -140.12 150.26 44.05 Favored 'General case' 0 N--CA 1.469 0.487 0 C-N-CA 125.161 1.384 . . . . 0.0 112.427 176.522 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 71' ' ' ALA . . . . . . . . . . . . . . . -70.29 -10.96 60.47 Favored 'General case' 0 CA--C 1.534 0.354 0 C-N-CA 126.039 1.736 . . . . 0.0 114.91 -174.443 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 72' ' ' ASN . . . . . . . . . . . . . 61.3 t30 -135.67 142.53 41.22 Favored Pre-proline 0 C--O 1.235 0.303 0 N-CA-C 105.756 -1.942 . . . . 0.0 105.756 177.716 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 73' ' ' PRO . . . . . . . . . . . . . 87.2 Cg_endo -84.56 -23.95 2.55 Favored 'Trans proline' 0 N--CA 1.458 -0.575 0 CA-C-N 120.536 1.227 . . . . 0.0 111.384 -163.862 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 74' ' ' GLN . . . . . . . . . . . . . 57.4 tt0 -60.06 -43.63 95.29 Favored 'General case' 0 N--CA 1.452 -0.332 0 C-N-CA 123.574 0.75 . . . . 0.0 109.004 175.311 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 75' ' ' LEU . . . . . . . . . . . . . 65.3 mt -59.25 -45.91 89.91 Favored 'General case' 0 C--N 1.341 0.199 0 CA-C-N 118.213 0.461 . . . . 0.0 110.309 178.726 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 76' ' ' ASN . . . . . . . . . . . . . 27.2 t-20 -64.83 -49.63 69.85 Favored 'General case' 0 C--O 1.222 -0.368 0 N-CA-C 108.892 -0.781 . . . . 0.0 108.892 -176.768 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 77' ' ' GLU . . . . . . . . . . . . . 8.4 tt0 -56.61 -34.5 67.29 Favored 'General case' 0 CA--C 1.537 0.471 0 C-N-CA 125.392 1.477 . . . . 0.0 112.754 -178.961 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 78' ' ' LEU . . . . . . . . . . . . . 3.5 mp -67.51 -14.01 62.56 Favored 'General case' 0 C--O 1.236 0.348 0 C-N-CA 125.056 1.343 . . . . 0.0 112.758 -179.574 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 79' ' ' ASP . . . . . . . . . . . . . 5.0 p-10 -60.23 -38.0 82.05 Favored 'General case' 0 CA--C 1.52 -0.196 0 CA-C-N 119.217 0.917 . . . . 0.0 111.531 176.355 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 80' ' ' ASN . . . . . . . . . . . . . 63.3 m-20 -77.26 -38.81 50.17 Favored 'General case' 0 N--CA 1.445 -0.675 0 CA-C-O 118.11 -0.948 . . . . 0.0 109.999 178.02 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 81' ' ' THR . . . . . . . . . . . . . 41.7 m -54.62 -52.76 61.22 Favored 'General case' 0 C--N 1.341 0.199 0 CA-C-N 118.983 0.81 . . . . 0.0 109.73 179.336 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 82' ' ' ILE . . . . . . . . . . . . . 9.6 tp -65.63 -36.89 78.69 Favored 'Isoleucine or valine' 0 CA--C 1.531 0.216 0 CA-C-N 118.842 0.746 . . . . 0.0 110.273 -175.182 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 83' ' ' SER . . . . . . . . . . . . . 10.8 t -58.11 -49.33 77.32 Favored 'General case' 0 C--O 1.234 0.269 0 CA-C-N 117.994 0.361 . . . . 0.0 110.897 174.819 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 84' ' ' GLU . . . . . . . . . . . . . 78.1 tt0 -78.18 -7.64 57.32 Favored 'General case' 0 C--N 1.327 -0.411 0 C-N-CA 126.593 1.957 . . . . 0.0 111.62 -175.557 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 85' ' ' MET . . . . . . . . . . . . . 81.5 mtp -90.28 -52.19 5.06 Favored 'General case' 0 CA--C 1.515 -0.371 0 CA-C-N 120.999 1.727 . . . . 0.0 110.373 167.243 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 86' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -66.47 -29.67 69.85 Favored 'General case' 0 N--CA 1.453 -0.293 0 CA-C-O 118.816 -0.612 . . . . 0.0 110.882 -169.387 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 87' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -58.84 -56.82 17.29 Favored 'General case' 0 N--CA 1.452 -0.357 0 CA-C-N 119.345 0.975 . . . . 0.0 112.405 -171.933 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 88' ' ' GLU . . . . . . . . . . . . . 81.1 mt-10 -73.39 -34.98 65.81 Favored 'General case' 0 C--N 1.331 -0.204 0 C-N-CA 123.137 0.575 . . . . 0.0 110.855 -175.327 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 89' ' ' GLY . . . . . . . . . . . . . . . 123.13 104.35 1.71 Allowed Glycine 0 C--N 1.333 0.365 0 N-CA-C 107.373 -2.291 . . . . 0.0 107.373 -176.108 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 90' ' ' ALA . . . . . . . . . . . . . . . -74.96 137.15 41.42 Favored 'General case' 0 N--CA 1.451 -0.424 0 N-CA-C 107.873 -1.158 . . . . 0.0 107.873 170.768 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 91' ' ' GLN . . . . . . . . . . . . . 17.9 mp0 -65.83 121.98 16.28 Favored 'General case' 0 N--CA 1.442 -0.844 0 N-CA-C 104.738 -2.319 . . . . 0.0 104.738 159.369 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 92' ' ' VAL . . . . . . . . . . . . . 25.2 t -107.33 119.91 57.76 Favored 'Isoleucine or valine' 0 N--CA 1.44 -0.968 0 N-CA-C 104.83 -2.285 . . . . 0.0 104.83 174.229 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 93' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -134.33 104.04 5.98 Favored 'General case' 0 N--CA 1.452 -0.338 0 N-CA-C 107.049 -1.463 . . . . 0.0 107.049 176.773 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 94' ' ' LEU . . . . . . . . . . . . . 27.1 tp -98.2 118.49 34.95 Favored 'General case' 0 CA--C 1.515 -0.39 0 N-CA-C 106.823 -1.547 . . . . 0.0 106.823 173.854 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 95' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -80.71 -165.4 0.88 Allowed 'General case' 0 C--N 1.323 -0.569 0 C-N-CA 124.429 1.091 . . . . 0.0 109.494 165.846 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 96' ' ' ALA . . . . . . . . . . . . . . . -47.74 -52.13 19.67 Favored 'General case' 0 CA--C 1.541 0.633 0 O-C-N 120.524 -1.36 . . . . 0.0 113.143 -179.887 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 97' ' ' ASN . . . . . . . . . . . . . 0.0 OUTLIER -135.26 8.52 3.43 Favored 'General case' 0 N--CA 1.478 0.961 0 N-CA-C 114.05 1.129 . . . . 0.0 114.05 -177.942 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 98' ' ' GLN . . . . . . . . . . . . . 18.4 tt0 -136.79 124.78 22.79 Favored 'General case' 0 N--CA 1.453 -0.294 0 O-C-N 121.233 -0.917 . . . . 0.0 109.371 -170.111 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 99' ' ' LEU . . . . . 0.461 HD22 ' CD2' ' A' ' 101' ' ' LEU . 1.0 OUTLIER -88.45 142.24 27.88 Favored 'General case' 0 N--CA 1.449 -0.515 0 C-N-CA 125.453 1.501 . . . . 0.0 109.229 175.521 . . . . . . . . 3 3 . 1 . 016 nuclear build full ' A' A ' 100' ' ' THR . . . . . . . . . . . . . 79.3 m -122.99 115.55 22.07 Favored 'General case' 0 C--N 1.322 -0.622 0 N-CA-C 105.436 -2.061 . . . . 0.0 105.436 171.685 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 101' ' ' LEU . . . . . 0.461 ' CD2' HD22 ' A' ' 99' ' ' LEU . 0.6 OUTLIER -112.93 101.35 9.41 Favored 'General case' 0 CA--C 1.51 -0.585 0 C-N-CA 126.109 1.764 . . . . 0.0 107.153 -179.05 . . . . . . . . 3 3 . 1 . 016 nuclear build full ' A' A ' 102' ' ' ALA . . . . . . . . . . . . . . . -117.69 152.49 35.12 Favored 'General case' 0 C--N 1.326 -0.444 0 C-N-CA 123.284 0.634 . . . . 0.0 109.59 -177.622 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 103' ' ' THR . . . . . . . . . . . . . 0.4 OUTLIER -159.09 176.12 12.66 Favored 'General case' 0 N--CA 1.44 -0.97 0 C-N-CA 126.481 1.912 . . . . 0.0 106.659 176.147 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 104' ' ' ALA . . . . . . . . . . . . . . . -62.58 -14.01 37.82 Favored 'General case' 0 CA--C 1.536 0.424 0 N-CA-C 113.338 0.866 . . . . 0.0 113.338 173.669 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 105' ' ' LYS . . . . . . . . . . . . . 12.6 tppt? -73.79 -75.76 0.14 Allowed 'General case' 0 N--CA 1.437 -1.084 0 C-N-CA 125.302 1.441 . . . . 0.0 107.461 176.154 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 106' ' ' GLN . . . . . . . . . . . . . 59.6 mt-30 -165.27 178.78 6.66 Favored 'General case' 0 CA--C 1.542 0.646 0 C-N-CA 128.605 2.762 . . . . 0.0 104.834 -169.213 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 107' ' ' THR . . . . . . . . . . . . . 4.6 t -131.42 141.85 49.92 Favored 'General case' 0 CA--C 1.539 0.547 0 C-N-CA 124.796 1.238 . . . . 0.0 110.237 -173.533 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 108' ' ' LEU . . . . . . . . . . . . . 8.9 mp -126.21 154.34 43.41 Favored 'General case' 0 C--O 1.234 0.265 0 C-N-CA 128.419 2.687 . . . . 0.0 108.596 -171.146 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 109' ' ' THR . . . . . . . . . . . . . 27.2 m -123.01 117.74 26.17 Favored 'General case' 0 N--CA 1.466 0.363 0 C-N-CA 123.409 0.684 . . . . 0.0 109.238 173.911 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 110' ' ' TYR . . . . . . . . . . . . . 73.9 m-85 -108.86 160.72 15.76 Favored 'General case' 0 CA--C 1.539 0.523 0 C-N-CA 123.461 0.704 . . . . 0.0 109.508 174.772 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 111' ' ' LYS . . . . . . . . . . . . . 2.1 tppt? -114.83 147.69 39.5 Favored 'General case' 0 N--CA 1.467 0.413 0 C-N-CA 124.603 1.161 . . . . 0.0 110.068 -178.944 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 112' ' ' LEU . . . . . . . . . . . . . 23.9 tp -73.43 38.33 0.09 Allowed 'General case' 0 CA--C 1.542 0.654 0 C-N-CA 127.379 2.272 . . . . 0.0 111.871 171.76 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 113' ' ' ALA . . . . . . . . . . . . . . . -77.05 88.06 3.56 Favored 'General case' 0 C--N 1.324 -0.535 0 O-C-N 119.234 -2.166 . . . . 0.0 109.453 -176.878 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 114' ' ' ASP . . . . . . . . . . . . 0.31 29.8 p-10 -105.3 55.99 0.69 Allowed 'General case' 0 N--CA 1.464 0.264 0 CA-C-O 123.712 1.72 . . . . 0.0 113.324 -173.134 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 115' ' ' LEU . . . . . 0.555 ' H ' HD23 ' A' ' 115' ' ' LEU . 0.1 OUTLIER -64.29 4.64 0.33 Allowed 'General case' 0 CA--C 1.54 0.571 0 C-N-CA 129.331 3.052 . . . . 0.0 114.726 174.175 . . . . . . . . 3 3 . 1 . 016 nuclear build full ' A' A ' 116' ' ' MET . . . . . . . . . . . . . 4.2 ppp? -78.6 -20.05 51.32 Favored 'General case' 0 C--N 1.325 -0.484 0 O-C-N 120.777 -1.202 . . . . 0.0 110.304 169.104 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 117' ' ' ASN . . . . . . . . . . . . . 3.9 p-10 . . . . . 0 N--CA 1.452 -0.348 0 N-CA-C 109.091 -0.707 . . . . 0.0 109.091 175.814 . . . . . . . . 0 0 . 1 . 017 nuclear build full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 24.6 tpp . . . . . 0 C--O 1.24 0.597 0 N-CA-C 108.895 -0.78 . . . . 0.0 108.895 . . . . . . . . . 0 0 . 1 . 017 nuclear build full ' A' A ' 2' ' ' VAL . . . . . . . . . . . . . 10.0 p -53.9 118.71 1.25 Allowed 'Isoleucine or valine' 0 N--CA 1.449 -0.485 0 C-N-CA 123.884 0.873 . . . . 0.0 109.128 -178.016 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 3' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -128.56 157.53 74.71 Favored Pre-proline 0 N--CA 1.449 -0.501 0 N-CA-C 109.287 -0.634 . . . . 0.0 109.287 -167.776 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 4' ' ' PRO . . . . . . . . . . . . . 21.7 Cg_endo -63.62 -48.45 5.66 Favored 'Trans proline' 0 N--CA 1.456 -0.691 0 C-N-CA 122.74 2.293 . . . . 0.0 111.787 -176.469 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 5' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER -68.17 -12.66 61.32 Favored 'General case' 0 C--N 1.325 -0.491 0 N-CA-C 113.722 1.008 . . . . 0.0 113.722 -173.007 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 6' ' ' GLN . . . . . . . . . . . . . 3.7 pt20 -93.85 15.21 17.18 Favored 'General case' 0 CA--C 1.54 0.566 0 N-CA-C 113.908 1.077 . . . . 0.0 113.908 167.442 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 7' ' ' LEU . . . . . . . . . . . . . 90.6 mt -129.88 -44.76 1.18 Allowed 'General case' 0 N--CA 1.469 0.508 0 C-N-CA 124.569 1.148 . . . . 0.0 111.949 -175.639 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 8' ' ' GLN . . . . . . . . . . . . . 1.5 mp0 -56.64 2.32 0.02 OUTLIER 'General case' 0 N--CA 1.472 0.671 0 N-CA-C 118.353 2.723 . . . . 0.0 118.353 -176.059 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 9' ' ' HIS . . . . . . . . . . . . . 5.7 m-70 -139.66 10.58 2.46 Favored 'General case' 0 C--N 1.319 -0.739 0 C-N-CA 127.946 2.498 . . . . 0.0 112.516 179.95 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 10' ' ' HIS . . . . . . . . . . . . . 33.3 m80 -133.25 110.54 10.17 Favored 'General case' 0 N--CA 1.455 -0.214 0 C-N-CA 124.153 0.981 . . . . 0.0 108.687 -161.462 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 11' ' ' ARG . . . . . 0.442 ' HD3' ' H ' ' A' ' 115' ' ' LEU . 20.7 ttt-85 -68.74 147.11 52.28 Favored 'General case' 0 N--CA 1.465 0.315 0 N-CA-C 108.444 -0.947 . . . . 0.0 108.444 172.915 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 12' ' ' PHE . . . . . . . . . . . . . 46.5 m-85 -127.83 161.07 29.87 Favored 'General case' 0 N--CA 1.45 -0.448 0 N-CA-C 107.648 -1.242 . . . . 0.0 107.648 165.502 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 13' ' ' VAL . . . . . 0.425 ' HA ' ' HA ' ' A' ' 30' ' ' GLU . 7.5 p -131.44 143.17 41.33 Favored 'Isoleucine or valine' 0 CA--C 1.512 -0.484 0 N-CA-C 108.188 -1.041 . . . . 0.0 108.188 172.045 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 14' ' ' LEU . . . . . . . . . . . . . 5.6 tt -70.04 110.19 4.96 Favored 'General case' 0 N--CA 1.441 -0.903 0 N-CA-C 107.874 -1.158 . . . . 0.0 107.874 179.977 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 15' ' ' GLU . . . . . 0.432 ' H ' ' HA ' ' A' ' 110' ' ' TYR . 3.1 tt0 -86.0 -42.05 14.33 Favored 'General case' 0 N--CA 1.438 -1.043 0 O-C-N 124.013 0.821 . . . . 0.0 110.217 -169.371 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 12.6 p -154.33 142.81 20.66 Favored 'General case' 0 N--CA 1.448 -0.555 0 CA-C-O 121.735 0.779 . . . . 0.0 109.834 168.369 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 17' ' ' VAL . . . . . 0.574 HG12 ' H ' ' A' ' 18' ' ' ASN . 23.2 t -75.62 175.08 0.76 Allowed 'Isoleucine or valine' 0 CA--C 1.536 0.409 0 N-CA-C 107.028 -1.471 . . . . 0.0 107.028 168.401 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 18' ' ' ASN . . . . . 0.574 ' H ' HG12 ' A' ' 17' ' ' VAL . 10.6 t30 -43.9 -51.6 7.44 Favored 'General case' 0 C--N 1.34 0.194 0 C-N-CA 124.533 1.133 . . . . 0.0 112.628 -171.554 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . -78.29 -66.21 1.77 Allowed Glycine 0 N--CA 1.444 -0.812 0 O-C-N 123.725 0.641 . . . . 0.0 111.609 176.28 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 0.8 OUTLIER -139.68 165.75 29.06 Favored Pre-proline 0 CA--C 1.532 0.259 0 CA-C-N 117.752 0.776 . . . . 0.0 112.917 -159.126 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 21' ' ' PRO . . . . . . . . . . . . . 56.5 Cg_endo -61.46 -176.9 0.19 Allowed 'Trans proline' 0 N--CA 1.457 -0.654 0 C-N-CA 124.094 3.196 . . . . 0.0 113.185 176.627 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 22' ' ' VAL . . . . . . . . . . . . . 81.6 t -120.86 155.36 24.36 Favored 'Isoleucine or valine' 0 N--CA 1.448 -0.544 0 C-N-CA 126.576 1.95 . . . . 0.0 109.208 -179.227 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 23' ' ' THR . . . . . . . . . . . . . 11.3 t -141.17 114.36 8.63 Favored 'General case' 0 C--O 1.235 0.292 0 CA-C-O 123.259 1.504 . . . . 0.0 111.844 168.169 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 24' ' ' SER . . . . . . . . . . . . . 39.1 t -158.18 94.91 1.33 Allowed 'General case' 0 C--N 1.319 -0.74 0 N-CA-C 105.017 -2.216 . . . . 0.0 105.017 172.433 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 25' ' ' ASP . . . . . . . . . . . . . 0.7 OUTLIER -80.06 38.97 0.42 Allowed 'General case' 0 N--CA 1.468 0.451 0 C-N-CA 125.467 1.507 . . . . 0.0 110.552 -176.297 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 26' ' ' LYS . . . . . . . . . . . . . 33.0 ttpt -151.28 -46.73 0.11 Allowed 'General case' 0 CA--C 1.508 -0.654 0 O-C-N 120.268 -1.52 . . . . 0.0 112.083 178.181 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 27' ' ' ASN . . . . . . . . . . . . . 0.0 OUTLIER -150.79 83.27 5.8 Favored Pre-proline 0 C--N 1.319 -0.739 0 N-CA-C 106.708 -1.59 . . . . 0.0 106.708 176.644 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 28' ' ' PRO . . . . . . . . . . . . . 75.2 Cg_endo -71.19 170.74 17.48 Favored 'Trans proline' 0 N--CA 1.454 -0.83 0 C-N-CA 122.171 1.914 . . . . 0.0 109.257 167.561 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 29' ' ' PRO . . . . . . . . . . . . . 37.6 Cg_endo -70.85 63.91 2.43 Favored 'Trans proline' 0 N--CA 1.457 -0.656 0 C-N-CA 124.065 3.177 . . . . 0.0 111.063 173.469 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 30' ' ' GLU . . . . . 0.425 ' HA ' ' HA ' ' A' ' 13' ' ' VAL . 2.4 pt-20 -78.66 168.82 19.2 Favored 'General case' 0 C--O 1.239 0.505 0 O-C-N 120.09 -1.631 . . . . 0.0 109.2 172.608 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 31' ' ' ILE . . . . . . . . . . . . . 14.4 tt -144.16 152.68 15.62 Favored 'Isoleucine or valine' 0 C--O 1.237 0.434 0 N-CA-C 107.641 -1.244 . . . . 0.0 107.641 -177.202 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 32' ' ' SER . . . . . . . . . . . . . 41.1 p -147.09 165.89 28.55 Favored 'General case' 0 N--CA 1.444 -0.747 0 CA-C-O 121.666 0.746 . . . . 0.0 109.372 178.154 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 33' ' ' PHE . . . . . . . . . . . . . 78.5 m-85 -146.13 125.67 13.27 Favored 'General case' 0 N--CA 1.445 -0.713 0 N-CA-C 105.623 -1.992 . . . . 0.0 105.623 -168.373 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 34' ' ' GLY . . . . . . . . . . . . . . . -156.19 167.13 33.31 Favored Glycine 0 CA--C 1.53 1.02 0 N-CA-C 109.631 -1.387 . . . . 0.0 109.631 160.729 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 35' ' ' GLU . . . . . . . . . . . . . 4.6 mt-10 56.54 89.63 0.04 OUTLIER 'General case' 0 N--CA 1.468 0.438 0 C-N-CA 126.945 2.098 . . . . 0.0 113.869 168.641 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 44.3 mtmt 74.14 32.35 1.03 Allowed 'General case' 0 N--CA 1.474 0.769 0 C-N-CA 127.472 2.309 . . . . 0.0 113.204 176.097 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 37' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER 59.03 33.86 23.21 Favored 'General case' 0 CA--C 1.54 0.585 0 C-N-CA 123.791 0.836 . . . . 0.0 110.21 -176.931 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 38' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -67.5 171.38 6.22 Favored 'General case' 0 N--CA 1.453 -0.278 0 O-C-N 120.902 -1.124 . . . . 0.0 111.115 170.535 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 39' ' ' ILE . . . . . . . . . . . . . 27.6 mt -137.33 109.34 6.72 Favored 'Isoleucine or valine' 0 C--O 1.235 0.325 0 N-CA-C 108.061 -1.089 . . . . 0.0 108.061 -176.452 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 40' ' ' SER . . . . . . . . . . . . . 34.7 m -90.1 137.93 31.94 Favored 'General case' 0 C--N 1.33 -0.246 0 C-N-CA 123.601 0.76 . . . . 0.0 109.027 158.642 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 41' ' ' GLY . . . . . . . . . . . . . . . -160.6 -179.33 35.29 Favored Glycine 0 CA--C 1.525 0.668 0 N-CA-C 110.254 -1.139 . . . . 0.0 110.254 165.257 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 42' ' ' SER . . . . . 0.508 ' HB3' ' HA ' ' A' ' 46' ' ' ARG . 1.8 p -160.34 92.78 1.0 Allowed 'General case' 0 N--CA 1.454 -0.24 0 CA-C-N 118.841 1.32 . . . . 0.0 111.254 174.439 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 43' ' ' MET . . . . . . . . . . . . . 9.2 mmt -64.73 -66.94 0.48 Allowed 'General case' 0 C--O 1.232 0.149 0 N-CA-C 109.498 -0.556 . . . . 0.0 109.498 175.316 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 44' ' ' CYS . . . . . 1.283 ' SG ' ' SG ' ' A' ' 70' ' ' CYS . 44.8 t -132.72 -59.83 0.89 Allowed 'General case' 0 N--CA 1.452 -0.358 0 N-CA-C 106.426 -1.694 . . . . 0.0 106.426 168.449 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 45' ' ' ASN . . . . . . . . . . . . . 4.8 m120 -80.34 27.56 0.34 Allowed 'General case' 0 C--N 1.328 -0.329 0 C-N-CA 128.665 2.786 . . . . 0.0 112.064 -165.453 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 46' ' ' ARG . . . . . 0.508 ' HA ' ' HB3' ' A' ' 42' ' ' SER . 0.0 OUTLIER 52.55 -166.19 0.06 Allowed 'General case' 0 C--N 1.327 -0.41 0 C-N-CA 124.769 1.228 . . . . 0.0 108.021 -157.275 . . . . . . . . 3 3 . 1 . 017 nuclear build full ' A' A ' 47' ' ' PHE . . . . . 0.481 ' HA ' ' HB3' ' A' ' 65' ' ' MET . 6.3 p90 -178.42 170.43 1.69 Allowed 'General case' 0 C--O 1.237 0.446 0 C-N-CA 129.19 2.996 . . . . 0.0 107.984 147.616 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 48' ' ' SER . . . . . . . . . . . . . 1.5 p -166.1 160.63 16.53 Favored 'General case' 0 C--N 1.322 -0.6 0 C-N-CA 126.192 1.797 . . . . 0.0 108.751 178.153 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 49' ' ' GLY . . . . . . . . . . . . . . . 177.83 163.1 28.98 Favored Glycine 0 C--N 1.332 0.337 0 N-CA-C 110.721 -0.951 . . . . 0.0 110.721 163.16 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 50' ' ' GLU . . . . . . . . . . . . . 11.1 pt-20 -68.52 100.31 1.09 Allowed 'General case' 0 N--CA 1.449 -0.493 0 CA-C-O 122.048 0.928 . . . . 0.0 108.721 173.525 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 51' ' ' GLY . . . . . . . . . . . . . . . -77.04 171.88 55.14 Favored Glycine 0 CA--C 1.529 0.945 0 C-N-CA 124.224 0.916 . . . . 0.0 111.912 171.421 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 52' ' ' LYS . . . . . . . . . . . . . 6.2 ttpm? -156.9 148.62 22.57 Favored 'General case' 0 N--CA 1.464 0.247 0 C-N-CA 124.916 1.287 . . . . 0.0 108.066 166.444 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 53' ' ' LEU . . . . . . . . . . . . . 50.7 tp -148.37 142.65 26.18 Favored 'General case' 0 C--N 1.338 0.069 0 C-N-CA 124.512 1.125 . . . . 0.0 109.141 174.655 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 23.1 t -156.21 -61.88 0.1 Allowed 'General case' 0 CA--C 1.535 0.393 0 C-N-CA 125.389 1.475 . . . . 0.0 107.792 173.599 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 55' ' ' ASN . . . . . . . . . . . . . 20.7 p-10 -65.46 -58.67 5.25 Favored 'General case' 0 N--CA 1.464 0.265 0 C-N-CA 125.711 1.604 . . . . 0.0 113.016 177.818 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 56' ' ' GLY . . . . . . . . . . . . . . . 150.96 14.16 0.08 OUTLIER Glycine 0 CA--C 1.529 0.944 0 C-N-CA 123.489 0.566 . . . . 0.0 111.911 -163.573 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 57' ' ' GLU . . . . . . . . . . . . . 26.8 tt0 -131.96 115.84 16.37 Favored 'General case' 0 CA--C 1.533 0.29 0 CA-C-N 118.185 0.992 . . . . 0.0 109.146 -175.654 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 58' ' ' LEU . . . . . . . . . . . . . 37.8 tp -93.13 102.4 14.71 Favored 'General case' 0 C--O 1.236 0.366 0 C-N-CA 127.291 2.237 . . . . 0.0 110.159 -177.503 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 59' ' ' THR . . . . . . . . . . . . . 18.2 p -94.68 163.59 13.31 Favored 'General case' 0 CA--C 1.533 0.313 0 C-N-CA 122.945 0.498 . . . . 0.0 110.036 168.122 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 60' ' ' ALA . . . . . . . . . . . . . . . -147.24 103.48 3.58 Favored 'General case' 0 C--N 1.342 0.273 0 C-N-CA 123.673 0.789 . . . . 0.0 111.218 155.465 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 61' ' ' LYS . . . . . . . . . . . . . 73.6 tttt -86.47 77.62 9.4 Favored 'General case' 0 N--CA 1.463 0.18 0 C-N-CA 124.496 1.118 . . . . 0.0 109.48 178.201 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 62' ' ' GLY . . . . . . . . . . . . . . . 148.01 80.44 0.03 OUTLIER Glycine 0 N--CA 1.464 0.526 0 N-CA-C 110.161 -1.176 . . . . 0.0 110.161 175.14 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 63' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -117.47 83.22 1.95 Allowed 'General case' 0 N--CA 1.439 -0.98 0 C-N-CA 124.294 1.038 . . . . 0.0 110.065 -159.609 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 64' ' ' ALA . . . . . . . . . . . . . . . -77.68 96.17 4.79 Favored 'General case' 0 C--O 1.244 0.777 0 C-N-CA 126.034 1.733 . . . . 0.0 112.134 179.756 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 65' ' ' MET . . . . . 0.481 ' HB3' ' HA ' ' A' ' 47' ' ' PHE 0.259 6.5 ptm -124.61 172.3 9.35 Favored 'General case' 0 CA--C 1.531 0.235 0 C-N-CA 123.706 0.803 . . . . 0.0 109.787 170.611 . . . . . . . . 3 3 . 1 . 017 nuclear build full ' A' A ' 66' ' ' THR . . . . . . . . . . . . . 15.8 p -104.85 -165.09 1.1 Allowed 'General case' 0 C--N 1.326 -0.455 0 C-N-CA 124.371 1.068 . . . . 0.0 109.503 -162.25 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 67' ' ' ARG . . . . . . . . . . . . . 0.5 OUTLIER -133.5 26.03 4.09 Favored 'General case' 0 C--O 1.237 0.404 0 C-N-CA 125.416 1.486 . . . . 0.0 112.075 -178.181 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 68' ' ' MET . . . . . . . . . . . . . 18.2 ptm -73.26 -169.68 0.67 Allowed 'General case' 0 CA--C 1.536 0.436 0 C-N-CA 125.321 1.448 . . . . 0.0 110.467 172.693 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 69' ' ' MET . . . . . . . . . . . . . 0.8 OUTLIER -142.6 -179.16 6.14 Favored 'General case' 0 C--O 1.238 0.49 0 C-N-CA 127.157 2.183 . . . . 0.0 109.03 -179.715 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 70' ' ' CYS . . . . . 1.283 ' SG ' ' SG ' ' A' ' 44' ' ' CYS . 70.0 m -149.21 163.71 36.86 Favored 'General case' 0 N--CA 1.455 -0.194 0 C-N-CA 124.417 1.087 . . . . 0.0 111.157 -176.581 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 71' ' ' ALA . . . . . . . . . . . . . . . -69.65 11.9 0.23 Allowed 'General case' 0 CA--C 1.54 0.592 0 C-N-CA 126.377 1.871 . . . . 0.0 113.874 178.214 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 72' ' ' ASN . . . . . . . . . . . . . 13.7 t30 -147.3 143.72 18.53 Favored Pre-proline 0 C--O 1.235 0.305 0 O-C-N 120.667 -1.27 . . . . 0.0 108.598 179.991 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 73' ' ' PRO . . . . . . . . . . . . . 68.1 Cg_endo -75.63 -25.42 10.92 Favored 'Trans proline' 0 N--CA 1.459 -0.556 0 C-N-CA 122.055 1.837 . . . . 0.0 111.601 179.919 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 74' ' ' GLN . . . . . . . . . . . . . 54.1 tt0 -70.13 -48.53 57.1 Favored 'General case' 0 N--CA 1.451 -0.385 0 C-N-CA 124.129 0.971 . . . . 0.0 109.606 -179.341 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 75' ' ' LEU . . . . . . . . . . . . . 41.5 mt -54.71 -45.15 73.97 Favored 'General case' 0 N--CA 1.471 0.612 0 CA-C-N 118.873 0.761 . . . . 0.0 109.149 174.528 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 76' ' ' ASN . . . . . . . . . . . . . 15.0 t-20 -61.07 -39.62 90.58 Favored 'General case' 0 CA--C 1.535 0.366 0 C-N-CA 124.236 1.015 . . . . 0.0 111.166 -175.787 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 77' ' ' GLU . . . . . . . . . . . . . 5.8 tm-20 -81.45 -30.8 33.33 Favored 'General case' 0 N--CA 1.455 -0.221 0 C-N-CA 125.721 1.608 . . . . 0.0 113.349 -177.889 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 78' ' ' LEU . . . . . . . . . . . . . 9.2 mt -61.12 -25.92 67.32 Favored 'General case' 0 N--CA 1.466 0.341 0 C-N-CA 123.231 0.612 . . . . 0.0 112.393 -179.796 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 79' ' ' ASP . . . . . . . . . . . . . 4.2 t70 -47.64 -49.56 26.94 Favored 'General case' 0 CA--C 1.517 -0.295 0 C-N-CA 125.912 1.685 . . . . 0.0 111.416 165.632 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 80' ' ' ASN . . . . . . . . . . . . . 2.7 m120 -74.34 -36.55 63.65 Favored 'General case' 0 N--CA 1.448 -0.568 0 CA-C-O 118.364 -0.827 . . . . 0.0 109.714 -175.234 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 81' ' ' THR . . . . . . . . . . . . . 89.9 m -54.11 -63.06 1.27 Allowed 'General case' 0 C--N 1.344 0.357 0 N-CA-C 108.054 -1.091 . . . . 0.0 108.054 172.152 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 82' ' ' ILE . . . . . 0.4 HD12 ' SD ' ' A' ' 85' ' ' MET . 10.9 tp -65.76 -39.05 83.7 Favored 'Isoleucine or valine' 0 N--CA 1.449 -0.506 0 CA-C-O 118.97 -0.538 . . . . 0.0 110.433 -165.643 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 83' ' ' SER . . . . . . . . . . . . . 8.6 t -61.55 -49.37 76.95 Favored 'General case' 0 N--CA 1.447 -0.592 0 N-CA-C 109.312 -0.625 . . . . 0.0 109.312 -177.842 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 84' ' ' GLU . . . . . . . . . . . . . 3.6 tp10 -67.55 -22.38 65.41 Favored 'General case' 0 CA--C 1.537 0.455 0 C-N-CA 123.738 0.815 . . . . 0.0 111.856 179.813 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 85' ' ' MET . . . . . 0.449 ' HA ' HG21 ' A' ' 103' ' ' THR . 7.1 ptm -87.6 -41.3 13.53 Favored 'General case' 0 CA--C 1.515 -0.388 0 N-CA-C 106.236 -1.765 . . . . 0.0 106.236 -171.691 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 86' ' ' LEU . . . . . . . . . . . . . 2.3 mm? -67.56 -25.57 65.86 Favored 'General case' 0 N--CA 1.439 -1.011 0 C-N-CA 119.272 -0.971 . . . . 0.0 111.926 -173.043 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 87' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -64.87 -53.95 38.62 Favored 'General case' 0 N--CA 1.448 -0.56 0 CA-C-O 118.799 -0.62 . . . . 0.0 110.785 -175.09 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 88' ' ' GLU . . . . . . . . . . . . . 12.4 pt-20 -71.49 -41.76 68.91 Favored 'General case' 0 C--O 1.234 0.255 0 CA-C-O 118.876 -0.583 . . . . 0.0 112.41 -176.092 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 89' ' ' GLY . . . . . . . . . . . . . . . 126.53 93.96 0.89 Allowed Glycine 0 C--N 1.334 0.457 0 N-CA-C 108.879 -1.689 . . . . 0.0 108.879 -173.405 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 90' ' ' ALA . . . . . . . . . . . . . . . -69.4 136.79 52.14 Favored 'General case' 0 N--CA 1.447 -0.612 0 N-CA-C 108.818 -0.808 . . . . 0.0 108.818 176.805 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 91' ' ' GLN . . . . . . . . . . . . . 29.0 mm-40 -74.89 92.71 2.57 Favored 'General case' 0 N--CA 1.446 -0.64 0 N-CA-C 105.011 -2.218 . . . . 0.0 105.011 177.974 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 92' ' ' VAL . . . . . . . . . . . . . 7.5 p -86.67 132.13 33.08 Favored 'Isoleucine or valine' 0 N--CA 1.443 -0.78 0 N-CA-C 106.007 -1.849 . . . . 0.0 106.007 179.955 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 93' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -137.61 152.43 49.35 Favored 'General case' 0 C--N 1.323 -0.559 0 N-CA-C 106.489 -1.671 . . . . 0.0 106.489 167.334 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 94' ' ' LEU . . . . . . . . . . . . . 54.1 tp -132.69 100.51 4.96 Favored 'General case' 0 CA--C 1.514 -0.429 0 CA-C-O 121.7 0.762 . . . . 0.0 108.968 -179.463 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 95' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -64.18 169.47 4.47 Favored 'General case' 0 C--N 1.323 -0.547 0 CA-C-N 113.718 -1.583 . . . . 0.0 109.831 164.099 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 96' ' ' ALA . . . . . . . . . . . . . . . -44.67 -24.54 0.2 Allowed 'General case' 0 N--CA 1.469 0.499 0 C-N-CA 127.952 2.501 . . . . 0.0 116.95 -170.93 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 97' ' ' ASN . . . . . . . . . . . . . 0.0 OUTLIER -155.39 6.71 0.24 Allowed 'General case' 0 CA--C 1.542 0.653 0 C-N-CA 126.551 1.94 . . . . 0.0 111.09 170.299 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 98' ' ' GLN . . . . . . . . . . . . . 25.7 tt0 -127.69 110.44 12.66 Favored 'General case' 0 N--CA 1.469 0.498 0 C-N-CA 125.383 1.473 . . . . 0.0 110.643 -170.382 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 99' ' ' LEU . . . . . 0.548 ' HB3' ' HB2' ' A' ' 110' ' ' TYR . 11.1 tp -75.01 143.72 43.44 Favored 'General case' 0 C--N 1.321 -0.667 0 C-N-CA 127.573 2.349 . . . . 0.0 108.037 173.606 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 100' ' ' THR . . . . . . . . . . . . . 4.6 m -132.81 118.91 19.58 Favored 'General case' 0 C--N 1.327 -0.378 0 N-CA-C 106.669 -1.604 . . . . 0.0 106.669 175.342 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 101' ' ' LEU . . . . . . . . . . . . . 2.7 mm? -115.59 111.08 20.14 Favored 'General case' 0 CA--C 1.513 -0.459 0 N-CA-C 106.099 -1.815 . . . . 0.0 106.099 174.521 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 102' ' ' ALA . . . . . . . . . . . . . . . -106.15 158.08 17.09 Favored 'General case' 0 C--N 1.326 -0.421 0 N-CA-C 108.331 -0.989 . . . . 0.0 108.331 162.775 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 103' ' ' THR . . . . . 0.449 HG21 ' HA ' ' A' ' 85' ' ' MET . 1.8 m -157.09 -179.28 8.05 Favored 'General case' 0 N--CA 1.436 -1.163 0 N-CA-C 105.596 -2.002 . . . . 0.0 105.596 171.853 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 104' ' ' ALA . . . . . . . . . . . . . . . -50.6 -39.01 48.8 Favored 'General case' 0 N--CA 1.451 -0.394 0 C-N-CA 122.683 0.393 . . . . 0.0 111.379 172.14 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 105' ' ' LYS . . . . . . . . . . . . . 4.5 tmtt? -61.69 -67.19 0.43 Allowed 'General case' 0 CA--C 1.532 0.279 0 N-CA-C 114.56 1.318 . . . . 0.0 114.56 -177.67 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 106' ' ' GLN . . . . . . . . . . . . . 3.0 pt20 -167.01 -173.45 2.35 Favored 'General case' 0 C--O 1.238 0.474 0 C-N-CA 126.477 1.911 . . . . 0.0 107.997 -178.993 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 107' ' ' THR . . . . . . . . . . . . . 14.8 t -118.47 140.26 50.15 Favored 'General case' 0 CA--C 1.534 0.345 0 C-N-CA 123.314 0.645 . . . . 0.0 109.869 174.008 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 108' ' ' LEU . . . . . . . . . . . . . 53.5 mt -125.11 138.15 54.17 Favored 'General case' 0 C--O 1.236 0.348 0 C-N-CA 127.726 2.41 . . . . 0.0 106.521 -178.513 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 109' ' ' THR . . . . . . . . . . . . . 31.5 m -112.38 144.96 40.94 Favored 'General case' 0 C--O 1.235 0.3 0 N-CA-C 107.793 -1.188 . . . . 0.0 107.793 179.992 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 110' ' ' TYR . . . . . 0.548 ' HB2' ' HB3' ' A' ' 99' ' ' LEU . 34.4 m-85 -130.5 172.77 11.54 Favored 'General case' 0 C--O 1.233 0.209 0 C-N-CA 123.987 0.915 . . . . 0.0 111.158 -178.918 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 111' ' ' LYS . . . . . . . . . . . . . 8.8 tppt? -125.79 143.87 50.88 Favored 'General case' 0 CA--C 1.514 -0.414 0 C-N-CA 124.885 1.274 . . . . 0.0 109.679 173.202 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 112' ' ' LEU . . . . . . . . . . . . . 43.7 tp -74.07 51.91 0.43 Allowed 'General case' 0 CA--C 1.539 0.535 0 C-N-CA 125.999 1.72 . . . . 0.0 108.93 165.159 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 113' ' ' ALA . . . . . . . . . . . . . . . -85.32 91.27 8.13 Favored 'General case' 0 N--CA 1.451 -0.406 0 O-C-N 119.84 -1.788 . . . . 0.0 106.421 170.238 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 114' ' ' ASP . . . . . . . . . . . . . 43.5 t0 -94.25 75.67 3.98 Favored 'General case' 0 CA--C 1.513 -0.457 0 CA-C-O 123.664 1.697 . . . . 0.0 109.243 -178.59 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 115' ' ' LEU . . . . . 0.442 ' H ' ' HD3' ' A' ' 11' ' ' ARG . 30.4 mt -94.85 26.44 3.58 Favored 'General case' 0 C--N 1.323 -0.582 0 CA-C-N 112.871 -1.968 . . . . 0.0 109.453 -174.297 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 116' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -56.18 132.65 51.06 Favored 'General case' 0 N--CA 1.454 -0.27 0 CA-C-O 121.056 0.455 . . . . 0.0 110.143 176.698 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 117' ' ' ASN . . . . . . . . . . . . . 18.4 p30 . . . . . 0 C--O 1.238 0.488 0 C-N-CA 124.805 1.242 . . . . 0.0 110.437 167.401 . . . . . . . . 0 0 . 1 . 018 nuclear build full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 29.5 ttm . . . . . 0 N--CA 1.452 -0.355 0 CA-C-O 121.157 0.503 . . . . 0.0 109.877 . . . . . . . . . 0 0 . 1 . 018 nuclear build full ' A' A ' 2' ' ' VAL . . . . . . . . . . . . . 7.7 p -50.18 151.73 0.6 Allowed 'Isoleucine or valine' 0 CA--C 1.536 0.419 0 C-N-CA 127.377 2.271 . . . . 0.0 111.838 173.238 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 3' ' ' THR . . . . . . . . . . . . . 20.6 p -134.95 165.05 39.62 Favored Pre-proline 0 CA--C 1.533 0.316 0 C-N-CA 123.382 0.673 . . . . 0.0 110.581 177.468 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 4' ' ' PRO . . . . . . . . . . . . . 9.7 Cg_endo -58.28 -36.33 97.81 Favored 'Trans proline' 0 C--O 1.235 0.343 0 C-N-CA 122.999 2.466 . . . . 0.0 113.452 175.828 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 5' ' ' GLU . . . . . . . . . . . . . 0.2 OUTLIER -61.18 -44.29 97.53 Favored 'General case' 0 CA--C 1.538 0.505 0 C-N-CA 124.198 0.999 . . . . 0.0 111.765 -174.947 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 6' ' ' GLN . . . . . . . . . . . . . 14.9 pt20 -75.14 18.94 0.17 Allowed 'General case' 0 CA--C 1.542 0.642 0 C-N-CA 125.306 1.442 . . . . 0.0 112.573 177.279 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 7' ' ' LEU . . . . . . . . . . . . . 81.4 mt -136.71 -51.35 0.68 Allowed 'General case' 0 N--CA 1.469 0.485 0 CA-C-N 119.843 1.202 . . . . 0.0 113.073 -174.12 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 8' ' ' GLN . . . . . . . . . . . . . 0.2 OUTLIER -44.04 -28.75 0.51 Allowed 'General case' 0 N--CA 1.473 0.679 0 N-CA-C 115.712 1.745 . . . . 0.0 115.712 -176.16 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 9' ' ' HIS . . . . . . . . . . . . . 79.5 m-70 -131.43 32.27 4.22 Favored 'General case' 0 C--O 1.238 0.489 0 C-N-CA 123.392 0.677 . . . . 0.0 111.82 -173.562 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 10' ' ' HIS . . . . . . . . . . . . . 98.4 m-70 -129.34 113.67 15.25 Favored 'General case' 0 N--CA 1.452 -0.339 0 C-N-CA 124.995 1.318 . . . . 0.0 109.634 176.537 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 11' ' ' ARG . . . . . . . . . . . . . 17.0 ttt180 -69.64 150.09 47.4 Favored 'General case' 0 C--O 1.233 0.214 0 N-CA-C 108.678 -0.86 . . . . 0.0 108.678 166.511 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 12' ' ' PHE . . . . . . . . . . . . . 99.0 m-85 -138.89 157.98 45.05 Favored 'General case' 0 CA--C 1.503 -0.84 0 CA-C-O 123.994 1.854 . . . . 0.0 108.655 171.018 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 13' ' ' VAL . . . . . 0.405 ' HA ' ' HA ' ' A' ' 30' ' ' GLU . 0.0 OUTLIER -126.7 131.36 71.24 Favored 'Isoleucine or valine' 0 C--N 1.311 -1.103 0 CA-C-N 113.008 -1.906 . . . . 0.0 106.09 -176.358 . . . . . . . . 3 3 . 1 . 018 nuclear build full ' A' A ' 14' ' ' LEU . . . . . . . . . . . . . 26.5 tp -65.64 102.61 0.75 Allowed 'General case' 0 CA--C 1.515 -0.375 0 N-CA-C 107.629 -1.248 . . . . 0.0 107.629 175.963 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -86.2 -52.87 5.38 Favored 'General case' 0 N--CA 1.443 -0.822 0 N-CA-C 107.652 -1.24 . . . . 0.0 107.652 -172.188 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -138.15 123.95 19.95 Favored 'General case' 0 C--O 1.235 0.33 0 CA-C-O 121.573 0.701 . . . . 0.0 110.248 -173.9 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 17' ' ' VAL . . . . . . . . . . . . . 11.3 t -75.86 170.52 1.47 Allowed 'Isoleucine or valine' 0 C--O 1.237 0.437 0 N-CA-C 107.621 -1.252 . . . . 0.0 107.621 172.847 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 18' ' ' ASN . . . . . . . . . . . . . 0.3 OUTLIER -58.17 -20.57 42.0 Favored 'General case' 0 CA--C 1.536 0.424 0 CA-C-O 117.873 -1.06 . . . . 0.0 112.896 168.475 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . -106.85 -64.53 0.61 Allowed Glycine 0 C--N 1.341 0.856 0 C-N-CA 125.491 1.52 . . . . 0.0 111.887 -174.896 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 25.1 mmtm -136.04 164.45 43.04 Favored Pre-proline 0 N--CA 1.469 0.495 0 CA-C-N 118.814 1.307 . . . . 0.0 110.55 -176.86 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 21' ' ' PRO . . . . . . . . . . . . . 57.2 Cg_endo -66.4 153.38 78.25 Favored 'Trans proline' 0 CA--C 1.537 0.659 0 N-CA-C 108.605 -1.344 . . . . 0.0 108.605 159.632 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 22' ' ' VAL . . . . . . . . . . . . . 11.7 t -89.51 158.4 2.96 Favored 'Isoleucine or valine' 0 C--O 1.24 0.601 0 N-CA-C 108.961 -0.755 . . . . 0.0 108.961 176.563 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 23' ' ' THR . . . . . . . . . . . . . 3.1 m -130.7 124.38 31.4 Favored 'General case' 0 CA--C 1.532 0.259 0 C-N-CA 125.143 1.377 . . . . 0.0 107.954 178.453 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 24' ' ' SER . . . . . . . . . . . . . 5.4 m -153.6 136.08 15.07 Favored 'General case' 0 N--CA 1.452 -0.331 0 C-N-CA 127.46 2.304 . . . . 0.0 106.921 -167.595 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 25' ' ' ASP . . . . . . . . . . . . . 2.9 t70 -47.95 -84.06 0.01 OUTLIER 'General case' 0 N--CA 1.472 0.634 0 C-N-CA 127.281 2.232 . . . . 0.0 110.266 -179.752 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 26' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -135.62 -1.36 2.53 Favored 'General case' 0 CA--C 1.531 0.214 0 C-N-CA 125.484 1.514 . . . . 0.0 112.753 173.923 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 27' ' ' ASN . . . . . . . . . . . . . 60.6 m-80 -115.62 81.25 8.92 Favored Pre-proline 0 CA--C 1.532 0.286 0 C-N-CA 126.092 1.757 . . . . 0.0 107.426 -179.038 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 28' ' ' PRO . . . . . . . . . . . . . 19.0 Cg_endo -68.76 169.09 18.36 Favored 'Trans proline' 0 CA--C 1.534 0.506 0 C-N-CA 123.067 2.511 . . . . 0.0 113.659 177.093 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 29' ' ' PRO . . . . . . . . . . . . . 13.6 Cg_endo -62.43 109.91 0.96 Allowed 'Trans proline' 0 N--CA 1.449 -1.131 0 N-CA-C 107.226 -1.875 . . . . 0.0 107.226 145.763 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 30' ' ' GLU . . . . . 0.405 ' HA ' ' HA ' ' A' ' 13' ' ' VAL . 10.4 pt-20 -130.21 165.04 23.2 Favored 'General case' 0 C--N 1.318 -0.767 0 C-N-CA 127.996 2.519 . . . . 0.0 106.046 175.847 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 31' ' ' ILE . . . . . . . . . . . . . 20.3 tt -145.47 146.13 19.88 Favored 'Isoleucine or valine' 0 N--CA 1.447 -0.609 0 C-N-CA 125.556 1.542 . . . . 0.0 107.189 -177.401 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 32' ' ' SER . . . . . . . . . . . . . 27.5 p -133.07 172.85 12.09 Favored 'General case' 0 N--CA 1.441 -0.905 0 C-N-CA 126.022 1.729 . . . . 0.0 107.373 168.223 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 33' ' ' PHE . . . . . . . . . . . . . 98.8 m-85 -137.13 -173.22 3.4 Favored 'General case' 0 N--CA 1.448 -0.535 0 N-CA-C 107.919 -1.141 . . . . 0.0 107.919 -174.663 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 34' ' ' GLY . . . . . . . . . . . . . . . 176.42 -160.43 28.05 Favored Glycine 0 N--CA 1.451 -0.333 0 N-CA-C 109.385 -1.486 . . . . 0.0 109.385 170.545 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 35' ' ' GLU . . . . . . . . . . . . . 1.9 tt0 -52.95 154.25 2.98 Favored 'General case' 0 N--CA 1.448 -0.56 0 C-N-CA 125.016 1.326 . . . . 0.0 111.84 -167.894 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 11.7 mtpt 52.78 26.99 4.92 Favored 'General case' 0 CA--C 1.536 0.423 0 CA-C-O 117.956 -1.021 . . . . 0.0 112.195 -169.193 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 37' ' ' MET . . . . . . . . . . . . . 31.4 mmm 54.95 26.48 7.99 Favored 'General case' 0 CA--C 1.542 0.659 0 C-N-CA 124.823 1.249 . . . . 0.0 111.14 -174.95 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 38' ' ' MET . . . . . . . . . . . . . 25.3 mmm -56.0 155.69 6.09 Favored 'General case' 0 CA--C 1.519 -0.213 0 O-C-N 121.055 -1.028 . . . . 0.0 110.444 175.521 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 39' ' ' ILE . . . . . . . . . . . . . 10.4 mt -123.91 135.61 62.96 Favored 'Isoleucine or valine' 0 N--CA 1.449 -0.511 0 C-N-CA 124.793 1.237 . . . . 0.0 107.815 -175.073 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 40' ' ' SER . . . . . . . . . . . . . 66.6 m -131.04 121.09 24.42 Favored 'General case' 0 N--CA 1.45 -0.437 0 N-CA-C 106.495 -1.669 . . . . 0.0 106.495 169.233 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 41' ' ' GLY . . . . . . . . . . . . . . . -164.82 165.2 37.43 Favored Glycine 0 C--O 1.237 0.291 0 N-CA-C 108.994 -1.642 . . . . 0.0 108.994 179.331 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 42' ' ' SER . . . . . 0.628 ' HA ' ' HA ' ' A' ' 46' ' ' ARG . 92.0 p -157.56 108.41 2.26 Favored 'General case' 0 N--CA 1.444 -0.752 0 CA-C-N 117.596 0.698 . . . . 0.0 111.681 -176.667 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 43' ' ' MET . . . . . . . . . . . . . 7.2 mmt -87.4 -58.43 2.58 Favored 'General case' 0 N--CA 1.451 -0.401 0 C-N-CA 124.121 0.968 . . . . 0.0 109.322 -177.533 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 44' ' ' CYS . . . . . 1.301 ' SG ' ' SG ' ' A' ' 70' ' ' CYS . 43.6 t -155.29 -19.11 0.11 Allowed 'General case' 0 CA--C 1.535 0.379 0 N-CA-C 112.442 0.534 . . . . 0.0 112.442 -179.406 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 45' ' ' ASN . . . . . . . . . . . . . 2.8 m-80 -125.95 16.36 7.96 Favored 'General case' 0 N--CA 1.473 0.687 0 C-N-CA 125.997 1.719 . . . . 0.0 109.413 179.68 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 46' ' ' ARG . . . . . 0.628 ' HA ' ' HA ' ' A' ' 42' ' ' SER 0.376 6.0 ptt180 44.05 -172.48 0.01 OUTLIER 'General case' 0 CA--C 1.536 0.413 0 C-N-CA 127.469 2.308 . . . . 0.0 113.623 -161.956 . . . . . . . . 3 3 . 1 . 018 nuclear build full ' A' A ' 47' ' ' PHE . . . . . . . . . . . . . 21.5 p90 -173.5 162.96 4.33 Favored 'General case' 0 N--CA 1.472 0.646 0 C-N-CA 125.672 1.589 . . . . 0.0 109.151 164.33 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 48' ' ' SER . . . . . . . . . . . . . 7.6 p -155.02 135.1 13.04 Favored 'General case' 0 N--CA 1.449 -0.512 0 C-N-CA 123.998 0.919 . . . . 0.0 108.649 178.134 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 49' ' ' GLY . . . . . . . . . . . . . . . -169.0 165.39 38.89 Favored Glycine 0 C--N 1.337 0.616 0 N-CA-C 110.014 -1.234 . . . . 0.0 110.014 171.519 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 50' ' ' GLU . . . . . . . . . . . . . 2.4 pt-20 -83.48 103.17 12.62 Favored 'General case' 0 N--CA 1.442 -0.867 0 CA-C-O 122.619 1.199 . . . . 0.0 108.796 178.588 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 51' ' ' GLY . . . . . . . . . . . . . . . -58.23 174.97 2.47 Favored Glycine 0 CA--C 1.539 1.559 0 CA-C-N 114.647 -1.16 . . . . 0.0 111.112 163.223 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 52' ' ' LYS . . . . . . . . . . . . . 29.8 ttpt -142.71 159.01 43.06 Favored 'General case' 0 C--N 1.329 -0.315 0 N-CA-C 106.006 -1.85 . . . . 0.0 106.006 156.651 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 53' ' ' LEU . . . . . . . . . . . . . 49.5 tp -148.08 95.29 2.45 Favored 'General case' 0 N--CA 1.447 -0.62 0 N-CA-C 107.195 -1.409 . . . . 0.0 107.195 170.23 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 2.4 t -137.58 6.37 2.73 Favored 'General case' 0 CA--C 1.533 0.3 0 CA-C-N 115.498 -0.773 . . . . 0.0 111.196 174.627 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 55' ' ' ASN . . . . . . . . . . . . . 4.1 p30 -142.74 -21.15 0.66 Allowed 'General case' 0 C--O 1.222 -0.394 0 CA-C-O 117.672 -1.156 . . . . 0.0 114.035 175.725 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 56' ' ' GLY . . . . . . . . . . . . . . . 119.28 7.92 9.72 Favored Glycine 0 CA--C 1.529 0.943 0 CA-C-N 119.29 0.95 . . . . 0.0 112.945 -172.099 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 57' ' ' GLU . . . . . . . . . . . . . 41.3 tt0 -127.16 128.37 46.04 Favored 'General case' 0 C--O 1.235 0.303 0 CA-C-N 118.841 1.32 . . . . 0.0 108.299 -173.836 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 58' ' ' LEU . . . . . . . . . . . . . 52.5 tp -100.42 94.25 6.06 Favored 'General case' 0 CA--C 1.531 0.216 0 C-N-CA 125.628 1.571 . . . . 0.0 108.924 177.505 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 59' ' ' THR . . . . . . . . . . . . . 40.8 p -91.42 146.51 23.75 Favored 'General case' 0 C--O 1.235 0.327 0 N-CA-C 108.129 -1.063 . . . . 0.0 108.129 162.745 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 60' ' ' ALA . . . . . . . . . . . . . . . -140.93 102.37 4.25 Favored 'General case' 0 C--N 1.334 -0.1 0 C-N-CA 124.491 1.116 . . . . 0.0 108.392 166.998 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 61' ' ' LYS . . . . . . . . . . . . . 49.6 mttp -65.4 -60.88 2.49 Favored 'General case' 0 N--CA 1.442 -0.837 0 C-N-CA 124.545 1.138 . . . . 0.0 111.856 -171.148 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 62' ' ' GLY . . . . . . . . . . . . . . . -55.35 -59.93 9.66 Favored Glycine 0 C--O 1.227 -0.282 0 C-N-CA 125.047 1.308 . . . . 0.0 111.262 -165.388 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 63' ' ' LEU . . . . . . . . . . . . . 3.8 tp 49.17 60.86 3.46 Favored 'General case' 0 N--CA 1.445 -0.696 0 C-N-CA 127.646 2.379 . . . . 0.0 113.817 168.962 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 64' ' ' ALA . . . . . . . . . . . . . . . -78.88 135.06 36.9 Favored 'General case' 0 C--N 1.324 -0.525 0 CA-C-N 115.845 -0.616 . . . . 0.0 111.192 -178.004 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 65' ' ' MET . . . . . . . . . . . . . 66.4 mtp -133.57 -175.17 3.73 Favored 'General case' 0 CA--C 1.547 0.84 0 C-N-CA 124.985 1.314 . . . . 0.0 111.288 -172.874 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 66' ' ' THR . . . . . . . . . . . . . 30.0 p -107.78 -164.81 1.0 Allowed 'General case' 0 N--CA 1.47 0.565 0 C-N-CA 127.604 2.361 . . . . 0.0 110.887 177.807 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 67' ' ' ARG . . . . . . . . . . . . . 2.1 mpp_? -132.81 87.44 2.41 Favored 'General case' 0 C--O 1.232 0.15 0 C-N-CA 126.821 2.048 . . . . 0.0 107.215 173.187 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 68' ' ' MET . . . . . . . . . . . . . 10.0 mtm -139.43 162.44 35.03 Favored 'General case' 0 N--CA 1.467 0.418 0 C-N-CA 123.878 0.871 . . . . 0.0 113.061 -173.017 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 69' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -119.01 164.17 15.87 Favored 'General case' 0 C--O 1.235 0.302 0 C-N-CA 127.492 2.317 . . . . 0.0 106.991 171.953 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 70' ' ' CYS . . . . . 1.301 ' SG ' ' SG ' ' A' ' 44' ' ' CYS . 57.5 m -140.36 23.89 2.32 Favored 'General case' 0 N--CA 1.474 0.733 0 C-N-CA 124.033 0.933 . . . . 0.0 112.73 -175.149 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 71' ' ' ALA . . . . . . . . . . . . . . . 54.6 -1.29 0.02 OUTLIER 'General case' 0 CA--C 1.511 -0.534 0 N-CA-C 117.586 2.439 . . . . 0.0 117.586 -176.602 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 72' ' ' ASN . . . . . . . . . . . . . 0.0 OUTLIER -138.58 144.05 40.64 Favored Pre-proline 0 N--CA 1.441 -0.913 0 CA-C-N 118.833 0.742 . . . . 0.0 109.512 167.928 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 73' ' ' PRO . . . . . . . . . . . . . 74.5 Cg_endo -74.97 -20.64 16.73 Favored 'Trans proline' 0 N--CA 1.45 -1.086 0 C-N-CA 121.944 1.763 . . . . 0.0 111.853 -178.056 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 74' ' ' GLN . . . . . . . . . . . . . 39.4 tt0 -58.54 -45.82 88.1 Favored 'General case' 0 CA--C 1.531 0.248 0 CA-C-N 120.606 1.548 . . . . 0.0 110.607 -177.184 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 75' ' ' LEU . . . . . . . . . . . . . 83.4 mt -66.75 -41.51 87.68 Favored 'General case' 0 CA--C 1.522 -0.117 0 C-N-CA 123.843 0.857 . . . . 0.0 110.122 175.911 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 76' ' ' ASN . . . . . . . . . . . . . 3.0 t-20 -59.79 -45.33 92.65 Favored 'General case' 0 C--O 1.219 -0.505 0 C-N-CA 124.052 0.941 . . . . 0.0 110.294 -177.403 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 77' ' ' GLU . . . . . . . . . . . . . 29.7 mt-10 -56.46 -43.01 79.13 Favored 'General case' 0 N--CA 1.448 -0.542 0 C-N-CA 125.508 1.523 . . . . 0.0 111.02 175.43 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 78' ' ' LEU . . . . . . . . . . . . . 0.7 OUTLIER -61.08 -32.05 71.71 Favored 'General case' 0 C--N 1.339 0.121 0 CA-C-O 118.253 -0.879 . . . . 0.0 112.355 -177.808 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 79' ' ' ASP . . . . . . . . . . . . . 0.0 OUTLIER -54.26 -39.82 67.2 Favored 'General case' 0 CA--C 1.535 0.398 0 C-N-CA 124.127 0.971 . . . . 0.0 112.902 174.311 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 80' ' ' ASN . . . . . . . . . . . . . 6.9 p30 -87.29 -37.8 16.86 Favored 'General case' 0 CA--C 1.518 -0.272 0 CA-C-N 119.001 0.819 . . . . 0.0 109.849 175.834 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 81' ' ' THR . . . . . . . . . . . . . 32.7 m -53.24 -54.44 36.14 Favored 'General case' 0 N--CA 1.455 -0.186 0 O-C-N 123.856 0.723 . . . . 0.0 109.18 -174.513 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 82' ' ' ILE . . . . . . . . . . . . . 10.7 tp -64.54 -32.94 59.87 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.475 0 C-N-CA 122.824 0.45 . . . . 0.0 111.356 -176.968 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 83' ' ' SER . . . . . . . . . . . . . 36.4 p -64.08 -53.41 50.24 Favored 'General case' 0 N--CA 1.443 -0.775 0 N-CA-C 109.647 -0.501 . . . . 0.0 109.647 -171.35 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 84' ' ' GLU . . . . . . . . . . . . . 2.4 tp10 -62.72 -42.08 99.47 Favored 'General case' 0 N--CA 1.449 -0.502 0 C-N-CA 124.734 1.213 . . . . 0.0 109.261 -176.421 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 85' ' ' MET . . . . . . . . . . . . . 78.9 mtp -60.28 -41.41 93.29 Favored 'General case' 0 C--N 1.343 0.323 0 C-N-CA 123.778 0.831 . . . . 0.0 110.18 179.141 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 86' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -80.44 -19.35 46.32 Favored 'General case' 0 C--N 1.332 -0.19 0 O-C-N 121.436 -0.79 . . . . 0.0 112.096 -176.657 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 87' ' ' LYS . . . . . . . . . . . . . 2.4 mptm? -76.46 -55.4 5.57 Favored 'General case' 0 N--CA 1.447 -0.584 0 CA-C-O 118.198 -0.906 . . . . 0.0 109.537 169.622 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 88' ' ' GLU . . . . . . . . . . . . . 21.1 pt-20 -69.06 -24.66 64.19 Favored 'General case' 0 CA--C 1.535 0.368 0 CA-C-N 118.768 0.713 . . . . 0.0 111.376 -177.004 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 89' ' ' GLY . . . . . . . . . . . . . . . 106.57 99.14 2.6 Favored Glycine 0 C--N 1.337 0.591 0 N-CA-C 110.106 -1.198 . . . . 0.0 110.106 174.848 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 90' ' ' ALA . . . . . . . . . . . . . . . -74.1 133.67 42.86 Favored 'General case' 0 N--CA 1.446 -0.665 0 C-N-CA 123.075 0.55 . . . . 0.0 110.158 -175.68 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 91' ' ' GLN . . . . . . . . . . . . . 1.8 mp0 -73.04 125.2 27.08 Favored 'General case' 0 N--CA 1.452 -0.356 0 N-CA-C 105.447 -2.057 . . . . 0.0 105.447 170.403 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 92' ' ' VAL . . . . . . . . . . . . . 25.5 t -122.21 126.72 74.7 Favored 'Isoleucine or valine' 0 N--CA 1.446 -0.628 0 N-CA-C 107.743 -1.206 . . . . 0.0 107.743 -174.579 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 93' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -135.38 80.7 1.85 Allowed 'General case' 0 N--CA 1.451 -0.376 0 N-CA-C 106.767 -1.568 . . . . 0.0 106.767 177.679 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 94' ' ' LEU . . . . . . . . . . . . . 1.6 tm? -84.75 102.79 13.29 Favored 'General case' 0 CA--C 1.514 -0.432 0 N-CA-C 107.433 -1.321 . . . . 0.0 107.433 173.726 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 95' ' ' THR . . . . . . . . . . . . . 1.1 m -82.58 177.71 8.57 Favored 'General case' 0 C--N 1.322 -0.611 0 CA-C-N 114.064 -1.425 . . . . 0.0 108.244 178.45 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 96' ' ' ALA . . . . . . . . . . . . . . . -52.62 -20.17 2.86 Favored 'General case' 0 CA--C 1.539 0.554 0 N-CA-C 114.574 1.324 . . . . 0.0 114.574 -173.607 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 97' ' ' ASN . . . . . . . . . . . . . 17.4 p30 -146.62 -10.15 0.47 Allowed 'General case' 0 N--CA 1.467 0.419 0 N-CA-C 116.553 2.057 . . . . 0.0 116.553 160.388 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 98' ' ' GLN . . . . . . . . . . . . . 6.2 tt0 -112.9 128.96 56.61 Favored 'General case' 0 N--CA 1.47 0.549 0 CA-C-N 122.092 2.223 . . . . 0.0 111.356 -178.526 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 99' ' ' LEU . . . . . 0.452 HD22 ' CD2' ' A' ' 101' ' ' LEU . 0.3 OUTLIER -84.24 122.97 29.62 Favored 'General case' 0 C--O 1.235 0.299 0 C-N-CA 125.012 1.325 . . . . 0.0 107.768 170.293 . . . . . . . . 3 3 . 1 . 018 nuclear build full ' A' A ' 100' ' ' THR . . . . . . . . . . . . . 5.1 m -110.18 127.82 55.14 Favored 'General case' 0 C--N 1.326 -0.444 0 N-CA-C 107.239 -1.393 . . . . 0.0 107.239 171.52 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 101' ' ' LEU . . . . . 0.452 ' CD2' HD22 ' A' ' 99' ' ' LEU . 2.7 mm? -114.49 143.12 45.46 Favored 'General case' 0 CA--C 1.514 -0.431 0 C-N-CA 125.464 1.506 . . . . 0.0 108.959 172.353 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 102' ' ' ALA . . . . . . . . . . . . . . . -144.8 159.62 42.59 Favored 'General case' 0 C--O 1.235 0.303 0 C-N-CA 124.936 1.295 . . . . 0.0 108.432 161.693 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 103' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -160.61 174.83 13.42 Favored 'General case' 0 N--CA 1.443 -0.781 0 C-N-CA 126.308 1.843 . . . . 0.0 108.014 170.416 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 104' ' ' ALA . . . . . . . . . . . . . . . -62.25 -28.72 69.91 Favored 'General case' 0 C--O 1.235 0.296 0 O-C-N 121.743 -0.598 . . . . 0.0 111.588 176.395 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 105' ' ' LYS . . . . . . . . . . . . . 8.9 mmtm -69.58 -84.77 0.03 OUTLIER 'General case' 0 N--CA 1.45 -0.434 0 C-N-CA 123.505 0.722 . . . . 0.0 109.769 167.014 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 106' ' ' GLN . . . . . . . . . . . . . 23.3 mt-30 -141.37 -169.83 2.95 Favored 'General case' 0 C--N 1.328 -0.362 0 C-N-CA 123.656 0.782 . . . . 0.0 109.364 -158.711 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 107' ' ' THR . . . . . . . . . . . . . 1.1 t -149.69 147.31 27.92 Favored 'General case' 0 N--CA 1.45 -0.455 0 N-CA-C 106.287 -1.746 . . . . 0.0 106.287 -168.773 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 108' ' ' LEU . . . . . . . . . . . . . 36.8 mt -144.87 160.74 40.81 Favored 'General case' 0 N--CA 1.465 0.324 0 N-CA-C 107.634 -1.247 . . . . 0.0 107.634 -177.503 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 109' ' ' THR . . . . . . . . . . . . . 63.6 m -133.0 133.91 43.76 Favored 'General case' 0 C--O 1.236 0.353 0 N-CA-C 107.609 -1.256 . . . . 0.0 107.609 169.649 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 110' ' ' TYR . . . . . . . . . . . . . 19.1 m-85 -118.32 178.86 4.29 Favored 'General case' 0 C--O 1.236 0.345 0 C-N-CA 124.231 1.013 . . . . 0.0 108.981 178.77 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 111' ' ' LYS . . . . . . . . . . . . . 1.0 OUTLIER -139.13 138.83 37.35 Favored 'General case' 0 N--CA 1.455 -0.215 0 CA-C-O 118.02 -0.99 . . . . 0.0 110.879 178.045 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 112' ' ' LEU . . . . . . . . . . . . . 22.5 tp -60.53 19.68 0.01 OUTLIER 'General case' 0 CA--C 1.544 0.718 0 C-N-CA 131.309 3.843 . . . . 0.0 114.839 175.643 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 113' ' ' ALA . . . . . . . . . . . . . . . -67.82 84.59 0.21 Allowed 'General case' 0 CA--C 1.541 0.609 0 O-C-N 120.233 -1.542 . . . . 0.0 111.082 179.91 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 114' ' ' ASP . . . . . . . . . . . . . 23.4 t0 -93.16 33.3 1.21 Allowed 'General case' 0 N--CA 1.47 0.541 0 CA-C-O 122.974 1.368 . . . . 0.0 110.791 -176.447 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 115' ' ' LEU . . . . . . . . . . . . . 26.2 mt 57.57 12.29 1.51 Allowed 'General case' 0 CA--C 1.544 0.717 0 C-N-CA 125.636 1.574 . . . . 0.0 112.975 -174.212 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 116' ' ' MET . . . . . . . . . . . . . 2.9 ttp -124.15 139.49 53.88 Favored 'General case' 0 N--CA 1.442 -0.83 0 C-N-CA 128.943 2.897 . . . . 0.0 103.875 163.962 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 117' ' ' ASN . . . . . . . . . . . . . 4.0 m120 . . . . . 0 C--O 1.234 0.265 0 CA-C-O 119.087 -0.482 . . . . 0.0 111.67 -171.644 . . . . . . . . 0 0 . 1 . 019 nuclear build full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 C--O 1.237 0.429 0 N-CA-C 111.097 0.036 . . . . 0.0 111.097 . . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 2' ' ' VAL . . . . . . . . . . . . . 7.2 p -57.92 139.25 17.81 Favored 'Isoleucine or valine' 0 C--O 1.238 0.455 0 O-C-N 123.595 0.56 . . . . 0.0 110.063 175.834 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 3' ' ' THR . . . . . . . . . . . . . 0.8 OUTLIER -121.9 165.05 21.68 Favored Pre-proline 0 N--CA 1.448 -0.53 0 C-N-CA 124.01 0.924 . . . . 0.0 110.173 179.3 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 4' ' ' PRO . . . . . . . . . . . . . 18.3 Cg_endo -61.78 -50.63 4.99 Favored 'Trans proline' 0 N--CA 1.454 -0.832 0 C-N-CA 122.281 1.987 . . . . 0.0 111.133 174.338 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 5' ' ' GLU . . . . . . . . . . . . . 13.9 tt0 -55.01 -40.31 70.02 Favored 'General case' 0 CA--C 1.536 0.407 0 C-N-CA 124.244 1.018 . . . . 0.0 112.613 -168.513 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 6' ' ' GLN . . . . . . . . . . . . . 3.6 pt20 -73.14 14.65 0.28 Allowed 'General case' 0 CA--C 1.538 0.518 0 C-N-CA 125.433 1.493 . . . . 0.0 113.938 179.96 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 7' ' ' LEU . . . . . . . . . . . . . 88.6 mt -129.74 -46.29 1.16 Allowed 'General case' 0 C--N 1.34 0.168 0 C-N-CA 125.081 1.352 . . . . 0.0 110.478 -176.017 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 8' ' ' GLN . . . . . . . . . . . . . 2.3 mp0 -49.01 -15.34 0.1 Allowed 'General case' 0 N--CA 1.473 0.715 0 C-N-CA 127.078 2.151 . . . . 0.0 116.697 -178.944 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 9' ' ' HIS . . . . . . . . . . . . . 94.6 m-70 -130.23 13.5 5.62 Favored 'General case' 0 C--N 1.325 -0.473 0 C-N-CA 124.828 1.251 . . . . 0.0 112.492 -175.819 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 10' ' ' HIS . . . . . . . . . . . . . 52.0 m80 -125.66 138.9 53.92 Favored 'General case' 0 C--O 1.238 0.462 0 C-N-CA 124.815 1.246 . . . . 0.0 107.987 -173.325 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 11' ' ' ARG . . . . . . . . . . . . . 21.6 ttt180 -95.0 146.7 24.07 Favored 'General case' 0 N--CA 1.465 0.279 0 C-N-CA 125.531 1.533 . . . . 0.0 109.754 174.277 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 12' ' ' PHE . . . . . . . . . . . . . 35.5 m-85 -134.26 156.14 48.93 Favored 'General case' 0 N--CA 1.441 -0.914 0 CA-C-O 123.675 1.702 . . . . 0.0 109.253 175.198 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 13' ' ' VAL . . . . . . . . . . . . . 0.0 OUTLIER -138.96 130.82 36.36 Favored 'Isoleucine or valine' 0 C--N 1.313 -1.002 0 CA-C-N 113.03 -1.895 . . . . 0.0 107.242 -172.713 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 14' ' ' LEU . . . . . . . . . . . . . 11.6 tp -64.86 102.72 0.62 Allowed 'General case' 0 N--CA 1.45 -0.475 0 N-CA-C 106.392 -1.707 . . . . 0.0 106.392 176.148 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 15' ' ' GLU . . . . . 0.484 ' HG3' ' HE2' ' A' ' 111' ' ' LYS . 1.3 tm-20 -85.33 -41.38 15.55 Favored 'General case' 0 N--CA 1.449 -0.495 0 N-CA-C 108.91 -0.774 . . . . 0.0 108.91 -173.826 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 5.8 p -151.92 142.71 22.91 Favored 'General case' 0 N--CA 1.442 -0.833 0 CA-C-O 122.442 1.115 . . . . 0.0 109.342 169.229 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 17' ' ' VAL . . . . . 0.51 HG12 ' H ' ' A' ' 18' ' ' ASN . 2.2 t -70.22 175.86 0.57 Allowed 'Isoleucine or valine' 0 CA--C 1.54 0.582 0 N-CA-C 107.111 -1.44 . . . . 0.0 107.111 168.253 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 18' ' ' ASN . . . . . 0.51 ' H ' HG12 ' A' ' 17' ' ' VAL . 0.6 OUTLIER -44.88 -24.01 0.18 Allowed 'General case' 0 CA--C 1.539 0.53 0 C-N-CA 127.473 2.309 . . . . 0.0 116.391 -172.467 . . . . . . . . 3 3 . 1 . 019 nuclear build full ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . -163.89 17.54 0.12 Allowed Glycine 0 CA--C 1.532 1.141 0 CA-C-O 118.356 -1.247 . . . . 0.0 113.413 170.512 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 40.9 mtmt -145.97 155.54 51.47 Favored Pre-proline 0 N--CA 1.469 0.523 0 CA-C-N 120.412 2.106 . . . . 0.0 109.519 -178.032 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 21' ' ' PRO . . . . . . . . . . . . . 80.9 Cg_endo -72.34 171.59 16.66 Favored 'Trans proline' 0 N--CA 1.45 -1.053 0 C-N-CA 122.118 1.879 . . . . 0.0 110.812 176.544 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 22' ' ' VAL . . . . . . . . . . . . . 3.8 p -120.1 165.37 15.58 Favored 'Isoleucine or valine' 0 CA--C 1.54 0.581 0 C-N-CA 124.349 1.059 . . . . 0.0 111.973 178.184 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 23' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -77.15 -175.8 3.78 Favored 'General case' 0 CA--C 1.545 0.778 0 C-N-CA 127.26 2.224 . . . . 0.0 112.503 -175.525 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 24' ' ' SER . . . . . . . . . . . . . 19.6 m 69.17 67.11 0.27 Allowed 'General case' 0 N--CA 1.452 -0.344 0 C-N-CA 128.995 2.918 . . . . 0.0 114.663 160.574 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 25' ' ' ASP . . . . . . . . . . . . . 6.5 m-20 -46.54 -38.9 10.03 Favored 'General case' 0 CA--C 1.538 0.483 0 C-N-CA 125.699 1.6 . . . . 0.0 113.308 176.324 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 26' ' ' LYS . . . . . . . . . . . . . 77.9 tttt -95.42 -17.9 21.15 Favored 'General case' 0 N--CA 1.466 0.335 0 O-C-N 120.874 -1.141 . . . . 0.0 112.501 -175.853 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 27' ' ' ASN . . . . . . . . . . . . . 4.1 p30 -150.44 69.62 8.83 Favored Pre-proline 0 CA--C 1.534 0.335 0 C-N-CA 124.136 0.974 . . . . 0.0 110.437 -177.015 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 28' ' ' PRO . . . . . . . . . . . . . 40.8 Cg_endo -65.38 162.49 33.38 Favored 'Trans proline' 0 N--CA 1.46 -0.5 0 C-N-CA 122.126 1.884 . . . . 0.0 111.279 -176.802 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 29' ' ' PRO . . . . . . . . . . . . . 18.6 Cg_endo -62.52 87.02 0.11 Allowed 'Trans proline' 0 N--CA 1.453 -0.873 0 C-N-CA 123.562 2.842 . . . . 0.0 109.416 160.211 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 30' ' ' GLU . . . . . . . . . . . . . 1.1 pt-20 -97.23 158.74 15.3 Favored 'General case' 0 N--CA 1.447 -0.576 0 C-N-CA 124.765 1.226 . . . . 0.0 108.292 173.504 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 31' ' ' ILE . . . . . . . . . . . . . 16.4 tt -139.06 137.09 42.36 Favored 'Isoleucine or valine' 0 N--CA 1.443 -0.777 0 N-CA-C 105.456 -2.053 . . . . 0.0 105.456 179.558 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 32' ' ' SER . . . . . . . . . . . . . 68.7 p -136.46 160.12 39.72 Favored 'General case' 0 C--N 1.321 -0.663 0 N-CA-C 106.804 -1.554 . . . . 0.0 106.804 170.151 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 33' ' ' PHE . . . . . . . . . . . . . 58.1 m-85 -118.38 164.67 14.89 Favored 'General case' 0 C--N 1.326 -0.445 0 N-CA-C 108.088 -1.078 . . . . 0.0 108.088 179.462 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 34' ' ' GLY . . . . . . . . . . . . . . . 167.91 142.4 3.47 Favored Glycine 0 N--CA 1.448 -0.542 0 N-CA-C 109.017 -1.633 . . . . 0.0 109.017 177.305 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 35' ' ' GLU . . . . . . . . . . . . . 0.3 OUTLIER 57.28 116.01 0.01 OUTLIER 'General case' 0 CA--C 1.537 0.461 0 C-N-CA 129.264 3.026 . . . . 0.0 114.481 168.947 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 8.6 mtmm 59.08 18.31 6.27 Favored 'General case' 0 N--CA 1.473 0.694 0 O-C-N 120.453 -1.404 . . . . 0.0 113.057 -173.091 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 37' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER 58.85 35.73 24.35 Favored 'General case' 0 CA--C 1.535 0.398 0 C-N-CA 124.843 1.257 . . . . 0.0 110.242 -174.163 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 38' ' ' MET . . . . . . . . . . . . . 9.2 mtp -69.05 164.49 22.32 Favored 'General case' 0 N--CA 1.45 -0.428 0 O-C-N 121.469 -0.77 . . . . 0.0 110.307 167.947 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 39' ' ' ILE . . . . . . . . . . . . . 9.3 mt -122.59 139.93 47.94 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.439 0 C-N-CA 126.485 1.914 . . . . 0.0 106.92 179.115 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 40' ' ' SER . . . . . . . . . . . . . 73.1 m -124.14 149.16 46.58 Favored 'General case' 0 N--CA 1.454 -0.239 0 C-N-CA 125.604 1.562 . . . . 0.0 108.364 163.223 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 41' ' ' GLY . . . . . . . . . . . . . . . 172.84 -178.8 44.69 Favored Glycine 0 CA--C 1.523 0.592 0 N-CA-C 109.221 -1.552 . . . . 0.0 109.221 172.199 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 42' ' ' SER . . . . . . . . . . . . . 40.4 t -142.0 154.61 45.14 Favored 'General case' 0 N--CA 1.449 -0.496 0 N-CA-C 107.303 -1.369 . . . . 0.0 107.303 162.569 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 43' ' ' MET . . . . . . . . . . . . . 14.9 mmt -107.03 -53.01 2.67 Favored 'General case' 0 N--CA 1.454 -0.247 0 N-CA-C 107.43 -1.322 . . . . 0.0 107.43 159.211 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 44' ' ' CYS . . . . . 1.298 ' SG ' ' SG ' ' A' ' 70' ' ' CYS . 12.7 t -151.06 -50.57 0.12 Allowed 'General case' 0 CA--C 1.534 0.338 0 N-CA-C 107.114 -1.439 . . . . 0.0 107.114 176.738 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 45' ' ' ASN . . . . . . . . . . . . . 14.1 m-80 -88.39 16.06 6.94 Favored 'General case' 0 CA--C 1.518 -0.25 0 C-N-CA 125.276 1.43 . . . . 0.0 113.967 -175.837 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 46' ' ' ARG . . . . . . . . . . . . . 3.9 mmt180 58.23 172.26 0.06 Allowed 'General case' 0 N--CA 1.465 0.277 0 C-N-CA 123.86 0.864 . . . . 0.0 110.459 -168.775 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 47' ' ' PHE . . . . . . . . . . . . . 48.7 p90 -163.59 172.35 14.47 Favored 'General case' 0 C--O 1.241 0.618 0 C-N-CA 123.841 0.856 . . . . 0.0 109.712 161.232 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 48' ' ' SER . . . . . . . . . . . . . 1.7 p -173.93 143.99 0.99 Allowed 'General case' 0 N--CA 1.449 -0.518 0 C-N-CA 124.898 1.279 . . . . 0.0 108.863 177.205 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 49' ' ' GLY . . . . . . . . . . . . . . . -176.91 169.83 42.35 Favored Glycine 0 CA--C 1.524 0.628 0 O-C-N 121.25 -0.906 . . . . 0.0 112.455 172.776 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 50' ' ' GLU . . . . . . . . . . . . . 17.3 mt-10 -72.31 94.83 1.64 Allowed 'General case' 0 N--CA 1.461 0.092 0 C-N-CA 124.922 1.289 . . . . 0.0 108.257 171.851 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 51' ' ' GLY . . . . . . . . . . . . . . . -58.98 -65.91 3.16 Favored Glycine 0 C--O 1.226 -0.385 0 C-N-CA 125.818 1.675 . . . . 0.0 113.193 -177.555 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 52' ' ' LYS . . . . . . . . . . . . . 2.5 ttmp? 70.57 138.48 0.04 OUTLIER 'General case' 0 C--N 1.326 -0.443 0 C-N-CA 128.041 2.537 . . . . 0.0 112.655 178.018 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 53' ' ' LEU . . . . . . . . . . . . . 24.8 tp -147.09 102.55 3.52 Favored 'General case' 0 C--O 1.236 0.347 0 C-N-CA 123.637 0.775 . . . . 0.0 109.801 179.734 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 2.0 t -153.09 19.48 0.57 Allowed 'General case' 0 CA--C 1.54 0.574 0 C-N-CA 123.775 0.83 . . . . 0.0 111.658 176.525 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 55' ' ' ASN . . . . . . . . . . . . . 11.9 p30 -146.03 3.69 0.94 Allowed 'General case' 0 N--CA 1.47 0.55 0 N-CA-C 113.847 1.055 . . . . 0.0 113.847 164.985 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 56' ' ' GLY . . . . . . . . . . . . . . . 95.68 16.14 40.51 Favored Glycine 0 CA--C 1.527 0.814 0 CA-C-N 119.495 1.043 . . . . 0.0 112.511 -175.695 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 57' ' ' GLU . . . . . . . . . . . . . 23.6 tt0 -136.04 156.67 48.38 Favored 'General case' 0 CA--C 1.537 0.472 0 C-N-CA 124.426 1.09 . . . . 0.0 108.331 -174.618 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 58' ' ' LEU . . . . . . . . . . . . . 38.9 tp -129.62 97.22 4.46 Favored 'General case' 0 CA--C 1.541 0.597 0 C-N-CA 125.182 1.393 . . . . 0.0 110.502 -173.109 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 59' ' ' THR . . . . . . . . . . . . . 2.7 p -113.07 104.99 12.93 Favored 'General case' 0 N--CA 1.474 0.746 0 C-N-CA 127.575 2.35 . . . . 0.0 112.203 -175.448 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 60' ' ' ALA . . . . . . . . . . . . . . . -72.73 126.05 28.97 Favored 'General case' 0 C--O 1.233 0.201 0 O-C-N 122.119 -0.363 . . . . 0.0 110.917 176.583 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 61' ' ' LYS . . . . . . . . . . . . . 16.2 ttpt -77.96 46.25 0.57 Allowed 'General case' 0 CA--C 1.543 0.692 0 C-N-CA 124.909 1.284 . . . . 0.0 113.68 -177.866 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 62' ' ' GLY . . . . . . . . . . . . . . . 134.33 -21.95 3.8 Favored Glycine 0 N--CA 1.474 1.207 0 O-C-N 120.708 -1.245 . . . . 0.0 114.84 170.732 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 63' ' ' LEU . . . . . . . . . . . . . 1.6 tp 44.89 80.06 0.04 OUTLIER 'General case' 0 CA--C 1.546 0.816 0 C-N-CA 128.008 2.523 . . . . 0.0 114.424 169.143 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 64' ' ' ALA . . . . . . . . . . . . . . . -65.18 100.03 0.42 Allowed 'General case' 0 CA--C 1.545 0.765 0 C-N-CA 127.166 2.187 . . . . 0.0 114.056 -175.132 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 65' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -108.55 175.3 5.51 Favored 'General case' 0 N--CA 1.484 1.263 0 C-N-CA 125.11 1.364 . . . . 0.0 111.433 -173.02 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 66' ' ' THR . . . . . . . . . . . . . 17.0 p -118.12 -165.65 1.13 Allowed 'General case' 0 N--CA 1.478 0.926 0 C-N-CA 126.146 1.778 . . . . 0.0 111.462 -177.618 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 67' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -142.79 75.99 1.51 Allowed 'General case' 0 N--CA 1.474 0.733 0 C-N-CA 125.463 1.505 . . . . 0.0 109.559 177.897 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 68' ' ' MET . . . . . . . . . . . . . 51.5 mtm -126.12 164.72 20.29 Favored 'General case' 0 C--N 1.326 -0.434 0 C-N-CA 129.592 3.157 . . . . 0.0 108.604 -179.423 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 69' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -113.63 163.32 15.12 Favored 'General case' 0 N--CA 1.449 -0.523 0 C-N-CA 126.246 1.819 . . . . 0.0 107.016 173.302 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 70' ' ' CYS . . . . . 1.298 ' SG ' ' SG ' ' A' ' 44' ' ' CYS . 0.5 OUTLIER -121.89 -6.94 9.01 Favored 'General case' 0 C--N 1.323 -0.548 0 C-N-CA 126.284 1.833 . . . . 0.0 114.276 -170.081 . . . . . . . . 3 3 . 1 . 019 nuclear build full ' A' A ' 71' ' ' ALA . . . . . . . . . . . . . . . 61.17 4.2 0.84 Allowed 'General case' 0 CA--C 1.538 0.503 0 C-N-CA 125.361 1.464 . . . . 0.0 114.597 -172.403 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 72' ' ' ASN . . . . . . . . . . . . . 21.7 t-20 -132.61 142.5 45.08 Favored Pre-proline 0 N--CA 1.472 0.641 0 CA-C-N 120.67 1.577 . . . . 0.0 108.575 160.457 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 73' ' ' PRO . . . . . . . . . . . . . 70.0 Cg_endo -79.25 -29.36 3.17 Favored 'Trans proline' 0 C--N 1.346 0.401 0 C-N-CA 122.124 1.883 . . . . 0.0 112.179 -169.986 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 74' ' ' GLN . . . . . . . . . . . . . 31.8 tt0 -60.52 -39.63 88.53 Favored 'General case' 0 C--O 1.221 -0.42 0 CA-C-N 116.691 -0.231 . . . . 0.0 110.419 -179.751 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 75' ' ' LEU . . . . . . . . . . . . . 69.5 mt -66.84 -37.73 85.03 Favored 'General case' 0 N--CA 1.467 0.399 0 O-C-N 121.834 -0.541 . . . . 0.0 109.895 174.328 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 76' ' ' ASN . . . . . . . . . . . . . 2.2 t-20 -64.52 -46.37 83.19 Favored 'General case' 0 C--O 1.22 -0.491 0 C-N-CA 125.182 1.393 . . . . 0.0 111.45 -177.663 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 77' ' ' GLU . . . . . . . . . . . . . 8.2 pt-20 -71.3 -30.2 65.95 Favored 'General case' 0 N--CA 1.468 0.455 0 CA-C-N 119.564 1.074 . . . . 0.0 111.935 177.237 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 78' ' ' LEU . . . . . . . . . . . . . 1.0 OUTLIER -61.09 -35.94 78.35 Favored 'General case' 0 C--N 1.329 -0.308 0 C-N-CA 124.13 0.972 . . . . 0.0 109.346 177.388 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 79' ' ' ASP . . . . . . . . . . . . . 0.0 OUTLIER -59.12 -29.03 67.09 Favored 'General case' 0 N--CA 1.463 0.188 0 C-N-CA 124.074 0.95 . . . . 0.0 112.489 173.603 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 80' ' ' ASN . . . . . . . . . . . . . 10.9 t30 -97.68 -20.04 17.87 Favored 'General case' 0 N--CA 1.452 -0.37 0 C-N-CA 124.082 0.953 . . . . 0.0 111.366 -178.842 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 81' ' ' THR . . . . . . . . . . . . . 20.4 m -69.8 -57.95 4.48 Favored 'General case' 0 N--CA 1.448 -0.545 0 N-CA-C 107.051 -1.462 . . . . 0.0 107.051 172.208 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 82' ' ' ILE . . . . . . . . . . . . . 8.9 tp -66.74 -39.91 84.81 Favored 'Isoleucine or valine' 0 N--CA 1.454 -0.269 0 C-N-CA 124.058 0.943 . . . . 0.0 111.333 -170.264 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 83' ' ' SER . . . . . . . . . . . . . 43.3 p -50.15 -49.23 52.78 Favored 'General case' 0 C--O 1.236 0.389 0 C-N-CA 124.542 1.137 . . . . 0.0 110.621 -176.141 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 84' ' ' GLU . . . . . . . . . . . . . 0.9 OUTLIER -70.94 -40.29 72.13 Favored 'General case' 0 N--CA 1.447 -0.582 0 CA-C-O 117.386 -1.293 . . . . 0.0 112.108 178.919 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 85' ' ' MET . . . . . . . . . . . . . 91.8 mtp -58.81 -41.37 86.61 Favored 'General case' 0 C--N 1.347 0.472 0 CA-C-N 120.94 1.7 . . . . 0.0 109.117 -176.279 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 86' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -77.56 -27.77 51.58 Favored 'General case' 0 C--O 1.232 0.179 0 C-N-CA 123.899 0.88 . . . . 0.0 112.043 -175.859 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 87' ' ' LYS . . . . . . . . . . . . . 64.5 mttt -76.34 -52.0 10.82 Favored 'General case' 0 N--CA 1.446 -0.672 0 N-CA-C 108.601 -0.888 . . . . 0.0 108.601 176.765 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 88' ' ' GLU . . . . . . . . . . . . . 18.0 mm-40 -51.19 -51.34 54.69 Favored 'General case' 0 CA--C 1.527 0.072 0 C-N-CA 125.242 1.417 . . . . 0.0 109.511 176.641 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 89' ' ' GLY . . . . . . . . . . . . . . . 106.67 133.16 7.28 Favored Glycine 0 C--N 1.335 0.523 0 N-CA-C 107.677 -2.169 . . . . 0.0 107.677 -166.653 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 90' ' ' ALA . . . . . . . . . . . . . . . -138.19 142.72 40.02 Favored 'General case' 0 CA--C 1.516 -0.35 0 C-N-CA 123.708 0.803 . . . . 0.0 109.695 -168.333 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 91' ' ' GLN . . . . . . . . . . . . . 6.0 mp0 -72.31 129.15 37.74 Favored 'General case' 0 N--CA 1.444 -0.775 0 N-CA-C 105.206 -2.146 . . . . 0.0 105.206 -177.098 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 92' ' ' VAL . . . . . . . . . . . . . 7.5 p -122.14 127.35 75.23 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.325 0 N-CA-C 106.947 -1.501 . . . . 0.0 106.947 -175.9 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 93' ' ' ASP . . . . . . . . . . . . . 0.8 OUTLIER -142.76 94.54 2.65 Favored 'General case' 0 C--O 1.234 0.253 0 N-CA-C 107.822 -1.177 . . . . 0.0 107.822 -173.452 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 94' ' ' LEU . . . . . . . . . . . . . 0.9 OUTLIER -99.45 102.65 14.28 Favored 'General case' 0 CA--C 1.515 -0.371 0 N-CA-C 107.069 -1.456 . . . . 0.0 107.069 176.043 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 95' ' ' THR . . . . . . . . . . . . . 5.8 t -78.02 -168.81 1.36 Allowed 'General case' 0 CA--C 1.536 0.407 0 O-C-N 125.043 1.465 . . . . 0.0 107.9 178.975 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 96' ' ' ALA . . . . . . . . . . . . . . . -53.15 -23.29 7.87 Favored 'General case' 0 CA--C 1.541 0.599 0 N-CA-C 114.041 1.126 . . . . 0.0 114.041 -175.075 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 97' ' ' ASN . . . . . . . . . . . . . 30.2 p30 -158.19 6.35 0.13 Allowed 'General case' 0 N--CA 1.473 0.697 0 N-CA-C 116.247 1.943 . . . . 0.0 116.247 164.757 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 98' ' ' GLN . . . . . . . . . . . . . 3.2 tt0 -121.6 130.53 53.56 Favored 'General case' 0 N--CA 1.471 0.6 0 CA-C-N 121.216 1.826 . . . . 0.0 110.743 -176.766 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 99' ' ' LEU . . . . . 0.465 ' HB3' ' HB2' ' A' ' 110' ' ' TYR . 14.5 tp -83.77 138.84 33.06 Favored 'General case' 0 C--O 1.232 0.168 0 O-C-N 121.523 -0.736 . . . . 0.0 110.145 171.768 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 100' ' ' THR . . . . . . . . . . . . . 28.8 m -120.74 120.14 34.78 Favored 'General case' 0 N--CA 1.448 -0.556 0 N-CA-C 105.773 -1.936 . . . . 0.0 105.773 159.433 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 101' ' ' LEU . . . . . . . . . . . . . 3.2 mm? -96.77 138.59 34.1 Favored 'General case' 0 CA--C 1.505 -0.753 0 N-CA-C 106.661 -1.607 . . . . 0.0 106.661 149.376 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 102' ' ' ALA . . . . . . . . . . . . . . . -131.98 154.04 49.72 Favored 'General case' 0 C--N 1.327 -0.411 0 N-CA-C 107.319 -1.363 . . . . 0.0 107.319 165.529 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 103' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -162.94 172.2 15.44 Favored 'General case' 0 N--CA 1.442 -0.845 0 C-N-CA 127.815 2.446 . . . . 0.0 107.891 176.274 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 104' ' ' ALA . . . . . . . . . . . . . . . -53.47 -29.97 38.52 Favored 'General case' 0 CA--C 1.537 0.471 0 C-N-CA 124.16 0.984 . . . . 0.0 113.103 174.94 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 105' ' ' LYS . . . . . . . . . . . . . 53.2 mmtt -70.7 -72.39 0.21 Allowed 'General case' 0 C--O 1.232 0.138 0 C-N-CA 123.61 0.764 . . . . 0.0 111.815 175.143 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 106' ' ' GLN . . . . . . . . . . . . . 2.6 pt20 -154.57 -168.48 2.93 Favored 'General case' 0 C--O 1.232 0.168 0 C-N-CA 123.49 0.716 . . . . 0.0 110.169 -178.983 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 107' ' ' THR . . . . . . . . . . . . . 7.2 t -130.64 152.91 49.49 Favored 'General case' 0 N--CA 1.446 -0.637 0 C-N-CA 126.284 1.834 . . . . 0.0 107.583 176.264 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 108' ' ' LEU . . . . . . . . . . . . . 3.5 mm? -121.63 166.29 14.47 Favored 'General case' 0 C--O 1.237 0.442 0 C-N-CA 125.193 1.397 . . . . 0.0 109.995 174.179 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 109' ' ' THR . . . . . . . . . . . . . 9.4 m -130.96 106.6 8.52 Favored 'General case' 0 N--CA 1.448 -0.565 0 N-CA-C 107.94 -1.133 . . . . 0.0 107.94 166.225 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 110' ' ' TYR . . . . . 0.465 ' HB2' ' HB3' ' A' ' 99' ' ' LEU . 49.6 m-85 -98.96 165.26 11.84 Favored 'General case' 0 C--O 1.235 0.308 0 N-CA-C 108.946 -0.761 . . . . 0.0 108.946 172.668 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 111' ' ' LYS . . . . . 0.484 ' HE2' ' HG3' ' A' ' 15' ' ' GLU . 5.0 tppt? -122.39 146.18 47.58 Favored 'General case' 0 C--O 1.226 -0.134 0 C-N-CA 124.249 1.02 . . . . 0.0 110.144 178.932 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 112' ' ' LEU . . . . . . . . . . . . . 26.1 tp -69.65 17.82 0.05 OUTLIER 'General case' 0 CA--C 1.546 0.795 0 C-N-CA 128.813 2.845 . . . . 0.0 113.519 -177.736 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 113' ' ' ALA . . . . . . . . . . . . . . . -60.54 90.19 0.02 OUTLIER 'General case' 0 CA--C 1.534 0.361 0 C-N-CA 126.023 1.729 . . . . 0.0 111.794 -168.397 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 114' ' ' ASP . . . . . . . . . . . . . 27.2 t0 -87.35 45.44 1.27 Allowed 'General case' 0 CA--C 1.51 -0.592 0 CA-C-O 122.901 1.334 . . . . 0.0 111.494 -168.864 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 115' ' ' LEU . . . . . . . . . . . . . 2.8 mt -76.62 5.45 7.47 Favored 'General case' 0 CA--C 1.54 0.56 0 CA-C-N 115.358 -0.837 . . . . 0.0 109.963 -173.746 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 116' ' ' MET . . . . . . . . . . . . . 6.5 tpt 65.27 124.42 0.02 OUTLIER 'General case' 0 CA--C 1.537 0.472 0 C-N-CA 130.203 3.401 . . . . 0.0 111.887 -176.439 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 117' ' ' ASN . . . . . . . . . . . . . 24.2 m120 . . . . . 0 C--O 1.24 0.597 0 C-N-CA 126.485 1.914 . . . . 0.0 111.661 -172.556 . . . . . . . . 0 0 . 1 . 001 nuclear nobuild core ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 9.6 ttt . . . . . 0 C--O 1.234 0.252 0 N-CA-C 109.506 -0.553 . . . . 0.0 109.506 . . . . . . . . . 0 0 . 1 . 001 nuclear nobuild core ' A' A ' 2' ' ' VAL . . . . . . . . . . . . . 74.9 t -59.69 137.3 22.3 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.448 0 N-CA-C 108.382 -0.97 . . . . 0.0 108.382 173.403 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 3' ' ' THR . . . . . . . . . . . . . 0.1 OUTLIER -124.75 162.38 43.32 Favored Pre-proline 0 CA--C 1.537 0.444 0 C-N-CA 122.494 0.318 . . . . 0.0 110.98 177.107 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 4' ' ' PRO . . . . . . . . . . . . . 9.2 Cg_endo -71.22 -41.74 2.38 Favored 'Trans proline' 0 CA--C 1.532 0.41 0 C-N-CA 122.833 2.356 . . . . 0.0 112.58 -179.312 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 5' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -61.01 -44.59 97.19 Favored 'General case' 0 C--N 1.325 -0.48 0 C-N-CA 124.231 1.012 . . . . 0.0 110.576 -173.516 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 6' ' ' GLN . . . . . . . . . . . . . 12.7 pt20 -65.5 12.63 0.05 OUTLIER 'General case' 0 CA--C 1.541 0.612 0 C-N-CA 125.803 1.641 . . . . 0.0 114.678 175.135 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 7' ' ' LEU . . . . . . . . . . . . . 77.0 mt -130.97 -45.57 1.03 Allowed 'General case' 0 C--O 1.225 -0.187 0 C-N-CA 125.488 1.515 . . . . 0.0 110.354 -177.34 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 8' ' ' GLN . . . . . . . . . . . . . 19.3 mt-30 -62.12 -3.08 1.12 Allowed 'General case' 0 N--CA 1.469 0.487 0 N-CA-C 115.534 1.679 . . . . 0.0 115.534 -171.956 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 9' ' ' HIS . . . . . . . . . . . . . 97.7 m-70 -135.41 13.68 3.49 Favored 'General case' 0 C--N 1.326 -0.414 0 C-N-CA 125.181 1.393 . . . . 0.0 111.488 177.128 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 10' ' ' HIS . . . . . . . . . . . . . 94.7 m-70 -131.13 108.21 9.58 Favored 'General case' 0 N--CA 1.451 -0.404 0 C-N-CA 124.753 1.221 . . . . 0.0 109.353 -172.119 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 11' ' ' ARG . . . . . . . . . . . . . 9.5 ptt180 -74.83 163.34 27.77 Favored 'General case' 0 C--O 1.235 0.311 0 N-CA-C 108.976 -0.75 . . . . 0.0 108.976 174.617 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 12' ' ' PHE . . . . . . . . . . . . . 46.7 m-85 -139.19 146.8 40.98 Favored 'General case' 0 N--CA 1.448 -0.568 0 N-CA-C 108.416 -0.957 . . . . 0.0 108.416 173.137 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 13' ' ' VAL . . . . . 0.482 ' HA ' ' HA ' ' A' ' 30' ' ' GLU . 7.2 p -112.3 137.17 46.11 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.478 0 O-C-N 121.267 -0.895 . . . . 0.0 109.686 178.622 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 14' ' ' LEU . . . . . . . . . . . . . 26.7 tp -64.22 121.97 15.51 Favored 'General case' 0 N--CA 1.466 0.375 0 N-CA-C 107.254 -1.387 . . . . 0.0 107.254 178.669 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 1.6 tm-20 -105.63 -50.22 3.25 Favored 'General case' 0 C--N 1.326 -0.454 0 N-CA-C 108.134 -1.061 . . . . 0.0 108.134 -174.429 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 5.3 p -146.11 124.23 12.16 Favored 'General case' 0 N--CA 1.446 -0.663 0 CA-C-O 121.995 0.902 . . . . 0.0 110.713 179.833 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 17' ' ' VAL . . . . . . . . . . . . . 2.4 t -64.93 160.04 3.57 Favored 'Isoleucine or valine' 0 C--O 1.239 0.531 0 N-CA-C 107.137 -1.431 . . . . 0.0 107.137 161.776 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 18' ' ' ASN . . . . . . . . . . . . . 1.5 t30 -44.97 -43.31 8.97 Favored 'General case' 0 CA--C 1.53 0.203 0 C-N-CA 123.77 0.828 . . . . 0.0 111.864 165.115 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . -90.43 -33.67 8.49 Favored Glycine 0 CA--C 1.526 0.756 0 CA-C-O 117.686 -1.619 . . . . 0.0 114.389 -170.235 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 10.5 mttt -161.67 165.7 15.93 Favored Pre-proline 0 N--CA 1.469 0.496 0 CA-C-N 119.806 1.803 . . . . 0.0 110.321 -174.357 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 21' ' ' PRO . . . . . . . . . . . . . 97.0 Cg_endo -64.01 -179.96 0.94 Allowed 'Trans proline' 0 CA--C 1.537 0.639 0 C-N-CA 122.614 2.209 . . . . 0.0 110.953 163.121 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 22' ' ' VAL . . . . . . . . . . . . . 3.8 t -130.1 145.37 35.74 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.426 0 N-CA-C 107.909 -1.145 . . . . 0.0 107.909 169.837 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 23' ' ' THR . . . . . . . . . . . . . 0.1 OUTLIER -143.65 111.79 6.24 Favored 'General case' 0 C--O 1.233 0.213 0 C-N-CA 124.877 1.271 . . . . 0.0 108.273 178.107 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 24' ' ' SER . . . . . . . . . . . . . 2.9 m -134.16 45.12 2.64 Favored 'General case' 0 CA--C 1.535 0.378 0 CA-C-N 118.668 0.667 . . . . 0.0 112.244 -163.989 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 25' ' ' ASP . . . . . . . . . . . . . 1.0 OUTLIER 65.14 -81.17 0.03 OUTLIER 'General case' 0 N--CA 1.463 0.178 0 C-N-CA 128.695 2.798 . . . . 0.0 110.171 172.27 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 26' ' ' LYS . . . . . . . . . . . . . 21.3 ttpp -143.63 5.23 1.38 Allowed 'General case' 0 CA--C 1.535 0.373 0 C-N-CA 124.653 1.181 . . . . 0.0 112.008 171.085 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 27' ' ' ASN . . . . . . . . . . . . . 70.0 m-80 -122.41 70.05 33.32 Favored Pre-proline 0 C--O 1.233 0.202 0 C-N-CA 125.514 1.525 . . . . 0.0 108.158 -174.238 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 28' ' ' PRO . . . . . . . . . . . . . 93.0 Cg_endo -72.91 160.68 45.46 Favored 'Trans proline' 0 N--CA 1.454 -0.811 0 C-N-CA 121.986 1.791 . . . . 0.0 111.214 -178.623 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 29' ' ' PRO . . . . . . . . . . . . . 39.6 Cg_endo -68.17 64.84 1.04 Allowed 'Trans proline' 0 N--CA 1.458 -0.568 0 C-N-CA 123.864 3.043 . . . . 0.0 111.392 164.022 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 30' ' ' GLU . . . . . 0.482 ' HA ' ' HA ' ' A' ' 13' ' ' VAL . 14.7 pt-20 -72.71 170.07 15.33 Favored 'General case' 0 N--CA 1.446 -0.635 0 O-C-N 120.316 -1.49 . . . . 0.0 109.408 166.705 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 31' ' ' ILE . . . . . . . . . . . . . 20.0 tt -141.77 149.26 20.05 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.483 0 N-CA-C 106.983 -1.488 . . . . 0.0 106.983 178.475 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 32' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER -134.75 164.35 27.74 Favored 'General case' 0 N--CA 1.442 -0.829 0 CA-C-O 122.856 1.312 . . . . 0.0 109.083 172.929 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 33' ' ' PHE . . . . . . . . . . . . . 95.2 m-85 -133.02 167.13 20.85 Favored 'General case' 0 C--N 1.323 -0.58 0 CA-C-N 113.74 -1.573 . . . . 0.0 107.609 -177.233 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 34' ' ' GLY . . . . . . . . . . . . . . . -166.47 -170.69 31.7 Favored Glycine 0 N--CA 1.447 -0.615 0 N-CA-C 110.007 -1.237 . . . . 0.0 110.007 172.354 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 35' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -44.31 149.15 0.39 Allowed 'General case' 0 C--O 1.234 0.282 0 C-N-CA 126.707 2.003 . . . . 0.0 111.383 -173.261 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 32.7 mmtm 65.01 15.66 10.12 Favored 'General case' 0 CA--C 1.536 0.43 0 C-N-CA 125.574 1.549 . . . . 0.0 111.727 -170.919 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 37' ' ' MET . . . . . . . . . . . . . 11.5 mmm 59.7 20.97 9.68 Favored 'General case' 0 CA--C 1.54 0.576 0 C-N-CA 126.12 1.768 . . . . 0.0 113.272 -171.839 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 38' ' ' MET . . . . . . . . . . . . . 0.8 OUTLIER -61.19 160.01 11.1 Favored 'General case' 0 N--CA 1.452 -0.328 0 O-C-N 121.171 -0.956 . . . . 0.0 112.011 178.911 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 39' ' ' ILE . . . . . . . . . . . . . 10.4 mt -131.7 138.45 52.85 Favored 'Isoleucine or valine' 0 C--O 1.236 0.375 0 C-N-CA 124.851 1.26 . . . . 0.0 108.625 -168.473 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 40' ' ' SER . . . . . . . . . . . . . 13.7 m -135.89 132.83 37.03 Favored 'General case' 0 CA--C 1.531 0.232 0 N-CA-C 106.389 -1.708 . . . . 0.0 106.389 166.47 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 41' ' ' GLY . . . . . . . . . . . . . . . -157.91 172.35 35.08 Favored Glycine 0 C--N 1.334 0.439 0 CA-C-N 119.109 0.868 . . . . 0.0 111.49 -177.965 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 42' ' ' SER . . . . . . . . . . . . . 15.1 p -149.57 72.17 1.13 Allowed 'General case' 0 N--CA 1.452 -0.336 0 O-C-N 121.861 -0.788 . . . . 0.0 112.068 -165.283 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 43' ' ' MET . . . . . . . . . . . . . 6.3 mmt -66.48 -58.42 5.28 Favored 'General case' 0 CA--C 1.537 0.445 0 N-CA-C 109.315 -0.624 . . . . 0.0 109.315 178.207 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 44' ' ' CYS . . . . . 1.293 ' SG ' ' SG ' ' A' ' 70' ' ' CYS . 3.8 t -145.4 -57.32 0.32 Allowed 'General case' 0 N--CA 1.462 0.17 0 N-CA-C 107.128 -1.434 . . . . 0.0 107.128 161.247 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 45' ' ' ASN . . . . . . . . . . . . . 16.1 m-80 -74.42 7.17 3.06 Favored 'General case' 0 C--N 1.331 -0.211 0 C-N-CA 127.363 2.265 . . . . 0.0 113.267 -171.327 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 46' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER 57.9 150.1 0.01 OUTLIER 'General case' 0 C--O 1.225 -0.2 0 C-N-CA 126.831 2.052 . . . . 0.0 112.23 -166.115 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 47' ' ' PHE . . . . . . . . . . . . . 38.4 p90 -146.02 170.14 17.24 Favored 'General case' 0 N--CA 1.445 -0.706 0 CA-C-O 122.63 1.205 . . . . 0.0 109.392 167.963 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 48' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -161.66 161.9 29.71 Favored 'General case' 0 C--N 1.324 -0.531 0 C-N-CA 126.032 1.733 . . . . 0.0 106.83 174.996 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 49' ' ' GLY . . . . . . . . . . . . . . . 174.15 168.04 34.49 Favored Glycine 0 CA--C 1.523 0.591 0 CA-C-N 119.364 0.984 . . . . 0.0 111.976 166.178 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 50' ' ' GLU . . . . . . . . . . . . . 31.1 mt-10 -80.2 94.93 6.14 Favored 'General case' 0 C--O 1.236 0.368 0 C-N-CA 123.514 0.726 . . . . 0.0 109.874 -178.964 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 51' ' ' GLY . . . . . . . . . . . . . . . -69.71 173.37 37.79 Favored Glycine 0 CA--C 1.528 0.857 0 CA-C-O 122.797 1.221 . . . . 0.0 113.135 174.147 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 52' ' ' LYS . . . . . . . . . . . . . 1.4 ttmp? -151.63 154.28 36.09 Favored 'General case' 0 N--CA 1.454 -0.268 0 C-N-CA 126.205 1.802 . . . . 0.0 107.635 -179.66 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 53' ' ' LEU . . . . . . . . . . . . . 1.5 tm? -149.44 117.73 6.44 Favored 'General case' 0 N--CA 1.453 -0.29 0 N-CA-C 106.247 -1.76 . . . . 0.0 106.247 169.231 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 1.3 t -144.06 -26.15 0.54 Allowed 'General case' 0 CA--C 1.535 0.392 0 C-N-CA 124.431 1.092 . . . . 0.0 112.126 -179.341 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 55' ' ' ASN . . . . . . . . . . . . . 0.5 OUTLIER -140.19 -10.75 1.11 Allowed 'General case' 0 N--CA 1.473 0.678 0 CA-C-N 119.924 1.238 . . . . 0.0 113.489 177.246 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 56' ' ' GLY . . . . . . . . . . . . . . . 126.3 6.23 5.82 Favored Glycine 0 CA--C 1.532 1.095 0 O-C-N 121.242 -0.911 . . . . 0.0 112.069 -173.063 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 57' ' ' GLU . . . . . . . . . . . . . 28.1 tt0 -114.26 113.71 24.98 Favored 'General case' 0 C--O 1.237 0.426 0 C-N-CA 125.419 1.488 . . . . 0.0 108.387 -169.535 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 58' ' ' LEU . . . . . . . . . . . . . 47.6 tp -94.36 97.4 10.18 Favored 'General case' 0 CA--C 1.533 0.305 0 C-N-CA 122.878 0.471 . . . . 0.0 110.439 175.354 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 59' ' ' THR . . . . . . . . . . . . . 6.4 p -99.29 139.01 35.57 Favored 'General case' 0 C--O 1.237 0.422 0 C-N-CA 124.171 0.988 . . . . 0.0 110.057 168.66 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 60' ' ' ALA . . . . . . . . . . . . . . . -94.34 108.73 20.62 Favored 'General case' 0 C--O 1.234 0.253 0 C-N-CA 124.799 1.239 . . . . 0.0 109.594 171.523 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 61' ' ' LYS . . . . . . . . . . . . . 11.0 tttt -75.36 72.0 2.37 Favored 'General case' 0 C--O 1.235 0.338 0 C-N-CA 124.916 1.286 . . . . 0.0 108.786 170.06 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 62' ' ' GLY . . . . . . . . . . . . . . . 102.86 104.47 2.86 Favored Glycine 0 N--CA 1.451 -0.349 0 N-CA-C 107.721 -2.152 . . . . 0.0 107.721 -174.433 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 63' ' ' LEU . . . . . . . . . . . . . 1.8 tp -90.42 161.79 15.4 Favored 'General case' 0 N--CA 1.447 -0.619 0 N-CA-C 108.506 -0.924 . . . . 0.0 108.506 160.352 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 64' ' ' ALA . . . . . . . . . . . . . . . -153.8 144.14 22.26 Favored 'General case' 0 C--O 1.235 0.299 0 C-N-CA 124.363 1.065 . . . . 0.0 109.858 165.848 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 65' ' ' MET . . . . . . . . . . . . . 8.5 mtt -145.48 169.31 18.6 Favored 'General case' 0 N--CA 1.472 0.628 0 C-N-CA 127.014 2.126 . . . . 0.0 111.752 -172.313 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 66' ' ' THR . . . . . . . . . . . . . 6.7 p -105.33 -172.37 2.08 Favored 'General case' 0 CA--C 1.544 0.748 0 C-N-CA 124.781 1.232 . . . . 0.0 110.78 177.003 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 67' ' ' ARG . . . . . . . . . . . . . 64.9 mtm-85 -121.48 76.14 1.23 Allowed 'General case' 0 N--CA 1.47 0.571 0 C-N-CA 124.728 1.211 . . . . 0.0 109.604 169.943 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 68' ' ' MET . . . . . . . . . . . . . 78.6 mtm -102.79 178.33 4.6 Favored 'General case' 0 CA--C 1.533 0.322 0 C-N-CA 124.924 1.29 . . . . 0.0 110.81 171.95 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 69' ' ' MET . . . . . . . . . . . . . 0.4 OUTLIER -137.24 171.7 14.09 Favored 'General case' 0 C--O 1.237 0.434 0 C-N-CA 127.058 2.143 . . . . 0.0 105.233 166.54 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 70' ' ' CYS . . . . . 1.293 ' SG ' ' SG ' ' A' ' 44' ' ' CYS . 97.0 m -141.51 9.03 2.01 Favored 'General case' 0 C--N 1.328 -0.327 0 N-CA-C 115.251 1.574 . . . . 0.0 115.251 -168.438 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 71' ' ' ALA . . . . . . . . . . . . . . . 62.19 2.23 0.8 Allowed 'General case' 0 CA--C 1.536 0.43 0 C-N-CA 126.72 2.008 . . . . 0.0 115.037 179.088 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 72' ' ' ASN . . . . . . . . . . . . . 0.1 OUTLIER -121.83 157.12 58.2 Favored Pre-proline 0 N--CA 1.476 0.867 0 N-CA-C 106.53 -1.655 . . . . 0.0 106.53 156.368 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 73' ' ' PRO . . . . . . . . . . . . . 64.7 Cg_endo -77.38 -41.85 0.32 Allowed 'Trans proline' 0 N--CA 1.459 -0.519 0 C-N-CA 122.236 1.957 . . . . 0.0 111.817 -178.487 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 74' ' ' GLN . . . . . . . . . . . . . 40.1 tt0 -47.52 -60.57 2.44 Favored 'General case' 0 CA--C 1.532 0.271 0 C-N-CA 126.972 2.109 . . . . 0.0 110.609 -173.959 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 75' ' ' LEU . . . . . . . . . . . . . 82.4 mt -55.44 -40.65 71.81 Favored 'General case' 0 CA--C 1.536 0.42 0 C-N-CA 125.126 1.37 . . . . 0.0 110.537 -177.786 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 76' ' ' ASN . . . . . . . . . . . . . 23.7 t-20 -75.14 -19.93 59.64 Favored 'General case' 0 N--CA 1.467 0.384 0 C-N-CA 125.309 1.444 . . . . 0.0 112.379 -176.05 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 77' ' ' GLU . . . . . . . . . . . . . 0.3 OUTLIER -92.48 -31.35 15.28 Favored 'General case' 0 CA--C 1.535 0.376 0 C-N-CA 124.501 1.12 . . . . 0.0 111.821 174.338 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 78' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -61.21 -25.48 67.08 Favored 'General case' 0 CA--C 1.534 0.347 0 C-N-CA 126.503 1.921 . . . . 0.0 111.787 -176.982 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 79' ' ' ASP . . . . . . . . . . . . . 20.2 m-20 -56.58 -43.44 80.03 Favored 'General case' 0 C--O 1.237 0.395 0 C-N-CA 125.549 1.54 . . . . 0.0 111.254 170.959 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 80' ' ' ASN . . . . . . . . . . . . . 49.1 m-20 -72.85 -32.07 65.21 Favored 'General case' 0 N--CA 1.453 -0.294 0 C-N-CA 119.288 -0.965 . . . . 0.0 110.261 -177.193 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 81' ' ' THR . . . . . . . . . . . . . 0.9 OUTLIER -58.04 -54.1 50.79 Favored 'General case' 0 N--CA 1.452 -0.367 0 CA-C-N 118.835 0.743 . . . . 0.0 110.264 172.567 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 82' ' ' ILE . . . . . . . . . . . . . 7.3 tp -65.06 -36.46 77.86 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.277 0 C-N-CA 119.77 -0.772 . . . . 0.0 110.143 -175.321 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 83' ' ' SER . . . . . . . . . . . . . 6.4 m -56.61 -51.62 67.96 Favored 'General case' 0 N--CA 1.449 -0.525 0 C-N-CA 122.974 0.51 . . . . 0.0 111.474 176.681 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 84' ' ' GLU . . . . . . . . . . . . . 3.3 mm-40 -56.75 -54.92 40.71 Favored 'General case' 0 N--CA 1.452 -0.355 0 C-N-CA 126.059 1.744 . . . . 0.0 110.083 176.414 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 85' ' ' MET . . . . . . . . . . . . . 87.8 mtp -60.95 -41.66 96.72 Favored 'General case' 0 C--N 1.341 0.233 0 CA-C-O 121.863 0.839 . . . . 0.0 108.762 -169.721 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 86' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -77.35 -20.57 54.64 Favored 'General case' 0 C--N 1.331 -0.223 0 O-C-N 121.361 -0.837 . . . . 0.0 112.407 -177.289 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 87' ' ' LYS . . . . . . . . . . . . . 5.4 tttm -72.66 -54.77 8.12 Favored 'General case' 0 N--CA 1.452 -0.364 0 N-CA-C 108.195 -1.039 . . . . 0.0 108.195 170.304 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 88' ' ' GLU . . . . . . . . . . . . . 15.4 pt-20 -73.95 -33.87 64.07 Favored 'General case' 0 CA--C 1.534 0.362 0 CA-C-O 118.667 -0.682 . . . . 0.0 111.918 -168.433 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 89' ' ' GLY . . . . . . . . . . . . . . . 120.33 87.4 1.01 Allowed Glycine 0 C--N 1.335 0.519 0 N-CA-C 108.616 -1.794 . . . . 0.0 108.616 178.509 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 90' ' ' ALA . . . . . 0.697 ' HB1' HD12 ' A' ' 101' ' ' LEU . . . -69.07 119.3 13.15 Favored 'General case' 0 N--CA 1.443 -0.823 0 N-CA-C 107.535 -1.283 . . . . 0.0 107.535 -173.26 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 91' ' ' GLN . . . . . . . . . . . . . 58.9 mm-40 -79.76 116.02 19.69 Favored 'General case' 0 N--CA 1.447 -0.579 0 N-CA-C 105.48 -2.044 . . . . 0.0 105.48 -177.083 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 92' ' ' VAL . . . . . . . . . . . . . 24.2 t -103.55 108.69 25.06 Favored 'Isoleucine or valine' 0 N--CA 1.448 -0.536 0 C-N-CA 127.422 2.289 . . . . 0.0 109.201 -168.787 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 93' ' ' ASP . . . . . . . . . . . . . 5.1 t0 -107.54 68.59 0.72 Allowed 'General case' 0 C--O 1.238 0.489 0 C-N-CA 126.508 1.923 . . . . 0.0 109.051 174.674 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 94' ' ' LEU . . . . . . . . . . . . . 1.7 tm? -75.55 109.93 9.52 Favored 'General case' 0 N--CA 1.452 -0.327 0 N-CA-C 106.882 -1.525 . . . . 0.0 106.882 168.944 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 95' ' ' THR . . . . . . . . . . . . . 7.7 t -89.52 -163.74 1.05 Allowed 'General case' 0 C--N 1.326 -0.42 0 C-N-CA 125.539 1.536 . . . . 0.0 108.387 175.766 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 96' ' ' ALA . . . . . . . . . . . . . . . -44.76 -40.87 6.41 Favored 'General case' 0 CA--C 1.54 0.584 0 C-N-CA 124.609 1.164 . . . . 0.0 113.791 -174.357 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 97' ' ' ASN . . . . . . . . . . . . . 6.2 p30 -162.91 14.52 0.07 Allowed 'General case' 0 N--CA 1.47 0.536 0 C-N-CA 124.681 1.193 . . . . 0.0 113.207 -173.752 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 98' ' ' GLN . . . . . . . . . . . . . 6.0 tt0 -128.83 130.42 46.91 Favored 'General case' 0 C--N 1.333 -0.143 0 N-CA-C 106.555 -1.646 . . . . 0.0 106.555 174.913 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 99' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -81.3 136.13 35.75 Favored 'General case' 0 C--N 1.327 -0.409 0 N-CA-C 107.17 -1.418 . . . . 0.0 107.17 169.465 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 100' ' ' THR . . . . . . . . . . . . . 0.3 OUTLIER -128.84 137.91 51.75 Favored 'General case' 0 N--CA 1.45 -0.456 0 N-CA-C 106.12 -1.807 . . . . 0.0 106.12 165.228 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 101' ' ' LEU . . . . . 0.697 HD12 ' HB1' ' A' ' 90' ' ' ALA . 4.5 mm? -106.63 157.33 17.77 Favored 'General case' 0 N--CA 1.449 -0.502 0 N-CA-C 107.861 -1.163 . . . . 0.0 107.861 164.753 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 102' ' ' ALA . . . . . . . . . . . . . . . -155.31 109.47 2.89 Favored 'General case' 0 C--N 1.329 -0.283 0 N-CA-C 108.321 -0.992 . . . . 0.0 108.321 159.06 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 103' ' ' THR . . . . . . . . . . . . . 0.5 OUTLIER -121.37 -172.66 2.46 Favored 'General case' 0 C--O 1.238 0.476 0 N-CA-C 108.608 -0.886 . . . . 0.0 108.608 -175.687 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 104' ' ' ALA . . . . . . . . . . . . . . . -53.09 -44.17 67.35 Favored 'General case' 0 N--CA 1.454 -0.26 0 O-C-N 121.102 -0.998 . . . . 0.0 110.202 168.728 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 105' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -59.57 -66.7 0.47 Allowed 'General case' 0 C--O 1.234 0.265 0 N-CA-C 113.277 0.843 . . . . 0.0 113.277 -173.758 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 106' ' ' GLN . . . . . . . . . . . . . 7.8 pt20 -166.22 -172.77 2.36 Favored 'General case' 0 CA--C 1.535 0.393 0 C-N-CA 127.114 2.165 . . . . 0.0 108.139 178.76 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 107' ' ' THR . . . . . . . . . . . . . 4.5 t -100.2 157.45 16.57 Favored 'General case' 0 C--O 1.24 0.57 0 C-N-CA 125.441 1.497 . . . . 0.0 108.186 163.267 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 108' ' ' LEU . . . . . . . . . . . . . 76.6 mt -146.95 141.56 26.62 Favored 'General case' 0 C--N 1.332 -0.173 0 C-N-CA 127.071 2.148 . . . . 0.0 105.968 176.757 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 109' ' ' THR . . . . . . . . . . . . . 27.9 m -130.14 126.5 37.67 Favored 'General case' 0 C--O 1.237 0.411 0 N-CA-C 107.959 -1.126 . . . . 0.0 107.959 -174.147 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 110' ' ' TYR . . . . . . . . . . . . . 12.4 m-85 -124.43 158.58 32.43 Favored 'General case' 0 CA--C 1.531 0.237 0 C-N-CA 124.215 1.006 . . . . 0.0 109.375 -176.04 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 111' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -108.75 145.32 35.31 Favored 'General case' 0 CA--C 1.516 -0.362 0 C-N-CA 124.14 0.976 . . . . 0.0 109.905 -178.931 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 112' ' ' LEU . . . . . . . . . . . . . 25.7 tp -75.61 58.56 1.07 Allowed 'General case' 0 CA--C 1.54 0.582 0 C-N-CA 124.816 1.246 . . . . 0.0 108.515 166.917 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 113' ' ' ALA . . . . . . . . . . . . . . . -78.94 64.5 3.89 Favored 'General case' 0 CA--C 1.529 0.163 0 O-C-N 120.534 -1.354 . . . . 0.0 108.102 170.66 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 114' ' ' ASP . . . . . . . . . . . . . 25.2 t0 . . . . . 0 N--CA 1.465 0.316 0 CA-C-O 122.04 0.924 . . . . 0.0 113.322 -161.526 . . . . . . . . 0 0 . 1 . 002 nuclear nobuild core ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 48.5 ttp . . . . . 0 N--CA 1.454 -0.239 0 N-CA-C 109.253 -0.647 . . . . 0.0 109.253 . . . . . . . . . 0 0 . 1 . 002 nuclear nobuild core ' A' A ' 2' ' ' VAL . . . . . . . . . . . . . 12.2 p -58.07 142.8 13.3 Favored 'Isoleucine or valine' 0 C--O 1.241 0.649 0 C-N-CA 124.197 0.999 . . . . 0.0 111.336 177.126 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 3' ' ' THR . . . . . 0.458 ' HB ' ' HD2' ' A' ' 4' ' ' PRO . 51.8 p -126.65 165.67 26.92 Favored Pre-proline 0 CA--C 1.535 0.371 0 C-N-CA 124.54 1.136 . . . . 0.0 110.223 179.467 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 4' ' ' PRO . . . . . 0.458 ' HD2' ' HB ' ' A' ' 3' ' ' THR . 45.2 Cg_endo -69.91 -34.45 14.05 Favored 'Trans proline' 0 CA--C 1.533 0.445 0 C-N-CA 122.672 2.248 . . . . 0.0 113.662 175.893 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 5' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -49.18 -59.97 3.2 Favored 'General case' 0 N--CA 1.477 0.88 0 C-N-CA 125.747 1.619 . . . . 0.0 110.121 -179.964 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 6' ' ' GLN . . . . . 0.413 HE21 HD23 ' A' ' 94' ' ' LEU . 19.9 pt20 -64.32 14.83 0.02 OUTLIER 'General case' 0 CA--C 1.542 0.64 0 C-N-CA 127.957 2.503 . . . . 0.0 114.789 176.946 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 7' ' ' LEU . . . . . . . . . . . . . 95.5 mt -132.77 -48.74 0.88 Allowed 'General case' 0 CA--C 1.518 -0.259 0 C-N-CA 124.758 1.223 . . . . 0.0 110.633 -175.734 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 8' ' ' GLN . . . . . . . . . . . . . 5.9 mt-30 -56.83 -5.76 0.27 Allowed 'General case' 0 CA--C 1.536 0.429 0 C-N-CA 126.024 1.73 . . . . 0.0 114.699 -175.725 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 9' ' ' HIS . . . . . . . . . . . . . 95.9 m-70 -125.11 0.63 7.87 Favored 'General case' 0 CA--C 1.532 0.27 0 CA-C-O 118.022 -0.99 . . . . 0.0 113.486 178.534 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 10' ' ' HIS . . . . . . . . . . . . . 98.2 m-70 -120.91 126.59 50.4 Favored 'General case' 0 C--O 1.234 0.253 0 CA-C-N 119.595 1.088 . . . . 0.0 111.919 -170.29 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 11' ' ' ARG . . . . . . . . . . . . . 32.8 ttt180 -70.4 154.38 41.96 Favored 'General case' 0 C--N 1.331 -0.212 0 C-N-CA 124.884 1.274 . . . . 0.0 109.06 162.929 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 12' ' ' PHE . . . . . . . . . . . . . 41.4 m-85 -130.83 165.83 22.15 Favored 'General case' 0 N--CA 1.444 -0.76 0 C-N-CA 125.727 1.611 . . . . 0.0 107.982 164.581 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 13' ' ' VAL . . . . . 0.501 ' HA ' ' HA ' ' A' ' 30' ' ' GLU . 7.3 p -128.86 145.83 35.11 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.436 0 O-C-N 120.924 -1.11 . . . . 0.0 108.562 174.495 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 14' ' ' LEU . . . . . . . . . . . . . 4.9 tp -77.86 86.93 4.08 Favored 'General case' 0 C--O 1.233 0.23 0 N-CA-C 107.452 -1.314 . . . . 0.0 107.452 176.838 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 15' ' ' GLU . . . . . 0.404 ' HG2' ' HE2' ' A' ' 111' ' ' LYS . 17.7 tp10 -70.49 -49.86 43.97 Favored 'General case' 0 C--N 1.323 -0.546 0 CA-C-N 115.718 -0.674 . . . . 0.0 109.455 -176.465 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 63.2 p -147.51 136.2 21.92 Favored 'General case' 0 N--CA 1.446 -0.642 0 CA-C-O 122.363 1.078 . . . . 0.0 111.386 176.408 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 17' ' ' VAL . . . . . . . . . . . . . 3.2 t -77.68 169.04 1.81 Allowed 'Isoleucine or valine' 0 C--O 1.238 0.486 0 C-N-CA 125.71 1.604 . . . . 0.0 107.355 174.324 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 18' ' ' ASN . . . . . . . . . . . . . 0.5 OUTLIER -51.23 -34.68 33.25 Favored 'General case' 0 CA--C 1.534 0.329 0 C-N-CA 123.469 0.707 . . . . 0.0 112.205 165.063 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . -93.01 -45.35 3.61 Favored Glycine 0 CA--C 1.527 0.788 0 CA-C-O 118.395 -1.225 . . . . 0.0 113.875 -170.892 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 13.9 mttt -160.28 166.09 16.39 Favored Pre-proline 0 N--CA 1.469 0.488 0 C-N-CA 126.145 1.778 . . . . 0.0 109.819 -173.261 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 21' ' ' PRO . . . . . . . . . . . . . 91.1 Cg_endo -63.5 -178.78 0.54 Allowed 'Trans proline' 0 CA--C 1.542 0.893 0 C-N-CA 122.718 2.279 . . . . 0.0 111.358 163.477 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 22' ' ' VAL . . . . . . . . . . . . . 4.0 t -131.59 154.74 40.93 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.377 0 C-N-CA 124.107 0.963 . . . . 0.0 108.445 172.881 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 23' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -148.63 112.91 5.25 Favored 'General case' 0 C--O 1.234 0.27 0 N-CA-C 105.791 -1.929 . . . . 0.0 105.791 170.832 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 24' ' ' SER . . . . . . . . . . . . . 15.3 m -121.33 48.94 1.58 Allowed 'General case' 0 N--CA 1.469 0.497 0 CA-C-N 119.505 1.048 . . . . 0.0 108.348 174.769 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 25' ' ' ASP . . . . . . . . . . . . . 38.4 t0 51.35 -83.77 0.01 OUTLIER 'General case' 0 N--CA 1.453 -0.308 0 C-N-CA 128.671 2.788 . . . . 0.0 110.852 -169.787 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 26' ' ' LYS . . . . . . . . . . . . . 32.6 tttm -130.5 -4.71 4.23 Favored 'General case' 0 CA--C 1.537 0.465 0 C-N-CA 125.698 1.599 . . . . 0.0 111.214 -172.121 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 27' ' ' ASN . . . . . . . . . . . . . 6.2 p30 -118.8 58.38 3.68 Favored Pre-proline 0 CA--C 1.545 0.753 0 C-N-CA 126.26 1.824 . . . . 0.0 112.885 177.735 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 28' ' ' PRO . . . . . . . . . . . . . 54.1 Cg_endo -71.09 168.07 24.3 Favored 'Trans proline' 0 CA--C 1.548 1.215 0 C-N-CA 123.72 2.947 . . . . 0.0 112.627 -176.6 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 29' ' ' PRO . . . . . . . . . . . . . 20.6 Cg_endo -73.2 63.71 4.3 Favored 'Trans proline' 0 C--N 1.355 0.873 0 C-N-CA 123.59 2.86 . . . . 0.0 113.525 179.067 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 30' ' ' GLU . . . . . 0.501 ' HA ' ' HA ' ' A' ' 13' ' ' VAL . 8.7 pt-20 -72.15 169.44 16.09 Favored 'General case' 0 CA--C 1.537 0.469 0 O-C-N 120.228 -1.545 . . . . 0.0 111.638 175.148 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 31' ' ' ILE . . . . . . . . . . . . . 16.6 tt -143.46 146.46 21.27 Favored 'Isoleucine or valine' 0 CA--C 1.529 0.166 0 N-CA-C 107.909 -1.145 . . . . 0.0 107.909 -179.39 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 32' ' ' SER . . . . . . . . . . . . . 14.7 p -137.48 157.26 46.94 Favored 'General case' 0 C--O 1.237 0.441 0 O-C-N 120.962 -1.086 . . . . 0.0 109.669 170.986 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 33' ' ' PHE . . . . . . . . . . . . . 86.5 m-85 -121.99 155.92 34.56 Favored 'General case' 0 N--CA 1.442 -0.857 0 N-CA-C 107.207 -1.405 . . . . 0.0 107.207 177.681 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 34' ' ' GLY . . . . . . . . . . . . . . . -149.87 -165.12 12.24 Favored Glycine 0 CA--C 1.516 0.12 0 N-CA-C 109.271 -1.532 . . . . 0.0 109.271 177.189 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 35' ' ' GLU . . . . . . . . . . . . . 0.2 OUTLIER -44.1 154.57 0.11 Allowed 'General case' 0 C--O 1.235 0.337 0 C-N-CA 126.745 2.018 . . . . 0.0 111.577 177.774 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 37.8 mtpt 55.92 13.92 1.24 Allowed 'General case' 0 CA--C 1.532 0.275 0 C-N-CA 124.778 1.231 . . . . 0.0 112.311 -171.659 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 37' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER 59.36 25.99 14.78 Favored 'General case' 0 CA--C 1.542 0.653 0 C-N-CA 124.872 1.269 . . . . 0.0 110.903 -175.135 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 38' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -61.86 164.54 6.27 Favored 'General case' 0 N--CA 1.444 -0.748 0 O-C-N 120.449 -1.407 . . . . 0.0 111.575 173.015 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 39' ' ' ILE . . . . . . . . . . . . . 10.6 mt -134.05 139.26 48.72 Favored 'Isoleucine or valine' 0 C--O 1.238 0.455 0 N-CA-C 106.732 -1.581 . . . . 0.0 106.732 -172.108 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 40' ' ' SER . . . . . . . . . . . . . 58.8 m -136.29 152.82 51.1 Favored 'General case' 0 C--O 1.234 0.266 0 N-CA-C 109.591 -0.522 . . . . 0.0 109.591 156.067 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 41' ' ' GLY . . . . . . . . . . . . . . . -164.98 -175.26 35.55 Favored Glycine 0 CA--C 1.527 0.835 0 C-N-CA 124.645 1.117 . . . . 0.0 110.323 172.532 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 42' ' ' SER . . . . . . . . . . . . . 22.1 p -151.27 87.43 1.39 Allowed 'General case' 0 N--CA 1.445 -0.713 0 C-N-CA 124.69 1.196 . . . . 0.0 110.02 177.737 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 43' ' ' MET . . . . . . . . . . . . . 6.2 mmt -61.11 -66.95 0.45 Allowed 'General case' 0 C--N 1.341 0.236 0 N-CA-C 108.455 -0.942 . . . . 0.0 108.455 169.601 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 44' ' ' CYS . . . . . 1.288 ' SG ' ' SG ' ' A' ' 70' ' ' CYS . 17.1 t -138.01 -57.04 0.67 Allowed 'General case' 0 N--CA 1.447 -0.586 0 N-CA-C 106.446 -1.687 . . . . 0.0 106.446 164.571 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 45' ' ' ASN . . . . . . . . . . . . . 5.8 m-80 -76.68 8.28 3.78 Favored 'General case' 0 N--CA 1.464 0.259 0 C-N-CA 127.4 2.28 . . . . 0.0 115.854 -168.394 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 46' ' ' ARG . . . . . . . . . . . . . 8.7 mtm180 53.37 160.24 0.01 OUTLIER 'General case' 0 CA--C 1.52 -0.176 0 C-N-CA 126.78 2.032 . . . . 0.0 112.362 -155.936 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 47' ' ' PHE . . . . . . . . . . . . . 48.8 p90 -159.32 153.1 23.01 Favored 'General case' 0 C--N 1.321 -0.657 0 CA-C-N 113.653 -1.612 . . . . 0.0 107.672 164.83 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 48' ' ' SER . . . . . . . . . . . . . 3.3 m -154.26 156.93 37.93 Favored 'General case' 0 N--CA 1.444 -0.754 0 C-N-CA 125.696 1.598 . . . . 0.0 106.823 176.391 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 49' ' ' GLY . . . . . . . . . . . . . . . 174.57 163.86 28.5 Favored Glycine 0 N--CA 1.448 -0.543 0 N-CA-C 111.193 -0.763 . . . . 0.0 111.193 167.994 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 50' ' ' GLU . . . . . . . . . . . . . 34.0 tt0 -64.66 100.12 0.36 Allowed 'General case' 0 N--CA 1.445 -0.685 0 C-N-CA 125.437 1.495 . . . . 0.0 108.985 171.985 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 51' ' ' GLY . . . . . . . . . . . . . . . -72.18 177.45 39.25 Favored Glycine 0 CA--C 1.527 0.79 0 N-CA-C 111.483 -0.647 . . . . 0.0 111.483 161.027 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 52' ' ' LYS . . . . . . . . . . . . . 16.6 tttp -162.77 151.24 14.38 Favored 'General case' 0 N--CA 1.455 -0.201 0 N-CA-C 106.985 -1.487 . . . . 0.0 106.985 171.281 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 53' ' ' LEU . . . . . . . . . . . . . 42.7 tp -146.9 119.36 8.45 Favored 'General case' 0 CA--C 1.517 -0.299 0 N-CA-C 107.436 -1.32 . . . . 0.0 107.436 173.808 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 2.1 t -157.64 14.63 0.23 Allowed 'General case' 0 CA--C 1.541 0.608 0 C-N-CA 123.158 0.583 . . . . 0.0 110.768 166.945 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 55' ' ' ASN . . . . . . . . . . . . . 18.2 p-10 -154.87 26.68 0.43 Allowed 'General case' 0 CA--C 1.537 0.446 0 C-N-CA 125.178 1.391 . . . . 0.0 111.528 -169.743 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 56' ' ' GLY . . . . . . . . . . . . . . . 63.62 17.08 59.69 Favored Glycine 0 CA--C 1.531 1.044 0 O-C-N 121.609 -0.682 . . . . 0.0 113.62 -179.605 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 57' ' ' GLU . . . . . . . . . . . . . 33.9 tt0 -129.74 151.12 50.67 Favored 'General case' 0 N--CA 1.451 -0.394 0 C-N-CA 125.633 1.573 . . . . 0.0 107.271 -174.24 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 58' ' ' LEU . . . . . . . . . . . . . 59.0 tp -131.6 107.91 9.17 Favored 'General case' 0 N--CA 1.455 -0.203 0 C-N-CA 125.717 1.607 . . . . 0.0 108.012 175.932 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 59' ' ' THR . . . . . . . . . . . . . 4.5 p -107.57 160.01 16.01 Favored 'General case' 0 CA--C 1.536 0.416 0 C-N-CA 125.726 1.611 . . . . 0.0 110.171 176.594 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 60' ' ' ALA . . . . . . . . . . . . . . . -110.14 102.37 11.08 Favored 'General case' 0 C--O 1.234 0.27 0 C-N-CA 124.851 1.26 . . . . 0.0 111.713 168.569 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 61' ' ' LYS . . . . . . . . . . . . . 0.3 OUTLIER -79.23 5.4 12.35 Favored 'General case' 0 CA--C 1.539 0.526 0 N-CA-C 112.755 0.65 . . . . 0.0 112.755 168.639 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 62' ' ' GLY . . . . . . . . . . . . . . . -167.91 48.68 0.24 Allowed Glycine 0 C--N 1.331 0.303 0 CA-C-N 121.384 1.902 . . . . 0.0 111.487 -177.567 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 63' ' ' LEU . . . . . . . . . . . . . 0.9 OUTLIER -61.29 140.03 58.05 Favored 'General case' 0 N--CA 1.45 -0.457 0 N-CA-C 108.351 -0.981 . . . . 0.0 108.351 171.438 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 64' ' ' ALA . . . . . . . . . . . . . . . -144.12 134.81 24.96 Favored 'General case' 0 N--CA 1.454 -0.25 0 N-CA-C 109.024 -0.732 . . . . 0.0 109.024 171.457 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 65' ' ' MET . . . . . . . . . . . . . 68.4 mtp -139.98 179.49 6.58 Favored 'General case' 0 C--O 1.24 0.604 0 C-N-CA 124.656 1.182 . . . . 0.0 110.094 -170.179 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 66' ' ' THR . . . . . . . . . . . . 0.282 3.3 p -120.4 -163.04 0.98 Allowed 'General case' 0 CA--C 1.551 0.992 0 C-N-CA 125.508 1.523 . . . . 0.0 112.671 -176.306 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 67' ' ' ARG . . . . . . . . . . . . . 17.7 mmt180 -130.15 62.25 1.57 Allowed 'General case' 0 N--CA 1.475 0.813 0 C-N-CA 126.6 1.96 . . . . 0.0 111.715 173.741 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 68' ' ' MET . . . . . . . . . . . . . 77.2 mtm -99.53 171.53 7.87 Favored 'General case' 0 N--CA 1.468 0.429 0 C-N-CA 125.837 1.655 . . . . 0.0 111.684 172.901 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 69' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -129.28 161.81 29.36 Favored 'General case' 0 C--O 1.237 0.402 0 C-N-CA 127.627 2.371 . . . . 0.0 108.489 -176.42 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 70' ' ' CYS . . . . . 1.288 ' SG ' ' SG ' ' A' ' 44' ' ' CYS . 66.2 m -145.74 13.08 1.32 Allowed 'General case' 0 N--CA 1.474 0.773 0 N-CA-C 116.585 2.069 . . . . 0.0 116.585 -170.125 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 71' ' ' ALA . . . . . . . . . . . . . . . 68.39 -28.04 0.15 Allowed 'General case' 0 N--CA 1.473 0.697 0 C-N-CA 127.741 2.416 . . . . 0.0 116.182 166.301 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 72' ' ' ASN . . . . . . . . . . . . . 1.1 t-20 -88.73 163.42 35.52 Favored Pre-proline 0 C--O 1.24 0.564 0 C-N-CA 127.235 2.214 . . . . 0.0 105.844 159.634 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 73' ' ' PRO . . . . . . . . . . . . . 24.6 Cg_endo -92.55 -19.68 0.6 Allowed 'Trans proline' 0 N--CA 1.451 -0.98 0 C-N-CA 121.596 1.531 . . . . 0.0 110.951 169.917 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 74' ' ' GLN . . . . . . . . . . . . . 63.3 tt0 -52.65 -62.62 1.53 Allowed 'General case' 0 C--N 1.343 0.312 0 C-N-CA 125.135 1.374 . . . . 0.0 110.586 -176.657 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 75' ' ' LEU . . . . . . . . . . . . . 19.9 mt -62.93 -28.0 69.76 Favored 'General case' 0 CA--C 1.538 0.481 0 C-N-CA 122.959 0.504 . . . . 0.0 110.451 -173.45 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 76' ' ' ASN . . . . . . . . . . . . . 2.0 t-20 -72.52 -34.64 67.73 Favored 'General case' 0 CA--C 1.532 0.27 0 C-N-CA 126.284 1.834 . . . . 0.0 111.811 -179.867 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 77' ' ' GLU . . . . . . . . . . . . . 1.1 mm-40 -78.99 -30.96 44.67 Favored 'General case' 0 C--O 1.234 0.24 0 C-N-CA 123.757 0.823 . . . . 0.0 110.694 172.451 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 78' ' ' LEU . . . . . . . . . . . . . 3.0 mp -62.68 -35.63 80.3 Favored 'General case' 0 N--CA 1.456 -0.155 0 C-N-CA 124.778 1.231 . . . . 0.0 110.442 -179.688 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 79' ' ' ASP . . . . . . . . . . . . . 74.2 m-20 -53.17 -47.55 68.7 Favored 'General case' 0 CA--C 1.517 -0.312 0 C-N-CA 124.207 1.003 . . . . 0.0 110.699 171.514 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 80' ' ' ASN . . . . . . . . . . . . . 37.4 m-20 -78.16 -35.08 49.26 Favored 'General case' 0 N--CA 1.452 -0.328 0 N-CA-C 108.801 -0.815 . . . . 0.0 108.801 -171.482 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 81' ' ' THR . . . . . . . . . . . . . 12.8 m -58.41 -56.22 24.88 Favored 'General case' 0 N--CA 1.445 -0.719 0 C-N-CA 123.814 0.846 . . . . 0.0 109.701 172.316 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 82' ' ' ILE . . . . . . . . . . . . . 10.2 tp -65.25 -34.35 69.91 Favored 'Isoleucine or valine' 0 C--N 1.34 0.195 0 CA-C-N 120.093 1.315 . . . . 0.0 110.905 -174.089 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 83' ' ' SER . . . . . . . . . . . . . 11.2 t -62.35 -54.25 43.13 Favored 'General case' 0 N--CA 1.446 -0.649 0 N-CA-C 109.249 -0.648 . . . . 0.0 109.249 -179.0 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 84' ' ' GLU . . . . . . . . . . . . . 4.5 mm-40 -57.56 -44.83 85.57 Favored 'General case' 0 N--CA 1.449 -0.484 0 C-N-CA 124.864 1.266 . . . . 0.0 110.127 174.99 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 85' ' ' MET . . . . . . . . . . . . . 95.4 mtp -73.02 -1.1 15.85 Favored 'General case' 0 CA--C 1.518 -0.284 0 CA-C-N 119.175 0.898 . . . . 0.0 112.665 -173.86 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 86' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -112.73 -16.19 12.82 Favored 'General case' 0 C--N 1.327 -0.398 0 CA-C-N 119.686 1.13 . . . . 0.0 110.786 170.941 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 87' ' ' LYS . . . . . . . . . . . . . 1.8 mptp? -79.3 -26.84 42.21 Favored 'General case' 0 N--CA 1.453 -0.286 0 CA-C-O 117.861 -1.066 . . . . 0.0 112.385 -173.578 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 88' ' ' GLU . . . . . . . . . . . . . 22.7 pt-20 -110.23 0.77 18.29 Favored 'General case' 0 CA--C 1.54 0.573 0 C-N-CA 124.977 1.311 . . . . 0.0 113.476 -170.778 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 89' ' ' GLY . . . . . . . . . . . . . . . 86.04 99.78 0.75 Allowed Glycine 0 C--N 1.338 0.679 0 C-N-CA 126.862 2.173 . . . . 0.0 110.256 -173.276 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 90' ' ' ALA . . . . . . . . . . . . . . . -71.87 139.68 48.95 Favored 'General case' 0 N--CA 1.465 0.309 0 N-CA-C 107.591 -1.263 . . . . 0.0 107.591 164.988 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 91' ' ' GLN . . . . . . . . . . . . . 78.1 mm-40 -74.17 145.89 43.87 Favored 'General case' 0 N--CA 1.445 -0.677 0 N-CA-C 105.771 -1.937 . . . . 0.0 105.771 158.359 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 92' ' ' VAL . . . . . . . . . . . . . 7.9 p -135.02 124.51 43.19 Favored 'Isoleucine or valine' 0 N--CA 1.449 -0.476 0 N-CA-C 106.645 -1.613 . . . . 0.0 106.645 -172.346 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 93' ' ' ASP . . . . . . . . . . . . . 4.1 m-20 -142.21 85.97 1.94 Allowed 'General case' 0 C--O 1.232 0.169 0 N-CA-C 107.893 -1.151 . . . . 0.0 107.893 -174.098 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 94' ' ' LEU . . . . . 0.413 HD23 HE21 ' A' ' 6' ' ' GLN . 42.7 tp -77.9 111.08 13.38 Favored 'General case' 0 N--CA 1.461 0.118 0 N-CA-C 107.474 -1.306 . . . . 0.0 107.474 169.891 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 95' ' ' THR . . . . . . . . . . . . . 8.9 t -77.73 -176.38 4.34 Favored 'General case' 0 CA--C 1.535 0.402 0 N-CA-C 109.292 -0.633 . . . . 0.0 109.292 165.258 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 96' ' ' ALA . . . . . . . . . . . . . . . -44.17 -41.1 5.49 Favored 'General case' 0 CA--C 1.532 0.27 0 C-N-CA 126.58 1.952 . . . . 0.0 113.053 -171.999 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 97' ' ' ASN . . . . . . . . . . . . . 12.9 p30 -161.41 70.25 0.35 Allowed 'General case' 0 N--CA 1.449 -0.516 0 C-N-CA 124.474 1.11 . . . . 0.0 108.174 168.532 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 98' ' ' GLN . . . . . . . . . . . . . 0.3 OUTLIER -170.25 135.31 1.28 Allowed 'General case' 0 N--CA 1.472 0.654 0 C-N-CA 125.836 1.654 . . . . 0.0 107.501 157.582 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 99' ' ' LEU . . . . . 0.699 HD22 ' CD2' ' A' ' 101' ' ' LEU . 0.5 OUTLIER -85.5 112.13 20.63 Favored 'General case' 0 N--CA 1.451 -0.383 0 C-N-CA 123.681 0.792 . . . . 0.0 109.736 174.775 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' A' A ' 100' ' ' THR . . . . . . . . . . . . . 53.4 m -89.42 115.66 27.03 Favored 'General case' 0 C--N 1.324 -0.504 0 N-CA-C 106.338 -1.727 . . . . 0.0 106.338 166.751 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 101' ' ' LEU . . . . . 0.699 ' CD2' HD22 ' A' ' 99' ' ' LEU . 1.7 mm? -109.7 141.67 41.95 Favored 'General case' 0 CA--C 1.507 -0.7 0 C-N-CA 124.656 1.182 . . . . 0.0 108.661 171.892 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 102' ' ' ALA . . . . . . . . . . . . . . . -145.0 143.55 30.56 Favored 'General case' 0 C--O 1.234 0.277 0 O-C-N 124.504 1.128 . . . . 0.0 110.351 178.573 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 103' ' ' THR . . . . . . . . . . . . . 0.6 OUTLIER -158.65 171.84 19.37 Favored 'General case' 0 N--CA 1.443 -0.818 0 C-N-CA 126.868 2.067 . . . . 0.0 108.278 174.35 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 104' ' ' ALA . . . . . . . . . . . . . . . -58.24 -35.39 71.65 Favored 'General case' 0 CA--C 1.533 0.326 0 O-C-N 121.34 -0.85 . . . . 0.0 111.275 178.117 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 105' ' ' LYS . . . . . . . . . . . . . 1.4 mmpt? -55.76 -72.58 0.07 Allowed 'General case' 0 CA--C 1.534 0.337 0 CA-C-O 118.424 -0.798 . . . . 0.0 113.005 170.992 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 106' ' ' GLN . . . . . . . . . . . . . 3.0 pt20 -159.8 -165.12 1.45 Allowed 'General case' 0 CA--C 1.536 0.41 0 C-N-CA 124.215 1.006 . . . . 0.0 110.129 -174.301 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 107' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -134.26 134.22 41.7 Favored 'General case' 0 CA--C 1.537 0.449 0 C-N-CA 126.564 1.945 . . . . 0.0 106.445 -179.5 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 108' ' ' LEU . . . . . . . . . . . . . 3.8 mm? -112.14 156.65 21.93 Favored 'General case' 0 C--O 1.235 0.315 0 C-N-CA 124.867 1.267 . . . . 0.0 109.065 174.585 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 109' ' ' THR . . . . . . . . . . . . . 3.3 m -127.52 87.77 2.68 Favored 'General case' 0 C--O 1.237 0.408 0 N-CA-C 105.946 -1.872 . . . . 0.0 105.946 -177.097 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 110' ' ' TYR . . . . . . . . . . . . . 91.4 m-85 -91.54 139.01 31.12 Favored 'General case' 0 CA--C 1.531 0.217 0 N-CA-C 109.42 -0.585 . . . . 0.0 109.42 -175.344 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 111' ' ' LYS . . . . . 0.404 ' HE2' ' HG2' ' A' ' 15' ' ' GLU . 2.5 tppt? -94.61 141.69 28.32 Favored 'General case' 0 N--CA 1.464 0.234 0 C-N-CA 123.733 0.813 . . . . 0.0 108.894 -178.47 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 112' ' ' LEU . . . . . . . . . . . . . 19.8 tp -75.07 49.67 0.45 Allowed 'General case' 0 CA--C 1.544 0.713 0 C-N-CA 126.572 1.949 . . . . 0.0 110.078 173.48 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 113' ' ' ALA . . . . . . . . . . . . . . . -84.25 78.46 9.78 Favored 'General case' 0 C--O 1.234 0.261 0 O-C-N 119.771 -1.83 . . . . 0.0 108.709 177.366 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 114' ' ' ASP . . . . . . . . . . . . . 1.9 p-10 . . . . . 0 C--N 1.328 -0.341 0 C-N-CA 124.098 0.959 . . . . 0.0 113.231 -170.759 . . . . . . . . 0 0 . 1 . 003 nuclear nobuild core ' A' A ' 1' ' ' MET . . . . . 0.413 ' O ' HG12 ' A' ' 2' ' ' VAL . 0.0 OUTLIER . . . . . 0 C--O 1.234 0.239 0 N-CA-C 114.106 1.15 . . . . 0.0 114.106 . . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 2' ' ' VAL . . . . . 0.53 HG23 HE21 ' A' ' 6' ' ' GLN 0.267 10.0 p 54.68 165.7 0.0 OUTLIER 'Isoleucine or valine' 0 CA--C 1.547 0.857 0 C-N-CA 129.588 3.155 . . . . 0.0 111.705 -170.223 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' A' A ' 3' ' ' THR . . . . . . . . . . . . . 25.3 p -130.01 155.77 80.14 Favored Pre-proline 0 CA--C 1.533 0.307 0 O-C-N 119.628 -1.92 . . . . 0.0 109.774 170.942 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 4' ' ' PRO . . . . . . . . . . . . . 58.2 Cg_endo -62.28 -33.11 81.66 Favored 'Trans proline' 0 C--N 1.345 0.386 0 C-N-CA 124.139 3.226 . . . . 0.0 112.221 178.217 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 5' ' ' GLU . . . . . . . . . . . . . 11.8 tt0 -51.68 -36.29 45.89 Favored 'General case' 0 C--N 1.318 -0.778 0 C-N-CA 125.2 1.4 . . . . 0.0 112.197 171.343 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 6' ' ' GLN . . . . . 0.53 HE21 HG23 ' A' ' 2' ' ' VAL . 6.4 mt-30 -73.04 10.67 0.86 Allowed 'General case' 0 CA--C 1.545 0.783 0 C-N-CA 123.7 0.8 . . . . 0.0 112.265 173.725 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 7' ' ' LEU . . . . . 0.52 HD22 ' CE2' ' A' ' 33' ' ' PHE . 97.7 mt -136.54 -50.61 0.68 Allowed 'General case' 0 C--O 1.223 -0.335 0 C-N-CA 125.103 1.361 . . . . 0.0 112.56 -172.503 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 8' ' ' GLN . . . . . . . . . . . . . 1.8 mt-30 -53.01 -8.32 0.1 Allowed 'General case' 0 N--CA 1.481 1.106 0 C-N-CA 126.163 1.785 . . . . 0.0 115.748 -174.993 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 9' ' ' HIS . . . . . . . . . . . . . 98.1 m-70 -131.09 7.14 4.63 Favored 'General case' 0 CA--C 1.537 0.48 0 C-N-CA 125.017 1.327 . . . . 0.0 112.763 177.581 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 10' ' ' HIS . . . . . . . . . . . . . 95.1 m-70 -130.57 116.8 18.64 Favored 'General case' 0 C--O 1.233 0.212 0 C-N-CA 125.247 1.419 . . . . 0.0 110.464 -169.537 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 11' ' ' ARG . . . . . . . . . . . . . 32.3 ttm-85 -70.15 155.12 41.08 Favored 'General case' 0 CA--C 1.518 -0.263 0 C-N-CA 124.406 1.082 . . . . 0.0 108.64 169.656 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 12' ' ' PHE . . . . . . . . . . . . . 74.9 m-85 -139.06 153.87 48.12 Favored 'General case' 0 CA--C 1.501 -0.923 0 CA-C-O 122.732 1.253 . . . . 0.0 109.233 163.809 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 13' ' ' VAL . . . . . . . . . . . . . 0.0 OUTLIER -130.3 135.13 61.37 Favored 'Isoleucine or valine' 0 CA--C 1.494 -1.187 0 CA-C-N 113.286 -1.779 . . . . 0.0 114.99 -173.81 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 14' ' ' LEU . . . . . . . . . . . . . 2.2 tt -65.09 110.84 2.65 Favored 'General case' 0 CA--C 1.497 -1.091 0 O-C-N 126.135 2.147 . . . . 0.0 109.135 -173.144 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 0.9 OUTLIER -94.3 -52.46 4.34 Favored 'General case' 0 N--CA 1.426 -1.665 0 O-C-N 125.576 1.797 . . . . 0.0 108.446 -168.913 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 16' ' ' SER . . . . . 0.448 ' HA ' ' HA ' ' A' ' 21' ' ' PRO . 87.1 p -139.94 150.41 44.5 Favored 'General case' 0 N--CA 1.444 -0.738 0 CA-C-N 115.523 -0.762 . . . . 0.0 110.569 166.536 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 17' ' ' VAL . . . . . 0.55 HG12 ' H ' ' A' ' 18' ' ' ASN . 2.7 t -83.8 178.35 0.55 Allowed 'Isoleucine or valine' 0 N--CA 1.443 -0.779 0 N-CA-C 107.251 -1.389 . . . . 0.0 107.251 176.334 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 18' ' ' ASN . . . . . 0.55 ' H ' HG12 ' A' ' 17' ' ' VAL . 0.0 OUTLIER -50.44 -28.65 8.63 Favored 'General case' 0 N--CA 1.464 0.273 0 N-CA-C 114.633 1.346 . . . . 0.0 114.633 -178.812 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . -104.31 -76.96 1.13 Allowed Glycine 0 N--CA 1.445 -0.712 0 N-CA-C 109.652 -1.379 . . . . 0.0 109.652 171.167 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 16.3 mttt -125.07 165.73 24.28 Favored Pre-proline 0 N--CA 1.466 0.345 0 C-N-CA 124.702 1.201 . . . . 0.0 112.318 -167.473 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 21' ' ' PRO . . . . . 0.448 ' HA ' ' HA ' ' A' ' 16' ' ' SER . 56.1 Cg_endo -61.8 167.85 9.59 Favored 'Trans proline' 0 N--CA 1.458 -0.617 0 C-N-CA 123.607 2.871 . . . . 0.0 113.142 170.126 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 22' ' ' VAL . . . . . . . . . . . . . 7.9 p -141.1 157.47 22.52 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.357 0 C-N-CA 127.733 2.413 . . . . 0.0 105.731 -178.419 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 23' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -145.89 91.82 2.13 Favored 'General case' 0 C--O 1.236 0.38 0 N-CA-C 108.571 -0.9 . . . . 0.0 108.571 176.539 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 24' ' ' SER . . . . . . . . . . . . . 61.1 m -77.64 49.2 0.73 Allowed 'General case' 0 CA--C 1.533 0.29 0 C-N-CA 125.284 1.434 . . . . 0.0 110.271 178.467 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 25' ' ' ASP . . . . . . . . . . . . . 0.7 OUTLIER 56.8 -84.46 0.02 OUTLIER 'General case' 0 CA--C 1.514 -0.408 0 C-N-CA 127.728 2.411 . . . . 0.0 110.536 -169.602 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 26' ' ' LYS . . . . . . . . . . . . . 35.5 tttt -142.74 3.91 1.47 Allowed 'General case' 0 C--N 1.325 -0.483 0 C-N-CA 127.957 2.503 . . . . 0.0 110.29 -168.342 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 27' ' ' ASN . . . . . . . . . . . . . 70.6 m-80 -122.05 62.98 15.77 Favored Pre-proline 0 N--CA 1.453 -0.281 0 C-N-CA 127.156 2.182 . . . . 0.0 107.207 -173.165 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 28' ' ' PRO . . . . . . . . . . . . . 65.7 Cg_endo -64.54 159.14 46.06 Favored 'Trans proline' 0 C--O 1.24 0.622 0 C-N-CA 122.615 2.21 . . . . 0.0 110.864 -172.657 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 29' ' ' PRO . . . . . . . . . . . . . 28.0 Cg_endo -71.99 63.99 3.31 Favored 'Trans proline' 0 N--CA 1.456 -0.682 0 C-N-CA 122.829 2.352 . . . . 0.0 110.048 166.818 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 30' ' ' GLU . . . . . . . . . . . . . 1.6 pt-20 -72.09 166.23 22.71 Favored 'General case' 0 CA--C 1.542 0.664 0 N-CA-C 108.31 -0.996 . . . . 0.0 108.31 177.439 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 31' ' ' ILE . . . . . . . . . . . . . 10.6 tt -138.31 150.66 24.45 Favored 'Isoleucine or valine' 0 N--CA 1.445 -0.711 0 N-CA-C 105.627 -1.99 . . . . 0.0 105.627 172.789 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 32' ' ' SER . . . . . . . . . . . . . 78.0 p -144.97 174.3 11.14 Favored 'General case' 0 N--CA 1.432 -1.359 0 CA-C-O 122.691 1.234 . . . . 0.0 108.907 165.919 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 33' ' ' PHE . . . . . 0.52 ' CE2' HD22 ' A' ' 7' ' ' LEU . 77.0 m-85 -136.31 164.43 28.11 Favored 'General case' 0 N--CA 1.434 -1.246 0 N-CA-C 106.372 -1.714 . . . . 0.0 106.372 -173.371 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 34' ' ' GLY . . . . . . . . . . . . . . . 165.08 -168.83 39.42 Favored Glycine 0 N--CA 1.445 -0.765 0 N-CA-C 110.073 -1.211 . . . . 0.0 110.073 176.918 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 35' ' ' GLU . . . . . . . . . . . . . 3.4 mt-10 63.69 -86.14 0.02 OUTLIER 'General case' 0 C--N 1.331 -0.202 0 C-N-CA 125.813 1.645 . . . . 0.0 110.064 -178.396 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 29.7 mtpt -154.42 72.31 0.86 Allowed 'General case' 0 N--CA 1.44 -0.965 0 C-N-CA 126.926 2.09 . . . . 0.0 110.67 -176.277 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 37' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER 55.72 26.68 9.69 Favored 'General case' 0 CA--C 1.539 0.543 0 C-N-CA 123.998 0.919 . . . . 0.0 109.428 -178.036 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 38' ' ' MET . . . . . . . . . . . . . 10.4 mtp -73.82 164.89 26.04 Favored 'General case' 0 N--CA 1.448 -0.557 0 N-CA-C 108.246 -1.02 . . . . 0.0 108.246 172.279 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 39' ' ' ILE . . . . . . . . . . . . . 34.1 mt -135.93 134.4 50.85 Favored 'Isoleucine or valine' 0 C--O 1.235 0.323 0 N-CA-C 108.163 -1.051 . . . . 0.0 108.163 -178.428 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 40' ' ' SER . . . . . . . . . . . . . 34.5 t -142.02 144.83 33.83 Favored 'General case' 0 CA--C 1.536 0.405 0 C-N-CA 125.051 1.34 . . . . 0.0 108.824 177.377 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 41' ' ' GLY . . . . . . . . . . . . . . . -177.64 -176.35 45.6 Favored Glycine 0 CA--C 1.528 0.845 0 N-CA-C 111.333 -0.707 . . . . 0.0 111.333 177.98 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 42' ' ' SER . . . . . . . . . . . . . 34.0 p -143.81 80.3 1.65 Allowed 'General case' 0 CA--C 1.538 0.497 0 C-N-CA 123.007 0.523 . . . . 0.0 111.829 -171.89 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 43' ' ' MET . . . . . . . . . . . . . 3.1 mmt -63.79 -59.75 4.16 Favored 'General case' 0 N--CA 1.472 0.662 0 O-C-N 121.107 -0.996 . . . . 0.0 109.918 173.76 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 44' ' ' CYS . . . . . 1.288 ' SG ' ' SG ' ' A' ' 70' ' ' CYS . 41.9 t -129.06 -66.0 0.84 Allowed 'General case' 0 N--CA 1.451 -0.383 0 N-CA-C 108.156 -1.053 . . . . 0.0 108.156 151.298 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 45' ' ' ASN . . . . . . . . . . . . . 0.6 OUTLIER -87.84 19.78 3.36 Favored 'General case' 0 C--N 1.33 -0.259 0 N-CA-C 114.215 1.191 . . . . 0.0 114.215 -152.242 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 46' ' ' ARG . . . . . . . . . . . . . 17.4 mmm-85 57.46 162.74 0.03 OUTLIER 'General case' 0 CA--C 1.52 -0.178 0 C-N-CA 128.823 2.849 . . . . 0.0 112.025 -158.385 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 47' ' ' PHE . . . . . . . . . . . . . 53.9 p90 -158.28 162.4 37.77 Favored 'General case' 0 C--O 1.242 0.678 0 C-N-CA 125.513 1.525 . . . . 0.0 107.163 172.361 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 48' ' ' SER . . . . . . . . . . . . . 2.5 p -167.87 142.24 3.55 Favored 'General case' 0 C--O 1.236 0.381 0 C-N-CA 123.747 0.819 . . . . 0.0 109.073 -178.01 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 49' ' ' GLY . . . . . . . . . . . . . . . -171.12 169.63 42.62 Favored Glycine 0 C--N 1.337 0.633 0 CA-C-N 119.979 1.263 . . . . 0.0 110.648 -177.661 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 50' ' ' GLU . . . . . . . . . . . . . 36.7 mt-10 -83.01 102.55 11.83 Favored 'General case' 0 N--CA 1.446 -0.632 0 N-CA-C 106.412 -1.699 . . . . 0.0 106.412 177.767 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 51' ' ' GLY . . . . . . . . . . . . . . . -64.16 167.08 27.8 Favored Glycine 0 CA--C 1.528 0.85 0 CA-C-O 122.705 1.169 . . . . 0.0 112.859 165.312 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 52' ' ' LYS . . . . . . . . . . . . . 60.6 tttm -152.97 140.36 19.62 Favored 'General case' 0 C--N 1.331 -0.232 0 N-CA-C 105.543 -2.021 . . . . 0.0 105.543 164.538 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 53' ' ' LEU . . . . . . . . . . . . . 15.2 tp -142.37 133.23 25.65 Favored 'General case' 0 CA--C 1.52 -0.173 0 C-N-CA 123.968 0.907 . . . . 0.0 108.745 179.09 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER -149.52 -38.62 0.15 Allowed 'General case' 0 CA--C 1.541 0.616 0 C-N-CA 125.54 1.536 . . . . 0.0 110.144 177.489 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 55' ' ' ASN . . . . . . . . . . . . . 2.6 t30 -124.38 7.0 8.36 Favored 'General case' 0 N--CA 1.471 0.583 0 N-CA-C 115.49 1.663 . . . . 0.0 115.49 -157.115 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 56' ' ' GLY . . . . . . . . . . . . . . . 90.22 13.16 60.67 Favored Glycine 0 N--CA 1.468 0.769 0 O-C-N 121.185 -0.947 . . . . 0.0 112.148 -166.013 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 57' ' ' GLU . . . . . . . . . . . . . 42.3 tt0 -130.16 144.4 51.34 Favored 'General case' 0 N--CA 1.446 -0.663 0 C-N-CA 124.652 1.181 . . . . 0.0 109.036 179.326 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 58' ' ' LEU . . . . . 0.435 ' HB2' HG21 ' A' ' 92' ' ' VAL . 5.1 tp -127.99 159.11 36.02 Favored 'General case' 0 N--CA 1.447 -0.618 0 C-N-CA 126.376 1.87 . . . . 0.0 108.788 178.878 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 59' ' ' THR . . . . . . . . . . . . . 0.7 OUTLIER -141.61 174.98 10.05 Favored 'General case' 0 C--N 1.321 -0.649 0 C-N-CA 125.936 1.695 . . . . 0.0 106.988 171.201 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 60' ' ' ALA . . . . . . . . . . . . . . . -134.39 99.91 4.51 Favored 'General case' 0 CA--C 1.516 -0.337 0 N-CA-C 108.043 -1.095 . . . . 0.0 108.043 160.085 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 61' ' ' LYS . . . . . 0.423 ' HE2' ' N ' ' A' ' 62' ' ' GLY . 0.2 OUTLIER -55.74 123.19 13.32 Favored 'General case' 0 C--O 1.234 0.27 0 N-CA-C 107.06 -1.459 . . . . 0.0 107.06 172.017 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' A' A ' 62' ' ' GLY . . . . . 0.423 ' N ' ' HE2' ' A' ' 61' ' ' LYS . . . 96.23 -59.67 1.37 Allowed Glycine 0 CA--C 1.525 0.664 0 C-N-CA 124.981 1.276 . . . . 0.0 111.586 166.109 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 63' ' ' LEU . . . . . 0.439 HD22 ' HA ' ' A' ' 83' ' ' SER . 0.5 OUTLIER 47.07 90.69 0.02 OUTLIER 'General case' 0 CA--C 1.537 0.447 0 C-N-CA 129.187 2.995 . . . . 0.0 114.425 -178.003 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' A' A ' 64' ' ' ALA . . . . . . . . . . . . . . . -88.48 104.53 16.89 Favored 'General case' 0 C--O 1.237 0.411 0 C-N-CA 124.126 0.97 . . . . 0.0 111.026 -178.462 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 65' ' ' MET . . . . . . . . . . . . . 54.8 mtp -97.48 176.47 5.85 Favored 'General case' 0 N--CA 1.471 0.599 0 C-N-CA 123.622 0.769 . . . . 0.0 110.188 172.487 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 66' ' ' THR . . . . . . . . . . . . 0.348 1.5 p -113.77 -164.92 0.96 Allowed 'General case' 0 CA--C 1.556 1.193 0 C-N-CA 124.101 0.96 . . . . 0.0 110.171 178.214 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 67' ' ' ARG . . . . . . . . . . . . . 16.2 mtt180 -136.52 30.94 2.86 Favored 'General case' 0 N--CA 1.489 1.476 0 CA-C-N 120.816 1.644 . . . . 0.0 114.429 -170.808 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 68' ' ' MET . . . . . . . . . . . . . 44.1 mtm -77.81 176.71 8.8 Favored 'General case' 0 CA--C 1.537 0.471 0 O-C-N 120.265 -1.522 . . . . 0.0 111.206 176.646 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 69' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -86.01 170.17 12.52 Favored 'General case' 0 C--O 1.243 0.758 0 C-N-CA 128.693 2.797 . . . . 0.0 108.479 165.842 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 70' ' ' CYS . . . . . 1.288 ' SG ' ' SG ' ' A' ' 44' ' ' CYS . 0.1 OUTLIER -110.02 -177.86 3.37 Favored 'General case' 0 N--CA 1.454 -0.267 0 C-N-CA 125.847 1.659 . . . . 0.0 112.83 -177.869 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' A' A ' 71' ' ' ALA . . . . . . . . . . . . . . . -104.24 -12.45 16.65 Favored 'General case' 0 N--CA 1.466 0.328 0 N-CA-C 112.163 0.431 . . . . 0.0 112.163 165.5 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 72' ' ' ASN . . . . . . . . . . . . . 52.7 t30 -156.07 143.12 13.64 Favored Pre-proline 0 N--CA 1.466 0.357 0 N-CA-C 107.503 -1.295 . . . . 0.0 107.503 -174.353 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 73' ' ' PRO . . . . . . . . . . . . . 38.9 Cg_endo -75.67 -33.52 3.9 Favored 'Trans proline' 0 C--N 1.345 0.342 0 C-N-CA 121.736 1.624 . . . . 0.0 111.447 -167.627 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 74' ' ' GLN . . . . . . . . . . . . . 20.7 tt0 -57.92 -32.91 68.23 Favored 'General case' 0 CA--C 1.535 0.377 0 C-N-CA 124.638 1.175 . . . . 0.0 112.065 177.952 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 75' ' ' LEU . . . . . 0.52 ' HB2' ' SG ' ' A' ' 70' ' ' CYS . 82.3 mt -70.03 -43.34 71.5 Favored 'General case' 0 N--CA 1.465 0.301 0 O-C-N 121.83 -0.544 . . . . 0.0 110.129 172.648 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 76' ' ' ASN . . . . . . . . . . . . . 3.3 t-20 -68.24 -8.02 35.59 Favored 'General case' 0 CA--C 1.532 0.278 0 C-N-CA 125.681 1.592 . . . . 0.0 112.017 -178.913 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 77' ' ' GLU . . . . . . . . . . . . . 32.8 tt0 -102.46 -48.13 4.25 Favored 'General case' 0 N--CA 1.45 -0.459 0 C-N-CA 127.227 2.211 . . . . 0.0 109.295 178.39 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 78' ' ' LEU . . . . . 0.469 HD21 HG13 ' A' ' 17' ' ' VAL . 0.9 OUTLIER -58.02 -25.04 60.61 Favored 'General case' 0 N--CA 1.468 0.443 0 C-N-CA 124.083 0.953 . . . . 0.0 112.762 171.095 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' A' A ' 79' ' ' ASP . . . . . . . . . . . . . 13.4 t70 -46.0 -54.98 7.47 Favored 'General case' 0 N--CA 1.443 -0.777 0 C-N-CA 126.464 1.906 . . . . 0.0 111.236 166.952 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 80' ' ' ASN . . . . . . . . . . . . . 76.8 m-20 -78.77 -34.44 45.62 Favored 'General case' 0 N--CA 1.453 -0.312 0 CA-C-O 118.743 -0.646 . . . . 0.0 109.499 -174.093 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 81' ' ' THR . . . . . . . . . . . . . 13.7 m -49.72 -59.32 3.92 Favored 'General case' 0 CA--C 1.535 0.391 0 C-N-CA 123.898 0.879 . . . . 0.0 110.334 171.088 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 82' ' ' ILE . . . . . . . . . . . . . 7.8 tp -63.49 -35.79 73.82 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.393 0 CA-C-N 119.608 1.095 . . . . 0.0 110.667 -174.291 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 83' ' ' SER . . . . . 0.439 ' HA ' HD22 ' A' ' 63' ' ' LEU . 0.5 OUTLIER -66.78 -12.56 59.29 Favored 'General case' 0 C--O 1.234 0.277 0 C-N-CA 127.345 2.258 . . . . 0.0 113.939 179.128 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' A' A ' 84' ' ' GLU . . . . . . . . . . . . . 89.3 tt0 -114.79 -22.47 9.65 Favored 'General case' 0 C--N 1.324 -0.512 0 C-N-CA 124.888 1.275 . . . . 0.0 111.351 179.902 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 85' ' ' MET . . . . . . . . . . . . . 87.9 mtp -73.04 -55.17 6.88 Favored 'General case' 0 C--O 1.23 0.056 0 CA-C-O 122.682 1.23 . . . . 0.0 108.81 178.375 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 86' ' ' LEU . . . . . . . . . . . . . 1.4 mm? -73.92 -17.56 61.01 Favored 'General case' 0 N--CA 1.454 -0.233 0 C-N-CA 124.979 1.312 . . . . 0.0 111.654 -167.791 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 87' ' ' LYS . . . . . . . . . . . . . 25.1 tttt -72.14 -48.79 41.02 Favored 'General case' 0 N--CA 1.447 -0.603 0 C-N-CA 124.201 1.0 . . . . 0.0 109.156 177.667 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 88' ' ' GLU . . . . . . . . . . . . . 1.9 mm-40 -69.84 -62.9 1.2 Allowed 'General case' 0 N--CA 1.448 -0.548 0 O-C-N 124.254 0.971 . . . . 0.0 108.426 -178.806 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 89' ' ' GLY . . . . . . . . . . . . . . . 144.72 110.27 0.69 Allowed Glycine 0 C--N 1.336 0.557 0 N-CA-C 109.179 -1.568 . . . . 0.0 109.179 -176.276 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 90' ' ' ALA . . . . . . . . . . . . . . . -91.45 142.99 27.08 Favored 'General case' 0 C--N 1.333 -0.119 0 C-N-CA 124.061 0.945 . . . . 0.0 109.06 -178.807 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 91' ' ' GLN . . . . . . . . . . . . . 6.8 mm-40 -74.49 142.33 44.85 Favored 'General case' 0 N--CA 1.443 -0.824 0 N-CA-C 105.752 -1.944 . . . . 0.0 105.752 161.098 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 92' ' ' VAL . . . . . 0.435 HG21 ' HB2' ' A' ' 58' ' ' LEU . 26.6 t -137.45 107.71 5.17 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.491 0 N-CA-C 105.068 -2.197 . . . . 0.0 105.068 -170.761 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 93' ' ' ASP . . . . . . . . . . . . . 2.1 t0 -127.19 97.61 4.99 Favored 'General case' 0 N--CA 1.448 -0.527 0 N-CA-C 108.085 -1.08 . . . . 0.0 108.085 -157.148 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 94' ' ' LEU . . . . . . . . . . . . . 55.9 tp -98.24 104.15 16.16 Favored 'General case' 0 CA--C 1.511 -0.535 0 CA-C-O 122.046 0.927 . . . . 0.0 109.247 -175.045 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 95' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -65.67 174.19 2.43 Favored 'General case' 0 C--N 1.319 -0.726 0 CA-C-N 113.633 -1.621 . . . . 0.0 109.569 167.605 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 96' ' ' ALA . . . . . . . . . . . . . . . -48.51 -33.24 9.18 Favored 'General case' 0 CA--C 1.539 0.55 0 O-C-N 120.826 -1.172 . . . . 0.0 113.856 -172.565 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 97' ' ' ASN . . . . . . . . . . . . . 23.8 p30 -151.41 17.94 0.73 Allowed 'General case' 0 CA--C 1.539 0.526 0 C-N-CA 125.145 1.378 . . . . 0.0 113.559 172.324 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 98' ' ' GLN . . . . . . . . . . . . . 21.5 tt0 -137.32 121.04 17.39 Favored 'General case' 0 N--CA 1.461 0.119 0 O-C-N 120.821 -1.174 . . . . 0.0 110.654 177.323 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 99' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -69.19 140.86 54.62 Favored 'General case' 0 N--CA 1.451 -0.408 0 C-N-CA 126.019 1.728 . . . . 0.0 109.183 169.479 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 100' ' ' THR . . . . . . . . . . . . . 2.5 m -133.65 130.65 38.55 Favored 'General case' 0 C--N 1.323 -0.567 0 N-CA-C 106.795 -1.558 . . . . 0.0 106.795 167.789 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 101' ' ' LEU . . . . . . . . . . . . . 2.6 mp -108.97 158.67 17.48 Favored 'General case' 0 CA--C 1.509 -0.609 0 C-N-CA 125.209 1.404 . . . . 0.0 110.458 174.856 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 102' ' ' ALA . . . . . . . . . . . . . . . -152.18 158.56 43.07 Favored 'General case' 0 C--N 1.327 -0.385 0 C-N-CA 124.559 1.144 . . . . 0.0 108.228 164.558 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 103' ' ' THR . . . . . 0.425 HG22 ' H ' ' A' ' 104' ' ' ALA . 1.3 m -157.24 -172.08 3.87 Favored 'General case' 0 N--CA 1.441 -0.916 0 C-N-CA 127.484 2.314 . . . . 0.0 105.659 167.141 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 104' ' ' ALA . . . . . 0.425 ' H ' HG22 ' A' ' 103' ' ' THR . . . -62.3 -35.48 79.17 Favored 'General case' 0 C--N 1.34 0.196 0 CA-C-N 119.918 1.235 . . . . 0.0 111.536 168.623 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 105' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -59.74 -79.83 0.03 OUTLIER 'General case' 0 C--N 1.339 0.123 0 C-N-CA 123.59 0.756 . . . . 0.0 110.712 -178.03 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 106' ' ' GLN . . . . . . . . . . . . . 26.0 mt-30 -151.53 -176.88 5.78 Favored 'General case' 0 CA--C 1.536 0.424 0 C-N-CA 125.89 1.676 . . . . 0.0 107.301 -169.672 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 107' ' ' THR . . . . . . . . . . . . . 0.1 OUTLIER -138.56 134.47 33.9 Favored 'General case' 0 N--CA 1.453 -0.314 0 C-N-CA 125.943 1.697 . . . . 0.0 106.571 -177.222 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 108' ' ' LEU . . . . . . . . . . . . . 1.5 mm? -125.75 158.48 34.81 Favored 'General case' 0 C--O 1.233 0.197 0 C-N-CA 124.345 1.058 . . . . 0.0 108.401 179.413 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 109' ' ' THR . . . . . . . . . . . . . 27.8 m -122.63 137.52 54.88 Favored 'General case' 0 C--O 1.236 0.356 0 N-CA-C 107.797 -1.186 . . . . 0.0 107.797 177.086 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 110' ' ' TYR . . . . . . . . . . . . . 4.4 m-85 -135.92 145.19 46.0 Favored 'General case' 0 CA--C 1.535 0.395 0 C-N-CA 124.107 0.963 . . . . 0.0 111.761 -178.815 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 111' ' ' LYS . . . . . . . . . . . . . 4.1 tppt? -90.23 150.78 21.82 Favored 'General case' 0 N--CA 1.474 0.764 0 O-C-N 120.82 -1.175 . . . . 0.0 110.806 -179.367 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 112' ' ' LEU . . . . . . . . . . . . . 35.7 tp -74.6 46.47 0.28 Allowed 'General case' 0 CA--C 1.541 0.626 0 C-N-CA 124.792 1.237 . . . . 0.0 109.881 158.653 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 113' ' ' ALA . . . . . . . . . . . . . . . -84.02 102.34 12.42 Favored 'General case' 0 N--CA 1.444 -0.775 0 N-CA-C 104.383 -2.451 . . . . 0.0 104.383 162.147 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 114' ' ' ASP . . . . . . . . . . . . . 57.2 t0 . . . . . 0 CA--C 1.516 -0.331 0 CA-C-O 122.287 1.041 . . . . 0.0 109.495 170.278 . . . . . . . . 0 0 . 1 . 004 nuclear nobuild core ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 10.0 tpt . . . . . 0 C--O 1.235 0.326 0 N-CA-C 107.325 -1.361 . . . . 0.0 107.325 . . . . . . . . . 0 0 . 1 . 004 nuclear nobuild core ' A' A ' 2' ' ' VAL . . . . . . . . . . . . . 2.3 p -59.87 144.56 12.7 Favored 'Isoleucine or valine' 0 C--O 1.234 0.243 0 N-CA-C 108.399 -0.963 . . . . 0.0 108.399 170.227 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 3' ' ' THR . . . . . . . . . . . . . 0.6 OUTLIER -110.42 153.83 43.27 Favored Pre-proline 0 N--CA 1.445 -0.723 0 C-N-CA 123.163 0.585 . . . . 0.0 110.756 172.521 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 4' ' ' PRO . . . . . . . . . . . . . 52.7 Cg_endo -64.95 -33.73 50.66 Favored 'Trans proline' 0 N--CA 1.461 -0.386 0 C-N-CA 123.825 3.017 . . . . 0.0 111.91 -179.263 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 5' ' ' GLU . . . . . . . . . . . . . 65.3 tt0 -49.77 -35.32 22.08 Favored 'General case' 0 CA--C 1.549 0.928 0 C-N-CA 124.216 1.006 . . . . 0.0 111.647 169.759 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 6' ' ' GLN . . . . . . . . . . . . . 11.3 mt-30 -72.46 5.62 2.87 Favored 'General case' 0 CA--C 1.539 0.543 0 O-C-N 120.955 -1.091 . . . . 0.0 112.886 176.08 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 7' ' ' LEU . . . . . . . . . . . . . 93.6 mt -131.52 -54.91 1.02 Allowed 'General case' 0 C--O 1.225 -0.229 0 C-N-CA 125.533 1.533 . . . . 0.0 110.368 -171.615 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 8' ' ' GLN . . . . . . . . . . . . . 4.9 mt-30 -55.41 -6.72 0.19 Allowed 'General case' 0 N--CA 1.479 0.992 0 C-N-CA 127.686 2.394 . . . . 0.0 115.736 -172.815 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 9' ' ' HIS . . . . . . . . . . . . . 76.1 m-70 -139.38 30.31 2.16 Favored 'General case' 0 CA--C 1.54 0.558 0 C-N-CA 125.428 1.491 . . . . 0.0 111.491 178.394 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 10' ' ' HIS . . . . . . . . . . . . . 94.4 m-70 -140.87 142.18 34.55 Favored 'General case' 0 CA--C 1.534 0.344 0 C-N-CA 124.636 1.174 . . . . 0.0 110.917 176.891 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 11' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -88.5 149.03 23.85 Favored 'General case' 0 N--CA 1.463 0.19 0 C-N-CA 124.452 1.101 . . . . 0.0 108.824 167.669 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 12' ' ' PHE . . . . . . . . . . . . . 82.9 m-85 -139.91 154.57 47.27 Favored 'General case' 0 CA--C 1.494 -1.176 0 CA-C-O 122.525 1.155 . . . . 0.0 108.841 169.712 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 13' ' ' VAL . . . . . 0.461 ' CG2' ' HB3' ' A' ' 113' ' ' ALA . 0.0 OUTLIER -127.84 139.46 51.84 Favored 'Isoleucine or valine' 0 N--CA 1.434 -1.242 0 CA-C-N 113.983 -1.462 . . . . 0.0 107.059 -174.103 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' A' A ' 14' ' ' LEU . . . . . . . . . . . . . 19.1 tp -73.11 97.52 2.39 Favored 'General case' 0 N--CA 1.453 -0.321 0 N-CA-C 106.97 -1.493 . . . . 0.0 106.97 174.463 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 2.9 mm-40 -64.04 -54.88 27.28 Favored 'General case' 0 N--CA 1.451 -0.415 0 N-CA-C 108.434 -0.95 . . . . 0.0 108.434 176.962 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 10.1 m -156.14 153.24 28.99 Favored 'General case' 0 N--CA 1.451 -0.425 0 CA-C-O 121.927 0.87 . . . . 0.0 110.85 -174.011 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 17' ' ' VAL . . . . . . . . . . . . . 1.9 t -111.03 169.24 4.04 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.317 0 C-N-CA 126.097 1.759 . . . . 0.0 107.108 -171.832 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 18' ' ' ASN . . . . . . . . . . . . . 1.7 p-10 -57.32 -2.38 0.11 Allowed 'General case' 0 CA--C 1.54 0.578 0 N-CA-C 116.494 2.035 . . . . 0.0 116.494 179.949 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . -146.67 -2.64 0.55 Allowed Glycine 0 CA--C 1.527 0.793 0 CA-C-N 120.496 1.498 . . . . 0.0 115.8 -178.312 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 10.9 pttm 179.67 162.24 0.81 Allowed Pre-proline 0 N--CA 1.469 0.495 0 CA-C-N 119.952 1.876 . . . . 0.0 109.71 175.245 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 21' ' ' PRO . . . . . . . . . . . . . 55.3 Cg_endo -67.94 179.48 2.74 Favored 'Trans proline' 0 N--CA 1.459 -0.541 0 C-N-CA 123.753 2.969 . . . . 0.0 110.775 170.551 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 22' ' ' VAL . . . . . . . . . . . . . 90.1 t -110.15 153.5 11.91 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.384 0 N-CA-C 109.804 -0.443 . . . . 0.0 109.804 169.638 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 23' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -129.89 105.08 7.76 Favored 'General case' 0 CA--C 1.534 0.345 0 C-N-CA 126.548 1.939 . . . . 0.0 107.515 174.424 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 24' ' ' SER . . . . . . . . . . . . . 10.3 t -163.36 94.01 0.79 Allowed 'General case' 0 C--O 1.234 0.244 0 N-CA-C 108.55 -0.907 . . . . 0.0 108.55 168.633 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 25' ' ' ASP . . . . . . . . . . . . . 11.5 m-20 -79.24 -6.31 56.35 Favored 'General case' 0 CA--C 1.535 0.377 0 O-C-N 121.793 -0.567 . . . . 0.0 111.149 -172.748 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 26' ' ' LYS . . . . . . . . . . . . . 13.6 tttp -116.69 -32.88 5.02 Favored 'General case' 0 N--CA 1.471 0.59 0 CA-C-N 119.621 1.1 . . . . 0.0 113.225 -179.091 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 27' ' ' ASN . . . . . . . . . . . . . 1.4 p30 -138.3 77.41 35.68 Favored Pre-proline 0 C--N 1.323 -0.546 0 C-N-CA 123.848 0.859 . . . . 0.0 109.944 175.157 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 28' ' ' PRO . . . . . . . . . . . . . 70.6 Cg_endo -64.3 155.56 64.86 Favored 'Trans proline' 0 N--CA 1.455 -0.791 0 C-N-CA 121.689 1.592 . . . . 0.0 110.052 174.176 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 29' ' ' PRO . . . . . . . . . . . . . 18.1 Cg_endo -69.24 74.92 1.02 Allowed 'Trans proline' 0 N--CA 1.453 -0.883 0 C-N-CA 123.008 2.472 . . . . 0.0 108.505 159.606 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 30' ' ' GLU . . . . . 0.439 ' HA ' ' HA ' ' A' ' 13' ' ' VAL . 0.1 OUTLIER -87.86 163.98 16.12 Favored 'General case' 0 N--CA 1.446 -0.669 0 N-CA-C 108.391 -0.966 . . . . 0.0 108.391 168.445 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' A' A ' 31' ' ' ILE . . . . . . . . . . . . . 19.1 tt -130.69 142.4 43.76 Favored 'Isoleucine or valine' 0 N--CA 1.437 -1.082 0 C-N-CA 126.79 2.036 . . . . 0.0 105.534 172.658 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 32' ' ' SER . . . . . . . . . . . . . 19.9 m -138.65 163.91 30.87 Favored 'General case' 0 N--CA 1.443 -0.815 0 N-CA-C 106.294 -1.743 . . . . 0.0 106.294 171.347 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 33' ' ' PHE . . . . . . . . . . . . . 96.6 m-85 -144.64 143.28 30.68 Favored 'General case' 0 N--CA 1.439 -0.998 0 N-CA-C 106.043 -1.836 . . . . 0.0 106.043 -167.421 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 34' ' ' GLY . . . . . . . . . . . . . . . -166.39 152.22 21.11 Favored Glycine 0 CA--C 1.518 0.263 0 N-CA-C 109.746 -1.342 . . . . 0.0 109.746 160.958 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 35' ' ' GLU . . . . . . . . . . . . . 3.0 pt-20 44.94 145.93 0.0 OUTLIER 'General case' 0 C--O 1.219 -0.508 1 C-N-CA 134.756 5.222 . . . . 0.0 113.556 -171.864 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 52.8 mtpt 51.19 17.38 0.47 Allowed 'General case' 0 N--CA 1.475 0.818 0 O-C-N 120.002 -1.687 . . . . 0.0 114.852 170.387 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 37' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER 62.57 26.74 15.87 Favored 'General case' 0 CA--C 1.544 0.731 0 CA-C-N 120.432 1.469 . . . . 0.0 113.515 -167.837 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 38' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -63.01 158.75 18.63 Favored 'General case' 0 C--N 1.34 0.185 0 O-C-N 119.702 -1.873 . . . . 0.0 110.326 173.589 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 39' ' ' ILE . . . . . . . . . . . . . 37.8 mt -134.2 129.3 53.48 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.493 0 N-CA-C 107.261 -1.385 . . . . 0.0 107.261 -167.32 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 40' ' ' SER . . . . . . . . . . . . . 22.5 m -131.32 114.07 14.56 Favored 'General case' 0 N--CA 1.454 -0.251 0 C-N-CA 124.86 1.264 . . . . 0.0 107.928 176.181 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 41' ' ' GLY . . . . . . . . . . . . . . . -154.09 178.94 30.68 Favored Glycine 0 CA--C 1.523 0.576 0 N-CA-C 110.311 -1.116 . . . . 0.0 110.311 -179.226 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 42' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -161.47 92.86 0.91 Allowed 'General case' 0 N--CA 1.451 -0.376 0 O-C-N 121.302 -1.117 . . . . 0.0 108.961 -176.19 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 43' ' ' MET . . . . . . . . . . . . . 34.1 mmm -69.89 -53.0 19.97 Favored 'General case' 0 C--O 1.224 -0.238 0 N-CA-C 108.649 -0.871 . . . . 0.0 108.649 174.92 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 44' ' ' CYS . . . . . 1.287 ' SG ' ' SG ' ' A' ' 70' ' ' CYS . 11.6 t -152.79 -61.74 0.15 Allowed 'General case' 0 CA--C 1.517 -0.304 0 N-CA-C 107.959 -1.126 . . . . 0.0 107.959 176.336 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 45' ' ' ASN . . . . . . . . . . . . . 13.7 m120 -75.25 14.02 0.63 Allowed 'General case' 0 CA--C 1.536 0.41 0 C-N-CA 125.213 1.405 . . . . 0.0 113.109 -174.242 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 46' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER 53.35 169.15 0.02 OUTLIER 'General case' 0 N--CA 1.468 0.454 0 C-N-CA 127.278 2.231 . . . . 0.0 112.073 -157.675 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 47' ' ' PHE . . . . . . . . . . . . . 33.8 p90 -161.81 172.97 15.25 Favored 'General case' 0 C--O 1.24 0.579 0 C-N-CA 124.357 1.063 . . . . 0.0 110.922 164.162 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 48' ' ' SER . . . . . . . . . . . . . 1.7 p -179.89 150.07 0.37 Allowed 'General case' 0 N--CA 1.444 -0.733 0 C-N-CA 126.871 2.068 . . . . 0.0 109.086 178.142 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 49' ' ' GLY . . . . . . . . . . . . . . . 179.71 166.02 34.67 Favored Glycine 0 CA--C 1.525 0.697 0 N-CA-C 110.446 -1.062 . . . . 0.0 110.446 172.486 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 50' ' ' GLU . . . . . . . . . . . . . 19.2 mt-10 -80.17 97.26 6.83 Favored 'General case' 0 C--N 1.332 -0.18 0 C-N-CA 123.967 0.907 . . . . 0.0 108.97 176.451 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 51' ' ' GLY . . . . . . . . . . . . . . . -63.15 177.71 6.71 Favored Glycine 0 CA--C 1.53 0.983 0 C-N-CA 123.976 0.798 . . . . 0.0 112.263 163.689 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 52' ' ' LYS . . . . . . . . . . . . . 78.6 tttt -156.16 159.75 39.28 Favored 'General case' 0 CA--C 1.536 0.413 0 C-N-CA 125.026 1.33 . . . . 0.0 107.949 166.028 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 53' ' ' LEU . . . . . . . . . . . . . 18.6 tp -156.51 90.15 1.15 Allowed 'General case' 0 N--CA 1.466 0.337 0 C-N-CA 124.681 1.193 . . . . 0.0 109.127 175.306 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 16.3 t -139.53 35.46 2.03 Favored 'General case' 0 CA--C 1.534 0.363 0 C-N-CA 124.449 1.1 . . . . 0.0 108.726 -178.119 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 55' ' ' ASN . . . . . . . . . . . . . 3.7 p30 -165.11 -80.5 0.03 OUTLIER 'General case' 0 N--CA 1.452 -0.347 0 C-N-CA 127.597 2.359 . . . . 0.0 105.676 -167.549 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 56' ' ' GLY . . . . . . . . . . . . . . . 163.11 15.66 0.03 OUTLIER Glycine 0 CA--C 1.534 1.224 0 C-N-CA 128.966 3.174 . . . . 0.0 109.686 -173.124 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 57' ' ' GLU . . . . . . . . . . . . . 51.1 tt0 -135.33 131.57 36.58 Favored 'General case' 0 C--N 1.343 0.293 0 N-CA-C 108.026 -1.101 . . . . 0.0 108.026 -166.869 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 58' ' ' LEU . . . . . . . . . . . . . 65.5 tp -111.35 90.31 3.3 Favored 'General case' 0 CA--C 1.533 0.307 0 C-N-CA 126.692 1.997 . . . . 0.0 108.929 -177.102 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 59' ' ' THR . . . . . . . . . . . . . 17.7 p -95.37 131.36 41.58 Favored 'General case' 0 C--O 1.236 0.387 0 C-N-CA 124.29 1.036 . . . . 0.0 108.59 171.244 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 60' ' ' ALA . . . . . . . . . . . . . . . -76.87 137.34 39.1 Favored 'General case' 0 N--CA 1.454 -0.252 0 N-CA-C 108.742 -0.836 . . . . 0.0 108.742 167.27 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 61' ' ' LYS . . . . . . . . . . . . . 72.9 tttt -66.59 -22.86 66.13 Favored 'General case' 0 C--N 1.329 -0.304 0 O-C-N 121.913 -0.492 . . . . 0.0 112.003 172.622 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 62' ' ' GLY . . . . . . . . . . . . . . . 168.93 111.89 0.25 Allowed Glycine 0 C--N 1.332 0.316 0 N-CA-C 107.989 -2.044 . . . . 0.0 107.989 -178.523 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 63' ' ' LEU . . . . . 0.432 HD22 ' HA ' ' A' ' 83' ' ' SER . 0.3 OUTLIER -77.75 112.81 14.98 Favored 'General case' 0 N--CA 1.454 -0.239 0 N-CA-C 107.621 -1.251 . . . . 0.0 107.621 175.735 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' A' A ' 64' ' ' ALA . . . . . . . . . . . . . . . -90.31 90.77 8.21 Favored 'General case' 0 C--N 1.326 -0.456 0 C-N-CA 124.802 1.241 . . . . 0.0 111.25 168.408 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 65' ' ' MET . . . . . . . . . . . . . 51.7 mtp -94.58 -179.73 4.98 Favored 'General case' 0 CA--C 1.539 0.54 0 O-C-N 120.842 -1.161 . . . . 0.0 109.314 179.513 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 66' ' ' THR . . . . . . . . . . . . . 16.9 p -121.32 -164.51 1.14 Allowed 'General case' 0 CA--C 1.54 0.571 0 O-C-N 120.973 -1.08 . . . . 0.0 109.683 -172.211 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 67' ' ' ARG . . . . . . . . . . . . . 10.9 mmm180 -128.13 51.2 1.99 Allowed 'General case' 0 CA--C 1.542 0.645 0 C-N-CA 125.929 1.692 . . . . 0.0 109.732 -176.049 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 68' ' ' MET . . . . . . . . . . . . . 19.6 ptp -113.17 -176.44 2.9 Favored 'General case' 0 CA--C 1.54 0.563 0 C-N-CA 127.451 2.3 . . . . 0.0 111.292 -179.889 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 69' ' ' MET . . . . . . . . . . . . . 0.4 OUTLIER -140.9 175.67 9.43 Favored 'General case' 0 C--O 1.235 0.308 0 C-N-CA 126.717 2.007 . . . . 0.0 108.905 -178.942 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 70' ' ' CYS . . . . . 1.287 ' SG ' ' SG ' ' A' ' 44' ' ' CYS . 1.1 p -140.33 152.97 46.26 Favored 'General case' 0 C--N 1.33 -0.254 0 C-N-CA 126.544 1.938 . . . . 0.0 109.633 -168.179 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 71' ' ' ALA . . . . . . . . . . . . . . . -79.44 6.63 9.74 Favored 'General case' 0 CA--C 1.534 0.329 0 C-N-CA 124.747 1.219 . . . . 0.0 113.963 -178.202 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 72' ' ' ASN . . . . . . . . . . . . . 24.8 t30 -135.79 143.34 44.19 Favored Pre-proline 0 C--O 1.233 0.192 0 CA-C-N 119.885 1.221 . . . . 0.0 108.023 172.427 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 73' ' ' PRO . . . . . . . . . . . . . 36.7 Cg_endo -75.56 -34.94 3.03 Favored 'Trans proline' 0 N--CA 1.463 -0.314 0 C-N-CA 122.103 1.869 . . . . 0.0 113.071 -169.888 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 74' ' ' GLN . . . . . . . . . . . . . 34.8 tt0 -60.35 -37.34 80.39 Favored 'General case' 0 CA--C 1.537 0.475 0 C-N-CA 123.746 0.818 . . . . 0.0 110.61 175.788 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 75' ' ' LEU . . . . . . . . . . . . . 91.1 mt -59.09 -41.24 87.58 Favored 'General case' 0 N--CA 1.467 0.384 0 CA-C-N 119.421 1.01 . . . . 0.0 109.407 176.461 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 76' ' ' ASN . . . . . . . . . . . . . 0.6 OUTLIER -68.1 -22.11 64.92 Favored 'General case' 0 N--CA 1.466 0.366 0 C-N-CA 124.204 1.002 . . . . 0.0 111.683 -179.661 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 77' ' ' GLU . . . . . . . . . . . . . 1.6 mt-10 -80.36 -41.39 24.82 Favored 'General case' 0 CA--C 1.53 0.187 0 C-N-CA 123.704 0.802 . . . . 0.0 110.51 173.001 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 78' ' ' LEU . . . . . . . . . . . . . 27.5 mt -62.76 -13.01 27.92 Favored 'General case' 0 N--CA 1.464 0.258 0 C-N-CA 124.839 1.256 . . . . 0.0 113.204 -174.098 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 79' ' ' ASP . . . . . . . . . . . . . 4.6 t70 -44.59 -58.58 2.93 Favored 'General case' 0 C--O 1.232 0.135 0 C-N-CA 125.309 1.444 . . . . 0.0 111.18 162.653 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 80' ' ' ASN . . . . . . . . . . . . . 0.7 OUTLIER -68.7 -37.44 79.54 Favored 'General case' 0 CA--C 1.516 -0.36 0 C-N-CA 120.394 -0.522 . . . . 0.0 109.882 -175.469 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 81' ' ' THR . . . . . . . . . . . . . 7.1 m -58.5 -52.97 63.41 Favored 'General case' 0 N--CA 1.447 -0.625 0 N-CA-C 108.689 -0.856 . . . . 0.0 108.689 -175.958 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 82' ' ' ILE . . . . . . . . . . . . . 11.1 tp -68.85 -39.48 80.05 Favored 'Isoleucine or valine' 0 N--CA 1.456 -0.128 0 CA-C-N 119.107 0.867 . . . . 0.0 111.062 -177.319 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 83' ' ' SER . . . . . 0.432 ' HA ' HD22 ' A' ' 63' ' ' LEU . 5.4 t -60.42 -53.02 62.61 Favored 'General case' 0 N--CA 1.451 -0.378 0 N-CA-C 108.915 -0.772 . . . . 0.0 108.915 -175.138 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 84' ' ' GLU . . . . . . . . . . . . . 5.9 mm-40 -61.03 -44.79 96.87 Favored 'General case' 0 N--CA 1.446 -0.671 0 C-N-CA 124.835 1.254 . . . . 0.0 111.142 179.8 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 85' ' ' MET . . . . . . . . . . . . . 90.8 mtp -66.98 -17.51 64.95 Favored 'General case' 0 N--CA 1.451 -0.41 0 CA-C-N 118.023 0.374 . . . . 0.0 110.798 -175.269 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 86' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -105.79 -25.43 12.19 Favored 'General case' 0 N--CA 1.456 -0.137 0 C-N-CA 124.12 0.968 . . . . 0.0 111.754 -177.309 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 87' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -72.81 -55.38 6.79 Favored 'General case' 0 CA--C 1.518 -0.256 0 N-CA-C 108.466 -0.939 . . . . 0.0 108.466 172.456 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 88' ' ' GLU . . . . . . . . . . . . . 54.9 mt-10 -72.72 -28.13 62.47 Favored 'General case' 0 CA--C 1.53 0.184 0 C-N-CA 119.315 -0.954 . . . . 0.0 112.244 -170.788 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 89' ' ' GLY . . . . . . . . . . . . . . . 120.37 95.56 1.51 Allowed Glycine 0 C--N 1.338 0.681 0 C-N-CA 124.361 0.982 . . . . 0.0 110.685 173.996 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 90' ' ' ALA . . . . . . . . . . . . . . . -62.51 134.21 56.07 Favored 'General case' 0 N--CA 1.451 -0.392 0 CA-C-O 118.12 -0.943 . . . . 0.0 108.508 177.286 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 91' ' ' GLN . . . . . . . . . . . . . 11.6 mm-40 -73.87 140.94 46.05 Favored 'General case' 0 C--O 1.239 0.52 0 N-CA-C 104.801 -2.296 . . . . 0.0 104.801 154.998 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 92' ' ' VAL . . . . . . . . . . . . . 7.2 p -132.73 120.3 41.14 Favored 'Isoleucine or valine' 0 N--CA 1.448 -0.546 0 N-CA-C 105.522 -2.029 . . . . 0.0 105.522 -174.134 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 93' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -142.13 90.14 2.23 Favored 'General case' 0 C--N 1.332 -0.184 0 N-CA-C 107.284 -1.376 . . . . 0.0 107.284 -171.23 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 94' ' ' LEU . . . . . . . . . . . . . 1.1 tm? -97.79 110.36 22.94 Favored 'General case' 0 N--CA 1.464 0.252 0 N-CA-C 107.254 -1.387 . . . . 0.0 107.254 -179.29 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 95' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -76.91 -164.68 0.46 Allowed 'General case' 0 CA--C 1.542 0.669 0 C-N-CA 125.162 1.385 . . . . 0.0 109.278 175.313 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 96' ' ' ALA . . . . . . . . . . . . . . . -62.28 -7.25 4.0 Favored 'General case' 0 CA--C 1.541 0.624 0 O-C-N 119.864 -1.772 . . . . 0.0 115.266 -178.106 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 97' ' ' ASN . . . . . . . . . . . . . 2.0 p30 -173.9 4.49 0.01 OUTLIER 'General case' 0 N--CA 1.476 0.844 0 C-N-CA 125.904 1.681 . . . . 0.0 114.521 169.882 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 98' ' ' GLN . . . . . . . . . . . . . 8.6 tt0 -120.28 132.56 55.37 Favored 'General case' 0 N--CA 1.472 0.634 0 CA-C-N 121.011 1.732 . . . . 0.0 108.976 -178.877 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 99' ' ' LEU . . . . . 0.49 HD22 ' CD2' ' A' ' 101' ' ' LEU . 0.4 OUTLIER -98.91 116.25 30.72 Favored 'General case' 0 C--O 1.233 0.231 0 C-N-CA 124.529 1.132 . . . . 0.0 109.385 176.694 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' A' A ' 100' ' ' THR . . . . . . . . . . . . . 26.7 m -93.27 117.66 30.34 Favored 'General case' 0 C--N 1.322 -0.601 0 C-N-CA 125.386 1.474 . . . . 0.0 107.381 170.363 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 101' ' ' LEU . . . . . 0.49 ' CD2' HD22 ' A' ' 99' ' ' LEU . 3.2 mm? -111.19 120.32 41.9 Favored 'General case' 0 N--CA 1.464 0.239 0 N-CA-C 106.803 -1.554 . . . . 0.0 106.803 166.678 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 102' ' ' ALA . . . . . . . . . . . . . . . -123.82 145.9 48.74 Favored 'General case' 0 N--CA 1.467 0.378 0 C-N-CA 124.676 1.19 . . . . 0.0 109.37 169.375 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 103' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -150.99 174.51 13.06 Favored 'General case' 0 N--CA 1.448 -0.53 0 C-N-CA 125.063 1.345 . . . . 0.0 109.796 178.125 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 104' ' ' ALA . . . . . . . . . . . . . . . -51.34 -29.51 15.46 Favored 'General case' 0 CA--C 1.537 0.467 0 C-N-CA 124.948 1.299 . . . . 0.0 113.032 171.846 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 105' ' ' LYS . . . . . . . . . . . . . 3.7 mtpt -80.93 -73.67 0.36 Allowed 'General case' 0 C--N 1.342 0.258 0 O-C-N 121.343 -0.848 . . . . 0.0 110.721 173.95 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 106' ' ' GLN . . . . . . . . . . . . . 29.1 mt-30 -144.26 177.56 8.52 Favored 'General case' 0 C--N 1.329 -0.325 0 C-N-CA 124.103 0.961 . . . . 0.0 108.6 -156.692 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 107' ' ' THR . . . . . . . . . . . . . 1.0 OUTLIER -130.42 142.31 50.51 Favored 'General case' 0 CA--C 1.531 0.222 0 N-CA-C 108.132 -1.062 . . . . 0.0 108.132 170.332 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 108' ' ' LEU . . . . . . . . . . . . . 6.4 mp -126.61 161.89 27.0 Favored 'General case' 0 N--CA 1.447 -0.609 0 C-N-CA 127.657 2.383 . . . . 0.0 108.488 -179.357 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 109' ' ' THR . . . . . . . . . . . . . 1.3 m -131.51 110.06 10.71 Favored 'General case' 0 C--O 1.238 0.46 0 N-CA-C 108.07 -1.085 . . . . 0.0 108.07 174.732 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 110' ' ' TYR . . . . . . . . . . . . . 37.0 m-85 -98.15 163.98 12.51 Favored 'General case' 0 C--O 1.235 0.29 0 N-CA-C 109.143 -0.688 . . . . 0.0 109.143 174.093 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 111' ' ' LYS . . . . . . . . . . . . . 0.7 OUTLIER -131.05 137.61 49.23 Favored 'General case' 0 CA--C 1.521 -0.138 0 C-N-CA 125.371 1.468 . . . . 0.0 109.347 -173.898 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 112' ' ' LEU . . . . . . . . . . . . . 25.6 tp -67.84 62.84 0.08 Allowed 'General case' 0 CA--C 1.542 0.66 0 C-N-CA 128.309 2.644 . . . . 0.0 110.382 168.527 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 113' ' ' ALA . . . . . 0.461 ' HB3' ' CG2' ' A' ' 13' ' ' VAL . . . -88.46 79.75 7.58 Favored 'General case' 0 CA--C 1.528 0.134 0 N-CA-C 105.909 -1.886 . . . . 0.0 105.909 165.018 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 114' ' ' ASP . . . . . . . . . . . . . 23.4 t0 . . . . . 0 CA--C 1.538 0.489 0 C-N-CA 125.324 1.45 . . . . 0.0 112.163 -167.807 . . . . . . . . 0 0 . 1 . 005 nuclear nobuild core ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 22.5 ttm . . . . . 0 C--O 1.237 0.424 0 N-CA-C 109.086 -0.709 . . . . 0.0 109.086 . . . . . . . . . 0 0 . 1 . 005 nuclear nobuild core ' A' A ' 2' ' ' VAL . . . . . 0.405 HG23 ' HB3' ' A' ' 94' ' ' LEU . 11.3 p -67.47 146.21 13.24 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.419 0 N-CA-C 109.517 -0.549 . . . . 0.0 109.517 177.794 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 3' ' ' THR . . . . . . . . . . . . . 6.1 p -135.34 162.57 56.6 Favored Pre-proline 0 CA--C 1.53 0.205 0 O-C-N 121.99 -0.444 . . . . 0.0 110.989 -173.977 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 4' ' ' PRO . . . . . . . . . . . . . 6.2 Cg_endo -59.68 -51.0 6.76 Favored 'Trans proline' 0 N--CA 1.454 -0.814 0 C-N-CA 122.059 1.839 . . . . 0.0 112.886 175.141 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 5' ' ' GLU . . . . . . . . . . . . . 6.5 mt-10 -58.73 -28.51 65.92 Favored 'General case' 0 CA--C 1.534 0.363 0 N-CA-C 113.74 1.015 . . . . 0.0 113.74 -170.747 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 6' ' ' GLN . . . . . . . . . . . . . 17.5 pt20 -79.89 9.08 5.72 Favored 'General case' 0 CA--C 1.533 0.31 0 N-CA-C 113.622 0.971 . . . . 0.0 113.622 175.939 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 7' ' ' LEU . . . . . . . . . . . . . 78.5 mt -127.17 -50.06 1.43 Allowed 'General case' 0 CA--C 1.52 -0.188 0 CA-C-N 119.272 0.942 . . . . 0.0 109.971 -170.322 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 8' ' ' GLN . . . . . . . . . . . . . 2.2 mp0 -55.38 -17.04 4.2 Favored 'General case' 0 N--CA 1.47 0.538 0 N-CA-C 114.985 1.476 . . . . 0.0 114.985 -175.977 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 9' ' ' HIS . . . . . . . . . . . . . 5.8 m170 -124.65 8.11 8.24 Favored 'General case' 0 CA--C 1.54 0.582 0 C-N-CA 124.234 1.014 . . . . 0.0 110.849 -172.582 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 10' ' ' HIS . . . . . . . . . . . . . 73.7 m-70 -131.75 108.68 9.63 Favored 'General case' 0 CA--C 1.533 0.299 0 C-N-CA 125.465 1.506 . . . . 0.0 109.454 -168.564 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 11' ' ' ARG . . . . . . . . . . . . . 1.5 ttt85 -65.61 154.37 38.95 Favored 'General case' 0 N--CA 1.465 0.276 0 C-N-CA 123.156 0.582 . . . . 0.0 110.674 176.676 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 12' ' ' PHE . . . . . . . . . . . . . 59.4 m-85 -131.87 158.0 42.5 Favored 'General case' 0 N--CA 1.447 -0.594 0 C-N-CA 124.47 1.108 . . . . 0.0 109.731 167.882 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 13' ' ' VAL . . . . . 0.485 ' HA ' ' HA ' ' A' ' 30' ' ' GLU . 7.6 p -129.44 136.52 59.14 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.373 0 N-CA-C 108.876 -0.787 . . . . 0.0 108.876 171.128 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 14' ' ' LEU . . . . . . . . . . . . . 20.2 tp -71.26 85.78 0.78 Allowed 'General case' 0 C--O 1.232 0.162 0 N-CA-C 106.784 -1.561 . . . . 0.0 106.784 176.654 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 2.7 mm-40 -67.9 -47.26 69.3 Favored 'General case' 0 C--N 1.325 -0.48 0 C-N-CA 124.098 0.959 . . . . 0.0 109.277 179.059 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 69.8 m -154.08 140.86 19.08 Favored 'General case' 0 N--CA 1.452 -0.35 0 O-C-N 121.139 -0.976 . . . . 0.0 112.184 -176.762 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 17' ' ' VAL . . . . . . . . . . . . . 85.8 t -98.98 171.12 1.31 Allowed 'Isoleucine or valine' 0 C--N 1.328 -0.328 0 C-N-CA 125.952 1.701 . . . . 0.0 108.601 -174.082 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 18' ' ' ASN . . . . . . . . . . . . . 1.3 t30 -44.36 -49.98 9.33 Favored 'General case' 0 C--N 1.337 0.059 0 C-N-CA 125.81 1.644 . . . . 0.0 112.02 -178.551 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . -79.65 -69.14 1.42 Allowed Glycine 0 CA--C 1.526 0.725 0 O-C-N 123.856 0.722 . . . . 0.0 111.459 177.269 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 30.2 mttm -136.72 165.68 33.3 Favored Pre-proline 0 CA--C 1.529 0.142 0 C-N-CA 125.728 1.611 . . . . 0.0 111.035 -164.273 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 21' ' ' PRO . . . . . . . . . . . . . 91.9 Cg_endo -67.37 176.41 4.85 Favored 'Trans proline' 0 N--CA 1.454 -0.852 0 C-N-CA 121.596 1.53 . . . . 0.0 110.045 162.728 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 22' ' ' VAL . . . . . . . . . . . . . 7.7 p -131.47 162.31 39.6 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.513 0 C-N-CA 124.834 1.254 . . . . 0.0 108.336 177.429 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 23' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -141.9 142.46 33.06 Favored 'General case' 0 CA--C 1.535 0.392 0 CA-C-N 119.008 0.822 . . . . 0.0 108.794 172.568 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 24' ' ' SER . . . . . . . . . . . . . 16.2 m -146.06 35.25 1.0 Allowed 'General case' 0 CA--C 1.537 0.448 0 C-N-CA 125.64 1.576 . . . . 0.0 110.483 -175.647 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 25' ' ' ASP . . . . . . . . . . . . . 18.0 m-20 53.13 52.68 13.24 Favored 'General case' 0 N--CA 1.47 0.563 0 C-N-CA 125.088 1.355 . . . . 0.0 110.801 -179.715 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 26' ' ' LYS . . . . . . . . . . . . . 5.0 tmtt? 64.71 9.24 5.05 Favored 'General case' 0 N--CA 1.45 -0.437 0 C-N-CA 124.456 1.102 . . . . 0.0 112.406 178.227 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 27' ' ' ASN . . . . . . . . . . . . . 73.3 m-20 -113.55 58.4 0.74 Allowed Pre-proline 0 CA--C 1.542 0.664 0 C-N-CA 125.151 1.38 . . . . 0.0 110.428 172.524 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 28' ' ' PRO . . . . . . . . . . . . . 23.2 Cg_endo -76.76 171.66 17.6 Favored 'Trans proline' 0 CA--C 1.543 0.936 0 C-N-CA 124.502 3.468 . . . . 0.0 113.457 -166.84 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 29' ' ' PRO . . . . . . . . . . . . . 19.5 Cg_endo -66.02 64.91 0.45 Allowed 'Trans proline' 0 C--N 1.357 0.978 0 C-N-CA 124.974 3.783 . . . . 0.0 111.811 170.984 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 30' ' ' GLU . . . . . 0.485 ' HA ' ' HA ' ' A' ' 13' ' ' VAL . 1.9 pt-20 -70.15 164.54 23.97 Favored 'General case' 0 C--O 1.239 0.525 0 O-C-N 120.222 -1.549 . . . . 0.0 109.339 172.28 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 31' ' ' ILE . . . . . . . . . . . . . 12.9 tt -139.94 147.63 23.57 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.474 0 CA-C-O 122.336 1.065 . . . . 0.0 108.492 176.935 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 32' ' ' SER . . . . . . . . . . . . . 5.0 p -138.75 154.29 48.52 Favored 'General case' 0 N--CA 1.443 -0.775 0 N-CA-C 107.064 -1.458 . . . . 0.0 107.064 -179.276 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 33' ' ' PHE . . . . . . . . . . . . . 91.7 m-85 -126.37 168.38 14.25 Favored 'General case' 0 N--CA 1.446 -0.638 0 N-CA-C 106.84 -1.541 . . . . 0.0 106.84 178.03 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 34' ' ' GLY . . . . . . . . . . . . . . . 157.85 170.49 22.69 Favored Glycine 0 CA--C 1.522 0.524 0 N-CA-C 109.197 -1.561 . . . . 0.0 109.197 -178.284 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 35' ' ' GLU . . . . . . . . . . . . . 25.1 mt-10 43.57 88.38 0.01 OUTLIER 'General case' 0 N--CA 1.467 0.406 0 C-N-CA 126.796 2.038 . . . . 0.0 113.38 163.647 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 29.3 mttm 69.67 24.42 5.49 Favored 'General case' 0 N--CA 1.466 0.369 0 C-N-CA 125.429 1.492 . . . . 0.0 112.609 -177.224 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 37' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER 64.98 21.66 12.34 Favored 'General case' 0 CA--C 1.542 0.673 0 CA-C-N 120.178 1.353 . . . . 0.0 109.878 -177.828 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 38' ' ' MET . . . . . . . . . . . . . 14.9 mtp -62.42 157.49 19.92 Favored 'General case' 0 N--CA 1.45 -0.445 0 O-C-N 120.959 -1.088 . . . . 0.0 110.006 171.406 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 39' ' ' ILE . . . . . . . . . . . . . 7.3 mt -119.26 131.22 72.56 Favored 'Isoleucine or valine' 0 N--CA 1.447 -0.587 0 C-N-CA 125.443 1.497 . . . . 0.0 107.2 -177.988 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 40' ' ' SER . . . . . . . . . . . . . 55.5 m -129.0 116.02 18.69 Favored 'General case' 0 N--CA 1.452 -0.363 0 C-N-CA 126.377 1.871 . . . . 0.0 107.182 178.78 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 41' ' ' GLY . . . . . . . . . . . . . . . -167.75 179.47 41.09 Favored Glycine 0 CA--C 1.526 0.738 0 N-CA-C 109.631 -1.388 . . . . 0.0 109.631 -179.395 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 42' ' ' SER . . . . . . . . . . . . . 1.0 OUTLIER -154.54 103.28 2.46 Favored 'General case' 0 N--CA 1.453 -0.283 0 O-C-N 121.989 -0.712 . . . . 0.0 109.257 -176.605 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 43' ' ' MET . . . . . . . . . . . . . 6.9 mmt -71.25 -43.55 67.02 Favored 'General case' 0 C--O 1.223 -0.335 0 N-CA-C 108.998 -0.741 . . . . 0.0 108.998 175.248 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 44' ' ' CYS . . . . . 1.275 ' SG ' ' SG ' ' A' ' 70' ' ' CYS . 38.7 t -153.84 -75.32 0.12 Allowed 'General case' 0 N--CA 1.453 -0.284 0 N-CA-C 104.61 -2.367 . . . . 0.0 104.61 172.878 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 45' ' ' ASN . . . . . . . . . . . . . 2.7 m120 -78.48 17.66 0.64 Allowed 'General case' 0 C--N 1.329 -0.3 0 C-N-CA 126.463 1.905 . . . . 0.0 112.494 -163.703 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 46' ' ' ARG . . . . . . . . . . . . . 3.9 mmm180 55.48 158.94 0.01 OUTLIER 'General case' 0 N--CA 1.465 0.299 0 C-N-CA 128.248 2.619 . . . . 0.0 112.631 -161.744 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 47' ' ' PHE . . . . . . . . . . . . . 47.3 p90 -152.69 171.74 17.73 Favored 'General case' 0 N--CA 1.448 -0.556 0 C-N-CA 125.352 1.461 . . . . 0.0 108.199 165.835 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 48' ' ' SER . . . . . . . . . . . . . 7.0 p -163.6 158.87 21.12 Favored 'General case' 0 N--CA 1.444 -0.765 0 N-CA-C 107.031 -1.47 . . . . 0.0 107.031 176.258 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 49' ' ' GLY . . . . . . . . . . . . . . . 173.62 169.17 35.64 Favored Glycine 0 C--N 1.34 0.756 0 CA-C-N 119.951 1.251 . . . . 0.0 112.265 164.7 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 50' ' ' GLU . . . . . . . . . . . . . 23.1 mt-10 -72.84 96.8 2.13 Favored 'General case' 0 C--O 1.239 0.503 0 C-N-CA 125.395 1.478 . . . . 0.0 108.884 171.607 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 51' ' ' GLY . . . . . . . . . . . . . . . -71.97 176.55 40.03 Favored Glycine 0 CA--C 1.527 0.818 0 CA-C-N 115.414 -0.812 . . . . 0.0 111.255 156.965 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 52' ' ' LYS . . . . . . . . . . . . . 29.9 ttpt -167.25 150.33 6.31 Favored 'General case' 0 CA--C 1.529 0.15 0 C-N-CA 126.21 1.804 . . . . 0.0 107.605 179.688 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 53' ' ' LEU . . . . . . . . . . . . . 46.7 tp -155.26 120.53 4.93 Favored 'General case' 0 C--O 1.232 0.142 0 C-N-CA 123.667 0.787 . . . . 0.0 109.345 177.132 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 1.2 t -162.21 39.56 0.12 Allowed 'General case' 0 CA--C 1.538 0.507 0 C-N-CA 123.639 0.776 . . . . 0.0 108.992 174.176 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 55' ' ' ASN . . . . . . . . . . . . . 15.8 p-10 -174.01 -51.4 0.01 OUTLIER 'General case' 0 N--CA 1.462 0.162 0 C-N-CA 124.779 1.232 . . . . 0.0 111.372 -161.497 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 56' ' ' GLY . . . . . . . . . . . . . . . 131.57 10.18 2.42 Favored Glycine 0 CA--C 1.529 0.91 0 C-N-CA 125.102 1.334 . . . . 0.0 113.128 -176.694 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 57' ' ' GLU . . . . . . . . . . . . . 51.7 tt0 -132.05 134.89 46.04 Favored 'General case' 0 C--O 1.233 0.233 0 CA-C-N 118.657 1.228 . . . . 0.0 109.118 -175.019 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 58' ' ' LEU . . . . . . . . . . . . . 38.1 tp -115.71 82.19 1.72 Allowed 'General case' 0 CA--C 1.535 0.393 0 C-N-CA 126.221 1.809 . . . . 0.0 110.685 -171.928 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 59' ' ' THR . . . . . . . . . . . . . 16.9 p -82.45 141.23 32.89 Favored 'General case' 0 C--O 1.237 0.427 0 O-C-N 121.445 -0.784 . . . . 0.0 110.931 177.366 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 60' ' ' ALA . . . . . 0.463 ' HB2' ' HB3' ' A' ' 86' ' ' LEU . . . -89.87 117.05 28.41 Favored 'General case' 0 CA--C 1.517 -0.309 0 C-N-CA 125.011 1.325 . . . . 0.0 110.584 173.604 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 61' ' ' LYS . . . . . . . . . . . . . 16.2 tttt -67.11 -9.47 40.03 Favored 'General case' 0 CA--C 1.543 0.683 0 N-CA-C 113.453 0.908 . . . . 0.0 113.453 176.05 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 62' ' ' GLY . . . . . . . . . . . . . . . 159.25 116.08 0.43 Allowed Glycine 0 CA--C 1.523 0.535 0 N-CA-C 108.606 -1.798 . . . . 0.0 108.606 179.597 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 63' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -97.59 108.54 21.28 Favored 'General case' 0 N--CA 1.452 -0.367 0 C-N-CA 124.227 1.011 . . . . 0.0 110.396 -173.07 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 64' ' ' ALA . . . . . . . . . . . . . . . -96.18 108.71 21.2 Favored 'General case' 0 C--N 1.324 -0.517 0 CA-C-N 115.634 -0.712 . . . . 0.0 110.114 -177.083 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 65' ' ' MET . . . . . . . . . . . . . 50.4 mtp -111.43 -178.72 3.52 Favored 'General case' 0 C--O 1.241 0.61 0 C-N-CA 126.091 1.756 . . . . 0.0 109.972 -174.588 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 66' ' ' THR . . . . . . . . . . . . . 10.1 p -122.6 -175.25 3.1 Favored 'General case' 0 CA--C 1.537 0.444 0 C-N-CA 123.625 0.77 . . . . 0.0 112.94 178.937 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 67' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -124.68 74.05 1.31 Allowed 'General case' 0 C--O 1.237 0.418 0 C-N-CA 126.727 2.011 . . . . 0.0 110.044 -174.622 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 68' ' ' MET . . . . . . . . . . . . . 2.0 ptt? -142.93 158.37 43.67 Favored 'General case' 0 N--CA 1.452 -0.343 0 C-N-CA 124.638 1.175 . . . . 0.0 111.694 172.824 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 69' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -104.92 134.67 47.65 Favored 'General case' 0 N--CA 1.448 -0.566 0 C-N-CA 127.388 2.275 . . . . 0.0 109.234 179.827 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 70' ' ' CYS . . . . . 1.275 ' SG ' ' SG ' ' A' ' 44' ' ' CYS . 60.0 m -100.05 -6.72 25.97 Favored 'General case' 0 N--CA 1.467 0.408 0 C-N-CA 125.611 1.564 . . . . 0.0 114.499 -173.489 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 71' ' ' ALA . . . . . . . . . . . . . . . 67.81 -45.04 0.49 Allowed 'General case' 0 C--O 1.234 0.248 0 C-N-CA 127.324 2.25 . . . . 0.0 113.936 -168.29 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 72' ' ' ASN . . . . . 0.68 ' HB3' HD22 ' A' ' 75' ' ' LEU . 43.4 t30 -68.38 142.71 94.81 Favored Pre-proline 0 C--O 1.234 0.26 0 CA-C-O 117.503 -1.237 . . . . 0.0 108.697 -177.598 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 73' ' ' PRO . . . . . . . . . . . . . 44.3 Cg_endo -78.92 -41.32 0.24 Allowed 'Trans proline' 0 N--CA 1.455 -0.756 0 C-N-CA 121.957 1.772 . . . . 0.0 110.999 178.414 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 74' ' ' GLN . . . . . . . . . . . . . 23.7 tt0 -61.58 -44.98 96.02 Favored 'General case' 0 CA--C 1.534 0.358 0 C-N-CA 123.126 0.57 . . . . 0.0 110.76 -169.506 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 75' ' ' LEU . . . . . 0.68 HD22 ' HB3' ' A' ' 72' ' ' ASN . 0.0 OUTLIER -52.31 -52.65 51.78 Favored 'General case' 0 N--CA 1.447 -0.605 0 C-N-CA 125.139 1.376 . . . . 0.0 110.583 169.543 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' A' A ' 76' ' ' ASN . . . . . . . . . . . . . 1.2 m-20 -71.18 -0.89 10.8 Favored 'General case' 0 N--CA 1.47 0.53 0 C-N-CA 126.657 1.983 . . . . 0.0 113.144 -174.767 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 77' ' ' GLU . . . . . . . . . . . . . 3.3 mm-40 -101.93 -40.31 6.95 Favored 'General case' 0 C--O 1.235 0.328 0 C-N-CA 126.214 1.806 . . . . 0.0 109.708 171.075 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 78' ' ' LEU . . . . . . . . . . . . . 4.9 mp -67.49 -24.24 65.56 Favored 'General case' 0 N--CA 1.456 -0.167 0 C-N-CA 125.589 1.556 . . . . 0.0 112.103 -178.58 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 79' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -58.24 -34.35 70.35 Favored 'General case' 0 C--O 1.232 0.171 0 C-N-CA 123.4 0.68 . . . . 0.0 111.695 175.233 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 80' ' ' ASN . . . . . . . . . . . . . 91.1 m-20 -87.17 -36.41 18.05 Favored 'General case' 0 CA--C 1.512 -0.496 0 CA-C-O 117.893 -1.051 . . . . 0.0 109.862 177.753 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 81' ' ' THR . . . . . . . . . . . . . 3.8 m -52.38 -55.33 22.41 Favored 'General case' 0 CA--C 1.531 0.246 0 CA-C-N 118.646 0.657 . . . . 0.0 109.985 174.657 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 82' ' ' ILE . . . . . . . . . . . . . 9.8 tp -66.56 -37.61 79.93 Favored 'Isoleucine or valine' 0 N--CA 1.454 -0.27 0 C-N-CA 119.808 -0.757 . . . . 0.0 111.361 -174.382 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 83' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER -59.75 -49.55 77.29 Favored 'General case' 0 N--CA 1.443 -0.802 0 N-CA-C 109.283 -0.636 . . . . 0.0 109.283 179.495 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 84' ' ' GLU . . . . . . . . . . . . . 36.8 tt0 -66.41 -46.31 76.99 Favored 'General case' 0 N--CA 1.449 -0.5 0 C-N-CA 125.065 1.346 . . . . 0.0 111.219 -176.725 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 85' ' ' MET . . . . . . . . . . . . . 85.0 mtp -58.21 -52.26 66.31 Favored 'General case' 0 C--N 1.342 0.265 0 C-N-CA 124.413 1.085 . . . . 0.0 109.318 -177.766 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 86' ' ' LEU . . . . . 0.463 ' HB3' ' HB2' ' A' ' 60' ' ' ALA . 0.1 OUTLIER -75.27 -22.97 57.39 Favored 'General case' 0 N--CA 1.453 -0.311 0 CA-C-N 115.906 -0.588 . . . . 0.0 111.329 -171.41 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' A' A ' 87' ' ' LYS . . . . . . . . . . . . . 9.5 mttt -67.14 -47.05 72.26 Favored 'General case' 0 N--CA 1.456 -0.172 0 N-CA-C 108.164 -1.05 . . . . 0.0 108.164 -178.797 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 88' ' ' GLU . . . . . . . . . . . . . 69.5 mt-10 -72.07 -51.45 21.54 Favored 'General case' 0 N--CA 1.454 -0.255 0 O-C-N 123.738 0.649 . . . . 0.0 110.077 177.567 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 89' ' ' GLY . . . . . . . . . . . . . . . 134.26 97.57 0.59 Allowed Glycine 0 C--N 1.337 0.597 0 N-CA-C 108.509 -1.836 . . . . 0.0 108.509 -169.732 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 90' ' ' ALA . . . . . . . . . . . . . . . -74.11 130.72 40.34 Favored 'General case' 0 N--CA 1.451 -0.387 0 N-CA-C 107.423 -1.325 . . . . 0.0 107.423 171.813 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 91' ' ' GLN . . . . . . . . . . . . . 82.1 mm-40 -62.64 130.91 47.14 Favored 'General case' 0 N--CA 1.442 -0.833 0 N-CA-C 106.109 -1.812 . . . . 0.0 106.109 159.239 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 92' ' ' VAL . . . . . . . . . . . . . 4.2 p -118.27 124.67 73.46 Favored 'Isoleucine or valine' 0 N--CA 1.44 -0.927 0 N-CA-C 104.069 -2.567 . . . . 0.0 104.069 -179.008 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 93' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -138.69 138.48 37.78 Favored 'General case' 0 N--CA 1.444 -0.739 0 N-CA-C 106.316 -1.735 . . . . 0.0 106.316 173.37 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 94' ' ' LEU . . . . . 0.556 ' HB2' HD12 ' A' ' 99' ' ' LEU . 10.8 tp -133.23 116.22 15.93 Favored 'General case' 0 N--CA 1.445 -0.687 0 N-CA-C 106.543 -1.651 . . . . 0.0 106.543 -178.923 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 95' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -82.59 -164.62 0.87 Allowed 'General case' 0 C--N 1.322 -0.619 0 CA-C-N 114.417 -1.265 . . . . 0.0 110.112 172.62 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 96' ' ' ALA . . . . . . . . . . . . . . . -49.59 -40.82 40.12 Favored 'General case' 0 CA--C 1.538 0.501 0 C-N-CA 124.611 1.164 . . . . 0.0 113.079 -178.004 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 97' ' ' ASN . . . . . . . . . . . . . 42.8 p30 -156.38 23.47 0.35 Allowed 'General case' 0 CA--C 1.541 0.63 0 N-CA-C 113.683 0.994 . . . . 0.0 113.683 -178.876 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 98' ' ' GLN . . . . . . . . . . . . . 13.7 tt0 -137.11 122.79 19.83 Favored 'General case' 0 N--CA 1.467 0.381 0 C-N-CA 124.45 1.1 . . . . 0.0 108.568 -177.735 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 99' ' ' LEU . . . . . 0.556 HD12 ' HB2' ' A' ' 94' ' ' LEU . 3.7 tp -82.38 130.81 35.19 Favored 'General case' 0 C--O 1.235 0.306 0 N-CA-C 107.709 -1.219 . . . . 0.0 107.709 170.723 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 100' ' ' THR . . . . . . . . . . . . . 5.0 m -117.73 114.32 23.15 Favored 'General case' 0 C--N 1.325 -0.471 0 C-N-CA 126.506 1.923 . . . . 0.0 106.743 171.371 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 101' ' ' LEU . . . . . . . . . . . . . 0.7 OUTLIER -115.54 123.82 49.47 Favored 'General case' 0 CA--C 1.505 -0.777 0 N-CA-C 106.832 -1.544 . . . . 0.0 106.832 -179.073 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 102' ' ' ALA . . . . . . . . . . . . . . . -139.14 158.48 44.1 Favored 'General case' 0 C--N 1.325 -0.488 0 C-N-CA 123.655 0.782 . . . . 0.0 108.97 178.577 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 103' ' ' THR . . . . . . . . . . . . . 0.6 OUTLIER -154.61 -179.95 8.47 Favored 'General case' 0 N--CA 1.443 -0.815 0 C-N-CA 126.438 1.895 . . . . 0.0 106.214 176.838 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 104' ' ' ALA . . . . . . . . . . . . . . . -60.53 -26.24 66.72 Favored 'General case' 0 C--O 1.236 0.363 0 O-C-N 120.992 -1.067 . . . . 0.0 112.284 174.613 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 105' ' ' LYS . . . . . . . . . . . . . 13.0 mmtt -77.63 -71.7 0.4 Allowed 'General case' 0 CA--C 1.512 -0.504 0 O-C-N 121.962 -0.461 . . . . 0.0 111.048 -179.992 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 106' ' ' GLN . . . . . . . . . . . . . 1.4 tt0 -154.07 -169.87 3.38 Favored 'General case' 0 N--CA 1.45 -0.446 0 N-CA-C 109.719 -0.475 . . . . 0.0 109.719 -166.435 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 107' ' ' THR . . . . . . . . . . . . . 10.0 t -143.74 164.13 31.35 Favored 'General case' 0 C--O 1.24 0.601 0 C-N-CA 123.431 0.692 . . . . 0.0 110.281 -173.682 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 108' ' ' LEU . . . . . . . . . . . . . 75.6 mt -150.05 134.05 16.99 Favored 'General case' 0 CA--C 1.536 0.434 0 C-N-CA 128.399 2.679 . . . . 0.0 106.123 -170.688 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 109' ' ' THR . . . . . . . . . . . . . 82.6 m -115.21 116.21 27.97 Favored 'General case' 0 C--O 1.237 0.398 0 N-CA-C 107.022 -1.473 . . . . 0.0 107.022 174.721 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 110' ' ' TYR . . . . . . . . . . . . . 21.7 m-85 -106.99 168.57 9.11 Favored 'General case' 0 C--O 1.237 0.424 0 CA-C-O 121.637 0.732 . . . . 0.0 109.811 176.652 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 111' ' ' LYS . . . . . . . . . . . . . 0.9 OUTLIER -130.03 143.71 50.94 Favored 'General case' 0 CA--C 1.519 -0.225 0 C-N-CA 126.013 1.725 . . . . 0.0 108.343 -170.847 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 112' ' ' LEU . . . . . . . . . . . . . 21.2 tp -70.71 60.63 0.23 Allowed 'General case' 0 CA--C 1.54 0.581 0 C-N-CA 126.222 1.809 . . . . 0.0 111.575 171.152 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 113' ' ' ALA . . . . . . . . . . . . . . . -88.04 103.34 15.63 Favored 'General case' 0 N--CA 1.453 -0.303 0 N-CA-C 105.297 -2.112 . . . . 0.0 105.297 163.251 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 114' ' ' ASP . . . . . . . . . . . . . 46.5 t0 . . . . . 0 C--N 1.33 -0.241 0 CA-C-O 122.918 1.342 . . . . 0.0 109.39 174.357 . . . . . . . . 0 0 . 1 . 006 nuclear nobuild core ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 21.1 ttm . . . . . 0 N--CA 1.455 -0.181 0 N-CA-C 108.321 -0.992 . . . . 0.0 108.321 . . . . . . . . . 0 0 . 1 . 006 nuclear nobuild core ' A' A ' 2' ' ' VAL . . . . . 0.555 HG11 ' O ' ' A' ' 92' ' ' VAL . 8.2 p -57.64 142.3 13.51 Favored 'Isoleucine or valine' 0 CA--C 1.542 0.648 0 CA-C-N 115.951 -0.568 . . . . 0.0 110.251 173.237 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 3' ' ' THR . . . . . . . . . . . . . 21.5 p -123.03 163.9 30.61 Favored Pre-proline 0 C--O 1.226 -0.153 0 O-C-N 121.353 -0.842 . . . . 0.0 109.956 172.724 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 4' ' ' PRO . . . . . . . . . . . . . 31.1 Cg_endo -63.89 -36.63 49.05 Favored 'Trans proline' 0 N--CA 1.461 -0.427 0 C-N-CA 122.227 1.951 . . . . 0.0 112.183 174.377 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 5' ' ' GLU . . . . . . . . . . . . . 13.3 tt0 -57.27 -56.67 18.84 Favored 'General case' 0 CA--C 1.534 0.333 0 C-N-CA 123.524 0.729 . . . . 0.0 111.25 -172.721 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 6' ' ' GLN . . . . . 0.485 HE21 HD12 ' A' ' 94' ' ' LEU . 20.0 pt20 -64.05 18.3 0.01 OUTLIER 'General case' 0 CA--C 1.543 0.691 0 C-N-CA 128.174 2.59 . . . . 0.0 114.252 178.877 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 7' ' ' LEU . . . . . . . . . . . . . 72.9 mt -134.95 -50.3 0.76 Allowed 'General case' 0 N--CA 1.453 -0.313 0 C-N-CA 126.272 1.829 . . . . 0.0 109.58 -176.649 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 8' ' ' GLN . . . . . . . . . . . . . 5.4 mt-30 -57.65 -21.31 39.17 Favored 'General case' 0 N--CA 1.472 0.652 0 N-CA-C 114.114 1.153 . . . . 0.0 114.114 -177.182 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 9' ' ' HIS . . . . . . . . . . . . . 8.3 m170 -110.76 11.46 22.57 Favored 'General case' 0 CA--C 1.537 0.475 0 C-N-CA 123.421 0.688 . . . . 0.0 111.218 -179.916 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 10' ' ' HIS . . . . . . . . . . . . . 60.5 m-70 -136.33 112.25 9.57 Favored 'General case' 0 CA--C 1.535 0.39 0 C-N-CA 124.686 1.195 . . . . 0.0 109.223 -165.754 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 11' ' ' ARG . . . . . . . . . . . . . 4.6 ttt85 -69.11 152.61 44.95 Favored 'General case' 0 N--CA 1.466 0.351 0 O-C-N 121.304 -0.873 . . . . 0.0 108.961 172.159 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 12' ' ' PHE . . . . . . . . . . . . . 21.3 m-85 -139.11 156.6 47.03 Favored 'General case' 0 CA--C 1.512 -0.513 0 N-CA-C 108.387 -0.968 . . . . 0.0 108.387 173.676 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 13' ' ' VAL . . . . . 0.688 ' CG1' ' HB3' ' A' ' 113' ' ' ALA . 1.8 p -140.5 128.68 24.59 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.583 0 N-CA-C 113.135 0.791 . . . . 0.0 113.135 -179.339 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 14' ' ' LEU . . . . . . . . . . . . . 6.4 tt -57.32 119.91 7.25 Favored 'General case' 0 CA--C 1.508 -0.666 0 N-CA-C 107.512 -1.292 . . . . 0.0 107.512 178.055 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 15' ' ' GLU . . . . . 0.456 ' HG3' ' HE2' ' A' ' 111' ' ' LYS . 0.1 OUTLIER -106.12 -45.23 4.38 Favored 'General case' 0 N--CA 1.439 -0.978 0 CA-C-N 115.092 -0.958 . . . . 0.0 108.996 -173.229 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -143.56 152.18 41.11 Favored 'General case' 0 N--CA 1.443 -0.79 0 CA-C-O 121.972 0.891 . . . . 0.0 111.406 174.242 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 17' ' ' VAL . . . . . . . . . . . . . 10.5 t -76.93 175.68 0.73 Allowed 'Isoleucine or valine' 0 C--O 1.242 0.673 0 N-CA-C 106.871 -1.529 . . . . 0.0 106.871 173.1 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 18' ' ' ASN . . . . . . . . . . . . . 0.2 OUTLIER -44.79 -34.49 2.32 Favored 'General case' 0 CA--C 1.535 0.374 0 C-N-CA 126.773 2.029 . . . . 0.0 113.103 169.6 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . -115.3 -54.31 0.38 Allowed Glycine 0 CA--C 1.525 0.687 0 CA-C-O 118.937 -0.924 . . . . 0.0 113.339 -168.198 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 12.9 mttm -134.07 160.76 67.3 Favored Pre-proline 0 N--CA 1.466 0.331 0 CA-C-N 118.694 1.247 . . . . 0.0 111.702 178.08 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 21' ' ' PRO . . . . . . . . . . . . . 59.8 Cg_endo -67.06 160.72 46.0 Favored 'Trans proline' 0 N--CA 1.45 -1.029 0 C-N-CA 122.012 1.808 . . . . 0.0 110.321 162.468 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 22' ' ' VAL . . . . . . . . . . . . . 13.3 p -139.74 165.52 22.16 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.41 0 C-N-CA 124.536 1.134 . . . . 0.0 109.166 -179.265 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 23' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -130.07 157.98 40.89 Favored 'General case' 0 C--O 1.235 0.338 0 CA-C-O 121.528 0.68 . . . . 0.0 111.465 -179.166 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 24' ' ' SER . . . . . 0.422 ' HB3' ' HA ' ' A' ' 28' ' ' PRO . 32.2 t -150.9 47.88 0.85 Allowed 'General case' 0 CA--C 1.536 0.435 0 C-N-CA 126.462 1.905 . . . . 0.0 106.624 -178.397 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 25' ' ' ASP . . . . . . . . . . . . . 32.6 m-20 44.54 54.59 6.33 Favored 'General case' 0 N--CA 1.469 0.506 0 C-N-CA 126.044 1.737 . . . . 0.0 112.466 -176.391 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 26' ' ' LYS . . . . . . . . . . . . . 7.1 tmtm? 69.99 -2.57 2.01 Favored 'General case' 0 N--CA 1.471 0.605 0 O-C-N 120.91 -1.119 . . . . 0.0 112.664 176.619 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 27' ' ' ASN . . . . . . . . . . . . . 82.5 m-20 -113.43 71.03 1.56 Allowed Pre-proline 0 CA--C 1.537 0.471 0 C-N-CA 125.761 1.624 . . . . 0.0 107.471 175.455 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 28' ' ' PRO . . . . . 0.422 ' HA ' ' HB3' ' A' ' 24' ' ' SER . 60.2 Cg_endo -67.99 170.35 14.48 Favored 'Trans proline' 0 C--N 1.349 0.6 0 C-N-CA 124.664 3.576 . . . . 0.0 113.412 -173.335 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 29' ' ' PRO . . . . . 0.479 ' HB3' ' HA ' ' A' ' 43' ' ' MET . 12.2 Cg_endo -61.46 69.49 0.1 OUTLIER 'Trans proline' 0 CA--C 1.544 1.013 0 C-N-CA 125.167 3.911 . . . . 0.0 112.042 164.569 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 30' ' ' GLU . . . . . . . . . . . . . 11.7 pt-20 -95.74 168.95 10.35 Favored 'General case' 0 C--N 1.327 -0.379 0 O-C-N 119.768 -1.833 . . . . 0.0 111.105 177.512 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 31' ' ' ILE . . . . . 0.418 HD11 ' CG2' ' A' ' 39' ' ' ILE . 14.4 tt -147.64 165.62 5.83 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.399 0 C-N-CA 124.392 1.077 . . . . 0.0 108.307 -168.854 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 32' ' ' SER . . . . . . . . . . . . . 5.9 p -145.92 161.67 39.53 Favored 'General case' 0 N--CA 1.443 -0.824 0 N-CA-C 107.985 -1.117 . . . . 0.0 107.985 165.884 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 33' ' ' PHE . . . . . . . . . . . . . 84.6 m-85 -127.57 167.43 16.35 Favored 'General case' 0 N--CA 1.442 -0.874 0 N-CA-C 106.619 -1.623 . . . . 0.0 106.619 175.357 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 34' ' ' GLY . . . . . . . . . . . . . . . 165.57 -167.28 38.92 Favored Glycine 0 N--CA 1.447 -0.596 0 N-CA-C 105.815 -2.914 . . . . 0.0 105.815 -177.189 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 35' ' ' GLU . . . . . . . . . . . . . 37.7 mt-10 44.38 72.51 0.19 Allowed 'General case' 0 C--N 1.33 -0.242 0 C-N-CA 124.952 1.301 . . . . 0.0 112.41 161.658 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 24.9 mtmt 60.33 28.31 17.92 Favored 'General case' 0 CA--C 1.541 0.633 0 CA-C-N 115.182 -0.917 . . . . 0.0 112.224 174.635 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 37' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER 75.23 15.92 2.81 Favored 'General case' 0 N--CA 1.469 0.521 0 C-N-CA 128.152 2.581 . . . . 0.0 112.649 -175.867 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 38' ' ' MET . . . . . . . . . . . . . 19.6 mtp -55.92 147.44 19.48 Favored 'General case' 0 C--O 1.237 0.395 0 O-C-N 120.697 -1.252 . . . . 0.0 110.664 167.451 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 39' ' ' ILE . . . . . 0.418 ' CG2' HD11 ' A' ' 31' ' ' ILE . 7.5 mt -108.61 135.47 47.33 Favored 'Isoleucine or valine' 0 N--CA 1.447 -0.588 0 N-CA-C 107.158 -1.423 . . . . 0.0 107.158 -177.428 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 40' ' ' SER . . . . . . . . . . . . . 4.4 m -136.18 135.57 39.27 Favored 'General case' 0 N--CA 1.452 -0.36 0 N-CA-C 107.584 -1.265 . . . . 0.0 107.584 171.757 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 41' ' ' GLY . . . . . . . . . . . . . . . -178.08 -175.46 45.25 Favored Glycine 0 C--O 1.237 0.325 0 CA-C-N 119.179 0.9 . . . . 0.0 111.114 -178.474 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 42' ' ' SER . . . . . . . . . . . . . 15.7 t -143.54 167.62 21.79 Favored 'General case' 0 N--CA 1.444 -0.75 0 N-CA-C 108.197 -1.038 . . . . 0.0 108.197 165.548 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 43' ' ' MET . . . . . 0.479 ' HA ' ' HB3' ' A' ' 29' ' ' PRO . 36.4 mmm -126.79 -45.33 1.61 Allowed 'General case' 0 N--CA 1.447 -0.614 0 N-CA-C 107.86 -1.163 . . . . 0.0 107.86 162.014 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 44' ' ' CYS . . . . . 1.283 ' SG ' ' SG ' ' A' ' 70' ' ' CYS . 41.6 t -149.16 -51.21 0.15 Allowed 'General case' 0 CA--C 1.542 0.664 0 C-N-CA 126.112 1.765 . . . . 0.0 108.009 167.706 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 45' ' ' ASN . . . . . . . . . . . . . 8.0 m-80 -88.95 10.34 21.74 Favored 'General case' 0 N--CA 1.467 0.4 0 N-CA-C 115.898 1.814 . . . . 0.0 115.898 -174.203 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 46' ' ' ARG . . . . . . . . . . . . . 0.4 OUTLIER 60.99 164.78 0.08 Allowed 'General case' 0 N--CA 1.474 0.774 0 C-N-CA 125.809 1.644 . . . . 0.0 111.661 -169.737 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 47' ' ' PHE . . . . . . . . . . . . . 51.6 p90 -162.76 169.09 20.5 Favored 'General case' 0 C--O 1.238 0.492 0 C-N-CA 124.954 1.301 . . . . 0.0 108.887 167.852 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 48' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -157.23 162.21 39.25 Favored 'General case' 0 CA--C 1.541 0.608 0 C-N-CA 124.656 1.182 . . . . 0.0 108.673 164.731 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 49' ' ' GLY . . . . . . . . . . . . . . . -179.1 167.96 38.45 Favored Glycine 0 CA--C 1.532 1.109 0 CA-C-N 120.572 1.533 . . . . 0.0 113.156 171.104 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 50' ' ' GLU . . . . . . . . . . . . . 40.4 mt-10 -68.81 95.35 0.67 Allowed 'General case' 0 CA--C 1.534 0.329 0 C-N-CA 125.013 1.325 . . . . 0.0 110.193 170.473 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 51' ' ' GLY . . . . . . . . . . . . . . . -76.85 165.01 53.4 Favored Glycine 0 CA--C 1.529 0.951 0 N-CA-C 110.296 -1.122 . . . . 0.0 110.296 161.242 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 52' ' ' LYS . . . . . . . . . . . . . 62.3 tttt -168.85 137.01 2.03 Favored 'General case' 0 CA--C 1.517 -0.289 0 C-N-CA 126.833 2.053 . . . . 0.0 106.036 174.837 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 53' ' ' LEU . . . . . 0.464 HD12 ' N ' ' A' ' 54' ' ' SER . 16.1 tp -130.77 128.96 41.81 Favored 'General case' 0 CA--C 1.517 -0.316 0 CA-C-O 122.317 1.055 . . . . 0.0 110.391 -177.441 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 54' ' ' SER . . . . . 0.464 ' N ' HD12 ' A' ' 53' ' ' LEU . 21.1 t -144.94 -37.18 0.29 Allowed 'General case' 0 N--CA 1.443 -0.796 0 C-N-CA 125.433 1.493 . . . . 0.0 109.903 174.729 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 55' ' ' ASN . . . . . . . . . . . . . 65.9 t30 -121.64 23.23 10.31 Favored 'General case' 0 CA--C 1.538 0.502 0 C-N-CA 124.175 0.99 . . . . 0.0 113.647 -164.66 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 56' ' ' GLY . . . . . . . . . . . . . . . 78.03 5.28 86.9 Favored Glycine 0 CA--C 1.532 1.095 0 O-C-N 120.606 -1.309 . . . . 0.0 113.512 -176.089 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 57' ' ' GLU . . . . . . . . . . . . . 40.3 tt0 -123.67 148.6 46.36 Favored 'General case' 0 C--O 1.237 0.399 0 CA-C-N 118.612 1.206 . . . . 0.0 108.589 -174.13 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 58' ' ' LEU . . . . . . . . . . . . . 8.4 tp -132.51 138.83 47.67 Favored 'General case' 0 C--N 1.33 -0.251 0 C-N-CA 125.364 1.466 . . . . 0.0 110.54 178.421 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 59' ' ' THR . . . . . . . . . . . . . 1.6 p -125.82 167.11 15.66 Favored 'General case' 0 C--O 1.237 0.429 0 C-N-CA 125.76 1.624 . . . . 0.0 111.17 -176.66 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 60' ' ' ALA . . . . . . . . . . . . . . . -139.45 107.32 5.67 Favored 'General case' 0 CA--C 1.53 0.18 0 C-N-CA 125.505 1.522 . . . . 0.0 111.706 168.381 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 61' ' ' LYS . . . . . . . . . . . . . 24.7 tttt -72.55 77.23 1.07 Allowed 'General case' 0 CA--C 1.542 0.636 0 C-N-CA 124.027 0.931 . . . . 0.0 111.027 178.273 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 62' ' ' GLY . . . . . . . . . . . . . . . 124.29 -65.29 0.54 Allowed Glycine 0 N--CA 1.466 0.674 0 C-N-CA 125.68 1.61 . . . . 0.0 111.397 172.801 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 63' ' ' LEU . . . . . . . . . . . . . 6.0 tt 65.51 103.39 0.04 OUTLIER 'General case' 0 CA--C 1.535 0.4 0 C-N-CA 128.578 2.751 . . . . 0.0 114.243 174.003 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 64' ' ' ALA . . . . . . . . . . . . . . . -84.22 97.48 9.42 Favored 'General case' 0 CA--C 1.533 0.32 0 C-N-CA 126.759 2.024 . . . . 0.0 112.635 -169.693 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 65' ' ' MET . . . . . . . . . . . . . 3.0 mtt -98.2 -179.66 4.45 Favored 'General case' 0 CA--C 1.543 0.675 0 C-N-CA 124.684 1.194 . . . . 0.0 111.127 176.064 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 66' ' ' THR . . . . . . . . . . . . . 9.2 p -118.2 -163.89 0.98 Allowed 'General case' 0 CA--C 1.552 1.028 0 C-N-CA 125.989 1.715 . . . . 0.0 111.822 -179.744 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 67' ' ' ARG . . . . . . . . . . . . . 28.9 mmt180 -133.21 49.12 2.33 Favored 'General case' 0 CA--C 1.553 1.089 0 C-N-CA 126.296 1.838 . . . . 0.0 111.474 172.985 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 68' ' ' MET . . . . . . . . . . . . . 59.4 mtm -84.12 -175.0 5.59 Favored 'General case' 0 CA--C 1.544 0.743 0 C-N-CA 128.113 2.565 . . . . 0.0 110.612 167.942 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 69' ' ' MET . . . . . . . . . . . . . 1.4 pmm? -151.01 173.83 13.86 Favored 'General case' 0 N--CA 1.466 0.341 0 C-N-CA 126.255 1.822 . . . . 0.0 111.449 171.058 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 70' ' ' CYS . . . . . 1.283 ' SG ' ' SG ' ' A' ' 44' ' ' CYS . 86.0 m -141.36 148.05 39.04 Favored 'General case' 0 C--O 1.234 0.263 0 CA-C-O 122.041 0.924 . . . . 0.0 112.028 -169.74 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 71' ' ' ALA . . . . . . . . . . . . . . . -71.9 26.92 0.05 OUTLIER 'General case' 0 CA--C 1.543 0.705 0 C-N-CA 128.374 2.669 . . . . 0.0 112.265 175.927 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 72' ' ' ASN . . . . . . . . . . . . . 53.3 t-20 -146.96 141.38 15.92 Favored Pre-proline 0 CA--C 1.535 0.4 0 N-CA-C 103.859 -2.645 . . . . 0.0 103.859 156.114 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 73' ' ' PRO . . . . . . . . . . . . . 56.1 Cg_endo -83.94 -26.84 1.79 Allowed 'Trans proline' 0 N--CA 1.465 -0.158 0 C-N-CA 122.271 1.981 . . . . 0.0 111.759 -176.968 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 74' ' ' GLN . . . . . . . . . . . . . 11.2 tt0 -63.14 -26.18 68.7 Favored 'General case' 0 CA--C 1.538 0.508 0 O-C-N 121.669 -0.645 . . . . 0.0 110.852 179.807 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 75' ' ' LEU . . . . . . . . . . . . . 62.1 mt -69.45 -32.14 70.9 Favored 'General case' 0 N--CA 1.47 0.542 0 C-N-CA 123.71 0.804 . . . . 0.0 111.728 173.121 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 76' ' ' ASN . . . . . . . . . . . . . 2.1 t-20 -79.79 -20.87 45.17 Favored 'General case' 0 CA--C 1.531 0.237 0 C-N-CA 124.177 0.991 . . . . 0.0 111.261 -177.555 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 77' ' ' GLU . . . . . . . . . . . . . 4.3 mm-40 -78.49 -34.08 47.76 Favored 'General case' 0 CA--C 1.536 0.41 0 C-N-CA 123.944 0.898 . . . . 0.0 110.114 169.591 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 78' ' ' LEU . . . . . 0.417 HD12 ' HE2' ' A' ' 43' ' ' MET . 0.9 OUTLIER -57.05 -24.83 56.66 Favored 'General case' 0 C--N 1.345 0.407 0 O-C-N 121.513 -0.742 . . . . 0.0 111.869 176.369 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' A' A ' 79' ' ' ASP . . . . . . . . . . . . . 69.3 m-20 -64.35 -27.32 68.94 Favored 'General case' 0 N--CA 1.454 -0.273 0 C-N-CA 122.977 0.511 . . . . 0.0 111.991 -176.708 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 80' ' ' ASN . . . . . . . . . . . . . 10.7 p30 -101.76 -29.82 11.66 Favored 'General case' 0 N--CA 1.437 -1.106 0 CA-C-O 116.613 -1.661 . . . . 0.0 111.77 174.961 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 81' ' ' THR . . . . . . . . . . . . . 25.2 m -44.94 -74.42 0.04 OUTLIER 'General case' 0 CA--C 1.535 0.403 0 CA-C-N 119.164 0.893 . . . . 0.0 108.82 161.818 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 82' ' ' ILE . . . . . . . . . . . . . 5.2 tp -66.62 -34.58 71.02 Favored 'Isoleucine or valine' 0 N--CA 1.455 -0.205 0 O-C-N 121.012 -1.055 . . . . 0.0 111.448 -167.589 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 83' ' ' SER . . . . . . . . . . . . . 4.3 m -61.91 -45.07 95.34 Favored 'General case' 0 N--CA 1.445 -0.701 0 O-C-N 122.155 -0.341 . . . . 0.0 110.646 -177.662 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 84' ' ' GLU . . . . . . . . . . . . . 31.9 tt0 -77.94 -34.51 51.16 Favored 'General case' 0 N--CA 1.446 -0.669 0 CA-C-O 118.03 -0.986 . . . . 0.0 110.173 -178.032 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 85' ' ' MET . . . . . . . . . . . . . 86.8 mtp -54.64 -48.64 72.03 Favored 'General case' 0 C--N 1.343 0.297 0 CA-C-O 121.956 0.884 . . . . 0.0 108.728 174.709 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 86' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -76.63 -26.62 55.11 Favored 'General case' 0 N--CA 1.45 -0.457 0 CA-C-O 118.612 -0.708 . . . . 0.0 111.566 -176.648 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 87' ' ' LYS . . . . . . . . . . . . . 31.5 mttt -70.89 -38.14 73.03 Favored 'General case' 0 CA--C 1.532 0.284 0 CA-C-N 119.94 1.245 . . . . 0.0 108.938 178.203 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 88' ' ' GLU . . . . . . . . . . . . . 31.8 mm-40 -66.47 -63.79 1.0 Allowed 'General case' 0 CA--C 1.532 0.283 0 C-N-CA 125.274 1.43 . . . . 0.0 109.494 173.168 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 89' ' ' GLY . . . . . . . . . . . . . . . 135.55 99.22 0.58 Allowed Glycine 0 C--N 1.335 0.523 0 N-CA-C 107.517 -2.233 . . . . 0.0 107.517 -161.873 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 90' ' ' ALA . . . . . . . . . . . . . . . -90.47 139.88 30.26 Favored 'General case' 0 N--CA 1.455 -0.221 0 N-CA-C 108.996 -0.742 . . . . 0.0 108.996 -179.327 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 91' ' ' GLN . . . . . . . . . . . . . 41.9 mm-40 -78.63 134.99 37.11 Favored 'General case' 0 N--CA 1.442 -0.865 0 N-CA-C 106.075 -1.824 . . . . 0.0 106.075 174.916 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 92' ' ' VAL . . . . . 0.555 ' O ' HG11 ' A' ' 2' ' ' VAL . 24.2 t -130.14 98.0 3.6 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.476 0 C-N-CA 127.444 2.297 . . . . 0.0 106.144 -167.133 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 93' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -116.71 94.19 4.51 Favored 'General case' 0 C--O 1.235 0.335 0 CA-C-O 121.225 0.536 . . . . 0.0 110.317 -175.736 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 94' ' ' LEU . . . . . 0.485 HD12 HE21 ' A' ' 6' ' ' GLN . 1.5 tm? -93.2 106.66 18.6 Favored 'General case' 0 C--O 1.233 0.213 0 N-CA-C 108.479 -0.934 . . . . 0.0 108.479 174.856 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 95' ' ' THR . . . . . . . . . . . . . 5.8 t -85.55 -164.81 1.07 Allowed 'General case' 0 CA--C 1.543 0.69 0 C-N-CA 125.932 1.693 . . . . 0.0 108.724 171.108 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 96' ' ' ALA . . . . . . . . . . . . . . . -55.33 -22.74 20.38 Favored 'General case' 0 CA--C 1.545 0.775 0 N-CA-C 115.638 1.718 . . . . 0.0 115.638 -172.953 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 97' ' ' ASN . . . . . . . . . . . . . 0.0 OUTLIER -152.83 2.63 0.31 Allowed 'General case' 0 N--CA 1.477 0.922 0 CA-C-N 120.313 1.415 . . . . 0.0 113.941 176.395 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 98' ' ' GLN . . . . . . . . . . . . . 6.5 tt0 -140.14 136.37 33.44 Favored 'General case' 0 CA--C 1.53 0.211 0 O-C-N 120.423 -1.423 . . . . 0.0 109.525 -163.551 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 99' ' ' LEU . . . . . . . . . . . . . 20.2 tp -113.99 115.3 27.41 Favored 'General case' 0 N--CA 1.464 0.272 0 C-N-CA 126.84 2.056 . . . . 0.0 108.455 -172.468 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 100' ' ' THR . . . . . . . . . . . . . 0.9 OUTLIER -89.73 149.68 22.63 Favored 'General case' 0 CA--C 1.541 0.61 0 N-CA-C 104.787 -2.301 . . . . 0.0 104.787 177.044 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 101' ' ' LEU . . . . . . . . . . . . . 1.2 mm? -120.74 117.29 27.1 Favored 'General case' 0 N--CA 1.455 -0.189 0 C-N-CA 127.211 2.204 . . . . 0.0 106.583 163.125 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 102' ' ' ALA . . . . . . . . . . . . . . . -129.17 140.78 51.38 Favored 'General case' 0 N--CA 1.464 0.233 0 CA-C-N 119.406 1.003 . . . . 0.0 109.603 174.526 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 103' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -160.33 175.49 12.77 Favored 'General case' 0 N--CA 1.448 -0.554 0 C-N-CA 126.636 1.975 . . . . 0.0 108.336 171.599 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 104' ' ' ALA . . . . . . . . . . . . . . . -47.64 -36.34 10.82 Favored 'General case' 0 N--CA 1.453 -0.283 0 CA-C-O 117.549 -1.215 . . . . 0.0 112.855 173.391 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 105' ' ' LYS . . . . . 0.523 ' HE3' ' HA ' ' A' ' 105' ' ' LYS . 0.0 OUTLIER -55.98 -69.04 0.16 Allowed 'General case' 0 C--N 1.344 0.355 0 CA-C-N 120.004 1.274 . . . . 0.0 111.588 178.716 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' A' A ' 106' ' ' GLN . . . . . . . . . . . . . 10.2 pt20 -176.62 -164.95 0.12 Allowed 'General case' 0 C--N 1.329 -0.325 0 C-N-CA 127.303 2.241 . . . . 0.0 106.526 -174.69 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 107' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -135.42 138.9 43.7 Favored 'General case' 0 N--CA 1.443 -0.786 0 N-CA-C 107.663 -1.236 . . . . 0.0 107.663 -163.459 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 108' ' ' LEU . . . . . . . . . . . . . 1.1 mm? -133.58 162.84 30.81 Favored 'General case' 0 C--N 1.331 -0.226 0 C-N-CA 125.73 1.612 . . . . 0.0 107.401 174.039 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 109' ' ' THR . . . . . . . . . . . . . 81.1 m -139.64 116.7 11.07 Favored 'General case' 0 C--O 1.237 0.435 0 N-CA-C 108.307 -0.998 . . . . 0.0 108.307 174.746 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 110' ' ' TYR . . . . . . . . . . . . . 0.8 OUTLIER -94.68 157.04 16.14 Favored 'General case' 0 CA--C 1.536 0.409 0 C-N-CA 126.498 1.919 . . . . 0.0 109.012 177.731 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 111' ' ' LYS . . . . . 0.456 ' HE2' ' HG3' ' A' ' 15' ' ' GLU . 3.7 tppt? -102.02 150.69 22.98 Favored 'General case' 0 C--O 1.237 0.41 0 C-N-CA 126.795 2.038 . . . . 0.0 108.994 176.05 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 112' ' ' LEU . . . . . . . . . . . . . 44.4 tp -72.95 59.34 0.5 Allowed 'General case' 0 CA--C 1.54 0.58 0 C-N-CA 124.968 1.307 . . . . 0.0 108.649 158.967 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 113' ' ' ALA . . . . . 0.688 ' HB3' ' CG1' ' A' ' 13' ' ' VAL . . . -96.63 83.83 3.54 Favored 'General case' 0 C--N 1.328 -0.351 0 N-CA-C 106.112 -1.811 . . . . 0.0 106.112 164.97 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 114' ' ' ASP . . . . . . . . . . . . . 3.2 p-10 . . . . . 0 CA--C 1.53 0.183 0 C-N-CA 125.271 1.429 . . . . 0.0 111.886 -176.89 . . . . . . . . 0 0 . 1 . 007 nuclear nobuild core ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 0.2 OUTLIER . . . . . 0 N--CA 1.451 -0.389 0 N-CA-C 109.099 -0.704 . . . . 0.0 109.099 . . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 2' ' ' VAL . . . . . . . . . . . . . 7.6 p -59.5 144.76 12.18 Favored 'Isoleucine or valine' 0 C--O 1.237 0.418 0 CA-C-O 120.879 0.371 . . . . 0.0 110.877 175.713 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 3' ' ' THR . . . . . . . . . . . . . 4.3 p -132.39 164.48 43.1 Favored Pre-proline 0 N--CA 1.453 -0.301 0 C-N-CA 124.508 1.123 . . . . 0.0 110.297 -178.064 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 4' ' ' PRO . . . . . . . . . . . . . 29.6 Cg_endo -66.15 -38.99 19.61 Favored 'Trans proline' 0 N--CA 1.462 -0.368 0 C-N-CA 122.559 2.173 . . . . 0.0 113.032 178.121 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 5' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -58.48 -47.48 83.92 Favored 'General case' 0 C--N 1.328 -0.353 0 C-N-CA 123.433 0.693 . . . . 0.0 110.907 -174.857 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 6' ' ' GLN . . . . . 0.405 HE21 HD12 ' A' ' 94' ' ' LEU . 15.8 pt20 -69.75 15.55 0.08 Allowed 'General case' 0 CA--C 1.541 0.603 0 C-N-CA 124.975 1.31 . . . . 0.0 114.048 176.161 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 7' ' ' LEU . . . . . . . . . . . . . 94.4 mt -130.3 -47.02 1.09 Allowed 'General case' 0 CA--C 1.529 0.17 0 C-N-CA 125.475 1.51 . . . . 0.0 110.882 -178.149 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 8' ' ' GLN . . . . . . . . . . . . . 7.1 mt-30 -60.77 -6.34 1.7 Allowed 'General case' 0 N--CA 1.479 1.012 0 N-CA-C 114.945 1.461 . . . . 0.0 114.945 -175.356 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 9' ' ' HIS . . . . . . . . . . . . . 10.7 m170 -126.94 13.29 7.32 Favored 'General case' 0 C--N 1.323 -0.554 0 C-N-CA 124.701 1.2 . . . . 0.0 111.359 -175.667 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 10' ' ' HIS . . . . . . . . . . . . . 73.8 m-70 -137.82 106.4 5.86 Favored 'General case' 0 CA--C 1.542 0.636 0 C-N-CA 124.466 1.107 . . . . 0.0 110.583 -161.341 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 11' ' ' ARG . . . . . . . . . . . . . 1.8 ttt180 -69.65 144.73 52.83 Favored 'General case' 0 N--CA 1.472 0.659 0 O-C-N 121.241 -0.912 . . . . 0.0 109.909 173.87 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 12' ' ' PHE . . . . . . . . . . . . . 39.4 m-85 -133.84 117.6 17.02 Favored 'General case' 0 N--CA 1.454 -0.26 0 C-N-CA 125.571 1.548 . . . . 0.0 107.709 177.584 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 13' ' ' VAL . . . . . 0.458 ' HA ' ' HA ' ' A' ' 30' ' ' GLU . 11.8 p -89.73 146.22 6.45 Favored 'Isoleucine or valine' 0 C--O 1.237 0.423 0 O-C-N 120.939 -1.101 . . . . 0.0 109.53 171.836 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 14' ' ' LEU . . . . . . . . . . . . . 25.0 tp -71.59 94.79 1.35 Allowed 'General case' 0 N--CA 1.453 -0.291 0 N-CA-C 107.572 -1.27 . . . . 0.0 107.572 173.078 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 4.3 mm-40 -61.89 -57.27 12.41 Favored 'General case' 0 N--CA 1.452 -0.327 0 N-CA-C 107.68 -1.23 . . . . 0.0 107.68 168.822 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 40.8 p -144.11 134.68 24.82 Favored 'General case' 0 N--CA 1.45 -0.457 0 N-CA-C 114.023 1.12 . . . . 0.0 114.023 -170.38 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 17' ' ' VAL . . . . . . . . . . . . . 65.9 t -72.52 165.07 3.16 Favored 'Isoleucine or valine' 0 C--O 1.24 0.577 0 N-CA-C 107.148 -1.427 . . . . 0.0 107.148 168.916 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 18' ' ' ASN . . . . . . . . . . . . . 0.0 OUTLIER -44.81 -39.56 5.4 Favored 'General case' 0 CA--C 1.534 0.33 0 C-N-CA 124.701 1.2 . . . . 0.0 112.185 174.776 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . -79.68 -81.11 0.76 Allowed Glycine 0 CA--C 1.526 0.734 0 C-N-CA 124.848 1.213 . . . . 0.0 110.609 177.565 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 37.7 mttt -141.99 166.29 22.46 Favored Pre-proline 0 CA--C 1.534 0.354 0 C-N-CA 127.057 2.143 . . . . 0.0 109.771 -173.517 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 21' ' ' PRO . . . . . . . . . . . . . 30.8 Cg_endo -58.14 168.54 3.54 Favored 'Trans proline' 0 N--CA 1.453 -0.865 0 C-N-CA 122.283 1.989 . . . . 0.0 113.042 172.58 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 22' ' ' VAL . . . . . . . . . . . . . 10.1 p -117.36 166.79 11.34 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.48 0 C-N-CA 127.31 2.244 . . . . 0.0 107.747 -179.45 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 23' ' ' THR . . . . . . . . . . . . . 39.7 m -131.14 156.35 45.42 Favored 'General case' 0 C--O 1.238 0.454 0 O-C-N 120.019 -1.676 . . . . 0.0 110.09 -177.772 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 24' ' ' SER . . . . . . . . . . . . . 1.7 p -154.98 136.15 13.94 Favored 'General case' 0 N--CA 1.435 -1.216 0 C-N-CA 125.806 1.642 . . . . 0.0 108.783 -162.379 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 25' ' ' ASP . . . . . . . . . . . . . 3.2 m-20 -71.14 63.33 0.33 Allowed 'General case' 0 C--N 1.32 -0.713 0 C-N-CA 124.936 1.295 . . . . 0.0 108.472 165.049 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 26' ' ' LYS . . . . . . . . . . . . . 31.0 tttp 62.79 4.9 1.57 Allowed 'General case' 0 CA--C 1.546 0.802 0 C-N-CA 124.329 1.052 . . . . 0.0 113.487 -179.554 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 27' ' ' ASN . . . . . . . . . . . . . 84.7 m-20 -127.2 76.54 76.26 Favored Pre-proline 0 C--O 1.239 0.525 0 C-N-CA 125.89 1.676 . . . . 0.0 108.306 -178.213 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 28' ' ' PRO . . . . . . . . . . . . . 85.4 Cg_endo -77.67 165.88 26.32 Favored 'Trans proline' 0 N--CA 1.461 -0.434 0 C-N-CA 124.078 3.186 . . . . 0.0 111.791 -176.42 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 29' ' ' PRO . . . . . . . . . . . . . 38.5 Cg_endo -66.89 83.41 0.32 Allowed 'Trans proline' 0 N--CA 1.452 -0.938 0 C-N-CA 122.789 2.326 . . . . 0.0 108.392 161.946 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 30' ' ' GLU . . . . . 0.458 ' HA ' ' HA ' ' A' ' 13' ' ' VAL . 12.9 pt-20 -91.67 163.73 13.99 Favored 'General case' 0 C--O 1.239 0.54 0 O-C-N 120.725 -1.235 . . . . 0.0 108.763 163.17 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 31' ' ' ILE . . . . . . . . . . . . . 12.1 tt -130.42 153.97 39.83 Favored 'Isoleucine or valine' 0 N--CA 1.449 -0.49 0 N-CA-C 106.06 -1.83 . . . . 0.0 106.06 171.806 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 32' ' ' SER . . . . . . . . . . . . . 3.6 t -144.86 172.46 13.0 Favored 'General case' 0 N--CA 1.445 -0.722 0 N-CA-C 107.074 -1.454 . . . . 0.0 107.074 167.765 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 33' ' ' PHE . . . . . . . . . . . . . 66.1 m-85 -136.12 163.07 31.19 Favored 'General case' 0 N--CA 1.445 -0.687 0 N-CA-C 107.027 -1.472 . . . . 0.0 107.027 -179.328 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 34' ' ' GLY . . . . . . . . . . . . . . . 167.54 113.95 0.29 Allowed Glycine 0 CA--C 1.495 -1.164 0 C-N-CA 118.226 -1.94 . . . . 0.0 114.639 172.263 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 35' ' ' GLU . . . . . . . . . . . . . 2.4 pt-20 77.12 140.57 0.07 Allowed 'General case' 0 N--CA 1.443 -0.787 1 C-N-CA 134.381 5.073 . . . . 0.0 106.845 -169.121 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 8.8 mtpm? 47.12 20.27 0.13 Allowed 'General case' 0 CA--C 1.544 0.733 0 N-CA-C 116.245 1.943 . . . . 0.0 116.245 176.167 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 37' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER 53.56 33.97 17.49 Favored 'General case' 0 C--N 1.331 -0.235 0 C-N-CA 126.418 1.887 . . . . 0.0 113.155 -167.964 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 38' ' ' MET . . . . . . . . . . . . . 0.1 OUTLIER -62.83 166.17 5.88 Favored 'General case' 0 N--CA 1.45 -0.451 0 N-CA-C 108.943 -0.762 . . . . 0.0 108.943 168.342 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 39' ' ' ILE . . . . . . . . . . . . . 9.1 mt -134.97 128.27 49.56 Favored 'Isoleucine or valine' 0 C--O 1.239 0.51 0 N-CA-C 107.471 -1.307 . . . . 0.0 107.471 -168.288 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 40' ' ' SER . . . . . . . . . . . . . 27.6 m -119.82 148.0 43.98 Favored 'General case' 0 CA--C 1.532 0.274 0 C-N-CA 124.735 1.214 . . . . 0.0 108.082 166.734 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 41' ' ' GLY . . . . . . . . . . . . . . . 173.23 178.61 43.34 Favored Glycine 0 CA--C 1.522 0.493 0 N-CA-C 109.725 -1.35 . . . . 0.0 109.725 -177.817 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 42' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -163.27 96.09 0.86 Allowed 'General case' 0 CA--C 1.536 0.418 0 O-C-N 121.942 -0.74 . . . . 0.0 110.863 -176.566 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 43' ' ' MET . . . . . . . . . . . . . 13.0 mmt -71.47 -68.73 0.43 Allowed 'General case' 0 N--CA 1.469 0.481 0 CA-C-N 118.456 0.571 . . . . 0.0 110.391 173.862 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 44' ' ' CYS . . . . . 1.286 ' SG ' ' SG ' ' A' ' 70' ' ' CYS . 45.6 t -135.59 -58.97 0.77 Allowed 'General case' 0 CA--C 1.527 0.089 0 N-CA-C 106.469 -1.678 . . . . 0.0 106.469 171.452 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 45' ' ' ASN . . . . . . . . . . . . . 25.7 m-20 -78.38 22.74 0.32 Allowed 'General case' 0 C--O 1.233 0.214 0 C-N-CA 126.811 2.044 . . . . 0.0 114.315 -175.118 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 46' ' ' ARG . . . . . . . . . . . . . 5.7 mpt_? 53.64 -173.85 0.04 OUTLIER 'General case' 0 C--O 1.225 -0.214 0 C-N-CA 124.028 0.931 . . . . 0.0 109.447 -163.737 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 47' ' ' PHE . . . . . . . . . . . . . 6.7 p90 -178.09 145.76 0.38 Allowed 'General case' 0 C--O 1.238 0.456 0 C-N-CA 126.399 1.88 . . . . 0.0 107.309 156.854 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 48' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -153.36 146.18 24.38 Favored 'General case' 0 C--N 1.324 -0.521 0 N-CA-C 107.749 -1.204 . . . . 0.0 107.749 177.23 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 49' ' ' GLY . . . . . . . . . . . . . . . -179.34 163.91 31.68 Favored Glycine 0 C--N 1.336 0.572 0 C-N-CA 120.398 -0.906 . . . . 0.0 112.615 179.133 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 50' ' ' GLU . . . . . . . . . . . . . 35.6 mt-10 -70.16 97.14 1.16 Allowed 'General case' 0 C--O 1.238 0.475 0 C-N-CA 124.809 1.244 . . . . 0.0 108.041 166.965 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 51' ' ' GLY . . . . . . . . . . . . . . . -72.08 175.58 41.97 Favored Glycine 0 CA--C 1.523 0.579 0 N-CA-C 110.416 -1.074 . . . . 0.0 110.416 155.888 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 52' ' ' LYS . . . . . . . . . . . . . 50.8 tttm -164.16 152.65 13.09 Favored 'General case' 0 C--N 1.332 -0.189 0 C-N-CA 125.795 1.638 . . . . 0.0 106.739 168.025 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 53' ' ' LEU . . . . . . . . . . . . . 46.2 tp -131.26 130.63 43.1 Favored 'General case' 0 C--O 1.232 0.179 0 C-N-CA 124.505 1.122 . . . . 0.0 109.169 170.813 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 40.1 t -139.37 -27.24 0.8 Allowed 'General case' 0 CA--C 1.535 0.399 0 C-N-CA 125.04 1.336 . . . . 0.0 111.292 177.832 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 55' ' ' ASN . . . . . . . . . . . . . 16.7 p-10 -146.41 17.96 1.34 Allowed 'General case' 0 CA--C 1.534 0.331 0 C-N-CA 124.486 1.114 . . . . 0.0 113.397 -153.319 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 56' ' ' GLY . . . . . . . . . . . . . . . 81.12 22.69 60.5 Favored Glycine 0 CA--C 1.525 0.692 0 CA-C-N 118.818 0.736 . . . . 0.0 112.958 -177.266 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 57' ' ' GLU . . . . . . . . . . . . . 35.8 tt0 -146.58 142.4 27.93 Favored 'General case' 0 C--O 1.237 0.425 0 C-N-CA 124.954 1.302 . . . . 0.0 109.183 -174.084 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 58' ' ' LEU . . . . . . . . . . . . . 57.9 tp -122.77 102.17 7.88 Favored 'General case' 0 CA--C 1.53 0.181 0 C-N-CA 127.115 2.166 . . . . 0.0 110.668 176.706 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 59' ' ' THR . . . . . . . . . . . . . 13.6 p -88.18 167.35 13.68 Favored 'General case' 0 CA--C 1.54 0.564 0 C-N-CA 124.611 1.164 . . . . 0.0 109.898 164.692 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 60' ' ' ALA . . . . . . . . . . . . . . . -132.23 107.54 8.65 Favored 'General case' 0 CA--C 1.528 0.131 0 C-N-CA 124.934 1.294 . . . . 0.0 109.574 163.069 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 61' ' ' LYS . . . . . . . . . . . . . 12.8 mttt -67.24 6.78 0.51 Allowed 'General case' 0 CA--C 1.54 0.585 0 N-CA-C 115.355 1.613 . . . . 0.0 115.355 -173.016 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 62' ' ' GLY . . . . . . . . . . . . . . . -150.35 -71.11 0.01 OUTLIER Glycine 0 CA--C 1.522 0.48 0 CA-C-N 120.818 1.645 . . . . 0.0 109.417 179.877 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 63' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER 60.55 89.75 0.07 Allowed 'General case' 0 N--CA 1.444 -0.728 0 C-N-CA 129.993 3.317 . . . . 0.0 113.261 179.304 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 64' ' ' ALA . . . . . . . . . . . . . . . -75.97 103.37 6.0 Favored 'General case' 0 C--O 1.236 0.393 0 C-N-CA 124.88 1.272 . . . . 0.0 111.239 -178.141 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 65' ' ' MET . . . . . . . . . . . . . 5.2 mtt -108.21 168.67 9.14 Favored 'General case' 0 N--CA 1.466 0.361 0 C-N-CA 124.0 0.92 . . . . 0.0 112.211 172.523 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 66' ' ' THR . . . . . . . . . . . . . 72.5 p -107.34 -163.96 0.94 Allowed 'General case' 0 CA--C 1.54 0.57 0 C-N-CA 126.392 1.877 . . . . 0.0 111.167 -176.474 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 67' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -141.01 84.26 1.92 Allowed 'General case' 0 N--CA 1.467 0.378 0 C-N-CA 124.282 1.033 . . . . 0.0 109.685 172.604 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 68' ' ' MET . . . . . . . . . . . . . 51.0 mtm -134.79 176.83 8.29 Favored 'General case' 0 C--N 1.324 -0.529 0 C-N-CA 129.566 3.147 . . . . 0.0 108.536 -178.641 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 69' ' ' MET . . . . . . . . . . . . . 1.6 pmm? -134.31 177.57 7.66 Favored 'General case' 0 N--CA 1.451 -0.392 0 C-N-CA 126.766 2.026 . . . . 0.0 109.872 170.114 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 70' ' ' CYS . . . . . 1.286 ' SG ' ' SG ' ' A' ' 44' ' ' CYS . 65.6 m -143.57 149.48 37.46 Favored 'General case' 0 C--N 1.33 -0.265 0 C-N-CA 126.37 1.868 . . . . 0.0 109.081 -170.037 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 71' ' ' ALA . . . . . . . . . . . . . . . -77.73 20.68 0.33 Allowed 'General case' 0 CA--C 1.539 0.524 0 N-CA-C 114.098 1.147 . . . . 0.0 114.098 -169.188 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 72' ' ' ASN . . . . . . . . . . . . . 21.8 t30 -147.22 142.26 16.73 Favored Pre-proline 0 C--O 1.236 0.393 0 N-CA-C 106.087 -1.82 . . . . 0.0 106.087 162.425 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 73' ' ' PRO . . . . . . . . . . . . . 30.4 Cg_endo -70.85 -21.98 27.71 Favored 'Trans proline' 0 C--N 1.346 0.399 0 C-N-CA 122.329 2.019 . . . . 0.0 112.621 -172.089 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 74' ' ' GLN . . . . . . . . . . . . . 39.0 tt0 -52.97 -38.3 62.04 Favored 'General case' 0 CA--C 1.534 0.332 0 C-N-CA 124.001 0.921 . . . . 0.0 111.581 -179.111 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 75' ' ' LEU . . . . . . . . . . . . . 32.5 mt -76.58 -31.37 57.46 Favored 'General case' 0 CA--C 1.533 0.312 0 C-N-CA 123.677 0.791 . . . . 0.0 111.732 -178.768 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 76' ' ' ASN . . . . . . . . . . . . . 3.2 t-20 -79.82 -14.34 58.75 Favored 'General case' 0 N--CA 1.469 0.52 0 C-N-CA 125.25 1.42 . . . . 0.0 110.991 179.975 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 77' ' ' GLU . . . . . . . . . . . . . 5.5 mm-40 -80.99 -44.83 17.53 Favored 'General case' 0 C--O 1.236 0.372 0 C-N-CA 126.265 1.826 . . . . 0.0 109.867 163.101 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 78' ' ' LEU . . . . . . . . . . . . . 23.9 mt -66.06 -36.21 82.61 Favored 'General case' 0 CA--C 1.51 -0.562 0 O-C-N 121.658 -0.651 . . . . 0.0 112.482 -171.822 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 79' ' ' ASP . . . . . . . . . . . . . 0.0 OUTLIER -61.65 -34.99 76.66 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-O 119.155 -0.45 . . . . 0.0 111.49 176.033 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 80' ' ' ASN . . . . . . . . . . . . . 11.2 t30 -75.61 -48.59 21.55 Favored 'General case' 0 N--CA 1.447 -0.591 0 N-CA-C 108.595 -0.891 . . . . 0.0 108.595 179.618 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 81' ' ' THR . . . . . . . . . . . . . 36.6 m -46.79 -59.8 2.82 Favored 'General case' 0 N--CA 1.449 -0.511 0 C-N-CA 125.175 1.39 . . . . 0.0 109.212 176.976 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 82' ' ' ILE . . . . . . . . . . . . . 4.6 tp -69.33 -34.77 64.25 Favored 'Isoleucine or valine' 0 C--O 1.237 0.407 0 O-C-N 121.615 -0.678 . . . . 0.0 111.914 -172.865 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 83' ' ' SER . . . . . . . . . . . . . 0.6 OUTLIER -58.94 -47.36 85.34 Favored 'General case' 0 N--CA 1.452 -0.365 0 N-CA-C 109.166 -0.679 . . . . 0.0 109.166 179.594 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 84' ' ' GLU . . . . . 0.443 ' OE1' ' HE2' ' A' ' 105' ' ' LYS . 16.8 tt0 -67.21 -42.8 83.51 Favored 'General case' 0 N--CA 1.447 -0.591 0 C-N-CA 124.453 1.101 . . . . 0.0 110.689 -179.163 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 85' ' ' MET . . . . . . . . . . . . . 48.4 mtp -59.66 -47.91 83.73 Favored 'General case' 0 C--N 1.343 0.317 0 CA-C-N 119.611 1.096 . . . . 0.0 110.115 -174.89 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 86' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -76.57 -20.3 56.96 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-O 118.824 -0.608 . . . . 0.0 112.114 -175.702 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 87' ' ' LYS . . . . . . . . . . . . . 3.3 tptt -71.93 -37.36 70.05 Favored 'General case' 0 N--CA 1.45 -0.43 0 N-CA-C 109.027 -0.731 . . . . 0.0 109.027 174.462 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 88' ' ' GLU . . . . . . . . . . . . . 89.2 mt-10 -89.24 -28.74 19.73 Favored 'General case' 0 C--O 1.233 0.218 0 CA-C-O 117.76 -1.114 . . . . 0.0 112.895 -173.106 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 89' ' ' GLY . . . . . . . . . . . . . . . 112.52 97.25 2.32 Favored Glycine 0 C--N 1.337 0.603 0 N-CA-C 109.483 -1.447 . . . . 0.0 109.483 -176.472 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 90' ' ' ALA . . . . . . . . . . . . . . . -78.89 128.86 33.88 Favored 'General case' 0 N--CA 1.449 -0.489 0 N-CA-C 108.02 -1.104 . . . . 0.0 108.02 174.514 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 91' ' ' GLN . . . . . . . . . . . . . 2.6 mp0 -62.8 140.65 58.78 Favored 'General case' 0 C--N 1.327 -0.402 0 N-CA-C 107.334 -1.358 . . . . 0.0 107.334 169.015 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 92' ' ' VAL . . . . . 0.464 ' HA ' HD22 ' A' ' 101' ' ' LEU . 25.4 t -126.45 114.6 38.85 Favored 'Isoleucine or valine' 0 N--CA 1.444 -0.753 0 C-N-CA 125.623 1.569 . . . . 0.0 108.14 -172.399 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 93' ' ' ASP . . . . . . . . . . . . . 14.4 m-20 -137.37 72.21 1.42 Allowed 'General case' 0 CA--C 1.538 0.486 0 C-N-CA 126.568 1.947 . . . . 0.0 106.709 -179.213 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 94' ' ' LEU . . . . . 0.405 HD12 HE21 ' A' ' 6' ' ' GLN . 0.9 OUTLIER -74.93 107.82 7.26 Favored 'General case' 0 N--CA 1.464 0.265 0 N-CA-C 106.694 -1.595 . . . . 0.0 106.694 168.311 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' A' A ' 95' ' ' THR . . . . . . . . . . . . . 2.2 t -71.93 -164.51 0.13 Allowed 'General case' 0 CA--C 1.54 0.564 0 C-N-CA 125.062 1.345 . . . . 0.0 108.313 172.127 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 96' ' ' ALA . . . . . . . . . . . . . . . -44.56 -49.26 10.2 Favored 'General case' 0 CA--C 1.543 0.68 0 O-C-N 121.26 -0.9 . . . . 0.0 112.725 -177.665 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 97' ' ' ASN . . . . . . . . . . . . . 31.3 p30 -157.66 28.44 0.28 Allowed 'General case' 0 CA--C 1.542 0.662 0 C-N-CA 125.707 1.603 . . . . 0.0 113.28 -174.529 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 98' ' ' GLN . . . . . . . . . . . . . 11.4 tt0 -137.72 121.91 18.05 Favored 'General case' 0 N--CA 1.466 0.329 0 C-N-CA 124.924 1.289 . . . . 0.0 107.953 173.822 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 99' ' ' LEU . . . . . . . . . . . . . 6.8 tp -69.43 123.63 21.77 Favored 'General case' 0 N--CA 1.451 -0.378 0 N-CA-C 105.793 -1.928 . . . . 0.0 105.793 172.666 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 100' ' ' THR . . . . . . . . . . . . . 3.7 m -121.64 113.82 20.29 Favored 'General case' 0 N--CA 1.452 -0.336 0 N-CA-C 105.698 -1.964 . . . . 0.0 105.698 172.478 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 101' ' ' LEU . . . . . 0.464 HD22 ' HA ' ' A' ' 92' ' ' VAL . 0.2 OUTLIER -121.01 150.76 40.64 Favored 'General case' 0 C--O 1.234 0.271 0 N-CA-C 107.345 -1.354 . . . . 0.0 107.345 -177.387 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' A' A ' 102' ' ' ALA . . . . . . . . . . . . . . . -144.86 161.37 39.47 Favored 'General case' 0 C--N 1.33 -0.277 0 C-N-CA 124.988 1.315 . . . . 0.0 108.595 172.745 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 103' ' ' THR . . . . . 0.452 HG22 ' H ' ' A' ' 104' ' ' ALA . 2.9 m -155.78 -168.14 2.7 Favored 'General case' 0 N--CA 1.446 -0.656 0 C-N-CA 127.404 2.282 . . . . 0.0 105.331 170.178 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 104' ' ' ALA . . . . . 0.452 ' H ' HG22 ' A' ' 103' ' ' THR . . . -57.42 -46.56 83.37 Favored 'General case' 0 CA--C 1.535 0.396 0 O-C-N 120.313 -1.492 . . . . 0.0 110.971 161.874 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 105' ' ' LYS . . . . . 0.443 ' HE2' ' OE1' ' A' ' 84' ' ' GLU . 3.3 tmtt? -49.61 -64.8 0.7 Allowed 'General case' 0 N--CA 1.465 0.298 0 C-N-CA 125.257 1.423 . . . . 0.0 113.056 -170.685 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 106' ' ' GLN . . . . . . . . . . . . . 3.5 pt20 -166.83 -167.78 1.02 Allowed 'General case' 0 CA--C 1.536 0.411 0 C-N-CA 126.092 1.757 . . . . 0.0 108.437 -175.838 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 107' ' ' THR . . . . . . . . . . . . . 0.5 OUTLIER -124.0 149.05 46.47 Favored 'General case' 0 CA--C 1.533 0.324 0 N-CA-C 107.504 -1.295 . . . . 0.0 107.504 168.672 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 108' ' ' LEU . . . . . . . . . . . . . 9.5 mp -120.35 157.16 29.84 Favored 'General case' 0 C--O 1.239 0.53 0 C-N-CA 126.362 1.865 . . . . 0.0 108.979 178.307 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 109' ' ' THR . . . . . . . . . . . . . 3.5 m -136.69 93.4 2.86 Favored 'General case' 0 C--O 1.238 0.479 0 N-CA-C 108.935 -0.765 . . . . 0.0 108.935 176.14 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 110' ' ' TYR . . . . . . . . . . . . . 34.5 m-85 -90.21 155.92 18.68 Favored 'General case' 0 CA--C 1.534 0.337 0 CA-C-O 121.168 0.509 . . . . 0.0 109.795 172.451 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 111' ' ' LYS . . . . . . . . . . . . . 0.3 OUTLIER -108.83 143.66 37.73 Favored 'General case' 0 CA--C 1.518 -0.271 0 C-N-CA 124.857 1.263 . . . . 0.0 108.145 178.426 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 112' ' ' LEU . . . . . . . . . . . . . 45.8 tp -70.45 68.17 0.36 Allowed 'General case' 0 CA--C 1.543 0.689 0 C-N-CA 125.155 1.382 . . . . 0.0 109.578 168.158 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 113' ' ' ALA . . . . . . . . . . . . . . . -100.26 75.24 1.8 Allowed 'General case' 0 N--CA 1.464 0.265 0 N-CA-C 106.571 -1.64 . . . . 0.0 106.571 -179.956 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 114' ' ' ASP . . . . . . . . . . . . . 42.6 t0 . . . . . 0 C--N 1.326 -0.414 0 CA-C-O 121.539 0.685 . . . . 0.0 110.802 -160.256 . . . . . . . . 0 0 . 1 . 008 nuclear nobuild core ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 1.4 pmm? . . . . . 0 CA--C 1.536 0.427 0 N-CA-C 109.437 -0.579 . . . . 0.0 109.437 . . . . . . . . . 0 0 . 1 . 008 nuclear nobuild core ' A' A ' 2' ' ' VAL . . . . . . . . . . . . . 6.7 p -72.34 153.37 7.74 Favored 'Isoleucine or valine' 0 C--O 1.236 0.357 0 N-CA-C 109.363 -0.606 . . . . 0.0 109.363 174.202 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 3' ' ' THR . . . . . . . . . . . . . 0.5 OUTLIER -132.79 159.15 73.74 Favored Pre-proline 0 CA--C 1.532 0.25 0 C-N-CA 124.053 0.941 . . . . 0.0 109.976 171.829 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 4' ' ' PRO . . . . . . . . . . . . . 55.4 Cg_endo -64.77 -34.28 50.63 Favored 'Trans proline' 0 C--N 1.345 0.358 0 C-N-CA 123.102 2.534 . . . . 0.0 111.341 -176.728 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 5' ' ' GLU . . . . . . . . . . . . . 19.2 tt0 -52.21 -55.31 21.94 Favored 'General case' 0 N--CA 1.449 -0.476 0 C-N-CA 125.471 1.508 . . . . 0.0 110.146 175.636 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 6' ' ' GLN . . . . . . . . . . . . . 11.8 pt20 -70.14 20.79 0.04 OUTLIER 'General case' 0 CA--C 1.543 0.694 0 N-CA-C 114.243 1.201 . . . . 0.0 114.243 176.039 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 7' ' ' LEU . . . . . . . . . . . . . 76.0 mt -129.54 -56.1 1.15 Allowed 'General case' 0 N--CA 1.461 0.119 0 C-N-CA 124.87 1.268 . . . . 0.0 110.922 178.435 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 8' ' ' GLN . . . . . . . . . . . . . 6.3 mt-30 -44.59 -8.73 0.01 OUTLIER 'General case' 0 N--CA 1.474 0.759 0 C-N-CA 129.257 3.023 . . . . 0.0 117.969 -178.159 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 9' ' ' HIS . . . . . . . . . . . . . 19.4 p80 -148.88 35.72 0.77 Allowed 'General case' 0 C--N 1.325 -0.473 0 C-N-CA 123.531 0.733 . . . . 0.0 112.276 177.651 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 10' ' ' HIS . . . . . . . . . . . . . 91.5 m-70 -130.86 165.1 23.77 Favored 'General case' 0 C--O 1.235 0.3 0 CA-C-O 121.626 0.727 . . . . 0.0 110.695 174.972 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 11' ' ' ARG . . . . . . . . . . . . . 60.3 ttt180 -128.94 139.46 52.1 Favored 'General case' 0 C--O 1.235 0.317 0 C-N-CA 126.252 1.821 . . . . 0.0 107.057 -173.606 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 12' ' ' PHE . . . . . . . . . . . . . 45.0 m-85 -137.43 112.28 8.93 Favored 'General case' 0 N--CA 1.441 -0.883 0 C-N-CA 125.181 1.392 . . . . 0.0 107.341 -164.684 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 13' ' ' VAL . . . . . . . . . . . . . 2.8 t -103.67 144.31 14.31 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.482 0 N-CA-C 106.709 -1.589 . . . . 0.0 106.709 -174.401 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 14' ' ' LEU . . . . . . . . . . . . . 11.5 tp -79.08 96.08 5.71 Favored 'General case' 0 N--CA 1.449 -0.494 0 N-CA-C 109.513 -0.551 . . . . 0.0 109.513 -169.834 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 1.4 mm-40 -76.3 -39.14 54.95 Favored 'General case' 0 N--CA 1.452 -0.344 0 CA-C-O 118.46 -0.781 . . . . 0.0 111.292 -170.943 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 2.6 t -156.03 156.73 34.92 Favored 'General case' 0 C--O 1.237 0.417 0 CA-C-N 119.721 1.146 . . . . 0.0 111.126 161.126 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 17' ' ' VAL . . . . . . . . . . . . . 21.3 t -86.3 171.66 1.12 Allowed 'Isoleucine or valine' 0 CA--C 1.534 0.331 0 C-N-CA 126.017 1.727 . . . . 0.0 107.504 172.519 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 18' ' ' ASN . . . . . . . . . . . . . 20.6 t30 -53.16 -35.59 59.95 Favored 'General case' 0 CA--C 1.53 0.195 0 C-N-CA 124.304 1.041 . . . . 0.0 112.494 166.393 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . -93.97 -54.16 1.67 Allowed Glycine 0 CA--C 1.525 0.659 0 C-N-CA 123.755 0.693 . . . . 0.0 112.806 -170.336 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 16.6 ptpt -160.0 163.83 21.45 Favored Pre-proline 0 N--CA 1.465 0.307 0 C-N-CA 125.665 1.586 . . . . 0.0 108.806 -174.723 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 21' ' ' PRO . . . . . . . . . . . . . 59.1 Cg_endo -70.93 171.21 16.2 Favored 'Trans proline' 0 N--CA 1.454 -0.815 0 CA-C-N 120.806 1.324 . . . . 0.0 110.973 170.67 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 22' ' ' VAL . . . . . . . . . . . . . 2.7 p -135.56 136.31 50.73 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.369 0 C-N-CA 126.552 1.941 . . . . 0.0 107.155 -178.155 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 23' ' ' THR . . . . . . . . . . . . . 0.8 OUTLIER -144.92 123.99 12.83 Favored 'General case' 0 C--O 1.238 0.459 0 N-CA-C 107.005 -1.48 . . . . 0.0 107.005 -175.398 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 24' ' ' SER . . . . . . . . . . . . . 14.7 m -123.26 41.25 3.52 Favored 'General case' 0 C--O 1.235 0.333 0 C-N-CA 124.957 1.303 . . . . 0.0 110.146 -163.958 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 25' ' ' ASP . . . . . . . . . . . . . 38.7 m-20 62.45 -78.46 0.03 OUTLIER 'General case' 0 C--O 1.234 0.254 0 C-N-CA 127.972 2.509 . . . . 0.0 108.582 -167.953 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 26' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -131.4 -8.58 3.72 Favored 'General case' 0 CA--C 1.523 -0.067 0 N-CA-C 115.684 1.735 . . . . 0.0 115.684 178.198 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 27' ' ' ASN . . . . . . . . . . . . . 13.2 m120 -115.41 75.91 4.92 Favored Pre-proline 0 N--CA 1.471 0.595 0 CA-C-N 120.167 1.349 . . . . 0.0 111.328 -175.624 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 28' ' ' PRO . . . . . . . . . . . . . 49.0 Cg_endo -66.53 162.41 36.93 Favored 'Trans proline' 0 CA--C 1.539 0.769 0 C-N-CA 123.392 2.728 . . . . 0.0 113.051 -177.611 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 29' ' ' PRO . . . . . . . . . . . . . 19.5 Cg_endo -66.04 64.85 0.45 Allowed 'Trans proline' 0 CA--C 1.54 0.802 0 C-N-CA 125.088 3.859 . . . . 0.0 113.443 170.833 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 30' ' ' GLU . . . . . . . . . . . . . 10.8 pt-20 -76.38 169.77 17.62 Favored 'General case' 0 CA--C 1.544 0.733 0 O-C-N 119.709 -1.869 . . . . 0.0 111.301 177.779 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 31' ' ' ILE . . . . . . . . . . . . . 16.8 tt -139.04 159.77 29.54 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.406 0 C-N-CA 127.212 2.205 . . . . 0.0 107.013 170.96 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 32' ' ' SER . . . . . . . . . . . . . 45.4 p -149.33 177.02 10.04 Favored 'General case' 0 N--CA 1.444 -0.773 0 C-N-CA 125.747 1.619 . . . . 0.0 107.345 167.453 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 33' ' ' PHE . . . . . . . . . . . . . 39.8 m-85 -134.65 148.8 50.45 Favored 'General case' 0 N--CA 1.447 -0.575 0 N-CA-C 106.458 -1.682 . . . . 0.0 106.458 175.284 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 34' ' ' GLY . . . . . . . . . . . . . . . -163.68 -176.23 35.4 Favored Glycine 0 N--CA 1.445 -0.749 0 N-CA-C 107.453 -2.259 . . . . 0.0 107.453 178.419 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 35' ' ' GLU . . . . . . . . . . . . 0.275 1.9 mt-10 47.36 -162.95 0.03 OUTLIER 'General case' 0 CA--C 1.538 0.506 0 C-N-CA 124.569 1.148 . . . . 0.0 110.083 -171.329 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 6.6 mmpt? -69.29 56.15 0.11 Allowed 'General case' 0 CA--C 1.546 0.791 0 O-C-N 119.207 -2.183 . . . . 0.0 112.644 -174.499 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 37' ' ' MET . . . . . . . . . . . . . 79.4 mmm 46.89 86.69 0.02 OUTLIER 'General case' 0 CA--C 1.539 0.549 0 C-N-CA 126.055 1.742 . . . . 0.0 110.401 -156.698 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 38' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -123.6 4.29 8.94 Favored 'General case' 0 N--CA 1.476 0.836 0 N-CA-C 114.062 1.134 . . . . 0.0 114.062 -175.489 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 39' ' ' ILE . . . . . . . . . . . . . 24.2 mt 46.92 133.47 0.0 OUTLIER 'Isoleucine or valine' 0 CA--C 1.539 0.555 1 C-N-CA 133.135 4.574 . . . . 0.0 111.963 179.888 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 40' ' ' SER . . . . . . . . . . . . . 8.3 m -140.2 101.95 4.26 Favored 'General case' 0 C--N 1.329 -0.31 0 O-C-N 120.163 -1.585 . . . . 0.0 107.227 178.792 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 41' ' ' GLY . . . . . . . . . . . . . . . -145.2 174.2 25.33 Favored Glycine 0 C--N 1.336 0.579 0 CA-C-N 118.841 0.746 . . . . 0.0 112.558 179.286 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 42' ' ' SER . . . . . . . . . . . . . 13.3 p -149.79 85.44 1.42 Allowed 'General case' 0 N--CA 1.451 -0.388 0 C-N-CA 123.108 0.563 . . . . 0.0 110.665 -178.635 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 43' ' ' MET . . . . . . . . . . . . . 3.4 mmt -59.52 -46.5 88.66 Favored 'General case' 0 N--CA 1.462 0.158 0 CA-C-O 122.081 0.943 . . . . 0.0 108.61 167.675 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 44' ' ' CYS . . . . . 1.305 ' SG ' ' SG ' ' A' ' 70' ' ' CYS . 36.5 t -149.32 -66.87 0.22 Allowed 'General case' 0 N--CA 1.442 -0.869 0 C-N-CA 125.178 1.391 . . . . 0.0 107.311 161.363 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 45' ' ' ASN . . . . . . . . . . . . . 3.0 m120 -87.23 22.42 2.11 Favored 'General case' 0 C--N 1.327 -0.387 0 C-N-CA 124.244 1.018 . . . . 0.0 111.884 -155.792 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 46' ' ' ARG . . . . . . . . . . . . . 7.0 mmm180 51.41 162.26 0.0 OUTLIER 'General case' 0 N--CA 1.465 0.291 0 C-N-CA 127.461 2.304 . . . . 0.0 113.09 -162.853 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 47' ' ' PHE . . . . . . . . . . . . . 49.6 p90 -163.64 163.74 24.26 Favored 'General case' 0 C--N 1.324 -0.521 0 C-N-CA 124.826 1.251 . . . . 0.0 109.521 170.03 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 48' ' ' SER . . . . . . . . . . . . . 6.2 m -158.79 165.66 33.75 Favored 'General case' 0 N--CA 1.44 -0.94 0 C-N-CA 126.866 2.066 . . . . 0.0 108.113 173.134 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 49' ' ' GLY . . . . . . . . . . . . . . . -178.59 167.71 38.32 Favored Glycine 0 CA--C 1.519 0.31 0 N-CA-C 110.354 -1.098 . . . . 0.0 110.354 166.981 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 50' ' ' GLU . . . . . . . . . . . . . 32.6 mt-10 -61.69 98.46 0.09 Allowed 'General case' 0 C--N 1.33 -0.253 0 N-CA-C 109.3 -0.629 . . . . 0.0 109.3 176.621 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 51' ' ' GLY . . . . . . . . . . . . . . . -60.14 -67.91 1.93 Allowed Glycine 0 C--N 1.335 0.475 0 O-C-N 124.485 1.116 . . . . 0.0 110.998 -176.94 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 52' ' ' LYS . . . . . . . . . . . . . 0.4 OUTLIER 64.49 164.27 0.14 Allowed 'General case' 0 N--CA 1.453 -0.282 0 C-N-CA 125.173 1.389 . . . . 0.0 109.187 -166.73 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 53' ' ' LEU . . . . . . . . . . . . . 5.9 tp -164.58 111.08 1.02 Allowed 'General case' 0 N--CA 1.45 -0.435 0 N-CA-C 107.429 -1.322 . . . . 0.0 107.429 164.065 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 1.4 t -148.95 -11.59 0.32 Allowed 'General case' 0 C--O 1.234 0.282 0 CA-C-O 117.561 -1.209 . . . . 0.0 112.701 178.087 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 55' ' ' ASN . . . . . . . . . . . . . 0.8 OUTLIER -156.96 46.87 0.42 Allowed 'General case' 0 CA--C 1.538 0.501 0 C-N-CA 124.897 1.279 . . . . 0.0 109.347 -170.201 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 56' ' ' GLY . . . . . . . . . . . . . . . 66.65 5.87 32.87 Favored Glycine 0 CA--C 1.533 1.192 0 N-CA-C 115.968 1.147 . . . . 0.0 115.968 170.425 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 57' ' ' GLU . . . . . . . . . . . . . 18.3 tt0 -132.6 110.61 10.56 Favored 'General case' 0 C--O 1.239 0.504 0 CA-C-N 118.579 1.189 . . . . 0.0 109.183 -164.633 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 58' ' ' LEU . . . . . . . . . . . . . 27.2 tp -89.69 104.44 17.0 Favored 'General case' 0 C--O 1.234 0.267 0 C-N-CA 126.364 1.866 . . . . 0.0 108.148 177.912 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 59' ' ' THR . . . . . . . . . . . . . 0.8 OUTLIER -91.72 168.91 11.14 Favored 'General case' 0 C--N 1.327 -0.393 0 CA-C-O 121.809 0.814 . . . . 0.0 110.302 169.706 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 60' ' ' ALA . . . . . . . . . . . . . . . -123.52 131.62 53.68 Favored 'General case' 0 N--CA 1.45 -0.426 0 N-CA-C 107.173 -1.417 . . . . 0.0 107.173 148.593 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 61' ' ' LYS . . . . . . . . . . . . . 24.3 ttmt -79.54 82.6 5.64 Favored 'General case' 0 N--CA 1.454 -0.24 0 N-CA-C 107.841 -1.17 . . . . 0.0 107.841 173.909 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 62' ' ' GLY . . . . . . . . . . . . . . . 103.99 -48.68 0.98 Allowed Glycine 0 CA--C 1.529 0.958 0 CA-C-O 118.827 -0.985 . . . . 0.0 113.044 174.402 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 63' ' ' LEU . . . . . . . . . . . . . 3.5 tp 64.88 106.29 0.03 OUTLIER 'General case' 0 N--CA 1.442 -0.86 0 C-N-CA 130.804 3.642 . . . . 0.0 113.777 -176.789 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 64' ' ' ALA . . . . . . . . . . . . . . . -77.69 146.25 36.13 Favored 'General case' 0 CA--C 1.533 0.291 0 N-CA-C 108.961 -0.755 . . . . 0.0 108.961 171.206 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 65' ' ' MET . . . . . . . . . . . . . 76.0 mtp -140.83 -164.91 1.83 Allowed 'General case' 0 CA--C 1.542 0.668 0 C-N-CA 126.58 1.952 . . . . 0.0 108.491 179.261 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 66' ' ' THR . . . . . . . . . . . . . 27.2 p -130.76 -165.89 1.62 Allowed 'General case' 0 N--CA 1.472 0.625 0 CA-C-N 120.062 1.301 . . . . 0.0 109.909 168.149 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 67' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -136.55 76.92 1.62 Allowed 'General case' 0 C--O 1.233 0.188 0 C-N-CA 126.167 1.787 . . . . 0.0 108.822 -179.199 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 68' ' ' MET . . . . . . . . . . . . . 15.3 ptp -124.51 158.23 33.41 Favored 'General case' 0 CA--C 1.533 0.323 0 C-N-CA 124.297 1.039 . . . . 0.0 111.97 -177.028 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 69' ' ' MET . . . . . . . . . . . . . 0.1 OUTLIER -73.97 162.31 29.18 Favored 'General case' 0 CA--C 1.533 0.305 0 C-N-CA 123.643 0.777 . . . . 0.0 109.424 171.432 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 70' ' ' CYS . . . . . 1.305 ' SG ' ' SG ' ' A' ' 44' ' ' CYS . 1.2 m -119.01 -179.53 3.85 Favored 'General case' 0 CA--C 1.537 0.476 0 C-N-CA 126.284 1.834 . . . . 0.0 108.692 161.551 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 71' ' ' ALA . . . . . . . . . . . . . . . -82.79 -26.6 31.65 Favored 'General case' 0 CA--C 1.535 0.393 0 C-N-CA 124.555 1.142 . . . . 0.0 111.615 166.012 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 72' ' ' ASN . . . . . . . . . . . . . 1.2 m-20 -119.97 152.67 54.43 Favored Pre-proline 0 N--CA 1.467 0.397 0 C-N-CA 123.962 0.905 . . . . 0.0 110.474 -172.167 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 73' ' ' PRO . . . . . . . . . . . . . 49.0 Cg_endo -70.39 -46.2 1.04 Allowed 'Trans proline' 0 N--CA 1.458 -0.585 0 C-N-CA 124.008 3.138 . . . . 0.0 111.198 173.146 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 74' ' ' GLN . . . . . . . . . . . . . 64.3 tt0 -51.31 -35.34 37.38 Favored 'General case' 0 C--O 1.221 -0.424 0 C-N-CA 123.569 0.748 . . . . 0.0 110.85 -174.172 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 75' ' ' LEU . . . . . 0.402 ' HB3' ' HB2' ' A' ' 44' ' ' CYS . 87.5 mt -66.33 -38.88 88.7 Favored 'General case' 0 CA--C 1.538 0.519 0 C-N-CA 123.686 0.794 . . . . 0.0 111.701 -177.373 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 76' ' ' ASN . . . . . . . . . . . . . 3.0 m-80 -79.07 -20.46 48.74 Favored 'General case' 0 N--CA 1.475 0.791 0 CA-C-N 119.506 1.048 . . . . 0.0 111.478 174.994 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 77' ' ' GLU . . . . . . . . . . . . . 0.7 OUTLIER -65.48 -38.18 89.02 Favored 'General case' 0 CA--C 1.545 0.766 0 O-C-N 121.056 -1.027 . . . . 0.0 109.48 164.918 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 78' ' ' LEU . . . . . . . . . . . . . 32.4 mt -80.34 -17.62 51.47 Favored 'General case' 0 N--CA 1.453 -0.3 0 CA-C-O 118.039 -0.982 . . . . 0.0 113.364 -174.847 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 79' ' ' ASP . . . . . . . . . . . . . 4.8 t70 -46.72 -57.52 4.76 Favored 'General case' 0 N--CA 1.469 0.476 0 C-N-CA 125.165 1.386 . . . . 0.0 109.406 162.511 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 80' ' ' ASN . . . . . . . . . . . . . 69.8 m-80 -74.48 -36.8 63.3 Favored 'General case' 0 N--CA 1.448 -0.544 0 CA-C-N 115.258 -0.883 . . . . 0.0 108.973 -171.818 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 81' ' ' THR . . . . . . . . . . . . . 28.0 m -54.49 -51.03 66.36 Favored 'General case' 0 CA--C 1.54 0.579 0 C-N-CA 124.052 0.941 . . . . 0.0 110.117 177.679 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 82' ' ' ILE . . . . . . . . . . . . . 7.0 tp -73.86 -33.27 36.7 Favored 'Isoleucine or valine' 0 C--N 1.345 0.385 0 CA-C-N 119.719 1.145 . . . . 0.0 111.015 -179.251 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 83' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -58.4 -53.24 60.58 Favored 'General case' 0 C--O 1.236 0.371 0 N-CA-C 108.832 -0.803 . . . . 0.0 108.832 178.713 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 84' ' ' GLU . . . . . . . . . . . . . 14.2 tp10 -75.6 -3.01 31.97 Favored 'General case' 0 CA--C 1.542 0.64 0 C-N-CA 124.873 1.269 . . . . 0.0 112.07 -174.667 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 85' ' ' MET . . . . . . . . . . . . . 84.7 mtp -107.45 -5.16 17.83 Favored 'General case' 0 CA--C 1.535 0.383 0 C-N-CA 124.338 1.055 . . . . 0.0 113.212 174.307 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 86' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -105.55 -22.86 12.9 Favored 'General case' 0 N--CA 1.475 0.802 0 CA-C-N 120.639 1.563 . . . . 0.0 111.628 173.818 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 87' ' ' LYS . . . . . . . . . . . . . 8.1 tttm -68.36 -44.6 74.88 Favored 'General case' 0 CA--C 1.543 0.707 0 N-CA-C 110.172 -0.307 . . . . 0.0 110.172 -169.035 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 88' ' ' GLU . . . . . . . . . . . . . 35.4 mt-10 -82.36 -14.67 54.89 Favored 'General case' 0 N--CA 1.468 0.425 0 C-N-CA 126.562 1.945 . . . . 0.0 112.265 177.581 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 89' ' ' GLY . . . . . . . . . . . . . . . 98.54 105.03 2.49 Favored Glycine 0 C--N 1.337 0.617 0 N-CA-C 110.572 -1.011 . . . . 0.0 110.572 -175.934 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 90' ' ' ALA . . . . . . . . . . . . . . . -74.16 138.08 43.58 Favored 'General case' 0 C--O 1.232 0.15 0 N-CA-C 108.596 -0.89 . . . . 0.0 108.596 171.57 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 91' ' ' GLN . . . . . . . . . . . . . 0.4 OUTLIER -64.81 129.05 38.3 Favored 'General case' 0 C--O 1.239 0.542 0 N-CA-C 105.231 -2.137 . . . . 0.0 105.231 161.039 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 92' ' ' VAL . . . . . . . . . . . . . 7.6 p -125.53 107.69 18.31 Favored 'Isoleucine or valine' 0 N--CA 1.447 -0.588 0 N-CA-C 106.762 -1.57 . . . . 0.0 106.762 -170.235 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 93' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -122.17 81.63 1.86 Allowed 'General case' 0 C--N 1.324 -0.521 0 N-CA-C 106.716 -1.587 . . . . 0.0 106.716 -179.213 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 94' ' ' LEU . . . . . . . . . . . . . 2.3 tm? -82.9 98.52 9.24 Favored 'General case' 0 CA--C 1.51 -0.572 0 N-CA-C 106.034 -1.839 . . . . 0.0 106.034 166.961 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 95' ' ' THR . . . . . . . . . . . . . 3.1 m -83.05 170.87 14.38 Favored 'General case' 0 C--N 1.316 -0.868 0 CA-C-N 112.195 -2.275 . . . . 0.0 106.182 172.501 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 96' ' ' ALA . . . . . . . . . . . . . . . -44.84 -32.63 1.64 Allowed 'General case' 0 CA--C 1.545 0.761 0 N-CA-C 116.395 1.998 . . . . 0.0 116.395 -160.877 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 97' ' ' ASN . . . . . . . . . . . . . 0.2 OUTLIER -141.11 9.69 2.12 Favored 'General case' 0 N--CA 1.472 0.665 0 CA-C-N 120.74 1.609 . . . . 0.0 113.035 173.16 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 98' ' ' GLN . . . . . . . . . . . . . 12.9 tt0 -143.5 129.79 19.87 Favored 'General case' 0 CA--C 1.52 -0.182 0 O-C-N 120.484 -1.385 . . . . 0.0 109.216 -169.874 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 99' ' ' LEU . . . . . 0.677 HD22 ' CD2' ' A' ' 101' ' ' LEU . 0.4 OUTLIER -91.34 123.12 34.54 Favored 'General case' 0 N--CA 1.444 -0.765 0 C-N-CA 125.298 1.439 . . . . 0.0 109.045 179.642 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' A' A ' 100' ' ' THR . . . . . . . . . . . . . 79.7 m -98.87 115.87 29.82 Favored 'General case' 0 C--N 1.323 -0.584 0 C-N-CA 125.883 1.673 . . . . 0.0 106.495 165.83 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 101' ' ' LEU . . . . . 0.677 ' CD2' HD22 ' A' ' 99' ' ' LEU . 1.4 mm? -110.7 126.22 54.31 Favored 'General case' 0 CA--C 1.501 -0.924 0 N-CA-C 106.649 -1.612 . . . . 0.0 106.649 171.356 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 102' ' ' ALA . . . . . . . . . . . . . . . -138.02 153.21 49.4 Favored 'General case' 0 C--N 1.323 -0.545 0 O-C-N 124.396 1.06 . . . . 0.0 109.807 174.171 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 103' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -160.51 174.08 14.59 Favored 'General case' 0 N--CA 1.443 -0.78 0 C-N-CA 126.026 1.731 . . . . 0.0 108.04 177.526 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 104' ' ' ALA . . . . . . . . . . . . . . . -53.09 -34.6 57.35 Favored 'General case' 0 C--O 1.231 0.079 0 C-N-CA 123.662 0.785 . . . . 0.0 112.731 173.915 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 105' ' ' LYS . . . . . . . . . . . . . 1.6 mmpm? -62.84 -80.57 0.03 OUTLIER 'General case' 0 N--CA 1.455 -0.179 0 CA-C-N 118.545 0.611 . . . . 0.0 111.178 172.635 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 106' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -150.38 -172.73 4.25 Favored 'General case' 0 N--CA 1.453 -0.304 0 C-N-CA 125.812 1.645 . . . . 0.0 108.241 -164.523 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 107' ' ' THR . . . . . . . . . . . . . 15.3 t -144.36 145.78 32.16 Favored 'General case' 0 N--CA 1.451 -0.389 0 C-N-CA 124.826 1.25 . . . . 0.0 108.303 -174.895 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 108' ' ' LEU . . . . . . . . . . . . . 4.2 mp -134.4 162.16 32.99 Favored 'General case' 0 N--CA 1.449 -0.491 0 C-N-CA 128.018 2.527 . . . . 0.0 108.725 -165.788 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 109' ' ' THR . . . . . . . . . . . . . 57.8 m -133.66 110.3 9.77 Favored 'General case' 0 C--N 1.329 -0.315 0 N-CA-C 107.744 -1.206 . . . . 0.0 107.744 171.455 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 110' ' ' TYR . . . . . . . . . . . . . 95.2 m-85 -98.93 161.4 13.65 Favored 'General case' 0 N--CA 1.453 -0.301 0 N-CA-C 108.608 -0.886 . . . . 0.0 108.608 167.787 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 111' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -123.06 133.36 54.32 Favored 'General case' 0 CA--C 1.517 -0.316 0 CA-C-O 117.964 -1.017 . . . . 0.0 108.338 -175.614 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 112' ' ' LEU . . . . . . . . . . . . . 28.0 tp -58.8 103.47 0.17 Allowed 'General case' 0 C--O 1.232 0.175 0 N-CA-C 107.018 -1.475 . . . . 0.0 107.018 167.567 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 113' ' ' ALA . . . . . . . . . . . . . . . -147.17 77.03 1.44 Allowed 'General case' 0 C--N 1.33 -0.275 0 N-CA-C 107.267 -1.383 . . . . 0.0 107.267 -175.577 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 114' ' ' ASP . . . . . . . . . . . . 0.251 56.9 p30 . . . . . 0 C--N 1.331 -0.199 0 CA-C-O 124.205 1.955 . . . . 0.0 112.02 -173.927 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 11.6 ttp . . . . . 0 CA--C 1.534 0.346 0 N-CA-C 113.226 0.825 . . . . 0.0 113.226 . . . . . . . . . 0 0 . 1 . 009 nuclear nobuild core ' A' A ' 2' ' ' VAL . . . . . 0.432 HG22 HD11 ' A' ' 7' ' ' LEU . 7.1 p 42.96 66.85 0.12 Allowed 'Isoleucine or valine' 0 C--N 1.334 -0.109 0 C-N-CA 124.744 1.218 . . . . 0.0 111.233 145.581 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 3' ' ' THR . . . . . . . . . . . . . 71.5 p -79.86 161.72 65.12 Favored Pre-proline 0 C--N 1.328 -0.363 0 C-N-CA 118.034 -1.466 . . . . 0.0 108.976 -167.599 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 4' ' ' PRO . . . . . . . . . . . . . 15.7 Cg_endo -54.37 -42.3 68.94 Favored 'Trans proline' 0 CA--C 1.532 0.411 0 C-N-CA 122.236 1.957 . . . . 0.0 112.644 175.066 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 5' ' ' GLU . . . . . . . . . . . . . 1.2 tm-20 -51.13 -60.61 2.91 Favored 'General case' 0 C--N 1.329 -0.322 0 C-N-CA 126.068 1.747 . . . . 0.0 111.539 -175.951 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 6' ' ' GLN . . . . . . . . . . . . . 18.1 pt20 -66.03 15.42 0.03 OUTLIER 'General case' 0 CA--C 1.54 0.558 0 C-N-CA 127.333 2.253 . . . . 0.0 114.242 -177.711 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 7' ' ' LEU . . . . . 0.432 HD11 HG22 ' A' ' 2' ' ' VAL . 67.3 mt -133.93 -48.03 0.8 Allowed 'General case' 0 CA--C 1.522 -0.115 0 C-N-CA 125.345 1.458 . . . . 0.0 111.254 -172.57 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 8' ' ' GLN . . . . . . . . . . . . . 17.5 mt-30 -57.74 -4.1 0.26 Allowed 'General case' 0 CA--C 1.543 0.701 0 N-CA-C 115.681 1.734 . . . . 0.0 115.681 -179.54 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 9' ' ' HIS . . . . . . . . . . . . . 9.4 m-70 -133.26 15.4 4.15 Favored 'General case' 0 CA--C 1.538 0.511 0 C-N-CA 124.569 1.148 . . . . 0.0 112.624 174.333 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 10' ' ' HIS . . . . . . . . . . . . . 63.8 m-70 -130.55 109.99 11.09 Favored 'General case' 0 CA--C 1.539 0.554 0 C-N-CA 125.136 1.374 . . . . 0.0 109.885 -169.118 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 11' ' ' ARG . . . . . . . . . . . . . 32.3 ttt180 -68.64 150.69 47.66 Favored 'General case' 0 N--CA 1.474 0.732 0 C-N-CA 125.231 1.412 . . . . 0.0 110.765 175.127 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 12' ' ' PHE . . . . . . . . . . . . . 23.0 m-85 -136.48 157.55 46.52 Favored 'General case' 0 N--CA 1.451 -0.411 0 CA-C-O 121.693 0.758 . . . . 0.0 109.3 169.351 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 13' ' ' VAL . . . . . . . . . . . . . 11.4 p -132.97 150.59 33.04 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.336 0 O-C-N 120.992 -1.068 . . . . 0.0 109.958 175.754 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 14' ' ' LEU . . . . . . . . . . . . . 30.6 tp -80.1 97.57 6.91 Favored 'General case' 0 N--CA 1.454 -0.258 0 N-CA-C 108.001 -1.111 . . . . 0.0 108.001 177.53 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 3.1 mm-40 -68.24 -55.96 10.38 Favored 'General case' 0 C--N 1.323 -0.546 0 C-N-CA 125.184 1.393 . . . . 0.0 109.584 172.737 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 6.1 p -148.56 164.53 33.96 Favored 'General case' 0 N--CA 1.449 -0.478 0 CA-C-O 122.445 1.117 . . . . 0.0 110.219 -175.75 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 17' ' ' VAL . . . . . 0.463 HG12 ' H ' ' A' ' 18' ' ' ASN . 1.7 t -109.78 -164.64 0.21 Allowed 'Isoleucine or valine' 0 N--CA 1.445 -0.681 0 N-CA-C 104.892 -2.262 . . . . 0.0 104.892 -172.07 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 18' ' ' ASN . . . . . 0.463 ' H ' HG12 ' A' ' 17' ' ' VAL . 2.0 p-10 -44.47 -38.48 4.12 Favored 'General case' 0 CA--C 1.538 0.482 0 C-N-CA 126.902 2.081 . . . . 0.0 113.485 -171.465 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . -141.78 -44.89 0.06 OUTLIER Glycine 0 CA--C 1.523 0.543 0 C-N-CA 125.22 1.39 . . . . 0.0 110.539 169.616 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 0.5 OUTLIER -81.14 158.07 70.2 Favored Pre-proline 0 CA--C 1.534 0.336 0 C-N-CA 123.857 0.863 . . . . 0.0 111.472 -170.11 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 21' ' ' PRO . . . . . . . . . . . . . 80.2 Cg_endo -79.21 172.58 14.52 Favored 'Trans proline' 0 N--CA 1.457 -0.655 0 C-N-CA 123.223 2.615 . . . . 0.0 110.954 178.803 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 22' ' ' VAL . . . . . . . . . . . . . 88.7 t -94.81 157.17 3.08 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.422 0 N-CA-C 107.691 -1.226 . . . . 0.0 107.691 162.938 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 23' ' ' THR . . . . . . . . . . . . . 7.5 p -134.58 87.83 2.39 Favored 'General case' 0 N--CA 1.444 -0.75 0 N-CA-C 107.35 -1.352 . . . . 0.0 107.35 166.513 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 24' ' ' SER . . . . . 0.458 ' HB3' ' HA ' ' A' ' 28' ' ' PRO . 0.6 OUTLIER -159.89 135.19 8.16 Favored 'General case' 0 N--CA 1.447 -0.612 0 N-CA-C 105.669 -1.975 . . . . 0.0 105.669 172.234 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' A' A ' 25' ' ' ASP . . . . . . . . . . . . . 54.9 t0 -136.41 -42.18 0.63 Allowed 'General case' 0 C--N 1.324 -0.523 0 C-N-CA 126.678 1.991 . . . . 0.0 108.959 -174.086 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 26' ' ' LYS . . . . . . . . . . . . . 17.9 pttt -48.45 -45.98 37.25 Favored 'General case' 0 CA--C 1.516 -0.349 0 C-N-CA 125.496 1.518 . . . . 0.0 111.797 177.79 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 27' ' ' ASN . . . . . . . . . . . . . 0.2 OUTLIER -162.14 87.07 1.49 Allowed Pre-proline 0 C--N 1.325 -0.486 0 C-N-CA 130.022 3.329 . . . . 0.0 107.443 174.319 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 28' ' ' PRO . . . . . 0.458 ' HA ' ' HB3' ' A' ' 24' ' ' SER . 17.0 Cg_endo -60.03 162.2 17.1 Favored 'Trans proline' 0 C--N 1.349 0.583 0 C-N-CA 122.972 2.448 . . . . 0.0 113.737 177.154 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 29' ' ' PRO . . . . . . . . . . . . . 17.9 Cg_endo -60.69 103.15 0.21 Allowed 'Trans proline' 0 N--CA 1.445 -1.359 0 C-N-CA 122.104 1.869 . . . . 0.0 108.401 152.388 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 30' ' ' GLU . . . . . . . . . . . . . 20.2 pt-20 -126.11 170.27 11.94 Favored 'General case' 0 C--N 1.323 -0.584 0 C-N-CA 125.578 1.551 . . . . 0.0 109.708 -179.905 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 31' ' ' ILE . . . . . 0.501 HD11 ' CG2' ' A' ' 39' ' ' ILE . 15.7 tt -141.15 157.02 22.24 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.412 0 N-CA-C 107.883 -1.154 . . . . 0.0 107.883 177.66 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 32' ' ' SER . . . . . . . . . . . . . 8.2 t -149.84 171.92 15.99 Favored 'General case' 0 C--N 1.323 -0.572 0 N-CA-C 106.64 -1.615 . . . . 0.0 106.64 166.2 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 33' ' ' PHE . . . . . . . . . . . . . 67.5 m-85 -141.07 168.21 20.34 Favored 'General case' 0 N--CA 1.447 -0.583 0 C-N-CA 124.004 0.921 . . . . 0.0 109.415 -173.895 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 34' ' ' GLY . . . . . . . . . . . . . . . -168.6 -165.0 25.26 Favored Glycine 0 C--N 1.332 0.345 0 C-N-CA 125.549 1.547 . . . . 0.0 109.332 168.092 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 35' ' ' GLU . . . . . . . . . . . . . 1.1 tm-20 -47.33 156.89 0.23 Allowed 'General case' 0 C--N 1.326 -0.445 0 C-N-CA 126.961 2.104 . . . . 0.0 112.96 -171.222 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 29.6 mtmm 52.59 26.52 4.39 Favored 'General case' 0 CA--C 1.531 0.221 0 C-N-CA 124.606 1.162 . . . . 0.0 112.015 -164.193 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 37' ' ' MET . . . . . . . . . . . . . 10.4 mmm 56.91 26.45 11.73 Favored 'General case' 0 CA--C 1.54 0.594 0 C-N-CA 124.3 1.04 . . . . 0.0 109.885 178.873 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 38' ' ' MET . . . . . . . . . . . . . 19.0 mtp -54.67 151.47 8.15 Favored 'General case' 0 N--CA 1.45 -0.437 0 C-N-CA 123.798 0.839 . . . . 0.0 110.113 176.473 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 39' ' ' ILE . . . . . 0.501 ' CG2' HD11 ' A' ' 31' ' ' ILE . 9.8 mt -134.13 116.22 22.5 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.465 0 N-CA-C 105.101 -2.185 . . . . 0.0 105.101 -176.664 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 40' ' ' SER . . . . . . . . . . . . . 66.8 m -141.7 119.63 11.96 Favored 'General case' 0 C--N 1.328 -0.33 0 N-CA-C 108.418 -0.956 . . . . 0.0 108.418 -172.479 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 41' ' ' GLY . . . . . . . . . . . . . . . -156.84 -165.36 14.73 Favored Glycine 0 CA--C 1.525 0.663 0 C-N-CA 124.42 1.009 . . . . 0.0 111.565 -171.111 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 42' ' ' SER . . . . . . . . . . . . . 28.7 t -157.43 123.37 4.74 Favored 'General case' 0 CA--C 1.511 -0.524 0 O-C-N 121.808 -0.819 . . . . 0.0 108.942 165.792 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 43' ' ' MET . . . . . . . . . . . . . 5.1 mmm -86.65 -43.15 12.86 Favored 'General case' 0 N--CA 1.45 -0.448 0 O-C-N 124.15 0.906 . . . . 0.0 111.18 160.142 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 44' ' ' CYS . . . . . 1.28 ' SG ' ' SG ' ' A' ' 70' ' ' CYS . 54.0 t -157.15 -71.23 0.1 Allowed 'General case' 0 CA--C 1.534 0.346 0 N-CA-C 107.413 -1.329 . . . . 0.0 107.413 177.907 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 45' ' ' ASN . . . . . . . . . . . . . 33.2 m-80 -77.66 26.81 0.17 Allowed 'General case' 0 N--CA 1.472 0.653 0 C-N-CA 127.488 2.315 . . . . 0.0 113.19 -179.054 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 46' ' ' ARG . . . . . . . . . . . . . 34.3 mtp85 53.08 -170.15 0.04 OUTLIER 'General case' 0 C--N 1.332 -0.194 0 C-N-CA 125.972 1.709 . . . . 0.0 108.973 -169.51 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 47' ' ' PHE . . . . . . . . . . . . . 29.6 p90 -178.99 153.11 0.6 Allowed 'General case' 0 C--O 1.238 0.493 0 C-N-CA 126.764 2.025 . . . . 0.0 108.516 160.753 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 48' ' ' SER . . . . . . . . . . . . . 6.3 p -163.93 143.13 7.85 Favored 'General case' 0 N--CA 1.449 -0.518 0 CA-C-O 117.695 -1.145 . . . . 0.0 110.669 179.184 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 49' ' ' GLY . . . . . . . . . . . . . . . -177.6 163.66 32.26 Favored Glycine 0 C--N 1.337 0.614 0 CA-C-N 119.647 1.112 . . . . 0.0 110.864 177.541 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 50' ' ' GLU . . . . . . . . . . . . . 38.1 mt-10 -75.84 100.45 4.78 Favored 'General case' 0 C--O 1.235 0.315 0 N-CA-C 109.241 -0.651 . . . . 0.0 109.241 173.902 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 51' ' ' GLY . . . . . . . . . . . . . . . -66.17 166.81 36.66 Favored Glycine 0 CA--C 1.529 0.921 0 CA-C-O 121.87 0.706 . . . . 0.0 112.343 170.199 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 52' ' ' LYS . . . . . . . . . . . . . 0.5 OUTLIER -132.71 143.16 49.43 Favored 'General case' 0 C--N 1.328 -0.356 0 C-N-CA 126.422 1.889 . . . . 0.0 107.301 165.982 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 53' ' ' LEU . . . . . . . . . . . . . 32.8 tp -156.66 151.77 26.3 Favored 'General case' 0 C--O 1.235 0.292 0 C-N-CA 126.286 1.834 . . . . 0.0 107.508 176.144 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 11.7 t -161.66 -24.26 0.05 Allowed 'General case' 0 CA--C 1.538 0.5 0 C-N-CA 124.818 1.247 . . . . 0.0 111.424 173.72 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 55' ' ' ASN . . . . . . . . . . . . . 17.8 p-10 -153.71 28.53 0.48 Allowed 'General case' 0 CA--C 1.54 0.562 0 C-N-CA 126.332 1.853 . . . . 0.0 112.304 -148.367 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 56' ' ' GLY . . . . . . . . . . . . . . . 71.89 27.12 71.2 Favored Glycine 0 CA--C 1.534 1.221 0 O-C-N 120.918 -1.114 . . . . 0.0 112.271 -177.721 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 57' ' ' GLU . . . . . . . . . . . . . 29.8 tt0 -135.02 142.83 46.5 Favored 'General case' 0 CA--C 1.533 0.303 0 N-CA-C 107.929 -1.138 . . . . 0.0 107.929 173.403 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 58' ' ' LEU . . . . . . . . . . . . . 31.7 tp -134.33 101.66 5.08 Favored 'General case' 0 C--O 1.234 0.287 0 C-N-CA 125.805 1.642 . . . . 0.0 109.403 -172.467 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 59' ' ' THR . . . . . . . . . . . . . 4.4 p -106.02 145.22 31.65 Favored 'General case' 0 C--N 1.328 -0.342 0 C-N-CA 124.345 1.058 . . . . 0.0 109.854 175.213 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 60' ' ' ALA . . . . . . . . . . . . . . . -95.41 130.06 42.34 Favored 'General case' 0 CA--C 1.531 0.225 0 C-N-CA 124.548 1.139 . . . . 0.0 110.202 169.781 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 61' ' ' LYS . . . . . . . . . . . . . 18.4 tttt -79.8 -15.23 57.85 Favored 'General case' 0 N--CA 1.473 0.684 0 N-CA-C 113.852 1.056 . . . . 0.0 113.852 177.853 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 62' ' ' GLY . . . . . . . . . . . . . . . 169.75 123.64 0.69 Allowed Glycine 0 C--N 1.332 0.33 0 N-CA-C 108.579 -1.808 . . . . 0.0 108.579 -178.86 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 63' ' ' LEU . . . . . . . . . . . . . 0.9 OUTLIER -128.26 94.24 3.85 Favored 'General case' 0 N--CA 1.45 -0.45 0 C-N-CA 124.769 1.228 . . . . 0.0 110.599 -151.971 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 64' ' ' ALA . . . . . . . . . . . . . . . -78.74 109.39 12.93 Favored 'General case' 0 C--O 1.236 0.361 0 C-N-CA 124.136 0.975 . . . . 0.0 111.601 -172.018 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 65' ' ' MET . . . . . . . . . . . . . 67.3 mtp -120.63 159.62 24.92 Favored 'General case' 0 CA--C 1.537 0.459 0 C-N-CA 124.24 1.016 . . . . 0.0 110.217 176.993 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 66' ' ' THR . . . . . . . . . . . . . 28.3 p -100.09 -164.89 1.16 Allowed 'General case' 0 CA--C 1.543 0.704 0 C-N-CA 125.444 1.498 . . . . 0.0 111.953 -169.379 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 67' ' ' ARG . . . . . . . . . . . . . 5.7 mmm180 -133.36 68.3 1.5 Allowed 'General case' 0 N--CA 1.471 0.597 0 C-N-CA 125.467 1.507 . . . . 0.0 109.968 -178.855 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 68' ' ' MET . . . . . . . . . . . . . 27.2 ptm -133.53 -172.22 2.91 Favored 'General case' 0 CA--C 1.538 0.506 0 C-N-CA 127.147 2.179 . . . . 0.0 110.369 -175.307 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 69' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -138.69 176.87 8.32 Favored 'General case' 0 C--O 1.236 0.35 0 C-N-CA 125.575 1.55 . . . . 0.0 110.061 -173.815 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 70' ' ' CYS . . . . . 1.28 ' SG ' ' SG ' ' A' ' 44' ' ' CYS . 60.2 m -138.05 4.88 2.53 Favored 'General case' 0 CA--C 1.54 0.582 0 N-CA-C 114.409 1.263 . . . . 0.0 114.409 -175.392 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 71' ' ' ALA . . . . . . . . . . . . . . . 58.61 3.98 0.33 Allowed 'General case' 0 N--CA 1.472 0.665 0 C-N-CA 125.743 1.617 . . . . 0.0 113.983 -177.057 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 72' ' ' ASN . . . . . . . . . . . . . 43.3 t-20 -143.19 142.05 20.75 Favored Pre-proline 0 C--O 1.238 0.498 0 N-CA-C 106.684 -1.599 . . . . 0.0 106.684 172.645 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 73' ' ' PRO . . . . . . . . . . . . . 37.3 Cg_endo -78.71 -27.65 4.77 Favored 'Trans proline' 0 C--O 1.221 -0.363 0 C-N-CA 121.564 1.509 . . . . 0.0 113.041 -169.189 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 74' ' ' GLN . . . . . . . . . . . . . 41.0 tt0 -51.43 -46.44 62.96 Favored 'General case' 0 N--CA 1.47 0.569 0 CA-C-N 119.501 1.046 . . . . 0.0 111.486 -177.435 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 75' ' ' LEU . . . . . . . . . . . . . 49.9 mt -70.02 -36.83 75.38 Favored 'General case' 0 C--N 1.329 -0.309 0 C-N-CA 124.914 1.286 . . . . 0.0 110.906 -178.286 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 76' ' ' ASN . . . . . . . . . . . . . 1.0 OUTLIER -78.9 2.11 21.28 Favored 'General case' 0 CA--C 1.541 0.599 0 C-N-CA 127.179 2.191 . . . . 0.0 112.325 178.046 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 77' ' ' GLU . . . . . . . . . . . . . 1.5 mm-40 -109.47 -39.82 5.06 Favored 'General case' 0 C--N 1.331 -0.212 0 C-N-CA 127.421 2.288 . . . . 0.0 108.338 173.819 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 78' ' ' LEU . . . . . . . . . . . . . 55.8 mt -56.29 -27.4 55.31 Favored 'General case' 0 C--N 1.343 0.319 0 C-N-CA 122.881 0.472 . . . . 0.0 110.653 168.285 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 79' ' ' ASP . . . . . . . . . . . . . 0.0 OUTLIER -63.76 -13.57 44.95 Favored 'General case' 0 CA--C 1.539 0.541 0 C-N-CA 126.3 1.84 . . . . 0.0 112.653 177.369 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 80' ' ' ASN . . . . . . . . . . . . . 67.8 m-20 -105.54 -44.84 4.59 Favored 'General case' 0 N--CA 1.465 0.277 0 C-N-CA 124.478 1.111 . . . . 0.0 109.962 169.452 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 81' ' ' THR . . . . . . . . . . . . . 85.9 m -44.59 -70.16 0.11 Allowed 'General case' 0 CA--C 1.535 0.38 0 C-N-CA 125.836 1.654 . . . . 0.0 111.273 -179.143 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 82' ' ' ILE . . . . . . . . . . . . . 8.2 tp -72.37 -29.72 32.5 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.347 0 O-C-N 121.428 -0.795 . . . . 0.0 111.088 -167.072 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 83' ' ' SER . . . . . . . . . . . . . 30.0 t -52.68 -60.09 3.67 Favored 'General case' 0 C--O 1.236 0.38 0 C-N-CA 124.735 1.214 . . . . 0.0 109.409 171.096 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 84' ' ' GLU . . . . . . . . . . . . . 30.8 tp10 -67.97 -39.03 83.42 Favored 'General case' 0 N--CA 1.449 -0.482 0 CA-C-O 118.209 -0.901 . . . . 0.0 110.875 -173.216 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 85' ' ' MET . . . . . . . . . . . . . 78.6 mtp -60.58 -42.78 97.4 Favored 'General case' 0 N--CA 1.464 0.275 0 CA-C-O 122.402 1.096 . . . . 0.0 109.309 -176.136 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 86' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -75.95 -23.71 55.4 Favored 'General case' 0 C--N 1.33 -0.257 0 C-N-CA 124.262 1.025 . . . . 0.0 111.722 -178.643 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 87' ' ' LYS . . . . . . . . . . . . . 3.0 tppt? -75.96 -52.29 10.58 Favored 'General case' 0 N--CA 1.441 -0.886 0 C-N-CA 124.589 1.156 . . . . 0.0 109.188 177.847 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 88' ' ' GLU . . . . . . . . . . . . . 17.3 pt-20 -64.95 -38.78 92.1 Favored 'General case' 0 CA--C 1.539 0.546 0 CA-C-O 118.927 -0.559 . . . . 0.0 110.536 178.124 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 89' ' ' GLY . . . . . . . . . . . . . . . 120.15 105.75 2.08 Favored Glycine 0 C--N 1.339 0.746 0 C-N-CA 126.743 2.116 . . . . 0.0 108.732 173.161 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 90' ' ' ALA . . . . . 0.426 ' HB1' HD13 ' A' ' 101' ' ' LEU . . . -77.18 133.29 38.97 Favored 'General case' 0 N--CA 1.448 -0.541 0 CA-C-O 118.457 -0.783 . . . . 0.0 109.566 -176.072 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 91' ' ' GLN . . . . . . . . . . . . . 59.1 mm-40 -65.21 139.2 58.63 Favored 'General case' 0 C--O 1.239 0.503 0 N-CA-C 105.099 -2.185 . . . . 0.0 105.099 152.533 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 92' ' ' VAL . . . . . . . . . . . . . 10.4 p -135.78 134.48 51.25 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.56 0 N-CA-C 106.154 -1.795 . . . . 0.0 106.154 -176.448 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 93' ' ' ASP . . . . . . . . . . . . . 0.7 OUTLIER -142.09 91.88 2.38 Favored 'General case' 0 N--CA 1.452 -0.373 0 N-CA-C 107.911 -1.144 . . . . 0.0 107.911 -170.442 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 94' ' ' LEU . . . . . 0.403 ' H ' ' HB ' ' A' ' 2' ' ' VAL . 0.4 OUTLIER -96.91 109.49 22.2 Favored 'General case' 0 C--O 1.235 0.31 0 N-CA-C 106.922 -1.51 . . . . 0.0 106.922 174.395 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' A' A ' 95' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -70.13 -163.77 0.07 Allowed 'General case' 0 CA--C 1.542 0.664 0 N-CA-C 108.173 -1.047 . . . . 0.0 108.173 166.139 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 96' ' ' ALA . . . . . . . . . . . . . . . -56.97 -27.86 61.73 Favored 'General case' 0 CA--C 1.536 0.437 0 O-C-N 119.291 -2.131 . . . . 0.0 113.138 -178.616 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 97' ' ' ASN . . . . . . . . . . . . . 28.4 p30 -167.41 18.69 0.03 OUTLIER 'General case' 0 CA--C 1.539 0.538 0 C-N-CA 124.072 0.949 . . . . 0.0 112.705 -168.766 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 98' ' ' GLN . . . . . . . . . . . . . 2.3 tt0 -130.93 124.35 30.88 Favored 'General case' 0 N--CA 1.47 0.527 0 CA-C-N 120.297 1.408 . . . . 0.0 107.724 169.997 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 99' ' ' LEU . . . . . 0.433 ' HB3' ' HB2' ' A' ' 110' ' ' TYR . 15.3 tp -86.13 139.89 30.69 Favored 'General case' 0 C--O 1.233 0.185 0 C-N-CA 124.238 1.015 . . . . 0.0 109.519 170.109 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 100' ' ' THR . . . . . . . . . . . . . 15.8 m -123.38 126.17 46.34 Favored 'General case' 0 C--N 1.322 -0.592 0 C-N-CA 126.308 1.843 . . . . 0.0 107.127 171.346 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 101' ' ' LEU . . . . . 0.426 HD13 ' HB1' ' A' ' 90' ' ' ALA . 0.7 OUTLIER -114.23 135.45 54.04 Favored 'General case' 0 C--N 1.334 -0.071 0 C-N-CA 127.502 2.321 . . . . 0.0 106.04 167.9 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' A' A ' 102' ' ' ALA . . . . . . . . . . . . . . . -157.23 82.5 0.92 Allowed 'General case' 0 CA--C 1.536 0.417 0 CA-C-N 120.057 1.299 . . . . 0.0 111.325 178.852 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 103' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -98.87 171.01 8.34 Favored 'General case' 0 C--O 1.236 0.374 0 C-N-CA 125.947 1.699 . . . . 0.0 110.392 179.867 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 104' ' ' ALA . . . . . . . . . . . . . . . -56.16 -28.14 56.93 Favored 'General case' 0 C--O 1.233 0.213 0 CA-C-O 118.466 -0.778 . . . . 0.0 112.239 176.705 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 105' ' ' LYS . . . . . . . . . . . . . 32.8 mmtt -58.81 -80.5 0.02 OUTLIER 'General case' 0 CA--C 1.531 0.24 0 CA-C-N 119.244 0.929 . . . . 0.0 110.927 165.345 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 106' ' ' GLN . . . . . . . . . . . . . 7.1 mt-30 -157.0 -170.36 3.26 Favored 'General case' 0 CA--C 1.536 0.428 0 C-N-CA 125.098 1.359 . . . . 0.0 109.803 -173.136 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 107' ' ' THR . . . . . . . . . . . . . 3.4 t -130.32 140.4 50.64 Favored 'General case' 0 CA--C 1.537 0.444 0 C-N-CA 126.376 1.87 . . . . 0.0 108.29 -174.949 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 108' ' ' LEU . . . . . . . . . . . . . 4.8 mp -134.09 153.16 51.99 Favored 'General case' 0 C--O 1.235 0.325 0 C-N-CA 130.097 3.359 . . . . 0.0 108.461 -172.665 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 109' ' ' THR . . . . . . . . . . . . . 7.1 m -138.6 96.97 3.25 Favored 'General case' 0 CA--C 1.539 0.534 0 N-CA-C 109.419 -0.586 . . . . 0.0 109.419 -175.771 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 110' ' ' TYR . . . . . 0.433 ' HB2' ' HB3' ' A' ' 99' ' ' LEU . 66.9 m-85 -99.08 155.83 17.25 Favored 'General case' 0 N--CA 1.464 0.259 0 C-N-CA 124.056 0.943 . . . . 0.0 110.712 -175.244 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 111' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -114.5 145.21 42.19 Favored 'General case' 0 C--N 1.331 -0.199 0 C-N-CA 125.703 1.601 . . . . 0.0 108.758 -171.487 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 112' ' ' LEU . . . . . . . . . . . . . 54.4 tp -75.62 60.98 1.29 Allowed 'General case' 0 CA--C 1.534 0.36 0 C-N-CA 127.957 2.503 . . . . 0.0 108.396 175.558 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 113' ' ' ALA . . . . . . . . . . . . . . . -93.31 94.69 8.89 Favored 'General case' 0 N--CA 1.448 -0.544 0 N-CA-C 106.189 -1.782 . . . . 0.0 106.189 177.299 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 114' ' ' ASP . . . . . . . . . . . . . 37.9 t0 . . . . . 0 CA--C 1.515 -0.39 0 CA-C-O 121.62 0.724 . . . . 0.0 110.993 -178.927 . . . . . . . . 0 0 . 1 . 010 nuclear nobuild core ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 4.4 ptm . . . . . 0 CA--C 1.535 0.391 0 CA-C-O 121.471 0.653 . . . . 0.0 111.065 . . . . . . . . . 0 0 . 1 . 010 nuclear nobuild core ' A' A ' 2' ' ' VAL . . . . . . . . . . . . . 14.6 p -61.92 155.24 4.73 Favored 'Isoleucine or valine' 0 CA--C 1.54 0.561 0 C-N-CA 125.622 1.569 . . . . 0.0 111.127 175.575 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 3' ' ' THR . . . . . 0.41 ' HB ' ' HD2' ' A' ' 4' ' ' PRO . 31.5 p -124.45 163.8 34.26 Favored Pre-proline 0 CA--C 1.535 0.368 0 C-N-CA 124.292 1.037 . . . . 0.0 108.64 173.269 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 4' ' ' PRO . . . . . 0.41 ' HD2' ' HB ' ' A' ' 3' ' ' THR . 57.9 Cg_endo -67.38 -34.8 25.7 Favored 'Trans proline' 0 N--CA 1.459 -0.5 0 C-N-CA 121.524 1.483 . . . . 0.0 111.046 170.066 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 5' ' ' GLU . . . . . . . . . . . . . 28.6 tt0 -56.14 -54.64 42.69 Favored 'General case' 0 C--N 1.328 -0.338 0 C-N-CA 125.005 1.322 . . . . 0.0 109.992 -174.918 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 6' ' ' GLN . . . . . 0.752 HE21 HD23 ' A' ' 94' ' ' LEU . 21.7 pt20 -63.87 6.4 0.17 Allowed 'General case' 0 CA--C 1.536 0.412 0 C-N-CA 125.318 1.447 . . . . 0.0 114.314 -179.48 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 7' ' ' LEU . . . . . 0.631 HD21 HD22 ' A' ' 94' ' ' LEU . 95.4 mt -123.77 -50.91 1.83 Allowed 'General case' 0 N--CA 1.451 -0.416 0 C-N-CA 125.895 1.678 . . . . 0.0 110.02 -177.763 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 8' ' ' GLN . . . . . 0.464 ' HG2' ' CD2' ' A' ' 9' ' ' HIS . 0.0 OUTLIER -61.37 -6.22 2.13 Favored 'General case' 0 N--CA 1.468 0.471 0 N-CA-C 113.967 1.099 . . . . 0.0 113.967 -169.794 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' A' A ' 9' ' ' HIS . . . . . 0.464 ' CD2' ' HG2' ' A' ' 8' ' ' GLN . 16.8 m170 -124.6 9.68 8.38 Favored 'General case' 0 CA--C 1.543 0.705 0 C-N-CA 127.078 2.151 . . . . 0.0 110.301 -171.002 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 10' ' ' HIS . . . . . . . . . . . . . 94.5 m-70 -132.99 154.97 49.99 Favored 'General case' 0 C--O 1.236 0.389 0 CA-C-N 119.438 1.017 . . . . 0.0 111.614 -175.771 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 11' ' ' ARG . . . . . . . . . . . . . 63.4 ttt180 -96.9 147.03 24.38 Favored 'General case' 0 CA--C 1.513 -0.445 0 C-N-CA 124.525 1.13 . . . . 0.0 108.694 173.821 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 12' ' ' PHE . . . . . . . . . . . . . 60.2 m-85 -126.24 161.4 27.84 Favored 'General case' 0 N--CA 1.45 -0.468 0 N-CA-C 108.953 -0.758 . . . . 0.0 108.953 165.487 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 13' ' ' VAL . . . . . . . . . . . . . 8.8 p -129.6 155.48 41.36 Favored 'Isoleucine or valine' 0 CA--C 1.545 0.782 0 C-N-CA 125.333 1.453 . . . . 0.0 109.797 166.889 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 14' ' ' LEU . . . . . 0.53 ' HG ' HG21 ' A' ' 22' ' ' VAL . 1.3 tp -85.75 100.61 12.14 Favored 'General case' 0 N--CA 1.47 0.527 0 C-N-CA 125.519 1.528 . . . . 0.0 108.909 -175.673 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 4.9 tm-20 -88.45 -36.21 16.62 Favored 'General case' 0 CA--C 1.534 0.329 0 C-N-CA 122.653 0.381 . . . . 0.0 110.056 -174.006 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -152.12 146.26 25.36 Favored 'General case' 0 C--O 1.234 0.247 0 CA-C-O 122.656 1.217 . . . . 0.0 109.97 -177.907 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 17' ' ' VAL . . . . . 0.629 HG12 ' H ' ' A' ' 18' ' ' ASN . 3.0 t -79.65 -164.64 0.07 OUTLIER 'Isoleucine or valine' 0 CA--C 1.546 0.807 0 C-N-CA 126.071 1.748 . . . . 0.0 107.597 172.095 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 18' ' ' ASN . . . . . 0.629 ' H ' HG12 ' A' ' 17' ' ' VAL . 40.3 t30 -51.83 -9.54 0.09 Allowed 'General case' 0 CA--C 1.547 0.853 0 C-N-CA 127.731 2.413 . . . . 0.0 115.648 170.207 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . 156.9 32.2 0.02 OUTLIER Glycine 0 CA--C 1.524 0.594 0 O-C-N 120.92 -1.113 . . . . 0.0 112.373 -179.122 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 26.0 mttp -150.73 156.02 35.95 Favored Pre-proline 0 C--O 1.236 0.387 0 C-N-CA 126.975 2.11 . . . . 0.0 108.05 176.18 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 21' ' ' PRO . . . . . . . . . . . . . 72.7 Cg_endo -86.06 172.5 7.39 Favored 'Trans proline' 0 N--CA 1.448 -1.195 0 C-N-CA 122.212 1.942 . . . . 0.0 111.426 -179.498 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 22' ' ' VAL . . . . . 0.53 HG21 ' HG ' ' A' ' 14' ' ' LEU . 54.4 t -115.18 127.39 72.76 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.342 0 C-N-CA 125.192 1.397 . . . . 0.0 109.449 -166.76 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 23' ' ' THR . . . . . . . . . . . . . 2.5 p -105.61 95.71 6.0 Favored 'General case' 0 CA--C 1.534 0.351 0 C-N-CA 125.219 1.407 . . . . 0.0 111.506 -167.637 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 24' ' ' SER . . . . . . . . . . . . . 34.7 t -163.4 135.34 5.06 Favored 'General case' 0 N--CA 1.449 -0.476 0 N-CA-C 108.069 -1.086 . . . . 0.0 108.069 172.714 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 25' ' ' ASP . . . . . . . . . . . . . 13.6 m-20 -107.26 -3.47 19.72 Favored 'General case' 0 N--CA 1.472 0.666 0 C-N-CA 124.567 1.147 . . . . 0.0 112.111 166.478 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 26' ' ' LYS . . . . . . . . . . . . . 92.2 mttt -142.97 129.5 20.15 Favored 'General case' 0 C--N 1.345 0.376 0 O-C-N 120.162 -1.586 . . . . 0.0 110.04 -176.667 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 27' ' ' ASN . . . . . . . . . . . . . 2.4 m-80 45.53 68.07 3.67 Favored Pre-proline 0 CA--C 1.535 0.382 0 C-N-CA 125.634 1.574 . . . . 0.0 109.443 -179.979 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 28' ' ' PRO . . . . . . . . . . . . . 18.0 Cg_endo -63.79 172.76 5.41 Favored 'Trans proline' 0 C--O 1.236 0.387 0 C-N-CA 123.314 2.676 . . . . 0.0 112.37 -173.361 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 29' ' ' PRO . . . . . . . . . . . . . 42.2 Cg_endo -74.05 62.71 5.03 Favored 'Trans proline' 0 N--CA 1.454 -0.826 0 C-N-CA 121.333 1.355 . . . . 0.0 110.435 166.497 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 30' ' ' GLU . . . . . . . . . . . . . 0.3 OUTLIER -81.37 169.85 16.72 Favored 'General case' 0 CA--C 1.536 0.42 0 O-C-N 120.581 -1.325 . . . . 0.0 108.897 174.812 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 31' ' ' ILE . . . . . . . . . . . . . 7.5 tt -146.17 105.86 0.66 Allowed 'Isoleucine or valine' 0 N--CA 1.452 -0.328 0 N-CA-C 105.665 -1.976 . . . . 0.0 105.665 169.6 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 32' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER -80.45 129.66 34.65 Favored 'General case' 0 N--CA 1.445 -0.706 0 N-CA-C 106.604 -1.628 . . . . 0.0 106.604 160.17 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 33' ' ' PHE . . . . . . . . . . . . . 59.7 m-85 -93.42 156.44 16.77 Favored 'General case' 0 C--O 1.239 0.512 0 N-CA-C 106.803 -1.554 . . . . 0.0 106.803 158.673 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 34' ' ' GLY . . . . . . . . . . . . . . . -167.53 122.34 1.03 Allowed Glycine 0 C--O 1.219 -0.803 0 CA-C-O 117.107 -1.941 . . . . 0.0 109.713 -177.221 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 35' ' ' GLU . . . . . . . . . . . . . 1.8 tm-20 70.24 114.46 0.05 OUTLIER 'General case' 0 CA--C 1.542 0.659 0 CA-C-N 120.341 2.071 . . . . 0.0 111.436 178.986 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 44.9 mtmt 63.91 -50.21 0.26 Allowed 'General case' 0 N--CA 1.477 0.913 0 C-N-CA 130.578 3.551 . . . . 0.0 116.478 176.751 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 37' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER 171.27 8.18 0.0 OUTLIER 'General case' 0 CA--C 1.543 0.676 1 C-N-CA 132.347 4.259 . . . . 0.0 111.342 177.173 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' A' A ' 38' ' ' MET . . . . . . . . . . . . . 65.5 mmm -57.02 157.32 5.92 Favored 'General case' 0 N--CA 1.473 0.683 0 CA-C-N 120.667 1.576 . . . . 0.0 111.596 -169.478 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 39' ' ' ILE . . . . . . . . . . . . . 52.9 mt -124.57 124.91 69.23 Favored 'Isoleucine or valine' 0 C--O 1.235 0.327 0 C-N-CA 126.641 1.976 . . . . 0.0 106.662 -166.687 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 40' ' ' SER . . . . . . . . . . . . . 59.8 p -138.21 123.39 19.23 Favored 'General case' 0 C--O 1.241 0.635 0 C-N-CA 125.309 1.444 . . . . 0.0 108.334 177.554 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 41' ' ' GLY . . . . . . . . . . . . . . . -171.93 178.44 44.16 Favored Glycine 0 CA--C 1.529 0.926 0 CA-C-N 119.974 1.261 . . . . 0.0 112.959 -173.677 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 42' ' ' SER . . . . . . . . . . . . . 20.6 t -154.47 109.98 3.15 Favored 'General case' 0 C--O 1.236 0.393 0 O-C-N 121.622 -0.929 . . . . 0.0 109.859 169.012 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 43' ' ' MET . . . . . . . . . . . . . 15.3 mmt -65.91 -64.58 0.83 Allowed 'General case' 0 N--CA 1.455 -0.185 0 N-CA-C 106.998 -1.482 . . . . 0.0 106.998 159.597 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 44' ' ' CYS . . . . . 1.296 ' SG ' ' SG ' ' A' ' 70' ' ' CYS . 19.7 t -146.37 -61.99 0.31 Allowed 'General case' 0 N--CA 1.454 -0.253 0 N-CA-C 108.807 -0.812 . . . . 0.0 108.807 -178.245 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 45' ' ' ASN . . . . . . . . . . . . . 2.9 m120 -77.24 15.95 0.66 Allowed 'General case' 0 CA--C 1.544 0.738 0 C-N-CA 125.731 1.612 . . . . 0.0 113.139 -175.371 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 46' ' ' ARG . . . . . . . . . . . . . 1.2 mtt180 56.94 164.93 0.03 OUTLIER 'General case' 0 N--CA 1.472 0.644 0 C-N-CA 126.765 2.026 . . . . 0.0 113.164 -156.421 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 47' ' ' PHE . . . . . . . . . . . . . 39.1 p90 -160.65 166.04 29.54 Favored 'General case' 0 C--O 1.234 0.249 0 C-N-CA 124.152 0.981 . . . . 0.0 110.416 153.873 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 48' ' ' SER . . . . . . . . . . . . . 0.2 OUTLIER -167.92 162.41 13.47 Favored 'General case' 0 C--O 1.236 0.366 0 C-N-CA 124.305 1.042 . . . . 0.0 109.457 174.545 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 49' ' ' GLY . . . . . . . . . . . . . . . -176.66 173.74 46.51 Favored Glycine 0 CA--C 1.53 1.021 0 CA-C-N 119.925 1.239 . . . . 0.0 113.23 175.573 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 50' ' ' GLU . . . . . . . . . . . . . 47.1 mt-10 -79.31 94.09 5.41 Favored 'General case' 0 C--O 1.238 0.452 0 C-N-CA 125.008 1.323 . . . . 0.0 107.771 167.263 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 51' ' ' GLY . . . . . . . . . . . . . . . -69.59 164.39 51.02 Favored Glycine 0 C--O 1.238 0.375 0 N-CA-C 110.995 -0.842 . . . . 0.0 110.995 168.455 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 52' ' ' LYS . . . . . . . . . . . . . 2.0 tttp -162.6 151.34 14.82 Favored 'General case' 0 N--CA 1.457 -0.084 0 C-N-CA 123.378 0.671 . . . . 0.0 110.06 169.915 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 53' ' ' LEU . . . . . . . . . . . . . 23.6 tp -148.68 135.13 19.54 Favored 'General case' 0 C--N 1.333 -0.12 0 N-CA-C 107.04 -1.467 . . . . 0.0 107.04 174.731 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 2.8 t -157.42 11.57 0.21 Allowed 'General case' 0 CA--C 1.543 0.687 0 CA-C-N 118.435 0.562 . . . . 0.0 111.929 170.123 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 55' ' ' ASN . . . . . . . . . . . . . 40.1 p30 -151.83 -2.02 0.3 Allowed 'General case' 0 N--CA 1.471 0.61 0 N-CA-C 114.232 1.197 . . . . 0.0 114.232 -172.572 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 56' ' ' GLY . . . . . . . . . . . . . . . 107.39 -2.24 34.75 Favored Glycine 0 CA--C 1.532 1.139 0 C-N-CA 125.437 1.494 . . . . 0.0 113.574 -175.049 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 57' ' ' GLU . . . . . . . . . . . . . 28.0 tt0 -119.25 142.79 47.73 Favored 'General case' 0 CA--C 1.539 0.524 0 CA-C-N 118.678 1.239 . . . . 0.0 109.542 -177.215 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 58' ' ' LEU . . . . . . . . . . . . . 57.2 tp -117.6 122.84 44.68 Favored 'General case' 0 C--O 1.232 0.175 0 C-N-CA 126.086 1.754 . . . . 0.0 109.713 175.919 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 59' ' ' THR . . . . . . . . . . . . . 63.5 p -109.24 166.24 11.0 Favored 'General case' 0 CA--C 1.534 0.331 0 C-N-CA 124.223 1.009 . . . . 0.0 110.782 165.103 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 60' ' ' ALA . . . . . . . . . . . . . . . -129.76 86.32 2.4 Favored 'General case' 0 C--O 1.235 0.301 0 CA-C-O 122.415 1.102 . . . . 0.0 108.67 150.266 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 61' ' ' LYS . . . . . . . . . . . . . 74.7 tttt -74.85 100.02 3.95 Favored 'General case' 0 C--O 1.236 0.38 0 N-CA-C 107.601 -1.259 . . . . 0.0 107.601 168.18 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 62' ' ' GLY . . . . . . . . . . . . . . . 111.87 48.18 0.69 Allowed Glycine 0 CA--C 1.525 0.716 0 C-N-CA 124.105 0.859 . . . . 0.0 111.744 -176.638 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 63' ' ' LEU . . . . . . . . . . . . . 4.0 tp -67.33 168.57 10.37 Favored 'General case' 0 CA--C 1.539 0.542 0 C-N-CA 125.071 1.348 . . . . 0.0 110.516 172.654 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 64' ' ' ALA . . . . . . . . . . . . . . . -143.4 160.92 39.68 Favored 'General case' 0 C--N 1.329 -0.316 0 O-C-N 119.885 -1.76 . . . . 0.0 107.395 159.731 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 65' ' ' MET . . . . . . . . . . . . . 68.3 mtp -152.82 -171.39 3.92 Favored 'General case' 0 CA--C 1.54 0.56 0 C-N-CA 126.848 2.059 . . . . 0.0 107.777 179.38 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 66' ' ' THR . . . . . . . . . . . . . 0.9 OUTLIER -131.86 -164.87 1.5 Allowed 'General case' 0 CA--C 1.545 0.755 0 C-N-CA 124.239 1.016 . . . . 0.0 109.36 164.993 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 67' ' ' ARG . . . . . . . . . . . . . 3.1 ppt_? -125.11 52.56 1.58 Allowed 'General case' 0 N--CA 1.466 0.347 0 C-N-CA 124.964 1.306 . . . . 0.0 110.931 176.916 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 68' ' ' MET . . . . . . . . . . . . . 22.5 ptp -102.56 163.08 12.43 Favored 'General case' 0 CA--C 1.52 -0.207 0 O-C-N 121.29 -0.881 . . . . 0.0 109.205 167.007 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 69' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -124.42 155.67 38.45 Favored 'General case' 0 C--N 1.323 -0.582 0 C-N-CA 126.772 2.029 . . . . 0.0 108.316 -170.639 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 70' ' ' CYS . . . . . 1.296 ' SG ' ' SG ' ' A' ' 44' ' ' CYS . 1.6 p -116.67 160.59 20.49 Favored 'General case' 0 C--N 1.324 -0.541 0 C-N-CA 125.528 1.531 . . . . 0.0 110.097 -174.984 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 71' ' ' ALA . . . . . . . . . . . . . . . -78.96 16.86 0.82 Allowed 'General case' 0 CA--C 1.54 0.591 0 C-N-CA 124.29 1.036 . . . . 0.0 112.097 176.548 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 72' ' ' ASN . . . . . . . . . . . . . 17.3 t-20 -136.17 143.62 44.63 Favored Pre-proline 0 CA--C 1.534 0.348 0 O-C-N 120.509 -1.369 . . . . 0.0 108.464 -173.589 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 73' ' ' PRO . . . . . . . . . . . . . 48.4 Cg_endo -71.72 -52.63 0.2 Allowed 'Trans proline' 0 C--N 1.349 0.587 0 C-N-CA 122.965 2.443 . . . . 0.0 111.455 179.721 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 74' ' ' GLN . . . . . . . . . . . . . 45.7 tt0 -57.83 -45.31 86.36 Favored 'General case' 0 C--O 1.22 -0.498 0 C-N-CA 124.277 1.031 . . . . 0.0 109.798 -175.691 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 75' ' ' LEU . . . . . . . . . . . . . 98.2 mt -61.29 -39.16 89.43 Favored 'General case' 0 CA--C 1.535 0.371 0 CA-C-N 118.966 0.803 . . . . 0.0 111.106 -177.331 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 76' ' ' ASN . . . . . . . . . . . . . 1.4 m-80 -64.46 -50.47 67.37 Favored 'General case' 0 N--CA 1.468 0.426 0 C-N-CA 124.554 1.142 . . . . 0.0 110.018 174.749 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 77' ' ' GLU . . . . . . . . . . . . . 18.5 tt0 -54.08 -34.75 60.97 Favored 'General case' 0 CA--C 1.539 0.542 0 C-N-CA 126.0 1.72 . . . . 0.0 111.145 175.082 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 78' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -73.88 -20.74 60.32 Favored 'General case' 0 N--CA 1.446 -0.655 0 CA-C-O 116.836 -1.554 . . . . 0.0 112.696 -175.116 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 79' ' ' ASP . . . . . . . . . . . . . 0.0 OUTLIER -54.49 -45.45 73.25 Favored 'General case' 0 N--CA 1.471 0.617 0 CA-C-N 120.474 1.488 . . . . 0.0 110.433 176.23 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 80' ' ' ASN . . . . . . . . . . . . . 3.1 p30 -99.15 -23.78 15.11 Favored 'General case' 0 N--CA 1.441 -0.887 0 C-N-CA 124.402 1.081 . . . . 0.0 109.811 -168.013 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 81' ' ' THR . . . . . . . . . . . . . 15.3 m -57.44 -57.24 13.55 Favored 'General case' 0 CA--C 1.541 0.618 0 N-CA-C 109.157 -0.683 . . . . 0.0 109.157 161.539 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 82' ' ' ILE . . . . . . . . . . . . . 10.8 tp -66.38 -37.94 80.72 Favored 'Isoleucine or valine' 0 C--N 1.345 0.372 0 CA-C-N 119.855 1.207 . . . . 0.0 111.089 -172.107 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 83' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -57.21 -46.63 82.73 Favored 'General case' 0 CA--C 1.533 0.319 0 CA-C-N 119.236 0.926 . . . . 0.0 110.529 -176.053 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 84' ' ' GLU . . . . . . . . . . . . . 4.0 mt-10 -81.56 -5.24 57.81 Favored 'General case' 0 N--CA 1.448 -0.547 0 CA-C-O 118.448 -0.787 . . . . 0.0 112.864 179.536 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 85' ' ' MET . . . . . . . . . . . . . 90.0 mtp -90.71 -4.21 56.89 Favored 'General case' 0 CA--C 1.537 0.445 0 CA-C-N 120.07 1.305 . . . . 0.0 111.985 164.8 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 86' ' ' LEU . . . . . . . . . . . . . 3.4 mm? -113.13 -32.36 6.35 Favored 'General case' 0 C--N 1.333 -0.112 0 O-C-N 121.231 -0.918 . . . . 0.0 112.071 178.043 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 87' ' ' LYS . . . . . . . . . . . . . 76.9 mttt -72.14 -49.4 36.22 Favored 'General case' 0 N--CA 1.448 -0.554 0 CA-C-N 118.817 0.735 . . . . 0.0 110.501 -177.408 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 88' ' ' GLU . . . . . . . . . . . . . 7.3 mm-40 -80.81 -3.31 50.65 Favored 'General case' 0 CA--C 1.54 0.591 0 C-N-CA 126.097 1.759 . . . . 0.0 112.642 -174.87 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 89' ' ' GLY . . . . . . . . . . . . . . . 84.5 106.04 0.6 Allowed Glycine 0 CA--C 1.524 0.656 0 CA-C-N 120.137 1.335 . . . . 0.0 110.916 -179.762 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 90' ' ' ALA . . . . . . . . . . . . . . . -79.87 152.25 29.76 Favored 'General case' 0 CA--C 1.516 -0.33 0 N-CA-C 109.014 -0.736 . . . . 0.0 109.014 170.632 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 91' ' ' GLN . . . . . . . . . . . . . 93.2 mm-40 -73.62 141.75 46.55 Favored 'General case' 0 N--CA 1.442 -0.858 0 N-CA-C 105.398 -2.075 . . . . 0.0 105.398 156.206 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 92' ' ' VAL . . . . . . . . . . . . . 7.4 p -128.9 108.8 17.74 Favored 'Isoleucine or valine' 0 N--CA 1.443 -0.821 0 N-CA-C 104.967 -2.234 . . . . 0.0 104.967 -179.502 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 93' ' ' ASP . . . . . . . . . . . . . 0.7 OUTLIER -124.81 75.48 1.43 Allowed 'General case' 0 C--N 1.327 -0.37 0 N-CA-C 106.444 -1.687 . . . . 0.0 106.444 -167.552 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 94' ' ' LEU . . . . . 0.752 HD23 HE21 ' A' ' 6' ' ' GLN . 42.0 tp -77.45 121.52 23.93 Favored 'General case' 0 C--O 1.234 0.254 0 N-CA-C 107.923 -1.14 . . . . 0.0 107.923 -178.188 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 95' ' ' THR . . . . . . . . . . . . . 1.4 m -86.65 -167.22 1.8 Allowed 'General case' 0 C--N 1.319 -0.743 0 C-N-CA 126.496 1.918 . . . . 0.0 108.057 168.238 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 96' ' ' ALA . . . . . . . . . . . . . . . -50.55 -37.87 41.87 Favored 'General case' 0 CA--C 1.543 0.676 0 O-C-N 119.563 -1.96 . . . . 0.0 113.729 -171.647 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 97' ' ' ASN . . . . . . . . . . . . . 1.3 p30 -157.3 18.48 0.29 Allowed 'General case' 0 CA--C 1.54 0.577 0 C-N-CA 125.783 1.633 . . . . 0.0 111.479 -173.363 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 98' ' ' GLN . . . . . . . . . . . . . 12.3 tt0 -136.03 116.87 14.11 Favored 'General case' 0 C--N 1.339 0.149 0 O-C-N 121.137 -0.977 . . . . 0.0 109.813 -177.673 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 99' ' ' LEU . . . . . 0.467 ' HB3' ' HB2' ' A' ' 110' ' ' TYR . 7.5 tp -77.2 117.94 19.22 Favored 'General case' 0 C--O 1.237 0.421 0 C-N-CA 127.509 2.324 . . . . 0.0 108.02 176.854 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 100' ' ' THR . . . . . . . . . . . . . 8.8 m -94.63 106.76 18.76 Favored 'General case' 0 CA--C 1.537 0.462 0 N-CA-C 106.758 -1.571 . . . . 0.0 106.758 165.192 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 101' ' ' LEU . . . . . . . . . . . . . 1.6 mm? -95.18 116.77 29.17 Favored 'General case' 0 CA--C 1.515 -0.373 0 N-CA-C 107.534 -1.284 . . . . 0.0 107.534 167.006 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 102' ' ' ALA . . . . . . . . . . . . . . . -126.71 139.47 53.12 Favored 'General case' 0 C--O 1.233 0.196 0 C-N-CA 123.499 0.719 . . . . 0.0 109.578 176.365 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 103' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -155.25 171.75 19.31 Favored 'General case' 0 N--CA 1.444 -0.755 0 C-N-CA 126.296 1.839 . . . . 0.0 107.959 178.346 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 104' ' ' ALA . . . . . . . . . . . . . . . -64.27 -22.14 66.84 Favored 'General case' 0 CA--C 1.539 0.536 0 N-CA-C 112.911 0.708 . . . . 0.0 112.911 178.025 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 105' ' ' LYS . . . . . . . . . . . . . 0.3 OUTLIER -67.61 -75.25 0.1 Allowed 'General case' 0 C--N 1.345 0.391 0 CA-C-N 119.19 0.905 . . . . 0.0 109.687 174.491 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 106' ' ' GLN . . . . . . . . . . . . . 7.8 mt-30 -147.29 178.5 8.36 Favored 'General case' 0 CA--C 1.536 0.431 0 C-N-CA 127.47 2.308 . . . . 0.0 107.825 -177.119 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 107' ' ' THR . . . . . . . . . . . . . 1.0 OUTLIER -128.7 158.22 39.19 Favored 'General case' 0 CA--C 1.542 0.636 0 C-N-CA 125.672 1.589 . . . . 0.0 107.467 171.333 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 108' ' ' LEU . . . . . . . . . . . . . 87.1 mt -145.76 162.56 37.34 Favored 'General case' 0 N--CA 1.468 0.455 0 C-N-CA 126.085 1.754 . . . . 0.0 110.491 -170.901 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 109' ' ' THR . . . . . . . . . . . . . 99.5 m -122.13 115.43 22.42 Favored 'General case' 0 C--O 1.238 0.456 0 C-N-CA 125.203 1.401 . . . . 0.0 108.196 172.293 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 110' ' ' TYR . . . . . 0.467 ' HB2' ' HB3' ' A' ' 99' ' ' LEU . 95.6 m-85 -109.68 143.32 39.61 Favored 'General case' 0 C--O 1.232 0.16 0 N-CA-C 109.617 -0.512 . . . . 0.0 109.617 171.461 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 111' ' ' LYS . . . . . . . . . . . . . 11.0 tppt? -99.08 142.97 29.89 Favored 'General case' 0 C--O 1.234 0.248 0 C-N-CA 123.954 0.902 . . . . 0.0 109.064 -178.134 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 112' ' ' LEU . . . . . . . . . . . . . 15.6 tp -73.95 60.01 0.73 Allowed 'General case' 0 CA--C 1.536 0.435 0 C-N-CA 125.275 1.43 . . . . 0.0 108.731 167.343 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 113' ' ' ALA . . . . . . . . . . . . . . . -81.8 75.43 8.74 Favored 'General case' 0 N--CA 1.449 -0.51 0 N-CA-C 106.863 -1.532 . . . . 0.0 106.863 167.67 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 114' ' ' ASP . . . . . . . . . . . . 0.269 19.5 p-10 . . . . . 0 CA--C 1.522 -0.102 0 CA-C-O 123.085 1.421 . . . . 0.0 112.307 -178.773 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 20.8 ttt . . . . . 0 CA--C 1.536 0.427 0 CA-C-O 121.396 0.617 . . . . 0.0 110.878 . . . . . . . . . 0 0 . 1 . 011 nuclear nobuild core ' A' A ' 2' ' ' VAL . . . . . 0.449 HG11 HG12 ' A' ' 92' ' ' VAL . 14.7 p -52.77 158.12 0.48 Allowed 'Isoleucine or valine' 0 CA--C 1.545 0.777 0 C-N-CA 128.088 2.555 . . . . 0.0 112.271 171.906 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 3' ' ' THR . . . . . . . . . . . . . 57.1 p -133.82 164.99 40.06 Favored Pre-proline 0 N--CA 1.467 0.425 0 O-C-N 121.24 -0.913 . . . . 0.0 111.071 178.367 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 4' ' ' PRO . . . . . . . . . . . . . 37.9 Cg_endo -62.84 -38.94 44.92 Favored 'Trans proline' 0 C--N 1.344 0.311 0 C-N-CA 123.565 2.843 . . . . 0.0 113.058 170.243 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 5' ' ' GLU . . . . . . . . . . . . . 8.7 tt0 -63.92 -44.73 92.02 Favored 'General case' 0 C--N 1.329 -0.284 0 C-N-CA 122.583 0.353 . . . . 0.0 111.019 -173.757 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 6' ' ' GLN . . . . . . . . . . . . . 13.5 pt20 -71.95 13.81 0.26 Allowed 'General case' 0 CA--C 1.541 0.611 0 C-N-CA 123.53 0.732 . . . . 0.0 112.744 179.542 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 7' ' ' LEU . . . . . . . . . . . . . 95.6 mt -126.52 -51.36 1.49 Allowed 'General case' 0 N--CA 1.452 -0.361 0 C-N-CA 125.928 1.691 . . . . 0.0 110.441 -176.58 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 8' ' ' GLN . . . . . . . . . . . . 0.267 0.0 OUTLIER -54.97 -12.07 0.76 Allowed 'General case' 0 N--CA 1.478 0.929 0 N-CA-C 115.098 1.518 . . . . 0.0 115.098 -173.303 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild core ' A' A ' 9' ' ' HIS . . . . . . . . . . . . . 10.3 m170 -125.63 13.84 8.09 Favored 'General case' 0 N--CA 1.443 -0.815 0 C-N-CA 125.44 1.496 . . . . 0.0 110.469 -169.509 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 10' ' ' HIS . . . . . . . . . . . . . 81.2 m-70 -141.42 126.02 17.86 Favored 'General case' 0 CA--C 1.538 0.483 0 C-N-CA 124.844 1.258 . . . . 0.0 112.162 -175.196 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 11' ' ' ARG . . . . . . . . . . . . . 39.3 ttt180 -68.66 149.63 48.88 Favored 'General case' 0 N--CA 1.467 0.417 0 C-N-CA 123.7 0.8 . . . . 0.0 110.004 165.63 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 12' ' ' PHE . . . . . . . . . . . . . 30.9 m-85 -129.64 167.07 18.53 Favored 'General case' 0 CA--C 1.538 0.489 0 C-N-CA 124.314 1.046 . . . . 0.0 109.66 163.417 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 13' ' ' VAL . . . . . 0.409 ' HA ' ' HA ' ' A' ' 30' ' ' GLU . 12.7 p -135.44 147.15 28.99 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.619 0 O-C-N 121.053 -1.029 . . . . 0.0 110.313 176.346 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 14' ' ' LEU . . . . . . . . . . . . . 43.6 tp -73.17 97.58 2.43 Favored 'General case' 0 N--CA 1.456 -0.155 0 N-CA-C 107.763 -1.199 . . . . 0.0 107.763 172.011 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 4.9 mm-40 -79.36 -50.64 10.54 Favored 'General case' 0 C--N 1.324 -0.503 0 N-CA-C 108.983 -0.747 . . . . 0.0 108.983 173.527 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 77.5 p -147.72 165.38 30.67 Favored 'General case' 0 C--O 1.236 0.365 0 CA-C-O 122.236 1.017 . . . . 0.0 112.595 -176.643 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 17' ' ' VAL . . . . . . . . . . . . . 13.3 t -132.83 161.85 40.91 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.53 0 C-N-CA 127.04 2.136 . . . . 0.0 107.16 -164.73 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 18' ' ' ASN . . . . . 0.403 ' HB2' ' H ' ' A' ' 107' ' ' THR . 30.9 t30 -56.41 -36.45 68.96 Favored 'General case' 0 N--CA 1.468 0.436 0 C-N-CA 124.272 1.029 . . . . 0.0 113.424 -177.379 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . -94.09 -31.73 7.9 Favored Glycine 0 C--N 1.335 0.473 0 CA-C-O 118.593 -1.115 . . . . 0.0 113.919 -167.521 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 1.3 pttt 174.47 154.85 0.31 Allowed Pre-proline 0 N--CA 1.465 0.317 0 C-N-CA 127.922 2.489 . . . . 0.0 107.012 -177.636 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 21' ' ' PRO . . . . . . . . . . . . . 72.0 Cg_endo -71.29 177.29 6.79 Favored 'Trans proline' 0 N--CA 1.454 -0.816 0 C-N-CA 121.537 1.492 . . . . 0.0 111.289 -179.13 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 22' ' ' VAL . . . . . . . . . . . . . 7.0 p -129.8 164.67 31.84 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.408 0 C-N-CA 125.403 1.481 . . . . 0.0 108.497 -172.792 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 23' ' ' THR . . . . . . . . . . . . . 0.6 OUTLIER -146.64 129.56 16.32 Favored 'General case' 0 CA--C 1.534 0.342 0 N-CA-C 107.11 -1.441 . . . . 0.0 107.11 174.671 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 24' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER -152.29 84.85 1.26 Allowed 'General case' 0 C--N 1.328 -0.347 0 N-CA-C 104.448 -2.427 . . . . 0.0 104.448 171.134 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 25' ' ' ASP . . . . . . . . . . . . . 0.8 OUTLIER -51.51 -40.7 60.11 Favored 'General case' 0 C--N 1.33 -0.25 0 C-N-CA 123.976 0.91 . . . . 0.0 109.492 175.441 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 26' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -91.4 107.18 19.03 Favored 'General case' 0 N--CA 1.449 -0.492 0 C-N-CA 125.829 1.652 . . . . 0.0 108.893 177.99 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 27' ' ' ASN . . . . . . . . . . . . . 73.9 m-80 47.75 73.37 1.01 Allowed Pre-proline 0 CA--C 1.537 0.456 0 C-N-CA 127.356 2.262 . . . . 0.0 112.116 173.228 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 28' ' ' PRO . . . . . . . . . . . . . 52.2 Cg_endo -66.59 170.76 11.83 Favored 'Trans proline' 0 C--O 1.242 0.678 0 C-N-CA 122.839 2.359 . . . . 0.0 112.615 -176.545 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 29' ' ' PRO . . . . . . . . . . . . . 43.6 Cg_endo -71.22 63.64 2.69 Favored 'Trans proline' 0 CA--C 1.538 0.705 0 C-N-CA 123.747 2.964 . . . . 0.0 111.615 173.411 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 30' ' ' GLU . . . . . 0.409 ' HA ' ' HA ' ' A' ' 13' ' ' VAL . 16.4 pt-20 -81.64 166.49 20.13 Favored 'General case' 0 C--O 1.24 0.557 0 O-C-N 120.461 -1.399 . . . . 0.0 109.927 174.275 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 31' ' ' ILE . . . . . . . . . . . . . 12.7 tt -139.57 138.23 39.6 Favored 'Isoleucine or valine' 0 N--CA 1.455 -0.224 0 N-CA-C 107.632 -1.247 . . . . 0.0 107.632 -179.969 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 32' ' ' SER . . . . . . . . . . . . . 36.8 p -124.01 120.97 33.99 Favored 'General case' 0 N--CA 1.445 -0.689 0 N-CA-C 106.627 -1.62 . . . . 0.0 106.627 176.882 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 33' ' ' PHE . . . . . . . . . . . . . 75.3 m-85 -86.88 137.55 32.29 Favored 'General case' 0 N--CA 1.448 -0.536 0 N-CA-C 105.035 -2.209 . . . . 0.0 105.035 171.97 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 34' ' ' GLY . . . . . . . . . . . . . . . -156.97 163.95 32.53 Favored Glycine 0 C--N 1.335 0.504 0 O-C-N 121.063 -1.023 . . . . 0.0 110.663 178.46 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 35' ' ' GLU . . . . . . . . . . . . . 3.9 tt0 63.73 -161.98 0.28 Allowed 'General case' 0 N--CA 1.452 -0.363 0 CA-C-N 118.675 1.238 . . . . 0.0 110.525 175.432 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 2.8 mtpt -59.32 71.71 0.01 OUTLIER 'General case' 0 CA--C 1.539 0.557 0 C-N-CA 127.046 2.139 . . . . 0.0 111.503 -177.005 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 37' ' ' MET . . . . . . . . . . . . 0.297 0.0 OUTLIER 50.71 19.36 0.59 Allowed 'General case' 0 N--CA 1.445 -0.688 0 C-N-CA 128.19 2.596 . . . . 0.0 115.449 -169.52 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild core ' A' A ' 38' ' ' MET . . . . . . . . . . . . . 0.7 OUTLIER -67.34 165.4 16.47 Favored 'General case' 0 N--CA 1.443 -0.777 0 O-C-N 120.877 -1.139 . . . . 0.0 110.757 -174.772 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 39' ' ' ILE . . . . . . . . . . . . . 5.2 mt -135.11 126.46 46.32 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.368 0 N-CA-C 105.75 -1.944 . . . . 0.0 105.75 -169.754 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 40' ' ' SER . . . . . . . . . . . . . 7.4 m -129.92 151.59 50.31 Favored 'General case' 0 CA--C 1.531 0.235 0 N-CA-C 107.819 -1.178 . . . . 0.0 107.819 169.039 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 41' ' ' GLY . . . . . . . . . . . . . . . 178.46 173.91 44.25 Favored Glycine 0 C--O 1.237 0.316 0 N-CA-C 109.599 -1.4 . . . . 0.0 109.599 -178.34 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 42' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -147.38 83.61 1.55 Allowed 'General case' 0 N--CA 1.451 -0.405 0 O-C-N 122.226 -0.573 . . . . 0.0 111.134 179.982 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 43' ' ' MET . . . . . . . . . . . . . 6.1 mmt -47.82 -55.71 9.12 Favored 'General case' 0 C--N 1.342 0.266 0 C-N-CA 123.68 0.792 . . . . 0.0 109.006 169.14 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 44' ' ' CYS . . . . . 1.293 ' SG ' ' SG ' ' A' ' 70' ' ' CYS . 18.0 p -163.26 -27.38 0.04 OUTLIER 'General case' 0 N--CA 1.443 -0.819 0 C-N-CA 125.115 1.366 . . . . 0.0 110.989 176.093 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 45' ' ' ASN . . . . . . . . . . . . . 0.5 OUTLIER -121.38 20.23 11.26 Favored 'General case' 0 N--CA 1.47 0.559 0 C-N-CA 126.265 1.826 . . . . 0.0 112.217 -167.107 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 46' ' ' ARG . . . . . . . . . . . . . 34.3 mtm180 48.35 166.88 0.0 OUTLIER 'General case' 0 C--N 1.329 -0.312 0 C-N-CA 127.011 2.124 . . . . 0.0 111.661 -155.124 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 47' ' ' PHE . . . . . . . . . . . . . 6.0 p90 -164.41 147.93 9.29 Favored 'General case' 0 C--N 1.317 -0.819 0 N-CA-C 106.127 -1.805 . . . . 0.0 106.127 166.029 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 48' ' ' SER . . . . . . . . . . . . . 1.5 p -160.75 151.79 18.82 Favored 'General case' 0 C--N 1.314 -0.954 0 N-CA-C 107.304 -1.369 . . . . 0.0 107.304 179.529 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 49' ' ' GLY . . . . . . . . . . . . . . . -172.51 163.05 35.01 Favored Glycine 0 CA--C 1.524 0.635 0 N-CA-C 106.574 -2.61 . . . . 0.0 106.574 165.852 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 50' ' ' GLU . . . . . . . . . . . . . 25.8 mt-10 -64.27 115.68 5.28 Favored 'General case' 0 C--O 1.238 0.498 0 N-CA-C 107.781 -1.192 . . . . 0.0 107.781 172.109 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 51' ' ' GLY . . . . . . . . . . . . . . . -61.42 161.36 26.48 Favored Glycine 0 CA--C 1.531 1.064 0 O-C-N 123.628 0.58 . . . . 0.0 113.388 174.545 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 52' ' ' LYS . . . . . . . . . . . . . 25.9 ttpt -133.4 135.53 44.71 Favored 'General case' 0 N--CA 1.464 0.227 0 O-C-N 121.692 -0.887 . . . . 0.0 109.219 165.894 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 53' ' ' LEU . . . . . . . . . . . . . 9.6 tp -160.47 93.76 1.04 Allowed 'General case' 0 N--CA 1.453 -0.31 0 C-N-CA 123.511 0.724 . . . . 0.0 109.881 -176.356 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 2.5 t -136.74 -12.45 1.75 Allowed 'General case' 0 C--N 1.326 -0.445 0 C-N-CA 123.721 0.808 . . . . 0.0 111.047 168.765 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 55' ' ' ASN . . . . . . . . . . . . . 4.3 t30 -136.6 24.67 3.14 Favored 'General case' 0 CA--C 1.541 0.602 0 C-N-CA 127.114 2.165 . . . . 0.0 109.944 -171.851 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 56' ' ' GLY . . . . . . . . . . . . . . . 73.66 -3.55 33.8 Favored Glycine 0 CA--C 1.532 1.096 0 O-C-N 120.584 -1.322 . . . . 0.0 114.716 -175.968 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 57' ' ' GLU . . . . . . . . . . . . . 30.9 tt0 -110.45 105.28 14.2 Favored 'General case' 0 N--CA 1.452 -0.363 0 CA-C-N 118.747 1.274 . . . . 0.0 110.159 -161.539 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 58' ' ' LEU . . . . . 0.612 ' HB2' HG21 ' A' ' 92' ' ' VAL . 21.2 tp -75.99 93.83 3.32 Favored 'General case' 0 CA--C 1.536 0.408 0 C-N-CA 125.222 1.409 . . . . 0.0 112.251 176.84 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 59' ' ' THR . . . . . . . . . . . . . 14.9 p -108.02 127.74 54.04 Favored 'General case' 0 N--CA 1.474 0.742 0 C-N-CA 124.815 1.246 . . . . 0.0 109.955 172.916 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 60' ' ' ALA . . . . . . . . . . . . . . . -132.0 87.34 2.43 Favored 'General case' 0 N--CA 1.454 -0.226 0 C-N-CA 124.443 1.097 . . . . 0.0 109.504 173.571 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 61' ' ' LYS . . . . . . . . . . . . . 47.6 tttm -44.89 -62.4 1.24 Allowed 'General case' 0 C--N 1.331 -0.209 0 C-N-CA 125.817 1.647 . . . . 0.0 110.082 167.745 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 62' ' ' GLY . . . . . . . . . . . . . . . -79.38 45.57 2.87 Favored Glycine 0 CA--C 1.521 0.441 0 C-N-CA 125.251 1.405 . . . . 0.0 112.725 -176.52 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 63' ' ' LEU . . . . . . . . . . . . . 5.7 tp -63.56 142.6 58.34 Favored 'General case' 0 N--CA 1.441 -0.879 0 CA-C-N 118.474 1.137 . . . . 0.0 108.248 166.641 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 64' ' ' ALA . . . . . . . . . . . . . . . -128.88 93.11 3.53 Favored 'General case' 0 N--CA 1.455 -0.223 0 C-N-CA 124.727 1.211 . . . . 0.0 109.741 -173.351 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 65' ' ' MET . . . . . . . . . . . . . 74.9 mtp -115.64 156.36 26.01 Favored 'General case' 0 N--CA 1.467 0.406 0 C-N-CA 124.717 1.207 . . . . 0.0 110.346 -177.377 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 66' ' ' THR . . . . . . . . . . . . . 34.7 p -88.73 -172.06 3.57 Favored 'General case' 0 CA--C 1.544 0.717 0 C-N-CA 123.933 0.893 . . . . 0.0 109.736 173.245 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 67' ' ' ARG . . . . . . . . . . . . . 34.0 mtm180 -130.45 14.34 5.52 Favored 'General case' 0 N--CA 1.47 0.564 0 C-N-CA 124.005 0.922 . . . . 0.0 112.97 170.614 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 68' ' ' MET . . . . . . . . . . . . . 4.0 mpp? -61.5 166.53 4.0 Favored 'General case' 0 CA--C 1.532 0.254 0 O-C-N 120.033 -1.667 . . . . 0.0 111.688 178.367 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 69' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -58.02 111.08 1.06 Allowed 'General case' 0 N--CA 1.445 -0.677 0 C-N-CA 125.96 1.704 . . . . 0.0 108.291 171.305 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 70' ' ' CYS . . . . . 1.293 ' SG ' ' SG ' ' A' ' 44' ' ' CYS . 69.7 m -62.12 -14.09 33.34 Favored 'General case' 0 C--O 1.231 0.111 0 CA-C-O 118.485 -0.769 . . . . 0.0 112.86 170.585 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 71' ' ' ALA . . . . . . . . . . . . . . . 61.03 3.98 0.76 Allowed 'General case' 0 CA--C 1.533 0.295 0 C-N-CA 126.69 1.996 . . . . 0.0 115.38 163.941 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 72' ' ' ASN . . . . . . . . . . . . . 7.4 t30 -142.73 143.4 25.72 Favored Pre-proline 0 N--CA 1.466 0.373 0 N-CA-C 107.775 -1.194 . . . . 0.0 107.775 158.315 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 73' ' ' PRO . . . . . . . . . . . . . 19.0 Cg_endo -63.83 -47.02 7.54 Favored 'Trans proline' 0 C--N 1.346 0.411 0 C-N-CA 123.148 2.565 . . . . 0.0 111.815 -165.963 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 74' ' ' GLN . . . . . . . . . . . . . 48.2 tt0 -59.79 -38.65 82.5 Favored 'General case' 0 CA--C 1.532 0.272 0 CA-C-O 119.238 -0.41 . . . . 0.0 110.616 -179.052 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 75' ' ' LEU . . . . . 0.425 ' HB3' ' HB3' ' A' ' 44' ' ' CYS . 36.7 mt -72.24 -41.99 66.17 Favored 'General case' 0 CA--C 1.533 0.301 0 N-CA-C 109.269 -0.641 . . . . 0.0 109.269 -178.115 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 76' ' ' ASN . . . . . 0.416 ' CB ' ' HB2' ' A' ' 70' ' ' CYS . 4.1 t-20 -63.14 -37.85 88.86 Favored 'General case' 0 N--CA 1.469 0.494 0 C-N-CA 123.104 0.562 . . . . 0.0 111.188 -179.721 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 77' ' ' GLU . . . . . . . . . . . . . 0.7 OUTLIER -60.53 -24.33 65.28 Favored 'General case' 0 CA--C 1.542 0.647 0 N-CA-C 113.331 0.863 . . . . 0.0 113.331 175.257 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 78' ' ' LEU . . . . . . . . . . . . . 94.3 mt -89.37 -15.42 33.36 Favored 'General case' 0 CA--C 1.522 -0.128 0 CA-C-O 118.352 -0.832 . . . . 0.0 111.585 -176.375 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 79' ' ' ASP . . . . . . . . . . . . . 35.5 t70 -55.9 -42.26 75.74 Favored 'General case' 0 CA--C 1.518 -0.26 0 C-N-CA 124.952 1.301 . . . . 0.0 111.895 175.58 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 80' ' ' ASN . . . . . . . . . . . . . 71.6 m-20 -77.16 -55.49 5.39 Favored 'General case' 0 N--CA 1.451 -0.398 0 N-CA-C 107.47 -1.307 . . . . 0.0 107.47 -179.104 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 81' ' ' THR . . . . . . . . . . . . . 22.5 m -45.23 -54.95 6.34 Favored 'General case' 0 CA--C 1.536 0.405 0 C-N-CA 126.241 1.816 . . . . 0.0 110.938 -176.931 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 82' ' ' ILE . . . . . . . . . . . . . 9.5 tp -64.93 -40.74 90.08 Favored 'Isoleucine or valine' 0 C--O 1.236 0.362 0 CA-C-N 119.089 0.859 . . . . 0.0 111.373 -175.529 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 83' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -64.86 -38.63 91.61 Favored 'General case' 0 N--CA 1.449 -0.513 0 N-CA-C 109.083 -0.71 . . . . 0.0 109.083 -175.893 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 84' ' ' GLU . . . . . . . . . . . . . 94.7 mt-10 -74.75 -34.1 62.46 Favored 'General case' 0 N--CA 1.446 -0.631 0 C-N-CA 126.705 2.002 . . . . 0.0 111.374 -177.402 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 85' ' ' MET . . . . . . . . . . . . . 84.3 mtp -67.31 -55.09 15.29 Favored 'General case' 0 C--N 1.34 0.192 0 CA-C-O 122.131 0.967 . . . . 0.0 108.556 -179.678 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 86' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -66.6 -20.79 66.09 Favored 'General case' 0 C--N 1.333 -0.122 0 C-N-CA 123.657 0.783 . . . . 0.0 111.98 -173.93 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 87' ' ' LYS . . . . . . . . . . . . . 2.5 tptt -71.19 -40.49 71.16 Favored 'General case' 0 N--CA 1.453 -0.321 0 CA-C-O 117.668 -1.158 . . . . 0.0 111.303 179.153 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 88' ' ' GLU . . . . . . . . . . . . . 0.6 OUTLIER -84.54 -37.94 20.62 Favored 'General case' 0 C--N 1.341 0.225 0 O-C-N 124.282 0.989 . . . . 0.0 112.169 -175.615 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 89' ' ' GLY . . . . . . . . . . . . . . . 122.09 84.94 0.75 Allowed Glycine 0 CA--C 1.503 -0.7 0 N-CA-C 109.937 -1.265 . . . . 0.0 109.937 -174.031 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 90' ' ' ALA . . . . . . . . . . . . . . . -67.33 139.43 57.23 Favored 'General case' 0 N--CA 1.447 -0.616 0 N-CA-C 108.441 -0.948 . . . . 0.0 108.441 175.336 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 91' ' ' GLN . . . . . . . . . . . . . 6.9 mp0 -67.33 141.94 56.97 Favored 'General case' 0 N--CA 1.439 -1.01 0 N-CA-C 105.305 -2.109 . . . . 0.0 105.305 164.897 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 92' ' ' VAL . . . . . 0.612 HG21 ' HB2' ' A' ' 58' ' ' LEU . 79.5 t -130.01 117.76 41.91 Favored 'Isoleucine or valine' 0 N--CA 1.447 -0.607 0 N-CA-C 105.561 -2.015 . . . . 0.0 105.561 178.597 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 93' ' ' ASP . . . . . . . . . . . . . 31.4 m-20 -128.0 84.79 2.28 Favored 'General case' 0 C--N 1.327 -0.375 0 C-N-CA 127.065 2.146 . . . . 0.0 105.309 -171.764 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 94' ' ' LEU . . . . . . . . . . . . . 57.8 tp -85.2 109.17 18.12 Favored 'General case' 0 CA--C 1.516 -0.359 0 CA-C-O 122.336 1.065 . . . . 0.0 108.568 173.131 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 95' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -77.75 179.27 6.74 Favored 'General case' 0 C--N 1.315 -0.933 0 C-N-CA 127.022 2.129 . . . . 0.0 109.115 169.086 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 96' ' ' ALA . . . . . . . . . . . . . . . -44.52 -41.94 6.81 Favored 'General case' 0 CA--C 1.535 0.373 0 C-N-CA 125.021 1.328 . . . . 0.0 114.026 -163.918 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 97' ' ' ASN . . . . . . . . . . . . . 17.0 p30 -150.96 31.55 0.62 Allowed 'General case' 0 CA--C 1.535 0.376 0 C-N-CA 125.352 1.461 . . . . 0.0 111.993 170.92 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 98' ' ' GLN . . . . . . . . . . . . . 13.7 tt0 -147.8 125.57 11.89 Favored 'General case' 0 N--CA 1.457 -0.122 0 O-C-N 121.484 -0.76 . . . . 0.0 109.83 -178.62 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 99' ' ' LEU . . . . . . . . . . . . . 22.5 tp -90.22 129.64 36.45 Favored 'General case' 0 C--N 1.327 -0.399 0 C-N-CA 126.615 1.966 . . . . 0.0 110.448 -177.007 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 100' ' ' THR . . . . . . . . . . . . . 74.5 m -104.58 128.64 52.63 Favored 'General case' 0 N--CA 1.454 -0.271 0 C-N-CA 123.815 0.846 . . . . 0.0 109.593 158.931 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 101' ' ' LEU . . . . . . . . . . . . . 1.0 OUTLIER -98.13 141.93 30.45 Favored 'General case' 0 CA--C 1.519 -0.222 0 C-N-CA 126.175 1.79 . . . . 0.0 107.126 159.881 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 102' ' ' ALA . . . . . . . . . . . . . . . -143.76 148.13 35.18 Favored 'General case' 0 C--N 1.328 -0.362 0 C-N-CA 124.814 1.246 . . . . 0.0 107.831 172.015 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 103' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -162.54 173.42 14.01 Favored 'General case' 0 N--CA 1.442 -0.838 0 C-N-CA 126.89 2.076 . . . . 0.0 107.651 173.591 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 104' ' ' ALA . . . . . . . . . . . . . . . -51.17 -36.64 42.11 Favored 'General case' 0 CA--C 1.531 0.214 0 C-N-CA 123.803 0.841 . . . . 0.0 112.146 173.868 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 105' ' ' LYS . . . . . . . . . . . . . 12.5 mmtp -63.33 -74.61 0.09 Allowed 'General case' 0 C--N 1.339 0.113 0 CA-C-O 118.683 -0.675 . . . . 0.0 111.162 174.706 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 106' ' ' GLN . . . . . . . . . . . . . 2.6 pt20 -152.73 -172.04 4.12 Favored 'General case' 0 CA--C 1.534 0.355 0 CA-C-N 118.625 0.648 . . . . 0.0 111.667 -176.261 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 107' ' ' THR . . . . . 0.403 ' H ' ' HB2' ' A' ' 18' ' ' ASN . 1.8 t -128.58 135.81 49.87 Favored 'General case' 0 CA--C 1.534 0.345 0 C-N-CA 126.321 1.848 . . . . 0.0 107.875 177.498 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 108' ' ' LEU . . . . . 0.401 HD23 ' CE1' ' A' ' 110' ' ' TYR . 5.9 mp -123.78 149.83 45.17 Favored 'General case' 0 C--O 1.233 0.229 0 C-N-CA 128.346 2.658 . . . . 0.0 107.604 -173.838 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 109' ' ' THR . . . . . . . . . . . . . 1.3 m -132.08 102.19 5.71 Favored 'General case' 0 C--O 1.238 0.45 0 CA-C-O 121.746 0.784 . . . . 0.0 109.469 -176.367 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 110' ' ' TYR . . . . . 0.401 ' CE1' HD23 ' A' ' 108' ' ' LEU . 51.5 m-85 -103.26 144.61 31.11 Favored 'General case' 0 N--CA 1.453 -0.318 0 C-N-CA 124.925 1.29 . . . . 0.0 110.375 -173.893 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 111' ' ' LYS . . . . . . . . . . . . . 0.8 OUTLIER -98.81 142.65 30.07 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-O 117.739 -1.124 . . . . 0.0 109.398 -176.769 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 112' ' ' LEU . . . . . . . . . . . . . 39.1 tp -74.14 56.91 0.63 Allowed 'General case' 0 CA--C 1.542 0.644 0 C-N-CA 124.017 0.927 . . . . 0.0 109.214 162.586 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 113' ' ' ALA . . . . . . . . . . . . . . . -92.22 63.68 4.34 Favored 'General case' 0 C--O 1.236 0.368 0 CA-C-O 122.487 1.137 . . . . 0.0 108.456 -177.625 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 114' ' ' ASP . . . . . . . . . . . . . 5.1 p-10 . . . . . 0 C--N 1.326 -0.43 0 CA-C-N 114.633 -1.167 . . . . 0.0 113.203 -157.202 . . . . . . . . 0 0 . 1 . 012 nuclear nobuild core ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 53.0 ttp . . . . . 0 N--CA 1.452 -0.371 0 N-CA-C 108.853 -0.795 . . . . 0.0 108.853 . . . . . . . . . 0 0 . 1 . 012 nuclear nobuild core ' A' A ' 2' ' ' VAL . . . . . 0.426 HG23 ' HB3' ' A' ' 94' ' ' LEU . 13.4 p -67.44 160.46 4.31 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.366 0 C-N-CA 123.986 0.914 . . . . 0.0 111.177 175.117 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 3' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -124.66 156.52 67.99 Favored Pre-proline 0 CA--C 1.541 0.616 0 C-N-CA 125.601 1.56 . . . . 0.0 111.093 163.885 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 4' ' ' PRO . . . . . . . . . . . . . 93.9 Cg_endo -72.72 -33.15 8.53 Favored 'Trans proline' 0 C--N 1.347 0.493 0 C-N-CA 124.001 3.134 . . . . 0.0 111.704 -174.943 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 5' ' ' GLU . . . . . . . . . . . . . 49.6 tt0 -44.51 -44.91 8.97 Favored 'General case' 0 CA--C 1.537 0.443 0 C-N-CA 124.304 1.041 . . . . 0.0 109.277 169.847 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 6' ' ' GLN . . . . . . . . . . . . . 10.6 mt-30 -70.35 4.88 2.0 Favored 'General case' 0 CA--C 1.538 0.503 0 N-CA-C 114.364 1.246 . . . . 0.0 114.364 -179.351 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 7' ' ' LEU . . . . . . . . . . . . . 19.7 mt -125.75 -48.98 1.63 Allowed 'General case' 0 C--N 1.333 -0.123 0 C-N-CA 125.712 1.605 . . . . 0.0 110.299 -174.922 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 8' ' ' GLN . . . . . . . . . . . . . 14.4 mt-30 -58.21 -2.73 0.2 Allowed 'General case' 0 CA--C 1.54 0.573 0 C-N-CA 127.395 2.278 . . . . 0.0 115.682 -171.708 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 9' ' ' HIS . . . . . . . . . . . . . 56.3 m-70 -141.15 8.07 2.03 Favored 'General case' 0 CA--C 1.537 0.461 0 C-N-CA 125.204 1.402 . . . . 0.0 112.809 173.296 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 10' ' ' HIS . . . . . . . . . . . . . 95.8 m-70 -122.6 120.17 32.97 Favored 'General case' 0 CA--C 1.529 0.152 0 CA-C-N 119.339 0.972 . . . . 0.0 109.937 -169.798 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 11' ' ' ARG . . . . . 0.464 HH21 ' CD ' ' A' ' 30' ' ' GLU . 1.2 ttt85 -81.76 150.79 27.76 Favored 'General case' 0 CA--C 1.517 -0.317 0 C-N-CA 124.049 0.94 . . . . 0.0 111.226 -179.577 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 12' ' ' PHE . . . . . 0.439 ' HB3' ' HB3' ' A' ' 110' ' ' TYR . 95.7 m-85 -139.11 159.08 43.0 Favored 'General case' 0 N--CA 1.438 -1.026 0 C-N-CA 125.829 1.652 . . . . 0.0 108.634 174.539 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 13' ' ' VAL . . . . . 0.411 ' HA ' ' HA ' ' A' ' 30' ' ' GLU . 0.0 OUTLIER -136.02 140.06 44.69 Favored 'Isoleucine or valine' 0 C--N 1.312 -1.025 0 C-N-CA 128.346 2.658 . . . . 0.0 106.391 -170.236 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild core ' A' A ' 14' ' ' LEU . . . . . . . . . . . . . 15.2 tp -77.48 77.82 4.0 Favored 'General case' 0 N--CA 1.465 0.287 0 CA-C-O 122.407 1.099 . . . . 0.0 110.376 -177.958 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 7.3 tp10 -63.79 -41.01 98.02 Favored 'General case' 0 C--N 1.324 -0.536 0 C-N-CA 127.03 2.132 . . . . 0.0 110.655 -174.241 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 2.6 p -154.78 147.55 24.39 Favored 'General case' 0 CA--C 1.535 0.365 0 N-CA-C 113.949 1.092 . . . . 0.0 113.949 167.811 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 17' ' ' VAL . . . . . . . . . . . . . 13.7 t -95.9 166.96 1.75 Allowed 'Isoleucine or valine' 0 N--CA 1.462 0.157 0 C-N-CA 125.467 1.507 . . . . 0.0 108.177 176.842 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 18' ' ' ASN . . . . . . . . . . . . . 15.0 t30 -44.8 -23.54 0.14 Allowed 'General case' 0 CA--C 1.536 0.409 0 C-N-CA 128.476 2.71 . . . . 0.0 114.857 168.846 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . -112.01 -54.88 0.48 Allowed Glycine 0 C--N 1.335 0.498 0 C-N-CA 124.256 0.932 . . . . 0.0 112.789 179.761 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -153.99 161.92 28.07 Favored Pre-proline 0 CA--C 1.533 0.3 0 C-N-CA 124.696 1.198 . . . . 0.0 108.821 -166.856 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 21' ' ' PRO . . . . . . . . . . . . . 59.4 Cg_endo -71.95 173.54 12.66 Favored 'Trans proline' 0 N--CA 1.456 -0.688 0 C-N-CA 121.772 1.648 . . . . 0.0 110.995 175.165 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 22' ' ' VAL . . . . . . . . . . . . . 3.9 t -119.9 145.38 26.25 Favored 'Isoleucine or valine' 0 C--O 1.233 0.223 0 N-CA-C 106.917 -1.512 . . . . 0.0 106.917 175.465 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 23' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -145.37 117.55 8.38 Favored 'General case' 0 C--N 1.324 -0.527 0 N-CA-C 108.112 -1.07 . . . . 0.0 108.112 172.959 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 24' ' ' SER . . . . . . . . . . . . . 70.4 p -117.2 4.24 12.65 Favored 'General case' 0 N--CA 1.462 0.169 0 O-C-N 120.971 -1.081 . . . . 0.0 112.746 175.932 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 25' ' ' ASP . . . . . . . . . . . . . 1.7 t70 62.21 -37.61 0.13 Allowed 'General case' 0 N--CA 1.475 0.791 0 C-N-CA 131.183 3.793 . . . . 0.0 114.464 -179.209 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 26' ' ' LYS . . . . . . . . . . . . . 7.0 tptp -134.98 155.45 50.73 Favored 'General case' 0 N--CA 1.438 -1.072 0 C-N-CA 128.223 2.609 . . . . 0.0 105.468 171.435 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 27' ' ' ASN . . . . . . . . . . . . . 76.6 m-20 49.13 68.07 3.88 Favored Pre-proline 0 C--N 1.325 -0.469 0 C-N-CA 126.232 1.813 . . . . 0.0 110.28 177.382 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 28' ' ' PRO . . . . . . . . . . . . . 54.7 Cg_endo -64.51 155.1 68.28 Favored 'Trans proline' 0 N--CA 1.455 -0.738 0 C-N-CA 122.559 2.172 . . . . 0.0 110.633 177.108 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 29' ' ' PRO . . . . . . . . . . . . . 30.1 Cg_endo -69.13 78.95 0.77 Allowed 'Trans proline' 0 N--CA 1.455 -0.776 0 C-N-CA 123.045 2.496 . . . . 0.0 108.841 166.155 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 30' ' ' GLU . . . . . 0.464 ' CD ' HH21 ' A' ' 11' ' ' ARG . 8.4 pt-20 -106.49 150.03 26.5 Favored 'General case' 0 C--N 1.319 -0.735 0 C-N-CA 127.66 2.384 . . . . 0.0 106.38 -178.829 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 31' ' ' ILE . . . . . . . . . . . . . 16.6 tt -132.14 144.8 36.03 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.467 0 N-CA-C 107.001 -1.481 . . . . 0.0 107.001 -173.752 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 32' ' ' SER . . . . . . . . . . . . . 65.6 p -138.5 164.69 28.76 Favored 'General case' 0 N--CA 1.447 -0.602 0 N-CA-C 107.199 -1.408 . . . . 0.0 107.199 172.71 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 33' ' ' PHE . . . . . . . . . . . . . 59.2 m-85 -125.78 163.68 22.33 Favored 'General case' 0 N--CA 1.447 -0.623 0 N-CA-C 109.018 -0.734 . . . . 0.0 109.018 176.505 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 34' ' ' GLY . . . . . . . . . . . . . . . -151.4 -171.85 19.74 Favored Glycine 0 N--CA 1.451 -0.301 0 N-CA-C 109.033 -1.627 . . . . 0.0 109.033 172.748 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 35' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -44.34 150.69 0.29 Allowed 'General case' 0 CA--C 1.531 0.24 0 C-N-CA 126.374 1.87 . . . . 0.0 111.106 -175.577 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 36' ' ' LYS . . . . . 0.433 ' HE3' ' HA ' ' A' ' 36' ' ' LYS . 0.0 OUTLIER 57.1 26.83 12.52 Favored 'General case' 0 CA--C 1.533 0.316 0 C-N-CA 124.496 1.118 . . . . 0.0 111.0 -169.486 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild core ' A' A ' 37' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER 51.6 28.66 4.85 Favored 'General case' 0 CA--C 1.542 0.658 0 C-N-CA 125.587 1.555 . . . . 0.0 111.573 -178.126 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 38' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -57.6 141.64 47.43 Favored 'General case' 0 N--CA 1.444 -0.761 0 C-N-CA 125.536 1.534 . . . . 0.0 109.633 -179.606 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 39' ' ' ILE . . . . . . . . . . . . . 18.8 mt -112.37 126.09 69.73 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.703 0 C-N-CA 126.429 1.892 . . . . 0.0 106.504 -170.099 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 40' ' ' SER . . . . . . . . . . . . . 69.4 m -135.71 135.7 40.26 Favored 'General case' 0 C--O 1.236 0.357 0 C-N-CA 124.213 1.005 . . . . 0.0 110.749 -178.964 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 41' ' ' GLY . . . . . . . . . . . . . . . 167.88 176.87 38.8 Favored Glycine 0 CA--C 1.534 1.245 0 C-N-CA 124.139 0.876 . . . . 0.0 112.225 -174.868 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 42' ' ' SER . . . . . . . . . . . . . 39.9 t -147.52 109.19 4.38 Favored 'General case' 0 N--CA 1.445 -0.725 0 C-N-CA 126.761 2.024 . . . . 0.0 107.901 169.873 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 43' ' ' MET . . . . . . . . . . . . . 11.8 mmt -62.17 -45.03 95.22 Favored 'General case' 0 C--O 1.222 -0.361 0 C-N-CA 120.603 -0.439 . . . . 0.0 110.804 164.339 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 44' ' ' CYS . . . . . 1.304 ' SG ' ' SG ' ' A' ' 70' ' ' CYS . 2.7 t -157.27 -60.87 0.09 Allowed 'General case' 0 CA--C 1.513 -0.444 0 N-CA-C 105.022 -2.214 . . . . 0.0 105.022 -172.32 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 45' ' ' ASN . . . . . . . . . . . . . 1.9 m-20 -101.34 12.85 36.69 Favored 'General case' 0 C--N 1.328 -0.328 0 C-N-CA 125.53 1.532 . . . . 0.0 114.746 -164.541 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 46' ' ' ARG . . . . . . . . . . . . . 18.1 mmm-85 61.38 152.26 0.03 OUTLIER 'General case' 0 C--O 1.218 -0.56 0 C-N-CA 128.191 2.596 . . . . 0.0 112.979 -164.512 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 47' ' ' PHE . . . . . . . . . . . . . 2.9 p90 -158.38 170.86 21.28 Favored 'General case' 0 CA--C 1.515 -0.401 0 C-N-CA 124.62 1.168 . . . . 0.0 107.919 169.639 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 48' ' ' SER . . . . . . . . . . . . . 19.4 m -160.62 163.34 32.67 Favored 'General case' 0 C--N 1.317 -0.824 0 N-CA-C 106.128 -1.804 . . . . 0.0 106.128 179.616 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 49' ' ' GLY . . . . . . . . . . . . . . . -175.91 170.07 42.9 Favored Glycine 0 N--CA 1.445 -0.755 0 CA-C-N 120.532 1.515 . . . . 0.0 110.739 155.487 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 50' ' ' GLU . . . . . . . . . . . . . 27.0 tt0 -74.17 111.68 9.57 Favored 'General case' 0 N--CA 1.441 -0.88 0 N-CA-C 107.266 -1.383 . . . . 0.0 107.266 162.79 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 51' ' ' GLY . . . . . . . . . . . . . . . -82.24 179.93 53.04 Favored Glycine 0 CA--C 1.536 1.377 0 C-N-CA 123.765 0.698 . . . . 0.0 112.927 158.317 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 52' ' ' LYS . . . . . . . . . . . . . 37.9 tttt -162.74 156.83 20.85 Favored 'General case' 0 N--CA 1.473 0.714 0 C-N-CA 126.554 1.941 . . . . 0.0 107.689 168.304 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 53' ' ' LEU . . . . . . . . . . . . . 1.2 tm? -123.89 115.47 21.35 Favored 'General case' 0 C--O 1.234 0.283 0 C-N-CA 124.143 0.977 . . . . 0.0 109.044 176.411 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 28.5 t -134.92 -54.25 0.81 Allowed 'General case' 0 CA--C 1.534 0.365 0 CA-C-O 118.429 -0.796 . . . . 0.0 111.19 175.541 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 55' ' ' ASN . . . . . . . . . . . . . 4.7 p30 -110.6 13.07 22.64 Favored 'General case' 0 N--CA 1.475 0.781 0 N-CA-C 113.55 0.944 . . . . 0.0 113.55 -178.237 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 56' ' ' GLY . . . . . . . . . . . . . . . 91.18 4.86 68.25 Favored Glycine 0 CA--C 1.528 0.887 0 C-N-CA 124.283 0.944 . . . . 0.0 111.911 -172.653 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 57' ' ' GLU . . . . . . . . . . . . . 39.5 tt0 -113.97 109.36 18.36 Favored 'General case' 0 N--CA 1.451 -0.394 0 C-N-CA 124.513 1.125 . . . . 0.0 108.672 -166.13 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 58' ' ' LEU . . . . . . . . . . . . . 35.7 tp -80.42 95.97 6.58 Favored 'General case' 0 N--CA 1.454 -0.257 0 C-N-CA 124.571 1.148 . . . . 0.0 109.074 173.609 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 59' ' ' THR . . . . . . . . . . . . . 1.2 p -95.11 146.86 24.0 Favored 'General case' 0 C--O 1.238 0.461 0 C-N-CA 123.749 0.82 . . . . 0.0 109.805 168.281 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 60' ' ' ALA . . . . . . . . . . . . . . . -68.84 170.28 9.9 Favored 'General case' 0 CA--C 1.537 0.477 0 CA-C-O 121.912 0.863 . . . . 0.0 110.955 163.931 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 61' ' ' LYS . . . . . . . . . . . . . 23.6 tttt -155.02 -9.76 0.12 Allowed 'General case' 0 CA--C 1.535 0.402 0 C-N-CA 128.191 2.596 . . . . 0.0 112.231 179.685 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 62' ' ' GLY . . . . . . . . . . . . . . . 171.03 77.34 0.04 OUTLIER Glycine 0 C--N 1.334 0.464 0 N-CA-C 106.279 -2.728 . . . . 0.0 106.279 -172.827 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 63' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -115.32 146.98 41.0 Favored 'General case' 0 N--CA 1.449 -0.512 0 C-N-CA 124.963 1.305 . . . . 0.0 109.326 -171.915 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 64' ' ' ALA . . . . . . . . . . . . . . . -120.87 167.13 12.87 Favored 'General case' 0 N--CA 1.45 -0.472 0 C-N-CA 125.025 1.33 . . . . 0.0 109.226 -175.01 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 65' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -150.85 -178.66 6.71 Favored 'General case' 0 C--O 1.238 0.456 0 C-N-CA 126.327 1.851 . . . . 0.0 107.223 171.354 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 66' ' ' THR . . . . . . . . . . . . . 4.0 p -129.83 179.53 5.79 Favored 'General case' 0 CA--C 1.538 0.515 0 CA-C-N 119.181 0.9 . . . . 0.0 110.206 164.268 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 67' ' ' ARG . . . . . . . . . . . . . 10.0 mmt85 -127.55 81.29 2.01 Favored 'General case' 0 CA--C 1.529 0.152 0 C-N-CA 125.953 1.701 . . . . 0.0 108.088 179.599 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 68' ' ' MET . . . . . . . . . . . . . 61.5 mtm -118.06 -174.4 2.64 Favored 'General case' 0 CA--C 1.538 0.501 0 C-N-CA 129.242 3.017 . . . . 0.0 109.389 170.933 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 69' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -104.69 173.1 6.45 Favored 'General case' 0 N--CA 1.465 0.284 0 C-N-CA 127.821 2.448 . . . . 0.0 108.709 168.244 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 70' ' ' CYS . . . . . 1.304 ' SG ' ' SG ' ' A' ' 44' ' ' CYS . 68.1 m -142.53 150.01 39.86 Favored 'General case' 0 C--O 1.233 0.214 0 C-N-CA 123.87 0.868 . . . . 0.0 110.265 174.854 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 71' ' ' ALA . . . . . . . . . . . . . . . -84.3 36.7 0.59 Allowed 'General case' 0 CA--C 1.538 0.489 0 C-N-CA 124.149 0.98 . . . . 0.0 111.398 179.074 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 72' ' ' ASN . . . . . . . . . . . . . 4.0 t30 -166.6 150.15 6.52 Favored Pre-proline 0 N--CA 1.465 0.324 0 C-N-CA 124.298 1.039 . . . . 0.0 108.821 159.302 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 73' ' ' PRO . . . . . . . . . . . . . 96.2 Cg_endo -84.2 -33.64 0.3 Allowed 'Trans proline' 0 N--CA 1.461 -0.424 0 C-N-CA 122.352 2.035 . . . . 0.0 113.288 -171.128 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 74' ' ' GLN . . . . . . . . . . . . . 43.2 tt0 -60.88 -37.4 82.06 Favored 'General case' 0 N--CA 1.465 0.317 0 O-C-N 121.671 -0.643 . . . . 0.0 111.541 -175.644 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 75' ' ' LEU . . . . . . . . . . . . . 50.2 mt -53.58 -43.61 68.67 Favored 'General case' 0 CA--C 1.535 0.382 0 C-N-CA 124.968 1.307 . . . . 0.0 108.678 173.186 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 76' ' ' ASN . . . . . . . . . . . . . 0.7 OUTLIER -77.85 5.07 10.33 Favored 'General case' 0 N--CA 1.47 0.528 0 C-N-CA 128.137 2.575 . . . . 0.0 112.4 -174.518 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 77' ' ' GLU . . . . . . . . . . . . . 0.2 OUTLIER -101.72 -46.02 5.06 Favored 'General case' 0 CA--C 1.535 0.394 0 C-N-CA 126.754 2.021 . . . . 0.0 107.79 168.901 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 78' ' ' LEU . . . . . . . . . . . . . 15.3 mt -65.41 -29.03 69.68 Favored 'General case' 0 CA--C 1.53 0.202 0 C-N-CA 124.977 1.311 . . . . 0.0 111.284 176.937 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 79' ' ' ASP . . . . . . . . . . . . . 0.0 OUTLIER -61.56 -6.48 2.47 Favored 'General case' 0 N--CA 1.469 0.498 0 C-N-CA 126.463 1.905 . . . . 0.0 114.467 168.835 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 80' ' ' ASN . . . . . . . . . . . . . 85.6 m-20 -106.95 -40.31 5.5 Favored 'General case' 0 CA--C 1.531 0.242 0 C-N-CA 124.614 1.166 . . . . 0.0 111.223 164.345 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 81' ' ' THR . . . . . . . . . . . . . 6.9 m -55.43 -65.02 0.66 Allowed 'General case' 0 C--N 1.347 0.493 0 CA-C-N 119.997 1.271 . . . . 0.0 111.524 -176.689 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 82' ' ' ILE . . . . . 0.501 HG13 HD12 ' A' ' 86' ' ' LEU . 9.4 tp -60.43 -37.08 73.36 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.297 0 CA-C-N 119.324 0.965 . . . . 0.0 110.345 -168.455 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 83' ' ' SER . . . . . . . . . . . . . 4.4 m -58.17 -46.82 85.05 Favored 'General case' 0 N--CA 1.446 -0.64 0 C-N-CA 124.891 1.276 . . . . 0.0 110.156 -178.857 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 84' ' ' GLU . . . . . . . . . . . . . 29.3 tt0 -76.8 -41.27 45.14 Favored 'General case' 0 N--CA 1.445 -0.704 0 C-N-CA 126.023 1.729 . . . . 0.0 110.368 -176.781 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 85' ' ' MET . . . . . . . . . . . . . 6.3 ptm -66.74 -40.28 88.27 Favored 'General case' 0 CA--C 1.516 -0.357 0 C-N-CA 123.923 0.889 . . . . 0.0 108.614 -176.59 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 86' ' ' LEU . . . . . 0.501 HD12 HG13 ' A' ' 82' ' ' ILE . 0.3 OUTLIER -71.32 -31.54 67.52 Favored 'General case' 0 N--CA 1.447 -0.577 0 C-N-CA 118.292 -1.363 . . . . 0.0 111.696 -171.138 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild core ' A' A ' 87' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -55.92 -49.89 72.23 Favored 'General case' 0 N--CA 1.45 -0.468 0 N-CA-C 107.859 -1.163 . . . . 0.0 107.859 177.953 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 88' ' ' GLU . . . . . . . . . . . . . 28.0 mt-10 -69.12 -26.58 64.97 Favored 'General case' 0 N--CA 1.445 -0.699 0 CA-C-O 117.235 -1.364 . . . . 0.0 112.544 174.978 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 89' ' ' GLY . . . . . . . . . . . . . . . 94.25 104.23 1.81 Allowed Glycine 0 CA--C 1.499 -0.935 0 CA-C-N 120.474 1.488 . . . . 0.0 109.395 -171.865 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 90' ' ' ALA . . . . . . . . . . . . . . . -80.22 136.04 36.38 Favored 'General case' 0 N--CA 1.445 -0.724 0 N-CA-C 108.668 -0.864 . . . . 0.0 108.668 173.346 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 91' ' ' GLN . . . . . . . . . . . . . 86.3 mm-40 -65.89 138.54 57.93 Favored 'General case' 0 N--CA 1.448 -0.57 0 N-CA-C 106.205 -1.776 . . . . 0.0 106.205 163.558 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 92' ' ' VAL . . . . . . . . . . . . . 76.1 t -131.62 119.8 43.42 Favored 'Isoleucine or valine' 0 N--CA 1.445 -0.692 0 N-CA-C 105.746 -1.946 . . . . 0.0 105.746 -178.975 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 93' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -136.62 94.67 3.02 Favored 'General case' 0 N--CA 1.446 -0.629 0 CA-C-O 122.62 1.2 . . . . 0.0 108.796 170.589 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 94' ' ' LEU . . . . . 0.426 ' HB3' HG23 ' A' ' 2' ' ' VAL . 0.4 OUTLIER -65.93 108.73 2.27 Favored 'General case' 0 N--CA 1.446 -0.656 0 N-CA-C 106.661 -1.607 . . . . 0.0 106.661 165.85 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild core ' A' A ' 95' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -71.21 -178.32 2.0 Allowed 'General case' 0 C--N 1.317 -0.811 0 C-N-CA 126.286 1.834 . . . . 0.0 106.862 168.987 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 96' ' ' ALA . . . . . . . . . . . . . . . -44.93 -34.22 2.31 Favored 'General case' 0 CA--C 1.542 0.668 0 N-CA-C 114.328 1.233 . . . . 0.0 114.328 -179.432 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 97' ' ' ASN . . . . . . . . . . . . . 14.2 p30 -152.02 22.43 0.67 Allowed 'General case' 0 N--CA 1.47 0.547 0 N-CA-C 114.459 1.281 . . . . 0.0 114.459 170.788 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 98' ' ' GLN . . . . . . . . . . . . . 1.5 tt0 -141.3 119.27 11.92 Favored 'General case' 0 N--CA 1.465 0.323 0 O-C-N 120.716 -1.24 . . . . 0.0 111.192 -175.56 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 99' ' ' LEU . . . . . 0.439 ' HB3' ' HB2' ' A' ' 110' ' ' TYR . 8.5 tp -70.85 107.29 3.95 Favored 'General case' 0 C--O 1.237 0.408 0 C-N-CA 126.957 2.103 . . . . 0.0 108.489 177.675 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 100' ' ' THR . . . . . . . . . . . . . 3.2 m -88.37 117.29 27.19 Favored 'General case' 0 C--N 1.327 -0.371 0 N-CA-C 106.0 -1.852 . . . . 0.0 106.0 172.778 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 101' ' ' LEU . . . . . . . . . . . . . 1.1 mm? -110.09 147.67 33.19 Favored 'General case' 0 CA--C 1.515 -0.367 0 N-CA-C 108.822 -0.807 . . . . 0.0 108.822 171.424 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 102' ' ' ALA . . . . . . . . . . . . . . . -149.09 161.27 42.29 Favored 'General case' 0 CA--C 1.53 0.209 0 C-N-CA 124.023 0.929 . . . . 0.0 109.654 166.289 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 103' ' ' THR . . . . . . . . . . . . . 1.6 p -147.7 177.19 9.49 Favored 'General case' 0 C--N 1.327 -0.385 0 C-N-CA 127.76 2.424 . . . . 0.0 107.358 159.682 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 104' ' ' ALA . . . . . . . . . . . . . . . -56.11 -25.04 44.18 Favored 'General case' 0 CA--C 1.534 0.334 0 CA-C-O 118.796 -0.621 . . . . 0.0 112.532 162.258 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 105' ' ' LYS . . . . . . . . . . . . . 24.5 mmtt -71.3 -82.41 0.04 OUTLIER 'General case' 0 N--CA 1.456 -0.141 0 C-N-CA 123.476 0.71 . . . . 0.0 109.392 170.835 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 106' ' ' GLN . . . . . . . . . . . . . 14.7 pt20 -156.29 176.6 12.47 Favored 'General case' 0 C--O 1.236 0.358 0 CA-C-O 121.401 0.619 . . . . 0.0 112.635 -171.057 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 107' ' ' THR . . . . . . . . . . . . . 0.8 OUTLIER -120.78 134.99 55.27 Favored 'General case' 0 C--O 1.232 0.172 0 C-N-CA 127.775 2.43 . . . . 0.0 108.848 -168.288 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 108' ' ' LEU . . . . . . . . . . . . . 2.4 mm? -117.29 151.22 37.41 Favored 'General case' 0 C--O 1.236 0.383 0 N-CA-C 107.843 -1.169 . . . . 0.0 107.843 176.904 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 109' ' ' THR . . . . . . . . . . . . . 0.1 OUTLIER -119.29 107.48 13.45 Favored 'General case' 0 C--N 1.324 -0.503 0 N-CA-C 103.564 -2.754 . . . . 0.0 103.564 179.614 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 110' ' ' TYR . . . . . 0.439 ' HB2' ' HB3' ' A' ' 99' ' ' LEU . 67.1 m-85 -110.77 134.05 52.82 Favored 'General case' 0 N--CA 1.447 -0.611 0 N-CA-C 108.645 -0.872 . . . . 0.0 108.645 173.555 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 111' ' ' LYS . . . . . . . . . . . . . 2.5 tmtt? -94.21 142.63 27.18 Favored 'General case' 0 C--N 1.322 -0.628 0 N-CA-C 108.246 -1.02 . . . . 0.0 108.246 -178.387 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 112' ' ' LEU . . . . . . . . . . . . . 56.8 tp -66.27 105.74 1.5 Allowed 'General case' 0 C--N 1.329 -0.31 0 N-CA-C 107.547 -1.279 . . . . 0.0 107.547 169.064 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 113' ' ' ALA . . . . . . . . . . . . . . . -137.72 98.38 3.66 Favored 'General case' 0 CA--C 1.516 -0.353 0 N-CA-C 107.038 -1.467 . . . . 0.0 107.038 177.846 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 114' ' ' ASP . . . . . . . . . . . . . 30.9 t0 . . . . . 0 C--N 1.325 -0.494 0 CA-C-O 123.67 1.7 . . . . 0.0 111.244 -169.115 . . . . . . . . 0 0 . 1 . 013 nuclear nobuild core ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 18.9 ttt . . . . . 0 C--O 1.236 0.385 0 N-CA-C 109.311 -0.626 . . . . 0.0 109.311 . . . . . . . . . 0 0 . 1 . 013 nuclear nobuild core ' A' A ' 2' ' ' VAL . . . . . . . . . . . . . 7.5 p -55.12 129.51 16.48 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.439 0 N-CA-C 109.397 -0.594 . . . . 0.0 109.397 175.78 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 3' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -122.64 159.93 50.93 Favored Pre-proline 0 N--CA 1.449 -0.487 0 N-CA-C 109.867 -0.42 . . . . 0.0 109.867 -179.164 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 4' ' ' PRO . . . . . . . . . . . . . 36.6 Cg_endo -70.67 -37.03 7.47 Favored 'Trans proline' 0 N--CA 1.464 -0.262 0 C-N-CA 122.472 2.115 . . . . 0.0 112.799 -173.757 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 5' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -57.84 -54.17 49.97 Favored 'General case' 0 C--N 1.328 -0.365 0 C-N-CA 125.788 1.635 . . . . 0.0 109.67 -179.289 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 6' ' ' GLN . . . . . . . . . . . . . 12.6 pt20 -67.02 25.34 0.02 OUTLIER 'General case' 0 CA--C 1.545 0.772 0 C-N-CA 126.24 1.816 . . . . 0.0 114.779 177.917 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 7' ' ' LEU . . . . . . . . . . . . . 97.4 mt -141.74 -49.41 0.39 Allowed 'General case' 0 N--CA 1.451 -0.398 0 C-N-CA 127.249 2.219 . . . . 0.0 108.869 -177.761 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 8' ' ' GLN . . . . . . . . . . . . . 0.1 OUTLIER -46.94 -6.3 0.01 OUTLIER 'General case' 0 N--CA 1.471 0.623 0 C-N-CA 130.119 3.367 . . . . 0.0 118.215 -177.914 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 9' ' ' HIS . . . . . . . . . . . . . 32.0 p80 -145.77 10.84 1.22 Allowed 'General case' 0 C--N 1.325 -0.463 0 CA-C-N 119.641 1.109 . . . . 0.0 112.972 174.798 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 10' ' ' HIS . . . . . . . . . . . . . 32.0 m-70 -100.69 163.96 12.09 Favored 'General case' 0 C--O 1.238 0.489 0 C-N-CA 123.711 0.804 . . . . 0.0 109.733 -176.631 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 11' ' ' ARG . . . . . 0.407 HH21 ' CD ' ' A' ' 30' ' ' GLU . 4.4 ttt85 -126.96 145.69 50.6 Favored 'General case' 0 CA--C 1.514 -0.407 0 C-N-CA 125.456 1.502 . . . . 0.0 107.811 173.184 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 12' ' ' PHE . . . . . . . . . . . . . 42.4 m-85 -136.21 148.13 47.96 Favored 'General case' 0 N--CA 1.445 -0.724 0 N-CA-C 105.717 -1.957 . . . . 0.0 105.717 179.478 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 13' ' ' VAL . . . . . . . . . . . . . 2.5 t -122.2 148.99 25.55 Favored 'Isoleucine or valine' 0 C--O 1.24 0.583 0 C-N-CA 125.413 1.485 . . . . 0.0 108.492 178.981 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 14' ' ' LEU . . . . . . . . . . . . . 7.5 tp -77.37 80.74 3.86 Favored 'General case' 0 N--CA 1.447 -0.596 0 O-C-N 124.418 1.074 . . . . 0.0 109.835 -178.471 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -61.08 -34.97 75.77 Favored 'General case' 0 CA--C 1.534 0.341 0 C-N-CA 123.969 0.908 . . . . 0.0 110.047 -179.961 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 3.2 m -165.83 143.69 5.71 Favored 'General case' 0 CA--C 1.535 0.373 0 O-C-N 121.35 -0.844 . . . . 0.0 111.717 176.368 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 17' ' ' VAL . . . . . . . . . . . . . 2.8 t -97.31 161.13 2.86 Favored 'Isoleucine or valine' 0 CA--C 1.542 0.644 0 C-N-CA 126.396 1.878 . . . . 0.0 108.25 -177.371 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 18' ' ' ASN . . . . . . . . . . . . . 19.9 t30 -51.85 -32.12 30.67 Favored 'General case' 0 N--CA 1.473 0.692 0 C-N-CA 123.438 0.695 . . . . 0.0 112.416 167.4 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . -78.66 -54.48 4.23 Favored Glycine 0 N--CA 1.445 -0.736 0 CA-C-O 119.039 -0.867 . . . . 0.0 111.842 -178.36 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 8.5 mtmt -168.87 166.35 6.49 Favored Pre-proline 0 N--CA 1.466 0.331 0 C-N-CA 126.709 2.003 . . . . 0.0 110.444 -168.703 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 21' ' ' PRO . . . . . . . . . . . . . 36.3 Cg_endo -58.29 161.93 12.98 Favored 'Trans proline' 0 N--CA 1.457 -0.648 0 C-N-CA 121.57 1.514 . . . . 0.0 111.151 163.572 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 22' ' ' VAL . . . . . . . . . . . . . 11.6 p -141.7 127.9 19.25 Favored 'Isoleucine or valine' 0 CA--C 1.529 0.162 0 C-N-CA 124.014 0.926 . . . . 0.0 108.677 175.267 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 23' ' ' THR . . . . . . . . . . . . . 0.6 OUTLIER -136.41 130.94 33.47 Favored 'General case' 0 N--CA 1.451 -0.377 0 N-CA-C 106.678 -1.601 . . . . 0.0 106.678 171.842 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 24' ' ' SER . . . . . . . . . . . . . 0.5 OUTLIER -126.74 67.59 1.25 Allowed 'General case' 0 N--CA 1.453 -0.315 0 N-CA-C 106.886 -1.524 . . . . 0.0 106.886 178.673 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 25' ' ' ASP . . . . . . . . . . . . . 2.0 t70 65.38 -70.69 0.09 Allowed 'General case' 0 C--O 1.233 0.2 0 C-N-CA 128.772 2.829 . . . . 0.0 113.878 173.003 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 26' ' ' LYS . . . . . . . . . . . . . 16.1 ttmt -145.88 -7.86 0.56 Allowed 'General case' 0 CA--C 1.531 0.217 0 C-N-CA 126.414 1.886 . . . . 0.0 111.928 175.07 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 27' ' ' ASN . . . . . . . . . . . . . 80.0 m-20 -124.18 73.33 57.64 Favored Pre-proline 0 C--O 1.232 0.135 0 C-N-CA 124.607 1.163 . . . . 0.0 108.424 -174.303 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 28' ' ' PRO . . . . . . . . . . . . . 55.5 Cg_endo -69.72 173.21 11.27 Favored 'Trans proline' 0 N--CA 1.457 -0.645 0 C-N-CA 123.259 2.639 . . . . 0.0 112.728 179.115 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 29' ' ' PRO . . . . . . . . . . . . . 34.8 Cg_endo -65.7 64.83 0.4 Allowed 'Trans proline' 0 CA--C 1.537 0.637 0 C-N-CA 125.145 3.897 . . . . 0.0 112.301 166.517 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 30' ' ' GLU . . . . . 0.407 ' CD ' HH21 ' A' ' 11' ' ' ARG . 4.5 pt-20 -79.99 169.68 17.52 Favored 'General case' 0 CA--C 1.538 0.489 0 O-C-N 120.592 -1.318 . . . . 0.0 110.218 175.203 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 31' ' ' ILE . . . . . . . . . . . . . 9.1 tt -145.48 143.5 21.84 Favored 'Isoleucine or valine' 0 C--O 1.238 0.45 0 N-CA-C 106.676 -1.602 . . . . 0.0 106.676 -179.058 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 32' ' ' SER . . . . . . . . . . . . . 80.4 p -140.08 150.5 44.41 Favored 'General case' 0 C--O 1.236 0.368 0 N-CA-C 108.762 -0.829 . . . . 0.0 108.762 174.139 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 33' ' ' PHE . . . . . . . . . . . . . 9.0 m-30 -127.66 133.11 49.63 Favored 'General case' 0 CA--C 1.535 0.385 0 C-N-CA 127.063 2.145 . . . . 0.0 105.237 -169.669 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 34' ' ' GLY . . . . . . . . . . . . . . . -112.43 -166.74 17.34 Favored Glycine 0 N--CA 1.471 0.999 0 C-N-CA 124.761 1.172 . . . . 0.0 111.642 -179.371 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 35' ' ' GLU . . . . . . . . . . . . . 16.8 tt0 -69.93 32.67 0.04 OUTLIER 'General case' 0 CA--C 1.546 0.823 0 C-N-CA 127.931 2.492 . . . . 0.0 116.143 -164.802 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 1.1 mmtm -157.16 10.98 0.21 Allowed 'General case' 0 N--CA 1.44 -0.959 0 C-N-CA 127.919 2.488 . . . . 0.0 116.609 -166.209 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 37' ' ' MET . . . . . . . . . . . . . 41.1 mmm 53.66 21.02 2.4 Favored 'General case' 0 CA--C 1.555 1.153 0 CA-C-N 120.129 1.332 . . . . 0.0 112.106 -161.576 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 38' ' ' MET . . . . . . . . . . . . . 11.0 mmm -69.76 165.6 21.05 Favored 'General case' 0 C--O 1.227 -0.127 0 O-C-N 120.178 -1.576 . . . . 0.0 110.979 177.765 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 39' ' ' ILE . . . . . . . . . . . . . 58.5 mt -137.27 138.03 45.66 Favored 'Isoleucine or valine' 0 C--O 1.237 0.411 0 O-C-N 121.85 -0.531 . . . . 0.0 109.749 -176.401 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 40' ' ' SER . . . . . . . . . . . . . 9.3 p -143.85 118.52 9.81 Favored 'General case' 0 CA--C 1.539 0.55 0 C-N-CA 125.194 1.398 . . . . 0.0 109.465 171.728 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 41' ' ' GLY . . . . . . . . . . . . . . . -157.48 -173.93 26.53 Favored Glycine 0 CA--C 1.533 1.187 0 C-N-CA 125.169 1.366 . . . . 0.0 111.138 178.114 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 42' ' ' SER . . . . . . . . . . . . . 74.0 p -157.39 94.2 1.36 Allowed 'General case' 0 C--O 1.223 -0.297 0 C-N-CA 124.208 1.003 . . . . 0.0 110.311 178.754 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 43' ' ' MET . . . . . . . . . . . . . 2.2 mmt -67.01 -40.98 87.4 Favored 'General case' 0 CA--C 1.534 0.331 0 CA-C-O 120.978 0.418 . . . . 0.0 110.868 176.622 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 44' ' ' CYS . . . . . 1.285 ' SG ' ' SG ' ' A' ' 70' ' ' CYS . 33.1 t -151.12 -63.24 0.19 Allowed 'General case' 0 N--CA 1.448 -0.554 0 N-CA-C 104.808 -2.293 . . . . 0.0 104.808 158.457 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 45' ' ' ASN . . . . . . . . . . . . . 71.4 m-20 -83.67 30.0 0.51 Allowed 'General case' 0 CA--C 1.528 0.134 0 C-N-CA 126.47 1.908 . . . . 0.0 114.328 -168.798 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 46' ' ' ARG . . . . . . . . . . . . . 61.7 mtt180 59.25 167.56 0.06 Allowed 'General case' 0 N--CA 1.472 0.649 0 C-N-CA 126.117 1.767 . . . . 0.0 110.965 -171.668 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 47' ' ' PHE . . . . . . . . . . . . . 34.8 p90 -159.31 167.2 29.49 Favored 'General case' 0 C--O 1.239 0.55 0 N-CA-C 108.506 -0.924 . . . . 0.0 108.506 154.122 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 48' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -162.1 137.03 7.07 Favored 'General case' 0 C--O 1.238 0.48 0 N-CA-C 108.352 -0.981 . . . . 0.0 108.352 177.529 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 49' ' ' GLY . . . . . . . . . . . . . . . -170.9 162.48 35.43 Favored Glycine 0 C--N 1.339 0.703 0 N-CA-C 110.209 -1.157 . . . . 0.0 110.209 172.152 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 50' ' ' GLU . . . . . . . . . . . . . 40.3 mt-10 -74.13 101.33 3.9 Favored 'General case' 0 C--O 1.237 0.407 0 C-N-CA 124.323 1.049 . . . . 0.0 108.442 170.258 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 51' ' ' GLY . . . . . . . . . . . . . . . -68.63 -179.46 19.4 Favored Glycine 0 CA--C 1.535 1.341 0 C-N-CA 123.542 0.592 . . . . 0.0 112.561 164.269 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 52' ' ' LYS . . . . . . . . . . . . . 13.9 ttmt -156.0 161.26 40.5 Favored 'General case' 0 CA--C 1.535 0.373 0 C-N-CA 126.373 1.869 . . . . 0.0 108.835 176.257 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 53' ' ' LEU . . . . . 0.406 HD13 ' N ' ' A' ' 54' ' ' SER . 1.2 tm? -146.67 129.59 16.32 Favored 'General case' 0 CA--C 1.519 -0.214 0 N-CA-C 105.597 -2.001 . . . . 0.0 105.597 174.162 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 54' ' ' SER . . . . . 0.406 ' N ' HD13 ' A' ' 53' ' ' LEU . 2.2 t -152.25 -33.84 0.13 Allowed 'General case' 0 CA--C 1.536 0.426 0 CA-C-N 117.642 0.201 . . . . 0.0 111.258 162.9 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 55' ' ' ASN . . . . . . . . . . . . . 20.0 p-10 -131.33 31.15 4.4 Favored 'General case' 0 CA--C 1.534 0.36 0 C-N-CA 128.052 2.541 . . . . 0.0 111.2 -164.761 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 56' ' ' GLY . . . . . . . . . . . . . . . 60.56 31.65 75.51 Favored Glycine 0 CA--C 1.532 1.1 0 O-C-N 121.591 -0.693 . . . . 0.0 111.645 -176.72 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 57' ' ' GLU . . . . . . . . . . . . . 33.5 tt0 -134.15 139.6 45.98 Favored 'General case' 0 C--O 1.237 0.426 0 N-CA-C 107.631 -1.248 . . . . 0.0 107.631 177.528 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 58' ' ' LEU . . . . . . . . . . . . . 56.6 tp -120.59 95.92 4.92 Favored 'General case' 0 CA--C 1.534 0.349 0 C-N-CA 127.806 2.442 . . . . 0.0 108.843 -176.198 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 59' ' ' THR . . . . . . . . . . . . . 15.6 p -98.48 137.61 36.91 Favored 'General case' 0 C--O 1.237 0.434 0 C-N-CA 124.982 1.313 . . . . 0.0 110.671 174.719 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 60' ' ' ALA . . . . . . . . . . . . . . . -123.32 85.46 2.42 Favored 'General case' 0 CA--C 1.536 0.411 0 C-N-CA 125.145 1.378 . . . . 0.0 111.476 171.888 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 61' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -53.19 -15.45 0.91 Allowed 'General case' 0 N--CA 1.455 -0.189 0 C-N-CA 128.82 2.848 . . . . 0.0 117.151 -178.903 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 62' ' ' GLY . . . . . . . . . . . . . . . -148.8 45.66 0.7 Allowed Glycine 0 CA--C 1.52 0.392 0 C-N-CA 124.734 1.159 . . . . 0.0 110.985 -174.379 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 63' ' ' LEU . . . . . . . . . . . . . 9.3 tp -55.91 139.82 44.85 Favored 'General case' 0 N--CA 1.446 -0.649 0 N-CA-C 108.831 -0.803 . . . . 0.0 108.831 168.171 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 64' ' ' ALA . . . . . . . . . . . . . . . -127.13 162.02 27.1 Favored 'General case' 0 C--N 1.327 -0.373 0 N-CA-C 108.17 -1.048 . . . . 0.0 108.17 166.35 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 65' ' ' MET . . . . . . . . . . . . . 0.1 OUTLIER -150.5 177.09 10.34 Favored 'General case' 0 CA--C 1.538 0.507 0 C-N-CA 126.468 1.907 . . . . 0.0 108.591 -175.571 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 66' ' ' THR . . . . . . . . . . . . . 25.4 p -118.0 -178.21 3.45 Favored 'General case' 0 N--CA 1.469 0.524 0 C-N-CA 125.141 1.376 . . . . 0.0 111.12 -178.401 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 67' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -126.2 87.27 2.65 Favored 'General case' 0 C--O 1.236 0.353 0 C-N-CA 123.858 0.863 . . . . 0.0 110.477 172.955 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 68' ' ' MET . . . . . . . . . . . . . 37.0 mtm -132.16 -166.13 1.69 Allowed 'General case' 0 CA--C 1.537 0.471 0 C-N-CA 128.161 2.584 . . . . 0.0 108.534 174.424 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 69' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -145.57 173.95 11.6 Favored 'General case' 0 CA--C 1.539 0.531 0 C-N-CA 125.183 1.393 . . . . 0.0 109.645 174.692 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 70' ' ' CYS . . . . . 1.285 ' SG ' ' SG ' ' A' ' 44' ' ' CYS . 73.0 m -130.48 14.08 5.5 Favored 'General case' 0 C--O 1.234 0.284 0 N-CA-C 114.174 1.176 . . . . 0.0 114.174 -172.707 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 71' ' ' ALA . . . . . . . . . . . . . . . 60.8 10.4 2.68 Favored 'General case' 0 CA--C 1.534 0.338 0 C-N-CA 124.943 1.297 . . . . 0.0 113.271 178.419 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 72' ' ' ASN . . . . . . . . . . . . . 0.2 OUTLIER -133.46 164.96 40.25 Favored Pre-proline 0 CA--C 1.547 0.828 0 C-N-CA 125.213 1.405 . . . . 0.0 107.26 168.667 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 73' ' ' PRO . . . . . . . . . . . . . 60.7 Cg_endo -82.25 -45.91 0.07 OUTLIER 'Trans proline' 0 N--CA 1.46 -0.454 0 C-N-CA 123.71 2.94 . . . . 0.0 111.917 175.157 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 74' ' ' GLN . . . . . . . . . . . . . 58.7 tt0 -47.95 -53.93 14.43 Favored 'General case' 0 C--O 1.223 -0.29 0 C-N-CA 126.394 1.878 . . . . 0.0 110.615 -171.55 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 75' ' ' LEU . . . . . . . . . . . . . 55.0 mt -60.28 -37.18 79.67 Favored 'General case' 0 CA--C 1.535 0.403 0 C-N-CA 125.764 1.626 . . . . 0.0 110.875 -178.567 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 76' ' ' ASN . . . . . . . . . . . . . 1.7 t-20 -73.03 -4.68 33.95 Favored 'General case' 0 N--CA 1.469 0.483 0 C-N-CA 126.198 1.799 . . . . 0.0 111.938 177.926 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 77' ' ' GLU . . . . . . . . . . . . . 1.0 OUTLIER -113.65 -24.4 9.22 Favored 'General case' 0 CA--C 1.535 0.394 0 C-N-CA 125.265 1.426 . . . . 0.0 110.439 170.609 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 78' ' ' LEU . . . . . . . . . . . . . 6.2 mp -63.99 -36.66 84.7 Favored 'General case' 0 N--CA 1.464 0.253 0 O-C-N 120.842 -1.161 . . . . 0.0 109.861 170.453 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 79' ' ' ASP . . . . . . . . . . . . . 0.0 OUTLIER -56.95 -32.69 66.27 Favored 'General case' 0 CA--C 1.53 0.182 0 C-N-CA 123.816 0.846 . . . . 0.0 111.38 173.958 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 80' ' ' ASN . . . . . . . . . . . . . 12.2 m-20 -91.22 -28.57 17.73 Favored 'General case' 0 N--CA 1.452 -0.356 0 C-N-CA 123.017 0.527 . . . . 0.0 110.529 178.558 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 81' ' ' THR . . . . . . . . . . . . . 29.7 m -54.02 -65.14 0.62 Allowed 'General case' 0 CA--C 1.534 0.348 0 C-N-CA 124.926 1.29 . . . . 0.0 108.7 171.27 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 82' ' ' ILE . . . . . . . . . . . . . 10.4 tp -64.18 -35.1 72.8 Favored 'Isoleucine or valine' 0 C--O 1.234 0.284 0 O-C-N 121.84 -0.537 . . . . 0.0 111.011 -171.539 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 83' ' ' SER . . . . . . . . . . . . . 8.6 m -64.3 -40.92 96.92 Favored 'General case' 0 N--CA 1.443 -0.804 0 CA-C-O 118.305 -0.855 . . . . 0.0 111.983 -170.605 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 84' ' ' GLU . . . . . 0.48 ' OE1' ' HE2' ' A' ' 105' ' ' LYS . 4.6 mt-10 -77.86 -39.5 43.15 Favored 'General case' 0 N--CA 1.45 -0.432 0 CA-C-O 118.497 -0.763 . . . . 0.0 110.963 175.421 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 85' ' ' MET . . . . . . . . . . . . . 96.0 mtp -57.88 -49.15 77.68 Favored 'General case' 0 N--CA 1.463 0.201 0 CA-C-O 121.919 0.866 . . . . 0.0 108.725 -173.147 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 86' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -71.7 -25.49 62.11 Favored 'General case' 0 N--CA 1.453 -0.32 0 C-N-CA 123.714 0.806 . . . . 0.0 112.861 -177.197 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 87' ' ' LYS . . . . . . . . . . . . . 6.5 tptm -73.81 -49.74 23.84 Favored 'General case' 0 CA--C 1.516 -0.328 0 N-CA-C 108.338 -0.986 . . . . 0.0 108.338 -178.292 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 88' ' ' GLU . . . . . . . . . . . . . 5.6 mm-40 -69.83 -38.86 76.66 Favored 'General case' 0 N--CA 1.447 -0.616 0 O-C-N 124.449 1.093 . . . . 0.0 110.254 -177.177 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 89' ' ' GLY . . . . . . . . . . . . . . . 126.09 92.27 0.85 Allowed Glycine 0 C--N 1.339 0.695 0 N-CA-C 109.125 -1.59 . . . . 0.0 109.125 -179.594 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 90' ' ' ALA . . . . . . . . . . . . . . . -69.66 136.38 51.05 Favored 'General case' 0 N--CA 1.452 -0.341 0 N-CA-C 106.983 -1.488 . . . . 0.0 106.983 178.388 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 91' ' ' GLN . . . . . . . . . . . . . 4.9 mp0 -68.78 136.43 52.76 Favored 'General case' 0 N--CA 1.442 -0.845 0 N-CA-C 104.385 -2.45 . . . . 0.0 104.385 167.617 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 92' ' ' VAL . . . . . . . . . . . . . 4.0 p -127.47 122.58 59.74 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.392 0 N-CA-C 105.88 -1.896 . . . . 0.0 105.88 -177.27 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 93' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -139.23 92.4 2.59 Favored 'General case' 0 C--N 1.33 -0.277 0 N-CA-C 108.475 -0.935 . . . . 0.0 108.475 178.914 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 94' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -89.54 107.37 19.04 Favored 'General case' 0 C--N 1.333 -0.14 0 N-CA-C 106.809 -1.552 . . . . 0.0 106.809 174.125 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 95' ' ' THR . . . . . . . . . . . . . 13.4 t -67.8 -163.22 0.03 OUTLIER 'General case' 0 CA--C 1.536 0.424 0 C-N-CA 125.822 1.649 . . . . 0.0 108.767 169.588 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 96' ' ' ALA . . . . . . . . . . . . . . . -44.62 -40.95 6.21 Favored 'General case' 0 CA--C 1.544 0.714 0 O-C-N 120.288 -1.507 . . . . 0.0 112.421 178.929 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 97' ' ' ASN . . . . . . . . . . . . . 9.9 p30 -157.12 4.02 0.14 Allowed 'General case' 0 CA--C 1.541 0.619 0 N-CA-C 114.839 1.422 . . . . 0.0 114.839 -170.135 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 98' ' ' GLN . . . . . . . . . . . . . 8.5 tt0 -126.96 129.89 49.02 Favored 'General case' 0 N--CA 1.464 0.257 0 CA-C-N 120.361 1.437 . . . . 0.0 109.649 -176.809 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 99' ' ' LEU . . . . . 0.439 ' HB3' ' HB2' ' A' ' 110' ' ' TYR . 9.9 tp -81.32 133.56 35.45 Favored 'General case' 0 N--CA 1.449 -0.482 0 C-N-CA 123.864 0.866 . . . . 0.0 109.275 175.584 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 100' ' ' THR . . . . . . . . . . . . . 1.1 m -115.13 128.15 56.02 Favored 'General case' 0 C--N 1.323 -0.575 0 N-CA-C 105.223 -2.14 . . . . 0.0 105.223 171.247 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 101' ' ' LEU . . . . . . . . . . . . . 8.5 mp -112.74 163.96 13.95 Favored 'General case' 0 CA--C 1.512 -0.49 0 N-CA-C 110.073 -0.343 . . . . 0.0 110.073 163.311 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 102' ' ' ALA . . . . . . . . . . . . . . . -151.81 160.68 43.48 Favored 'General case' 0 C--N 1.325 -0.488 0 C-N-CA 126.764 2.026 . . . . 0.0 106.187 158.418 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 103' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -165.84 178.63 6.4 Favored 'General case' 0 N--CA 1.444 -0.73 0 C-N-CA 129.17 2.988 . . . . 0.0 106.208 164.134 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 104' ' ' ALA . . . . . . . . . . . . . . . -46.86 -45.06 20.06 Favored 'General case' 0 CA--C 1.533 0.292 0 O-C-N 121.417 -0.802 . . . . 0.0 111.089 169.511 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 105' ' ' LYS . . . . . 0.48 ' HE2' ' OE1' ' A' ' 84' ' ' GLU . 22.0 mttm -58.04 -74.32 0.06 Allowed 'General case' 0 C--N 1.343 0.284 0 N-CA-C 112.202 0.445 . . . . 0.0 112.202 179.955 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 106' ' ' GLN . . . . . . . . . . . . . 8.8 pt20 -163.0 -174.46 3.89 Favored 'General case' 0 C--N 1.33 -0.274 0 C-N-CA 123.247 0.619 . . . . 0.0 109.743 -173.368 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 107' ' ' THR . . . . . . . . . . . . . 2.1 t -105.51 166.2 10.6 Favored 'General case' 0 CA--C 1.539 0.55 0 C-N-CA 125.6 1.56 . . . . 0.0 107.924 168.746 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 108' ' ' LEU . . . . . . . . . . . . . 76.6 mt -139.92 150.43 44.55 Favored 'General case' 0 C--O 1.237 0.436 0 C-N-CA 126.556 1.942 . . . . 0.0 106.517 169.425 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 109' ' ' THR . . . . . . . . . . . . . 4.9 m -123.48 108.47 12.7 Favored 'General case' 0 C--O 1.238 0.497 0 N-CA-C 107.92 -1.141 . . . . 0.0 107.92 176.152 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 110' ' ' TYR . . . . . 0.439 ' HB2' ' HB3' ' A' ' 99' ' ' LEU . 75.2 m-85 -110.17 156.06 21.13 Favored 'General case' 0 N--CA 1.453 -0.282 0 N-CA-C 109.684 -0.487 . . . . 0.0 109.684 179.302 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 111' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -127.93 134.59 49.33 Favored 'General case' 0 C--O 1.236 0.377 0 CA-C-O 118.0 -1.0 . . . . 0.0 108.582 -172.394 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 112' ' ' LEU . . . . . . . . . . . . . 64.1 tp -60.63 82.28 0.01 OUTLIER 'General case' 0 CA--C 1.534 0.344 0 C-N-CA 127.911 2.484 . . . . 0.0 110.653 177.568 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 113' ' ' ALA . . . . . . . . . . . . . . . -115.39 83.0 1.85 Allowed 'General case' 0 C--N 1.33 -0.262 0 N-CA-C 106.015 -1.846 . . . . 0.0 106.015 172.673 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 114' ' ' ASP . . . . . . . . . . . . . 3.0 p-10 . . . . . 0 C--N 1.332 -0.155 0 C-N-CA 123.809 0.844 . . . . 0.0 110.848 -176.382 . . . . . . . . 0 0 . 1 . 014 nuclear nobuild core ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 CA--C 1.534 0.36 0 CA-C-O 121.827 0.823 . . . . 0.0 110.837 . . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 2' ' ' VAL . . . . . . . . . . . . . 8.7 p -57.11 152.09 2.83 Favored 'Isoleucine or valine' 0 CA--C 1.544 0.737 0 C-N-CA 126.672 1.989 . . . . 0.0 110.521 164.115 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 3' ' ' THR . . . . . . . . . . . . . 29.6 p -128.03 162.32 50.62 Favored Pre-proline 0 CA--C 1.537 0.467 0 O-C-N 120.993 -1.067 . . . . 0.0 110.594 176.573 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 4' ' ' PRO . . . . . . . . . . . . . 18.1 Cg_endo -65.99 -41.48 13.45 Favored 'Trans proline' 0 C--N 1.345 0.394 0 C-N-CA 122.436 2.091 . . . . 0.0 112.54 175.117 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 5' ' ' GLU . . . . . . . . . . . . . 2.9 mt-10 -57.33 -50.03 74.23 Favored 'General case' 0 C--N 1.329 -0.286 0 C-N-CA 124.163 0.985 . . . . 0.0 111.016 -176.425 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 6' ' ' GLN . . . . . . . . . . . . . 5.5 pt20 -71.7 14.56 0.19 Allowed 'General case' 0 CA--C 1.541 0.604 0 N-CA-C 114.649 1.351 . . . . 0.0 114.649 -170.951 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 7' ' ' LEU . . . . . . . . . . . . . 94.1 mt -126.22 -52.51 1.51 Allowed 'General case' 0 CA--C 1.516 -0.344 0 C-N-CA 126.358 1.863 . . . . 0.0 109.27 -170.555 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 8' ' ' GLN . . . . . . . . . . . . . 2.0 mt-30 -44.9 -20.67 0.04 OUTLIER 'General case' 0 CA--C 1.539 0.538 0 C-N-CA 127.829 2.452 . . . . 0.0 116.701 -176.187 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 9' ' ' HIS . . . . . . . . . . . . . 33.2 p80 -138.66 19.33 2.69 Favored 'General case' 0 CA--C 1.537 0.446 0 C-N-CA 123.825 0.85 . . . . 0.0 113.245 177.769 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 10' ' ' HIS . . . . . . . . . . . . . 78.1 m-70 -118.6 118.46 31.74 Favored 'General case' 0 CA--C 1.531 0.246 0 C-N-CA 124.104 0.961 . . . . 0.0 108.438 179.22 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 11' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -74.5 140.85 44.83 Favored 'General case' 0 N--CA 1.465 0.284 0 N-CA-C 108.692 -0.855 . . . . 0.0 108.692 175.916 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 12' ' ' PHE . . . . . . . . . . . . . 3.3 m-85 -121.19 162.25 20.47 Favored 'General case' 0 N--CA 1.446 -0.633 0 CA-C-O 124.749 2.214 . . . . 0.0 108.762 163.98 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 13' ' ' VAL . . . . . . . . . . . . . 0.0 OUTLIER -136.79 145.98 29.25 Favored 'Isoleucine or valine' 0 C--N 1.31 -1.112 0 C-N-CA 130.143 3.377 . . . . 0.0 106.873 -179.218 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 14' ' ' LEU . . . . . . . . . . . . . 0.8 OUTLIER -69.75 140.92 53.5 Favored 'General case' 0 CA--C 1.504 -0.805 0 N-CA-C 106.532 -1.655 . . . . 0.0 106.532 166.555 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -117.29 -55.7 2.3 Favored 'General case' 0 N--CA 1.44 -0.952 0 O-C-N 124.222 0.951 . . . . 0.0 108.859 177.017 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 55.3 p -133.43 113.22 12.28 Favored 'General case' 0 N--CA 1.447 -0.616 0 CA-C-O 122.364 1.078 . . . . 0.0 109.841 -173.548 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 17' ' ' VAL . . . . . . . . . . . . . 3.2 t -74.25 160.0 5.4 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.45 0 C-N-CA 125.485 1.514 . . . . 0.0 107.648 179.639 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 18' ' ' ASN . . . . . . . . . . . . . 0.2 OUTLIER -44.75 -35.99 2.97 Favored 'General case' 0 N--CA 1.466 0.371 0 C-N-CA 125.536 1.534 . . . . 0.0 113.773 174.795 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . -107.4 -8.84 30.28 Favored Glycine 0 CA--C 1.528 0.855 0 CA-C-O 116.88 -2.067 . . . . 0.0 115.392 -173.519 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 20' ' ' LYS . . . . . 0.428 ' HB2' ' HD2' ' A' ' 21' ' ' PRO . 16.0 ptpt 174.62 165.21 0.35 Allowed Pre-proline 0 N--CA 1.476 0.833 0 CA-C-N 120.497 2.149 . . . . 0.0 112.146 178.742 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 21' ' ' PRO . . . . . 0.428 ' HD2' ' HB2' ' A' ' 20' ' ' LYS . 45.5 Cg_endo -62.12 173.69 3.04 Favored 'Trans proline' 0 CA--C 1.534 0.499 0 C-N-CA 123.284 2.656 . . . . 0.0 111.856 164.064 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 22' ' ' VAL . . . . . . . . . . . . . 9.0 p -145.6 150.99 15.16 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.508 0 CA-C-O 121.66 0.743 . . . . 0.0 111.013 168.428 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 23' ' ' THR . . . . . . . . . . . . . 14.6 p -115.47 103.96 11.28 Favored 'General case' 0 N--CA 1.452 -0.326 0 C-N-CA 126.458 1.903 . . . . 0.0 107.338 172.743 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 24' ' ' SER . . . . . . . . . . . . . 14.9 m -127.72 75.73 1.62 Allowed 'General case' 0 C--N 1.332 -0.154 0 N-CA-C 106.88 -1.526 . . . . 0.0 106.88 -179.07 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 25' ' ' ASP . . . . . . . . . . . . . 97.2 m-20 -81.79 14.3 2.75 Favored 'General case' 0 N--CA 1.468 0.431 0 C-N-CA 123.917 0.887 . . . . 0.0 111.873 -169.927 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 26' ' ' LYS . . . . . . . . . . . . . 32.8 ttpt -148.88 114.8 5.72 Favored 'General case' 0 N--CA 1.45 -0.447 0 N-CA-C 105.881 -1.896 . . . . 0.0 105.881 179.947 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 27' ' ' ASN . . . . . . . . . . . . . 0.0 OUTLIER 43.6 73.76 0.89 Allowed Pre-proline 0 CA--C 1.546 0.804 0 C-N-CA 127.73 2.412 . . . . 0.0 109.788 -172.724 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 28' ' ' PRO . . . . . . . . . . . . . 9.3 Cg_endo -60.0 164.53 11.98 Favored 'Trans proline' 0 CA--C 1.538 0.677 0 CA-C-N 120.952 1.376 . . . . 0.0 111.988 -176.091 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 29' ' ' PRO . . . . . . . . . . . . . 61.5 Cg_endo -63.9 92.89 0.18 Allowed 'Trans proline' 0 N--CA 1.452 -0.934 0 N-CA-C 106.972 -1.972 . . . . 0.0 106.972 161.045 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 30' ' ' GLU . . . . . . . . . . . . . 7.9 pt-20 -123.24 157.81 32.28 Favored 'General case' 0 C--N 1.32 -0.715 0 C-N-CA 124.652 1.181 . . . . 0.0 108.112 -168.199 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 31' ' ' ILE . . . . . 0.503 HD11 HG23 ' A' ' 39' ' ' ILE . 16.3 tt -143.48 109.83 1.51 Allowed 'Isoleucine or valine' 0 N--CA 1.453 -0.293 0 N-CA-C 108.223 -1.029 . . . . 0.0 108.223 178.596 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 32' ' ' SER . . . . . . . . . . . . . 22.9 t -88.31 171.77 9.92 Favored 'General case' 0 N--CA 1.445 -0.684 0 N-CA-C 107.341 -1.355 . . . . 0.0 107.341 159.684 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 33' ' ' PHE . . . . . . . . . . . . . 92.0 m-85 -133.73 -170.09 2.43 Favored 'General case' 0 N--CA 1.441 -0.893 0 C-N-CA 125.467 1.507 . . . . 0.0 107.327 178.08 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 34' ' ' GLY . . . . . . . . . . . . . . . 170.87 -163.43 36.5 Favored Glycine 0 N--CA 1.444 -0.771 0 N-CA-C 109.57 -1.412 . . . . 0.0 109.57 172.142 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 35' ' ' GLU . . . . . . . . . . . . . 2.2 tt0 -55.76 157.09 4.44 Favored 'General case' 0 CA--C 1.534 0.334 0 C-N-CA 124.229 1.012 . . . . 0.0 112.096 -162.378 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 30.2 mtmt 52.74 20.83 1.69 Allowed 'General case' 0 CA--C 1.537 0.448 0 C-N-CA 124.235 1.014 . . . . 0.0 113.109 -168.94 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 37' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER 61.93 29.07 17.71 Favored 'General case' 0 CA--C 1.542 0.666 0 C-N-CA 125.475 1.51 . . . . 0.0 110.638 -175.967 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 38' ' ' MET . . . . . . . . . . . . . 0.7 OUTLIER -60.32 162.05 6.53 Favored 'General case' 0 C--O 1.233 0.232 0 O-C-N 120.794 -1.191 . . . . 0.0 111.633 172.957 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 39' ' ' ILE . . . . . 0.503 HG23 HD11 ' A' ' 31' ' ' ILE . 19.7 mt -122.96 135.21 63.78 Favored 'Isoleucine or valine' 0 C--O 1.237 0.401 0 C-N-CA 126.123 1.769 . . . . 0.0 107.217 -174.262 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 40' ' ' SER . . . . . . . . . . . . . 56.8 m -137.49 114.53 10.74 Favored 'General case' 0 C--O 1.226 -0.156 0 N-CA-C 108.019 -1.104 . . . . 0.0 108.019 170.983 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 41' ' ' GLY . . . . . . . . . . . . . . . -146.96 174.65 26.7 Favored Glycine 0 C--N 1.335 0.495 0 CA-C-N 119.335 0.97 . . . . 0.0 112.53 177.288 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 42' ' ' SER . . . . . 0.409 ' HA ' ' HA ' ' A' ' 46' ' ' ARG . 8.4 t -150.75 70.7 1.01 Allowed 'General case' 0 C--O 1.226 -0.137 0 C-N-CA 123.567 0.747 . . . . 0.0 110.55 -172.009 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 43' ' ' MET . . . . . . . . . . . . . 82.8 mmm -54.71 -62.82 1.41 Allowed 'General case' 0 C--N 1.344 0.336 0 N-CA-C 108.324 -0.991 . . . . 0.0 108.324 173.475 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 44' ' ' CYS . . . . . 1.283 ' SG ' ' SG ' ' A' ' 70' ' ' CYS . 8.8 t -139.33 -50.43 0.51 Allowed 'General case' 0 N--CA 1.451 -0.387 0 C-N-CA 123.625 0.77 . . . . 0.0 110.548 165.664 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 45' ' ' ASN . . . . . . . . . . . . . 48.6 m-80 -103.69 19.35 20.03 Favored 'General case' 0 N--CA 1.472 0.649 0 CA-C-N 119.973 1.26 . . . . 0.0 113.342 -171.309 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 46' ' ' ARG . . . . . 0.409 ' HA ' ' HA ' ' A' ' 42' ' ' SER . 0.0 OUTLIER 66.04 152.47 0.06 Allowed 'General case' 0 N--CA 1.464 0.253 0 C-N-CA 125.431 1.493 . . . . 0.0 111.043 -177.848 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild core ' A' A ' 47' ' ' PHE . . . . . . . . . . . . . 25.0 p90 -154.54 168.36 26.98 Favored 'General case' 0 N--CA 1.447 -0.611 0 CA-C-O 122.768 1.27 . . . . 0.0 108.621 171.26 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 48' ' ' SER . . . . . . . . . . . . . 3.9 p -152.15 171.94 17.13 Favored 'General case' 0 N--CA 1.44 -0.973 0 CA-C-N 113.889 -1.505 . . . . 0.0 108.027 177.597 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 49' ' ' GLY . . . . . . . . . . . . . . . 179.25 163.78 30.76 Favored Glycine 0 N--CA 1.445 -0.73 0 N-CA-C 109.337 -1.505 . . . . 0.0 109.337 164.628 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 50' ' ' GLU . . . . . . . . . . . . . 13.5 pt-20 -82.99 95.37 7.99 Favored 'General case' 0 N--CA 1.44 -0.939 0 N-CA-C 105.572 -2.011 . . . . 0.0 105.572 165.032 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 51' ' ' GLY . . . . . . . . . . . . . . . -70.13 169.93 45.38 Favored Glycine 0 N--CA 1.447 -0.62 0 N-CA-C 109.781 -1.328 . . . . 0.0 109.781 167.85 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 52' ' ' LYS . . . . . . . . . . . . . 2.1 tppm? -153.27 146.42 24.66 Favored 'General case' 0 N--CA 1.452 -0.344 0 N-CA-C 107.72 -1.215 . . . . 0.0 107.72 169.585 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 53' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -121.33 82.39 1.93 Allowed 'General case' 0 CA--C 1.515 -0.385 0 N-CA-C 106.236 -1.765 . . . . 0.0 106.236 -178.992 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 1.5 t -103.91 -53.53 2.74 Favored 'General case' 0 N--CA 1.448 -0.567 0 N-CA-C 108.222 -1.029 . . . . 0.0 108.222 178.502 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 55' ' ' ASN . . . . . . . . . . . . . 17.6 p-10 -132.39 28.88 4.32 Favored 'General case' 0 CA--C 1.537 0.474 0 C-N-CA 125.889 1.676 . . . . 0.0 112.749 -163.954 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 56' ' ' GLY . . . . . . . . . . . . . . . 69.26 30.25 71.69 Favored Glycine 0 CA--C 1.53 1.007 0 O-C-N 121.146 -0.971 . . . . 0.0 111.806 -179.077 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 57' ' ' GLU . . . . . . . . . . . . . 42.8 tt0 -131.84 126.27 33.85 Favored 'General case' 0 N--CA 1.449 -0.5 0 N-CA-C 107.28 -1.378 . . . . 0.0 107.28 -178.176 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 58' ' ' LEU . . . . . 0.502 ' HB2' HG21 ' A' ' 92' ' ' VAL . 49.5 tp -102.6 103.62 13.94 Favored 'General case' 0 C--O 1.234 0.274 0 C-N-CA 124.073 0.949 . . . . 0.0 109.163 173.109 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 59' ' ' THR . . . . . . . . . . . . . 2.8 p -93.04 153.44 18.7 Favored 'General case' 0 CA--C 1.532 0.273 0 C-N-CA 122.883 0.473 . . . . 0.0 110.478 168.439 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 60' ' ' ALA . . . . . . . . . . . . . . . -155.34 106.3 2.55 Favored 'General case' 0 C--O 1.234 0.256 0 C-N-CA 125.58 1.552 . . . . 0.0 108.399 153.852 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 61' ' ' LYS . . . . . . . . . . . . . 29.1 ttpt -79.48 -25.3 41.91 Favored 'General case' 0 CA--C 1.535 0.365 0 C-N-CA 123.226 0.611 . . . . 0.0 110.638 168.157 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 62' ' ' GLY . . . . . . . . . . . . . . . -83.83 37.45 2.82 Favored Glycine 0 C--N 1.334 0.434 0 C-N-CA 126.443 1.973 . . . . 0.0 112.852 -176.399 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 63' ' ' LEU . . . . . 0.457 HD22 ' HA ' ' A' ' 83' ' ' SER . 0.5 OUTLIER -82.03 81.33 8.02 Favored 'General case' 0 N--CA 1.444 -0.729 0 CA-C-O 121.857 0.837 . . . . 0.0 111.7 -164.096 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild core ' A' A ' 64' ' ' ALA . . . . . . . . . . . . . . . -72.46 131.43 42.55 Favored 'General case' 0 C--N 1.327 -0.402 0 CA-C-N 115.278 -0.874 . . . . 0.0 108.98 176.09 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 65' ' ' MET . . . . . . . . . . . . . 54.9 mtp -130.97 -178.22 4.72 Favored 'General case' 0 CA--C 1.543 0.691 0 C-N-CA 128.239 2.616 . . . . 0.0 109.832 179.666 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 66' ' ' THR . . . . . . . . . . . . . 18.2 p -116.68 -168.93 1.54 Allowed 'General case' 0 N--CA 1.472 0.643 0 C-N-CA 125.339 1.456 . . . . 0.0 111.834 -179.171 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 67' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -138.35 79.97 1.77 Allowed 'General case' 0 N--CA 1.452 -0.36 0 C-N-CA 126.556 1.943 . . . . 0.0 107.014 -177.024 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 68' ' ' MET . . . . . . . . . . . . . 76.1 mtm -131.72 -160.31 1.04 Allowed 'General case' 0 C--N 1.325 -0.475 0 C-N-CA 126.804 2.042 . . . . 0.0 107.575 178.962 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 69' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -143.53 155.96 44.47 Favored 'General case' 0 N--CA 1.445 -0.685 0 C-N-CA 124.993 1.317 . . . . 0.0 110.205 160.382 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 70' ' ' CYS . . . . . 1.283 ' SG ' ' SG ' ' A' ' 44' ' ' CYS . 1.6 p -92.0 -9.01 44.47 Favored 'General case' 0 C--N 1.321 -0.663 0 C-N-CA 126.946 2.099 . . . . 0.0 112.001 171.006 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 71' ' ' ALA . . . . . . . . . . . . . . . 59.64 5.99 0.77 Allowed 'General case' 0 CA--C 1.538 0.503 0 C-N-CA 126.675 1.99 . . . . 0.0 114.183 -167.636 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 72' ' ' ASN . . . . . . . . . . . . . 21.2 t-20 -111.24 144.66 30.91 Favored Pre-proline 0 CA--C 1.533 0.301 0 C-N-CA 124.828 1.251 . . . . 0.0 108.567 174.362 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 73' ' ' PRO . . . . . . . . . . . . . 87.5 Cg_endo -77.48 -47.05 0.13 Allowed 'Trans proline' 0 CA--C 1.534 0.513 0 C-N-CA 122.652 2.235 . . . . 0.0 111.912 -178.471 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 74' ' ' GLN . . . . . . . . . . . . . 15.4 tt0 -59.12 -45.75 90.11 Favored 'General case' 0 N--CA 1.452 -0.361 0 C-N-CA 127.381 2.272 . . . . 0.0 110.175 -171.749 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 75' ' ' LEU . . . . . . . . . . . . . 98.6 mt -65.06 -42.99 93.71 Favored 'General case' 0 N--CA 1.452 -0.344 0 C-N-CA 125.138 1.375 . . . . 0.0 110.498 177.687 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 76' ' ' ASN . . . . . . . . . . . . . 0.6 OUTLIER -60.55 -44.99 95.53 Favored 'General case' 0 N--CA 1.468 0.473 0 C-N-CA 123.854 0.861 . . . . 0.0 111.679 177.977 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 77' ' ' GLU . . . . . . . . . . . . . 21.3 tp10 -63.99 -34.5 78.15 Favored 'General case' 0 CA--C 1.536 0.435 0 C-N-CA 123.699 0.8 . . . . 0.0 111.23 175.077 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 78' ' ' LEU . . . . . . . . . . . . . 21.7 mt -64.2 -20.49 66.06 Favored 'General case' 0 CA--C 1.533 0.3 0 CA-C-O 118.166 -0.921 . . . . 0.0 112.259 178.682 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 79' ' ' ASP . . . . . . . . . . . . . 67.6 m-20 -65.1 -27.67 68.92 Favored 'General case' 0 N--CA 1.467 0.406 0 CA-C-N 119.641 1.109 . . . . 0.0 111.39 172.153 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 80' ' ' ASN . . . . . . . . . . . . . 0.9 OUTLIER -76.12 -52.93 9.09 Favored 'General case' 0 N--CA 1.455 -0.214 0 N-CA-C 107.749 -1.204 . . . . 0.0 107.749 175.85 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 81' ' ' THR . . . . . 0.837 HG21 HE21 ' A' ' 106' ' ' GLN . 28.9 m -47.98 -57.27 5.97 Favored 'General case' 0 CA--C 1.535 0.391 0 C-N-CA 124.066 0.946 . . . . 0.0 110.468 178.482 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 82' ' ' ILE . . . . . . . . . . . . . 10.7 tp -58.13 -39.98 75.26 Favored 'Isoleucine or valine' 0 C--O 1.233 0.193 0 CA-C-N 119.538 1.063 . . . . 0.0 111.401 -172.851 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 83' ' ' SER . . . . . 0.457 ' HA ' HD22 ' A' ' 63' ' ' LEU . 28.6 t -60.65 -53.9 51.88 Favored 'General case' 0 N--CA 1.446 -0.645 0 C-N-CA 123.572 0.749 . . . . 0.0 109.008 -177.459 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 84' ' ' GLU . . . . . . . . . . . . . 9.7 tt0 -76.34 -16.21 59.8 Favored 'General case' 0 CA--C 1.539 0.53 0 N-CA-C 112.765 0.654 . . . . 0.0 112.765 -175.765 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 85' ' ' MET . . . . . . . . . . . . . 77.6 mtp -67.41 -61.18 2.03 Favored 'General case' 0 C--N 1.34 0.175 0 CA-C-N 120.175 1.352 . . . . 0.0 107.499 166.657 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 86' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -63.45 -29.09 70.43 Favored 'General case' 0 C--N 1.33 -0.249 0 C-N-CA 124.63 1.172 . . . . 0.0 112.025 -172.614 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 87' ' ' LYS . . . . . . . . . . . . . 10.9 mttt -64.4 -34.88 79.2 Favored 'General case' 0 C--N 1.333 -0.116 0 CA-C-N 118.752 0.706 . . . . 0.0 110.735 179.703 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 88' ' ' GLU . . . . . . . . . . . . . 9.4 mm-40 -105.07 0.56 27.66 Favored 'General case' 0 CA--C 1.53 0.2 0 C-N-CA 124.669 1.188 . . . . 0.0 111.845 -167.876 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 89' ' ' GLY . . . . . . . . . . . . . . . 86.77 96.68 0.84 Allowed Glycine 0 C--N 1.336 0.545 0 N-CA-C 108.797 -1.721 . . . . 0.0 108.797 -177.432 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 90' ' ' ALA . . . . . . . . . . . . . . . -78.29 135.23 37.49 Favored 'General case' 0 N--CA 1.449 -0.481 0 N-CA-C 109.074 -0.713 . . . . 0.0 109.074 175.759 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 91' ' ' GLN . . . . . . . . . . . . . 2.4 mp0 -72.76 112.14 8.53 Favored 'General case' 0 N--CA 1.449 -0.481 0 N-CA-C 105.548 -2.019 . . . . 0.0 105.548 176.125 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 92' ' ' VAL . . . . . 0.502 HG21 ' HB2' ' A' ' 58' ' ' LEU . 55.4 t -104.15 105.94 19.4 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.35 0 N-CA-C 106.551 -1.648 . . . . 0.0 106.551 -178.731 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 93' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER -121.58 91.49 3.53 Favored 'General case' 0 CA--C 1.516 -0.36 0 N-CA-C 108.478 -0.934 . . . . 0.0 108.478 176.72 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 94' ' ' LEU . . . . . . . . . . . . . 44.0 tp -76.73 134.34 39.22 Favored 'General case' 0 N--CA 1.451 -0.408 0 N-CA-C 107.527 -1.286 . . . . 0.0 107.527 167.519 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 95' ' ' THR . . . . . . . . . . . . . 1.2 t -117.7 178.36 4.43 Favored 'General case' 0 C--N 1.319 -0.746 0 N-CA-C 104.969 -2.234 . . . . 0.0 104.969 169.581 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 96' ' ' ALA . . . . . . . . . . . . . . . -44.78 -21.15 0.05 OUTLIER 'General case' 0 CA--C 1.545 0.758 0 N-CA-C 118.542 2.793 . . . . 0.0 118.542 -157.617 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 97' ' ' ASN . . . . . . . . . . . . . 0.4 OUTLIER -160.35 14.72 0.12 Allowed 'General case' 0 CA--C 1.542 0.643 0 C-N-CA 125.257 1.423 . . . . 0.0 111.68 162.693 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 98' ' ' GLN . . . . . . . . . . . . . 16.4 tt0 -130.57 124.95 32.97 Favored 'General case' 0 N--CA 1.466 0.326 0 O-C-N 120.466 -1.396 . . . . 0.0 109.197 -176.388 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 99' ' ' LEU . . . . . 0.492 ' HB3' ' HB2' ' A' ' 110' ' ' TYR . 12.6 tp -79.06 148.22 32.53 Favored 'General case' 0 C--N 1.326 -0.441 0 C-N-CA 125.875 1.67 . . . . 0.0 109.052 172.676 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 100' ' ' THR . . . . . . . . . . . . . 22.8 m -122.07 129.27 52.25 Favored 'General case' 0 N--CA 1.454 -0.228 0 N-CA-C 106.973 -1.491 . . . . 0.0 106.973 152.077 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 101' ' ' LEU . . . . . . . . . . . . . 1.5 mm? -102.2 100.39 10.59 Favored 'General case' 0 CA--C 1.517 -0.313 0 N-CA-C 105.716 -1.957 . . . . 0.0 105.716 160.703 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 102' ' ' ALA . . . . . . . . . . . . . . . -94.42 151.03 19.7 Favored 'General case' 0 CA--C 1.532 0.286 0 N-CA-C 107.863 -1.162 . . . . 0.0 107.863 167.793 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 103' ' ' THR . . . . . 0.426 HG22 ' H ' ' A' ' 104' ' ' ALA . 0.2 OUTLIER -161.82 177.76 9.58 Favored 'General case' 0 N--CA 1.443 -0.809 0 C-N-CA 126.209 1.803 . . . . 0.0 108.177 166.524 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild core ' A' A ' 104' ' ' ALA . . . . . 0.426 ' H ' HG22 ' A' ' 103' ' ' THR . . . -50.86 -37.87 45.93 Favored 'General case' 0 N--CA 1.447 -0.589 0 C-N-CA 123.418 0.687 . . . . 0.0 112.715 174.05 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 105' ' ' LYS . . . . . . . . . . . . . 0.3 OUTLIER -60.85 -71.99 0.13 Allowed 'General case' 0 C--N 1.342 0.255 0 N-CA-C 112.604 0.594 . . . . 0.0 112.604 178.928 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 106' ' ' GLN . . . . . 0.837 HE21 HG21 ' A' ' 81' ' ' THR . 26.7 mt-30 -150.75 176.86 10.64 Favored 'General case' 0 C--N 1.329 -0.307 0 C-N-CA 127.573 2.349 . . . . 0.0 106.76 -171.956 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 107' ' ' THR . . . . . . . . . . . . . 5.8 t -114.13 149.6 35.39 Favored 'General case' 0 N--CA 1.448 -0.555 0 N-CA-C 106.523 -1.658 . . . . 0.0 106.523 161.697 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 108' ' ' LEU . . . . . . . . . . . . . 78.9 mt -140.59 123.22 16.19 Favored 'General case' 0 C--O 1.237 0.403 0 N-CA-C 106.773 -1.566 . . . . 0.0 106.773 -175.6 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 109' ' ' THR . . . . . . . . . . . . . 24.4 m -89.65 122.27 32.62 Favored 'General case' 0 C--O 1.24 0.566 0 N-CA-C 107.286 -1.376 . . . . 0.0 107.286 176.974 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 110' ' ' TYR . . . . . 0.492 ' HB2' ' HB3' ' A' ' 99' ' ' LEU . 95.4 m-85 -114.32 157.52 22.68 Favored 'General case' 0 N--CA 1.453 -0.324 0 N-CA-C 108.717 -0.846 . . . . 0.0 108.717 174.045 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 111' ' ' LYS . . . . . . . . . . . . . 0.8 OUTLIER -122.38 141.02 52.02 Favored 'General case' 0 C--N 1.332 -0.163 0 C-N-CA 124.029 0.932 . . . . 0.0 109.016 -173.271 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 112' ' ' LEU . . . . . . . . . . . . . 25.3 tp -73.86 54.19 0.49 Allowed 'General case' 0 CA--C 1.534 0.343 0 C-N-CA 128.347 2.659 . . . . 0.0 108.875 171.857 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 113' ' ' ALA . . . . . . . . . . . . . . . -93.64 79.75 4.28 Favored 'General case' 0 N--CA 1.448 -0.526 0 N-CA-C 105.26 -2.126 . . . . 0.0 105.26 174.808 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 114' ' ' ASP . . . . . . . . . . . . . 20.4 t0 . . . . . 0 C--N 1.327 -0.384 0 CA-C-O 123.745 1.736 . . . . 0.0 109.99 -170.153 . . . . . . . . 0 0 . 1 . 015 nuclear nobuild core ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 4.6 ttp . . . . . 0 C--O 1.234 0.269 0 N-CA-C 108.195 -1.039 . . . . 0.0 108.195 . . . . . . . . . 0 0 . 1 . 015 nuclear nobuild core ' A' A ' 2' ' ' VAL . . . . . . . . . . . . . 54.2 t -61.89 156.32 4.07 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.446 0 C-N-CA 124.573 1.149 . . . . 0.0 109.861 179.781 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 3' ' ' THR . . . . . 0.419 ' HB ' ' HD2' ' A' ' 4' ' ' PRO . 62.2 p -134.16 165.66 35.05 Favored Pre-proline 0 CA--C 1.53 0.209 0 O-C-N 121.844 -0.535 . . . . 0.0 111.919 170.277 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 4' ' ' PRO . . . . . 0.419 ' HD2' ' HB ' ' A' ' 3' ' ' THR . 29.9 Cg_endo -63.38 -35.96 58.51 Favored 'Trans proline' 0 N--CA 1.459 -0.53 0 C-N-CA 123.116 2.544 . . . . 0.0 113.791 170.951 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 5' ' ' GLU . . . . . . . . . . . . . 57.2 tt0 -57.37 -49.63 75.55 Favored 'General case' 0 C--N 1.325 -0.48 0 C-N-CA 123.217 0.607 . . . . 0.0 111.116 -171.935 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 6' ' ' GLN . . . . . . . . . . . . . 18.4 pt20 -68.56 14.22 0.08 Allowed 'General case' 0 CA--C 1.537 0.447 0 C-N-CA 127.374 2.27 . . . . 0.0 114.491 -178.259 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 7' ' ' LEU . . . . . . . . . . . . . 72.1 mt -134.7 -49.54 0.77 Allowed 'General case' 0 N--CA 1.456 -0.129 0 C-N-CA 124.449 1.1 . . . . 0.0 112.372 -170.726 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 8' ' ' GLN . . . . . . . . . . . . . 0.2 OUTLIER -52.65 -1.35 0.02 OUTLIER 'General case' 0 N--CA 1.466 0.362 0 C-N-CA 128.518 2.727 . . . . 0.0 117.902 -172.771 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 9' ' ' HIS . . . . . . . . . . . . . 91.8 m-70 -143.55 10.94 1.66 Allowed 'General case' 0 CA--C 1.535 0.393 0 CA-C-N 120.269 1.395 . . . . 0.0 111.695 172.538 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 10' ' ' HIS . . . . . . . . . . . . . 81.7 m-70 -108.42 115.26 29.77 Favored 'General case' 0 N--CA 1.452 -0.346 0 C-N-CA 124.909 1.284 . . . . 0.0 108.563 -167.892 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 11' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -70.38 142.08 52.13 Favored 'General case' 0 N--CA 1.464 0.27 0 N-CA-C 107.777 -1.194 . . . . 0.0 107.777 169.726 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 12' ' ' PHE . . . . . . . . . . . . . 41.9 m-85 -125.47 164.61 20.09 Favored 'General case' 0 N--CA 1.444 -0.76 0 C-N-CA 125.623 1.569 . . . . 0.0 107.874 162.459 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 13' ' ' VAL . . . . . . . . . . . . . 4.3 t -134.29 146.91 30.44 Favored 'Isoleucine or valine' 0 C--O 1.236 0.345 0 N-CA-C 107.784 -1.191 . . . . 0.0 107.784 -178.794 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 14' ' ' LEU . . . . . . . . . . . . . 27.2 tp -75.18 91.28 2.6 Favored 'General case' 0 N--CA 1.454 -0.252 0 O-C-N 123.787 0.679 . . . . 0.0 109.402 -175.301 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 0.7 OUTLIER -66.44 -42.38 87.74 Favored 'General case' 0 C--O 1.237 0.397 0 C-N-CA 124.656 1.182 . . . . 0.0 109.514 -177.134 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -161.9 152.95 18.02 Favored 'General case' 0 N--CA 1.449 -0.51 0 CA-C-O 121.737 0.78 . . . . 0.0 111.174 -174.146 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 17' ' ' VAL . . . . . . . . . . . . . 2.0 t -116.72 161.29 15.58 Favored 'Isoleucine or valine' 0 C--O 1.235 0.324 0 N-CA-C 107.011 -1.477 . . . . 0.0 107.011 -179.53 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 18' ' ' ASN . . . . . . . . . . . . . 17.9 t30 -51.17 -42.2 60.68 Favored 'General case' 0 N--CA 1.46 0.07 0 C-N-CA 123.147 0.579 . . . . 0.0 111.902 176.846 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . -62.54 -72.89 0.58 Allowed Glycine 0 CA--C 1.525 0.697 0 N-CA-C 110.159 -1.176 . . . . 0.0 110.159 174.265 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 17.0 mttt -165.74 166.88 9.58 Favored Pre-proline 0 C--N 1.332 -0.176 0 C-N-CA 128.239 2.616 . . . . 0.0 108.405 -171.445 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 21' ' ' PRO . . . . . . . . . . . . . 56.8 Cg_endo -58.96 169.43 3.51 Favored 'Trans proline' 0 N--CA 1.455 -0.751 0 CA-C-N 120.389 1.175 . . . . 0.0 110.679 172.389 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 22' ' ' VAL . . . . . . . . . . . . . 2.7 t -105.97 162.4 5.06 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.396 0 N-CA-C 107.067 -1.457 . . . . 0.0 107.067 174.922 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 23' ' ' THR . . . . . . . . . . . . . 0.6 OUTLIER -136.96 81.0 1.85 Allowed 'General case' 0 C--N 1.329 -0.289 0 C-N-CA 124.3 1.04 . . . . 0.0 108.533 -172.868 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 24' ' ' SER . . . . . . . . . . . . . 27.7 m -128.88 100.51 5.71 Favored 'General case' 0 C--N 1.325 -0.458 0 C-N-CA 125.701 1.6 . . . . 0.0 107.179 -175.637 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 25' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER -75.1 -16.06 60.58 Favored 'General case' 0 N--CA 1.467 0.405 0 C-N-CA 125.765 1.626 . . . . 0.0 112.151 -174.164 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 26' ' ' LYS . . . . . . . . . . . . . 20.4 tttp -143.4 136.72 28.09 Favored 'General case' 0 N--CA 1.448 -0.554 0 N-CA-C 105.748 -1.945 . . . . 0.0 105.748 -174.679 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 27' ' ' ASN . . . . . . . . . . . . . 42.8 m-20 44.93 66.62 4.96 Favored Pre-proline 0 CA--C 1.547 0.839 0 C-N-CA 125.844 1.657 . . . . 0.0 110.862 178.895 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 28' ' ' PRO . . . . . . . . . . . . . 56.2 Cg_endo -65.87 173.82 6.48 Favored 'Trans proline' 0 C--N 1.346 0.413 0 C-N-CA 123.988 3.125 . . . . 0.0 112.751 -176.275 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 29' ' ' PRO . . . . . . . . . . . . . 70.3 Cg_endo -72.82 93.79 0.79 Allowed 'Trans proline' 0 N--CA 1.446 -1.272 0 N-CA-C 108.397 -1.424 . . . . 0.0 108.397 157.359 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 30' ' ' GLU . . . . . . . . . . . . . 0.2 OUTLIER -98.38 177.64 5.29 Favored 'General case' 0 C--N 1.327 -0.403 0 O-C-N 120.546 -1.346 . . . . 0.0 109.686 167.754 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 31' ' ' ILE . . . . . . . . . . . . . 9.0 tt -147.54 114.33 0.98 Allowed 'Isoleucine or valine' 0 N--CA 1.451 -0.378 0 N-CA-C 106.952 -1.499 . . . . 0.0 106.952 171.348 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 32' ' ' SER . . . . . . . . . . . . . 15.1 m -116.11 159.61 21.5 Favored 'General case' 0 C--O 1.238 0.477 0 N-CA-C 108.902 -0.777 . . . . 0.0 108.902 174.441 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 33' ' ' PHE . . . . . . . . . . . . . 29.0 m-85 -130.55 152.55 49.8 Favored 'General case' 0 N--CA 1.448 -0.555 0 N-CA-C 108.364 -0.976 . . . . 0.0 108.364 175.862 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 34' ' ' GLY . . . . . . . . . . . . . . . -117.98 -178.44 17.26 Favored Glycine 0 C--N 1.332 0.317 0 N-CA-C 109.568 -1.413 . . . . 0.0 109.568 171.13 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 35' ' ' GLU . . . . . . . . . . . . . 3.8 pt-20 -63.22 -26.17 68.67 Favored 'General case' 0 C--N 1.324 -0.513 0 C-N-CA 128.671 2.788 . . . . 0.0 112.527 -158.359 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 0.3 OUTLIER -85.2 13.44 6.35 Favored 'General case' 0 N--CA 1.437 -1.121 0 C-N-CA 129.296 3.038 . . . . 0.0 114.308 173.352 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 37' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER 60.8 14.78 5.38 Favored 'General case' 0 CA--C 1.55 0.946 0 C-N-CA 127.394 2.278 . . . . 0.0 112.522 -168.305 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 38' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -54.58 160.51 1.77 Allowed 'General case' 0 N--CA 1.467 0.416 0 O-C-N 119.912 -1.742 . . . . 0.0 110.623 177.658 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 39' ' ' ILE . . . . . . . . . . . . . 17.9 mt -132.12 120.7 44.53 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.514 0 N-CA-C 105.555 -2.017 . . . . 0.0 105.555 -177.546 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 40' ' ' SER . . . . . . . . . . . . . 17.3 m -129.18 89.1 2.8 Favored 'General case' 0 CA--C 1.535 0.378 0 C-N-CA 126.131 1.772 . . . . 0.0 108.607 -174.674 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 41' ' ' GLY . . . . . . . . . . . . . . . -135.61 -167.91 11.42 Favored Glycine 0 CA--C 1.538 1.487 0 C-N-CA 124.304 0.954 . . . . 0.0 110.95 -173.735 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 42' ' ' SER . . . . . . . . . . . . . 23.6 t -171.91 93.02 0.14 Allowed 'General case' 0 CA--C 1.535 0.379 0 C-N-CA 128.247 2.619 . . . . 0.0 108.525 177.497 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 43' ' ' MET . . . . . . . . . . . . . 2.6 mmt -63.74 -51.1 66.46 Favored 'General case' 0 C--O 1.231 0.107 0 N-CA-C 108.651 -0.87 . . . . 0.0 108.651 170.761 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 44' ' ' CYS . . . . . 1.302 ' SG ' ' SG ' ' A' ' 70' ' ' CYS . 48.9 t -148.79 -66.06 0.23 Allowed 'General case' 0 CA--C 1.514 -0.427 0 N-CA-C 108.182 -1.044 . . . . 0.0 108.182 169.023 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 45' ' ' ASN . . . . . . . . . . . . . 1.1 m-80 -75.93 17.36 0.33 Allowed 'General case' 0 CA--C 1.534 0.347 0 C-N-CA 127.835 2.454 . . . . 0.0 112.549 -172.612 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 46' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER 61.68 161.32 0.07 Allowed 'General case' 0 N--CA 1.463 0.207 0 C-N-CA 125.855 1.662 . . . . 0.0 111.545 -163.952 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 47' ' ' PHE . . . . . . . . . . . . . 35.0 p90 -158.81 159.78 35.5 Favored 'General case' 0 C--N 1.329 -0.308 0 N-CA-C 107.541 -1.281 . . . . 0.0 107.541 153.348 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 48' ' ' SER . . . . . . . . . . . . . 1.4 m -151.91 158.47 43.22 Favored 'General case' 0 C--O 1.237 0.427 0 N-CA-C 108.561 -0.903 . . . . 0.0 108.561 161.075 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 49' ' ' GLY . . . . . . . . . . . . . . . -177.76 166.68 37.12 Favored Glycine 0 CA--C 1.52 0.389 0 N-CA-C 110.136 -1.186 . . . . 0.0 110.136 179.578 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 50' ' ' GLU . . . . . . . . . . . . . 43.4 mt-10 -88.51 98.26 11.54 Favored 'General case' 0 N--CA 1.449 -0.488 0 N-CA-C 107.575 -1.268 . . . . 0.0 107.575 -176.832 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 51' ' ' GLY . . . . . . . . . . . . . . . -59.61 169.87 6.54 Favored Glycine 0 CA--C 1.531 1.083 0 CA-C-N 115.737 -0.665 . . . . 0.0 112.424 172.106 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 52' ' ' LYS . . . . . . . . . . . . . 35.6 ttpt -155.02 147.03 23.6 Favored 'General case' 0 C--O 1.235 0.327 0 O-C-N 121.549 -0.971 . . . . 0.0 111.142 169.606 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 53' ' ' LEU . . . . . . . . . . . . . 24.2 tp -134.77 139.73 45.37 Favored 'General case' 0 N--CA 1.453 -0.324 0 C-N-CA 127.575 2.35 . . . . 0.0 107.484 170.148 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 54' ' ' SER . . . . . 0.411 ' H ' ' H ' ' A' ' 55' ' ' ASN . 1.3 t -162.21 -14.77 0.04 OUTLIER 'General case' 0 CA--C 1.541 0.606 0 C-N-CA 125.574 1.55 . . . . 0.0 110.39 163.917 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 55' ' ' ASN . . . . . 0.411 ' H ' ' H ' ' A' ' 54' ' ' SER . 43.9 m-20 -123.44 14.12 9.54 Favored 'General case' 0 CA--C 1.541 0.601 0 C-N-CA 124.761 1.224 . . . . 0.0 113.099 -170.407 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 56' ' ' GLY . . . . . . . . . . . . . . . 72.09 19.7 78.61 Favored Glycine 0 CA--C 1.533 1.183 0 CA-C-N 120.429 1.468 . . . . 0.0 112.672 -172.24 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 57' ' ' GLU . . . . . . . . . . . . . 19.7 tt0 -130.01 149.84 51.55 Favored 'General case' 0 CA--C 1.541 0.607 0 C-N-CA 125.187 1.395 . . . . 0.0 107.958 -176.726 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 58' ' ' LEU . . . . . . . . . . . . . 66.2 tp -114.72 124.74 52.57 Favored 'General case' 0 N--CA 1.465 0.291 0 CA-C-N 119.603 1.092 . . . . 0.0 109.066 177.516 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 59' ' ' THR . . . . . . . . . . . . . 11.8 p -123.01 159.47 28.32 Favored 'General case' 0 C--N 1.326 -0.42 0 C-N-CA 126.171 1.788 . . . . 0.0 110.15 169.531 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 60' ' ' ALA . . . . . 0.618 ' HB2' ' HB3' ' A' ' 86' ' ' LEU . . . -80.54 169.62 17.44 Favored 'General case' 0 N--CA 1.451 -0.423 0 C-N-CA 126.191 1.796 . . . . 0.0 113.468 162.532 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 61' ' ' LYS . . . . . . . . . . . . . 77.6 tttt -135.79 121.51 19.66 Favored 'General case' 0 N--CA 1.441 -0.876 0 N-CA-C 105.211 -2.144 . . . . 0.0 105.211 147.212 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 62' ' ' GLY . . . . . . . . . . . . . . . 104.41 -61.25 0.41 Allowed Glycine 0 CA--C 1.526 0.73 0 CA-C-O 118.575 -1.125 . . . . 0.0 113.775 160.569 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 63' ' ' LEU . . . . . . . . . . . . . 2.5 tp 44.85 87.79 0.02 OUTLIER 'General case' 0 CA--C 1.54 0.578 0 C-N-CA 128.305 2.642 . . . . 0.0 113.591 -175.499 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 64' ' ' ALA . . . . . . . . . . . . . . . -71.57 147.44 47.63 Favored 'General case' 0 C--N 1.33 -0.25 0 N-CA-C 107.094 -1.446 . . . . 0.0 107.094 162.05 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 65' ' ' MET . . . . . . . . . . . . . 63.9 mtp -147.06 -171.11 3.7 Favored 'General case' 0 CA--C 1.542 0.666 0 C-N-CA 126.806 2.042 . . . . 0.0 107.625 174.679 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 66' ' ' THR . . . . . . . . . . . . . 3.9 p -139.15 -168.82 2.52 Favored 'General case' 0 CA--C 1.546 0.812 0 C-N-CA 124.494 1.118 . . . . 0.0 109.847 176.785 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 67' ' ' ARG . . . . . . . . . . . . . 16.6 mmt85 -119.18 28.44 8.24 Favored 'General case' 0 N--CA 1.473 0.716 0 C-N-CA 127.322 2.249 . . . . 0.0 111.935 177.934 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 68' ' ' MET . . . . . . . . . . . . . 77.4 mtm -74.98 -169.7 0.96 Allowed 'General case' 0 CA--C 1.541 0.621 0 O-C-N 120.632 -1.293 . . . . 0.0 109.698 178.651 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 69' ' ' MET . . . . . . . . . . . . . 1.0 OUTLIER -149.63 176.68 10.44 Favored 'General case' 0 CA--C 1.522 -0.134 0 C-N-CA 125.531 1.532 . . . . 0.0 109.626 174.321 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 70' ' ' CYS . . . . . 1.302 ' SG ' ' SG ' ' A' ' 44' ' ' CYS . 75.9 m -133.8 15.38 3.96 Favored 'General case' 0 CA--C 1.537 0.461 0 C-N-CA 124.225 1.01 . . . . 0.0 111.658 179.986 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 71' ' ' ALA . . . . . . . . . . . . . . . 60.6 -25.75 0.04 OUTLIER 'General case' 0 CA--C 1.537 0.455 0 C-N-CA 130.184 3.394 . . . . 0.0 115.308 -171.212 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 72' ' ' ASN . . . . . . . . . . . . . 19.8 t30 -96.42 144.56 28.04 Favored Pre-proline 0 C--O 1.236 0.347 0 C-N-CA 124.116 0.967 . . . . 0.0 110.366 -176.552 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 73' ' ' PRO . . . . . . . . . . . . . 53.5 Cg_endo -73.72 -38.19 2.55 Favored 'Trans proline' 0 N--CA 1.46 -0.447 0 C-N-CA 122.044 1.829 . . . . 0.0 112.284 -174.6 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 74' ' ' GLN . . . . . . . . . . . . . 63.1 tt0 -52.48 -46.25 66.5 Favored 'General case' 0 C--O 1.224 -0.277 0 CA-C-N 118.973 0.806 . . . . 0.0 110.661 -178.378 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 75' ' ' LEU . . . . . . . . . . . . . 90.0 mt -66.12 -37.65 86.26 Favored 'General case' 0 CA--C 1.534 0.347 0 O-C-N 121.873 -0.517 . . . . 0.0 111.623 -179.557 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 76' ' ' ASN . . . . . . . . . . . . . 0.8 OUTLIER -76.05 -28.92 57.84 Favored 'General case' 0 N--CA 1.467 0.38 0 CA-C-N 118.936 0.789 . . . . 0.0 111.691 -178.483 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 77' ' ' GLU . . . . . . . . . . . . . 3.3 tp10 -65.75 -36.64 84.14 Favored 'General case' 0 CA--C 1.533 0.321 0 C-N-CA 125.047 1.339 . . . . 0.0 109.008 166.729 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 78' ' ' LEU . . . . . . . . . . . . . 5.2 mp -70.63 -13.17 61.98 Favored 'General case' 0 N--CA 1.453 -0.298 0 O-C-N 121.121 -0.987 . . . . 0.0 113.55 -177.429 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 79' ' ' ASP . . . . . . . . . . . . . 13.4 t70 -52.99 -58.28 7.51 Favored 'General case' 0 C--O 1.231 0.12 0 C-N-CA 124.725 1.21 . . . . 0.0 110.696 163.273 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 80' ' ' ASN . . . . . . . . . . . . . 13.4 p30 -75.33 -35.7 61.15 Favored 'General case' 0 N--CA 1.444 -0.731 0 N-CA-C 109.605 -0.517 . . . . 0.0 109.605 -173.525 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 81' ' ' THR . . . . . . . . . . . . . 32.6 m -48.43 -53.15 18.86 Favored 'General case' 0 N--CA 1.447 -0.606 0 C-N-CA 125.29 1.436 . . . . 0.0 110.349 174.29 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 82' ' ' ILE . . . . . . . . . . . . . 8.9 tp -77.2 -38.31 27.15 Favored 'Isoleucine or valine' 0 C--N 1.341 0.231 0 CA-C-N 120.069 1.304 . . . . 0.0 111.586 -178.686 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 83' ' ' SER . . . . . . . . . . . . . 4.2 t -50.46 -50.96 51.0 Favored 'General case' 0 C--O 1.238 0.467 0 C-N-CA 123.679 0.791 . . . . 0.0 109.851 -179.904 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 84' ' ' GLU . . . . . . . . . . . . . 0.5 OUTLIER -67.41 -44.64 78.31 Favored 'General case' 0 N--CA 1.45 -0.444 0 C-N-CA 124.46 1.104 . . . . 0.0 112.006 -178.451 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 85' ' ' MET . . . . . . . . . . . . . 90.2 mtp -66.8 -23.41 66.05 Favored 'General case' 0 C--O 1.232 0.16 0 CA-C-O 121.864 0.84 . . . . 0.0 110.7 -166.667 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 86' ' ' LEU . . . . . 0.618 ' HB3' ' HB2' ' A' ' 60' ' ' ALA . 2.8 mm? -98.02 -31.42 12.16 Favored 'General case' 0 N--CA 1.446 -0.664 0 C-N-CA 125.301 1.44 . . . . 0.0 110.413 -177.814 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 87' ' ' LYS . . . . . . . . . . . . . 54.0 mttt -66.6 -49.91 64.77 Favored 'General case' 0 N--CA 1.439 -0.986 0 N-CA-C 107.438 -1.319 . . . . 0.0 107.438 179.16 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 88' ' ' GLU . . . . . . . . . . . . . 31.2 mt-10 -89.15 -8.44 53.68 Favored 'General case' 0 CA--C 1.532 0.265 0 N-CA-C 113.169 0.804 . . . . 0.0 113.169 -168.115 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 89' ' ' GLY . . . . . . . . . . . . . . . 83.54 138.91 3.63 Favored Glycine 0 C--N 1.337 0.588 0 C-N-CA 124.358 0.98 . . . . 0.0 112.423 175.45 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 90' ' ' ALA . . . . . . . . . . . . . . . -131.48 154.03 49.16 Favored 'General case' 0 CA--C 1.514 -0.426 0 N-CA-C 114.127 1.158 . . . . 0.0 114.127 -165.275 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 91' ' ' GLN . . . . . . . . . . . . . 9.0 mp0 -70.36 129.22 38.71 Favored 'General case' 0 N--CA 1.445 -0.709 0 N-CA-C 104.242 -2.503 . . . . 0.0 104.242 163.1 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 92' ' ' VAL . . . . . . . . . . . . . 3.3 p -128.6 77.32 0.55 Allowed 'Isoleucine or valine' 0 C--N 1.325 -0.489 0 N-CA-C 106.512 -1.662 . . . . 0.0 106.512 -177.135 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 93' ' ' ASP . . . . . . . . . . . . . 2.4 m-20 -72.32 147.65 46.12 Favored 'General case' 0 N--CA 1.448 -0.546 0 N-CA-C 107.206 -1.405 . . . . 0.0 107.206 172.537 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 94' ' ' LEU . . . . . . . . . . . . . 61.1 tp -142.07 102.73 4.18 Favored 'General case' 0 N--CA 1.448 -0.534 0 N-CA-C 107.909 -1.145 . . . . 0.0 107.909 171.283 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 95' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -70.67 179.48 2.58 Favored 'General case' 0 N--CA 1.442 -0.855 0 CA-C-N 114.771 -1.104 . . . . 0.0 108.825 168.486 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 96' ' ' ALA . . . . . . . . . . . . . . . -47.07 -33.01 4.53 Favored 'General case' 0 CA--C 1.535 0.401 0 C-N-CA 126.273 1.829 . . . . 0.0 115.173 -169.955 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 97' ' ' ASN . . . . . . . . . . . . . 0.0 OUTLIER -148.35 6.8 0.76 Allowed 'General case' 0 CA--C 1.537 0.445 0 C-N-CA 126.325 1.85 . . . . 0.0 110.69 -173.897 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 98' ' ' GLN . . . . . . . . . . . . . 24.7 tt0 -143.46 111.41 6.09 Favored 'General case' 0 CA--C 1.529 0.156 0 CA-C-N 119.566 1.076 . . . . 0.0 109.899 -164.9 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 99' ' ' LEU . . . . . 0.446 ' HB3' ' HB2' ' A' ' 110' ' ' TYR . 10.9 tp -66.79 147.37 53.35 Favored 'General case' 0 C--O 1.235 0.321 0 C-N-CA 125.63 1.572 . . . . 0.0 107.745 170.744 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 100' ' ' THR . . . . . . . . . . . . . 85.3 m -143.46 100.69 3.65 Favored 'General case' 0 C--N 1.326 -0.439 0 N-CA-C 106.638 -1.615 . . . . 0.0 106.638 169.506 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 101' ' ' LEU . . . . . . . . . . . . . 3.2 mm? -81.37 146.33 30.38 Favored 'General case' 0 CA--C 1.517 -0.303 0 N-CA-C 107.651 -1.241 . . . . 0.0 107.651 175.571 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 102' ' ' ALA . . . . . . . . . . . . . . . -143.46 152.03 41.04 Favored 'General case' 0 C--O 1.235 0.336 0 C-N-CA 123.679 0.792 . . . . 0.0 109.7 164.126 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 103' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -151.61 173.92 14.07 Favored 'General case' 0 C--N 1.326 -0.448 0 C-N-CA 126.93 2.092 . . . . 0.0 108.735 179.631 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 104' ' ' ALA . . . . . . . . . . . . . . . -49.85 -19.19 0.62 Allowed 'General case' 0 CA--C 1.536 0.419 0 N-CA-C 115.44 1.644 . . . . 0.0 115.44 164.392 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 105' ' ' LYS . . . . . . . . . . . . . 23.8 mmtt -87.95 -74.15 0.46 Allowed 'General case' 0 N--CA 1.455 -0.19 0 CA-C-N 119.775 1.171 . . . . 0.0 109.245 172.67 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 106' ' ' GLN . . . . . . . . . . . . . 13.4 mt-30 -150.34 179.76 7.86 Favored 'General case' 0 N--CA 1.462 0.151 0 C-N-CA 124.644 1.178 . . . . 0.0 109.835 -160.862 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 107' ' ' THR . . . . . . . . . . . . . 3.5 t -135.22 125.51 26.36 Favored 'General case' 0 CA--C 1.538 0.506 0 C-N-CA 124.587 1.155 . . . . 0.0 109.699 177.777 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 108' ' ' LEU . . . . . . . . . . . . . 8.5 mp -119.44 149.02 42.56 Favored 'General case' 0 C--O 1.234 0.245 0 C-N-CA 126.746 2.018 . . . . 0.0 109.337 -172.257 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 109' ' ' THR . . . . . . . . . . . . . 32.2 m -121.27 124.69 45.24 Favored 'General case' 0 N--CA 1.451 -0.419 0 N-CA-C 108.338 -0.986 . . . . 0.0 108.338 -173.022 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 110' ' ' TYR . . . . . 0.446 ' HB2' ' HB3' ' A' ' 99' ' ' LEU . 32.3 m-85 -124.39 163.86 20.88 Favored 'General case' 0 CA--C 1.518 -0.272 0 N-CA-C 109.482 -0.562 . . . . 0.0 109.482 -179.98 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 111' ' ' LYS . . . . . 0.511 ' HE2' ' HB2' ' A' ' 113' ' ' ALA . 0.5 OUTLIER -128.0 140.08 52.18 Favored 'General case' 0 CA--C 1.514 -0.405 0 CA-C-O 117.54 -1.219 . . . . 0.0 108.883 -171.734 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild core ' A' A ' 112' ' ' LEU . . . . . . . . . . . . . 28.9 tp -71.85 47.01 0.13 Allowed 'General case' 0 CA--C 1.54 0.592 0 C-N-CA 127.386 2.275 . . . . 0.0 110.079 175.078 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 113' ' ' ALA . . . . . 0.511 ' HB2' ' HE2' ' A' ' 111' ' ' LYS . . . -78.96 82.32 5.15 Favored 'General case' 0 N--CA 1.446 -0.644 0 N-CA-C 106.489 -1.671 . . . . 0.0 106.489 166.225 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 114' ' ' ASP . . . . . . . . . . . . . 45.1 t0 . . . . . 0 CA--C 1.506 -0.73 0 N-CA-C 107.421 -1.325 . . . . 0.0 107.421 173.908 . . . . . . . . 0 0 . 1 . 016 nuclear nobuild core ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 C--O 1.237 0.424 0 N-CA-C 110.069 -0.345 . . . . 0.0 110.069 . . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 2' ' ' VAL . . . . . . . . . . . . . 7.3 p -55.63 142.89 9.54 Favored 'Isoleucine or valine' 0 N--CA 1.447 -0.59 0 C-N-CA 124.133 0.973 . . . . 0.0 109.331 175.377 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 3' ' ' THR . . . . . . . . . . . . . 0.8 OUTLIER -130.74 162.88 52.44 Favored Pre-proline 0 C--N 1.327 -0.403 0 C-N-CA 124.953 1.301 . . . . 0.0 109.196 -176.939 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 4' ' ' PRO . . . . . . . . . . . . . 30.7 Cg_endo -65.53 -34.52 42.25 Favored 'Trans proline' 0 N--CA 1.457 -0.636 0 C-N-CA 122.275 1.984 . . . . 0.0 111.731 -178.579 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 5' ' ' GLU . . . . . . . . . . . . . 55.1 tt0 -58.63 -55.13 39.02 Favored 'General case' 0 C--N 1.322 -0.61 0 C-N-CA 124.731 1.212 . . . . 0.0 110.656 -177.156 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 6' ' ' GLN . . . . . . . . . . . . . 21.3 pt20 -66.35 12.65 0.06 Allowed 'General case' 0 CA--C 1.541 0.635 0 C-N-CA 125.348 1.459 . . . . 0.0 113.793 177.829 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 7' ' ' LEU . . . . . . . . . . . . . 82.4 mt -124.46 -47.19 1.86 Allowed 'General case' 0 N--CA 1.454 -0.238 0 C-N-CA 126.378 1.871 . . . . 0.0 110.456 177.815 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 8' ' ' GLN . . . . . . . . . . . . 0.259 3.3 pt20 -56.34 -14.53 2.98 Favored 'General case' 0 N--CA 1.472 0.66 0 N-CA-C 114.874 1.435 . . . . 0.0 114.874 -176.361 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 9' ' ' HIS . . . . . . . . . . . . . 10.6 m-70 -124.92 16.64 8.58 Favored 'General case' 0 C--N 1.32 -0.685 0 C-N-CA 124.489 1.116 . . . . 0.0 111.274 -174.811 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 10' ' ' HIS . . . . . . . . . . . . . 97.8 m-70 -142.53 121.3 12.67 Favored 'General case' 0 CA--C 1.541 0.63 0 C-N-CA 125.711 1.604 . . . . 0.0 110.805 -179.879 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 11' ' ' ARG . . . . . . . . . . . . . 4.4 ptm85 -78.67 160.18 27.64 Favored 'General case' 0 N--CA 1.467 0.397 0 C-N-CA 124.853 1.261 . . . . 0.0 109.578 174.164 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 12' ' ' PHE . . . . . . . . . . . . . 34.2 m-85 -140.03 134.74 31.84 Favored 'General case' 0 C--N 1.329 -0.286 0 C-N-CA 123.926 0.891 . . . . 0.0 110.664 -179.171 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 13' ' ' VAL . . . . . . . . . . . . . 11.0 p -120.88 144.21 30.55 Favored 'Isoleucine or valine' 0 C--O 1.233 0.226 0 O-C-N 121.192 -0.942 . . . . 0.0 110.149 -179.213 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 14' ' ' LEU . . . . . . . . . . . . . 35.0 tp -79.42 86.56 5.11 Favored 'General case' 0 C--N 1.332 -0.193 0 C-N-CA 124.959 1.304 . . . . 0.0 110.598 -169.383 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 4.0 mm-40 -55.44 -42.3 74.02 Favored 'General case' 0 C--O 1.235 0.322 0 C-N-CA 124.527 1.131 . . . . 0.0 111.022 176.169 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 22.3 t -155.11 142.98 19.98 Favored 'General case' 0 N--CA 1.452 -0.369 0 CA-C-O 121.918 0.866 . . . . 0.0 110.962 174.571 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 17' ' ' VAL . . . . . . . . . . . . . 44.3 t -67.2 171.15 0.85 Allowed 'Isoleucine or valine' 0 C--O 1.24 0.594 0 N-CA-C 107.235 -1.394 . . . . 0.0 107.235 159.42 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 18' ' ' ASN . . . . . . . . . . . . . 0.2 OUTLIER -46.65 -44.47 18.44 Favored 'General case' 0 CA--C 1.528 0.129 0 C-N-CA 124.245 1.018 . . . . 0.0 111.503 170.888 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . -86.73 -58.57 1.9 Allowed Glycine 0 N--CA 1.446 -0.649 0 O-C-N 124.223 0.952 . . . . 0.0 110.988 -166.421 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 24.3 mttt -149.42 166.15 15.95 Favored Pre-proline 0 C--O 1.238 0.493 0 C-N-CA 126.286 1.834 . . . . 0.0 110.449 -173.178 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 21' ' ' PRO . . . . . . . . . . . . . 42.4 Cg_endo -56.11 171.27 0.86 Allowed 'Trans proline' 0 N--CA 1.455 -0.793 0 C-N-CA 122.082 1.854 . . . . 0.0 111.897 164.329 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 22' ' ' VAL . . . . . . . . . . . . . 4.1 p -128.37 147.15 32.94 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.341 0 C-N-CA 124.775 1.23 . . . . 0.0 108.415 -178.757 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 23' ' ' THR . . . . . . . . . . . . . 1.4 p -110.61 145.57 37.64 Favored 'General case' 0 N--CA 1.452 -0.358 0 C-N-CA 124.734 1.214 . . . . 0.0 109.38 179.172 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 24' ' ' SER . . . . . . . . . . . . . 23.3 t -150.27 137.91 19.88 Favored 'General case' 0 N--CA 1.437 -1.096 0 C-N-CA 127.5 2.32 . . . . 0.0 105.247 176.483 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 25' ' ' ASP . . . . . . . . . . . . . 37.4 t70 -49.74 -59.27 3.97 Favored 'General case' 0 C--N 1.32 -0.706 0 C-N-CA 124.098 0.959 . . . . 0.0 111.905 171.875 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 26' ' ' LYS . . . . . . . . . . . . . 11.2 tttt -153.47 -3.58 0.2 Allowed 'General case' 0 N--CA 1.47 0.542 0 N-CA-C 113.946 1.091 . . . . 0.0 113.946 -175.97 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 27' ' ' ASN . . . . . . . . . . . . . 43.4 m-80 -127.02 83.36 66.2 Favored Pre-proline 0 C--O 1.234 0.263 0 N-CA-C 107.543 -1.28 . . . . 0.0 107.543 -176.249 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 28' ' ' PRO . . . . . . . . . . . . . 49.2 Cg_endo -65.77 162.86 32.86 Favored 'Trans proline' 0 N--CA 1.453 -0.909 0 C-N-CA 121.817 1.678 . . . . 0.0 110.633 -176.559 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 29' ' ' PRO . . . . . . . . . . . . . 30.0 Cg_endo -65.29 84.8 0.2 Allowed 'Trans proline' 0 N--CA 1.449 -1.131 0 C-N-CA 122.437 2.091 . . . . 0.0 108.512 162.913 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 30' ' ' GLU . . . . . . . . . . . . . 11.6 pt-20 -105.49 162.21 13.67 Favored 'General case' 0 C--O 1.241 0.622 0 C-N-CA 124.337 1.055 . . . . 0.0 108.31 169.709 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 31' ' ' ILE . . . . . . . . . . . . . 20.2 tt -138.53 137.19 43.63 Favored 'Isoleucine or valine' 0 N--CA 1.447 -0.622 0 C-N-CA 127.606 2.363 . . . . 0.0 105.501 177.894 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 32' ' ' SER . . . . . . . . . . . . . 1.5 m -131.39 163.72 27.26 Favored 'General case' 0 N--CA 1.447 -0.622 0 N-CA-C 107.974 -1.121 . . . . 0.0 107.974 174.159 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 33' ' ' PHE . . . . . . . . . . . . . 35.3 m-85 -131.65 166.6 21.1 Favored 'General case' 0 N--CA 1.445 -0.679 0 N-CA-C 107.097 -1.446 . . . . 0.0 107.097 -179.698 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 34' ' ' GLY . . . . . . . . . . . . . . . 166.93 141.15 3.07 Favored Glycine 0 CA--C 1.503 -0.659 0 N-CA-C 108.208 -1.957 . . . . 0.0 108.208 -174.966 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 35' ' ' GLU . . . . . . . . . . . . . 90.8 mt-10 59.64 108.83 0.02 OUTLIER 'General case' 0 C--O 1.222 -0.348 0 C-N-CA 127.698 2.399 . . . . 0.0 110.675 -176.612 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 35.5 mtpt 61.48 12.31 4.33 Favored 'General case' 0 N--CA 1.473 0.701 0 N-CA-C 115.312 1.597 . . . . 0.0 115.312 169.486 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 37' ' ' MET . . . . . . . . . . . . . 13.5 mmm 58.06 49.84 10.97 Favored 'General case' 0 CA--C 1.537 0.479 0 C-N-CA 124.35 1.06 . . . . 0.0 112.488 -161.097 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 38' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -63.27 167.13 5.48 Favored 'General case' 0 N--CA 1.452 -0.346 0 O-C-N 120.624 -1.298 . . . . 0.0 109.279 150.017 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 39' ' ' ILE . . . . . . . . . . . . . 10.3 mt -132.61 133.46 59.53 Favored 'Isoleucine or valine' 0 C--O 1.238 0.477 0 C-N-CA 125.503 1.521 . . . . 0.0 107.214 -179.223 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 40' ' ' SER . . . . . . . . . . . . . 16.4 m -131.47 151.84 51.22 Favored 'General case' 0 C--N 1.33 -0.268 0 N-CA-C 106.887 -1.523 . . . . 0.0 106.887 156.361 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 41' ' ' GLY . . . . . . . . . . . . . . . -178.06 178.42 48.51 Favored Glycine 0 N--CA 1.446 -0.699 0 N-CA-C 109.767 -1.333 . . . . 0.0 109.767 174.158 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 42' ' ' SER . . . . . . . . . . . . . 6.1 p -151.95 84.53 1.28 Allowed 'General case' 0 N--CA 1.445 -0.687 0 N-CA-C 108.978 -0.749 . . . . 0.0 108.978 -169.673 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 43' ' ' MET . . . . . . . . . . . . . 17.5 mmm -60.81 -46.38 90.73 Favored 'General case' 0 C--N 1.341 0.228 0 N-CA-C 108.43 -0.952 . . . . 0.0 108.43 169.726 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 44' ' ' CYS . . . . . 1.282 ' SG ' ' SG ' ' A' ' 70' ' ' CYS . 2.2 t -159.84 -66.93 0.07 Allowed 'General case' 0 N--CA 1.433 -1.319 0 N-CA-C 105.14 -2.17 . . . . 0.0 105.14 165.559 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 45' ' ' ASN . . . . . . . . . . . . . 5.0 m-80 -74.63 10.96 1.14 Allowed 'General case' 0 N--CA 1.471 0.595 0 C-N-CA 125.633 1.573 . . . . 0.0 114.682 -166.89 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 46' ' ' ARG . . . . . . . . . . . . . 6.7 mmm-85 56.46 164.79 0.02 OUTLIER 'General case' 0 C--N 1.332 -0.195 0 C-N-CA 126.671 1.988 . . . . 0.0 112.695 -169.329 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 47' ' ' PHE . . . . . . . . . . . . . 53.0 p90 -167.05 165.21 15.84 Favored 'General case' 0 C--N 1.325 -0.496 0 C-N-CA 125.561 1.544 . . . . 0.0 107.727 178.403 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 48' ' ' SER . . . . . . . . . . . . . 0.5 OUTLIER -168.54 141.37 2.93 Favored 'General case' 0 C--N 1.329 -0.303 0 C-N-CA 125.611 1.564 . . . . 0.0 107.742 171.688 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 49' ' ' GLY . . . . . . . . . . . . . . . -152.94 163.33 30.44 Favored Glycine 0 CA--C 1.53 1.028 0 N-CA-C 111.019 -0.832 . . . . 0.0 111.019 175.21 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 50' ' ' GLU . . . . . . . . . . . . . 9.9 pt-20 -63.76 83.18 0.03 OUTLIER 'General case' 0 CA--C 1.538 0.504 0 C-N-CA 128.258 2.623 . . . . 0.0 110.038 172.432 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 51' ' ' GLY . . . . . . . . . . . . . . . -63.8 -76.79 0.26 Allowed Glycine 0 N--CA 1.466 0.635 0 O-C-N 121.386 -0.821 . . . . 0.0 113.355 -166.754 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 52' ' ' LYS . . . . . . . . . . . . . 3.4 ttpm? 57.33 126.94 0.0 OUTLIER 'General case' 0 C--N 1.331 -0.208 0 C-N-CA 130.631 3.573 . . . . 0.0 112.797 176.518 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 53' ' ' LEU . . . . . . . . . . . . . 32.4 tp -125.07 119.45 28.67 Favored 'General case' 0 N--CA 1.467 0.405 0 O-C-N 121.643 -0.661 . . . . 0.0 110.339 -174.341 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 10.0 t -145.1 -17.09 0.5 Allowed 'General case' 0 CA--C 1.539 0.551 0 C-N-CA 125.185 1.394 . . . . 0.0 110.692 178.703 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 55' ' ' ASN . . . . . . . . . . . . . 6.6 m-20 -129.3 6.65 5.33 Favored 'General case' 0 CA--C 1.536 0.416 0 CA-C-N 119.331 0.969 . . . . 0.0 112.275 -159.734 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 56' ' ' GLY . . . . . . . . . . . . . . . 75.06 4.66 73.25 Favored Glycine 0 CA--C 1.532 1.124 0 O-C-N 121.451 -0.781 . . . . 0.0 112.237 -165.792 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 57' ' ' GLU . . . . . . . . . . . . . 33.2 tt0 -121.03 131.24 54.16 Favored 'General case' 0 C--O 1.234 0.28 0 CA-C-N 118.443 1.121 . . . . 0.0 108.698 -169.052 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 58' ' ' LEU . . . . . . . . . . . . . 47.0 tp -116.65 98.64 6.64 Favored 'General case' 0 C--O 1.236 0.352 0 C-N-CA 124.814 1.246 . . . . 0.0 108.864 173.713 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 59' ' ' THR . . . . . . . . . . . . . 2.1 p -85.34 169.73 13.44 Favored 'General case' 0 C--N 1.327 -0.379 0 C-N-CA 123.961 0.904 . . . . 0.0 111.945 172.492 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 60' ' ' ALA . . . . . . . . . . . . . . . -142.94 103.76 4.22 Favored 'General case' 0 N--CA 1.455 -0.18 0 C-N-CA 125.995 1.718 . . . . 0.0 109.437 148.567 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 61' ' ' LYS . . . . . . . . . . . . . 45.5 tttt -69.23 -18.45 63.88 Favored 'General case' 0 CA--C 1.542 0.672 0 CA-C-O 118.892 -0.575 . . . . 0.0 111.988 173.598 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 62' ' ' GLY . . . . . . . . . . . . . . . -102.84 -83.85 1.75 Allowed Glycine 0 CA--C 1.526 0.73 0 C-N-CA 124.521 1.058 . . . . 0.0 110.764 176.382 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 63' ' ' LEU . . . . . . . . . . . . . 2.4 tp 65.03 79.06 0.26 Allowed 'General case' 0 N--CA 1.448 -0.546 0 C-N-CA 129.442 3.097 . . . . 0.0 114.379 -178.003 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 64' ' ' ALA . . . . . . . . . . . . . . . -70.09 92.65 0.76 Allowed 'General case' 0 CA--C 1.539 0.525 0 C-N-CA 125.121 1.368 . . . . 0.0 112.367 178.591 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 65' ' ' MET . . . . . . . . . . . . . 52.8 mtp -99.22 173.81 6.61 Favored 'General case' 0 N--CA 1.472 0.628 0 C-N-CA 124.649 1.18 . . . . 0.0 111.45 176.205 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 66' ' ' THR . . . . . . . . . . . . . 5.5 p -115.76 -164.84 0.98 Allowed 'General case' 0 CA--C 1.547 0.836 0 C-N-CA 124.725 1.21 . . . . 0.0 112.104 -178.429 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 67' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -141.26 31.53 1.73 Allowed 'General case' 0 N--CA 1.474 0.772 0 C-N-CA 126.449 1.9 . . . . 0.0 112.332 -173.265 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 68' ' ' MET . . . . . . . . . . . . . 76.6 mtm -76.71 179.97 5.72 Favored 'General case' 0 CA--C 1.545 0.785 0 C-N-CA 125.302 1.441 . . . . 0.0 109.969 173.079 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 69' ' ' MET . . . . . . . . . . . . . 1.5 mpp? -110.91 168.63 9.34 Favored 'General case' 0 C--O 1.237 0.417 0 C-N-CA 128.415 2.686 . . . . 0.0 109.702 172.915 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 70' ' ' CYS . . . . . 1.282 ' SG ' ' SG ' ' A' ' 44' ' ' CYS . 1.7 m -140.12 150.26 44.05 Favored 'General case' 0 N--CA 1.469 0.487 0 C-N-CA 125.161 1.384 . . . . 0.0 112.427 176.522 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 71' ' ' ALA . . . . . . . . . . . . . . . -70.29 -10.96 60.47 Favored 'General case' 0 CA--C 1.534 0.354 0 C-N-CA 126.039 1.736 . . . . 0.0 114.91 -174.443 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 72' ' ' ASN . . . . . . . . . . . . . 61.3 t30 -135.67 142.53 41.22 Favored Pre-proline 0 C--O 1.235 0.303 0 N-CA-C 105.756 -1.942 . . . . 0.0 105.756 177.716 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 73' ' ' PRO . . . . . . . . . . . . . 87.2 Cg_endo -84.56 -23.95 2.55 Favored 'Trans proline' 0 N--CA 1.458 -0.575 0 CA-C-N 120.536 1.227 . . . . 0.0 111.384 -163.862 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 74' ' ' GLN . . . . . . . . . . . . . 57.4 tt0 -60.06 -43.63 95.29 Favored 'General case' 0 N--CA 1.452 -0.332 0 C-N-CA 123.574 0.75 . . . . 0.0 109.004 175.311 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 75' ' ' LEU . . . . . . . . . . . . . 65.3 mt -59.25 -45.91 89.91 Favored 'General case' 0 C--N 1.341 0.199 0 CA-C-N 118.213 0.461 . . . . 0.0 110.309 178.726 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 76' ' ' ASN . . . . . . . . . . . . . 27.2 t-20 -64.83 -49.63 69.85 Favored 'General case' 0 C--O 1.222 -0.368 0 N-CA-C 108.892 -0.781 . . . . 0.0 108.892 -176.768 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 77' ' ' GLU . . . . . . . . . . . . . 8.4 tt0 -56.61 -34.5 67.29 Favored 'General case' 0 CA--C 1.537 0.471 0 C-N-CA 125.392 1.477 . . . . 0.0 112.754 -178.961 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 78' ' ' LEU . . . . . . . . . . . . . 3.5 mp -67.51 -14.01 62.56 Favored 'General case' 0 C--O 1.236 0.348 0 C-N-CA 125.056 1.343 . . . . 0.0 112.758 -179.574 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 79' ' ' ASP . . . . . . . . . . . . . 5.0 p-10 -60.23 -38.0 82.05 Favored 'General case' 0 CA--C 1.52 -0.196 0 CA-C-N 119.217 0.917 . . . . 0.0 111.531 176.355 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 80' ' ' ASN . . . . . . . . . . . . . 63.3 m-20 -77.26 -38.81 50.17 Favored 'General case' 0 N--CA 1.445 -0.675 0 CA-C-O 118.11 -0.948 . . . . 0.0 109.999 178.02 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 81' ' ' THR . . . . . . . . . . . . . 41.7 m -54.62 -52.76 61.22 Favored 'General case' 0 C--N 1.341 0.199 0 CA-C-N 118.983 0.81 . . . . 0.0 109.73 179.336 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 82' ' ' ILE . . . . . . . . . . . . . 9.6 tp -65.63 -36.89 78.69 Favored 'Isoleucine or valine' 0 CA--C 1.531 0.216 0 CA-C-N 118.842 0.746 . . . . 0.0 110.273 -175.182 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 83' ' ' SER . . . . . . . . . . . . . 10.8 t -58.11 -49.33 77.32 Favored 'General case' 0 C--O 1.234 0.269 0 CA-C-N 117.994 0.361 . . . . 0.0 110.897 174.819 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 84' ' ' GLU . . . . . . . . . . . . . 78.1 tt0 -78.18 -7.64 57.32 Favored 'General case' 0 C--N 1.327 -0.411 0 C-N-CA 126.593 1.957 . . . . 0.0 111.62 -175.557 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 85' ' ' MET . . . . . . . . . . . . . 81.5 mtp -90.28 -52.19 5.06 Favored 'General case' 0 CA--C 1.515 -0.371 0 CA-C-N 120.999 1.727 . . . . 0.0 110.373 167.243 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 86' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -66.47 -29.67 69.85 Favored 'General case' 0 N--CA 1.453 -0.293 0 CA-C-O 118.816 -0.612 . . . . 0.0 110.882 -169.387 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 87' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -58.84 -56.82 17.29 Favored 'General case' 0 N--CA 1.452 -0.357 0 CA-C-N 119.345 0.975 . . . . 0.0 112.405 -171.933 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 88' ' ' GLU . . . . . . . . . . . . . 81.1 mt-10 -73.39 -34.98 65.81 Favored 'General case' 0 C--N 1.331 -0.204 0 C-N-CA 123.137 0.575 . . . . 0.0 110.855 -175.327 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 89' ' ' GLY . . . . . . . . . . . . . . . 123.13 104.35 1.71 Allowed Glycine 0 C--N 1.333 0.365 0 N-CA-C 107.373 -2.291 . . . . 0.0 107.373 -176.108 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 90' ' ' ALA . . . . . . . . . . . . . . . -74.96 137.15 41.42 Favored 'General case' 0 N--CA 1.451 -0.424 0 N-CA-C 107.873 -1.158 . . . . 0.0 107.873 170.768 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 91' ' ' GLN . . . . . . . . . . . . . 17.9 mp0 -65.83 121.98 16.28 Favored 'General case' 0 N--CA 1.442 -0.844 0 N-CA-C 104.738 -2.319 . . . . 0.0 104.738 159.369 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 92' ' ' VAL . . . . . . . . . . . . . 25.2 t -107.33 119.91 57.76 Favored 'Isoleucine or valine' 0 N--CA 1.44 -0.968 0 N-CA-C 104.83 -2.285 . . . . 0.0 104.83 174.229 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 93' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -134.33 104.04 5.98 Favored 'General case' 0 N--CA 1.452 -0.338 0 N-CA-C 107.049 -1.463 . . . . 0.0 107.049 176.773 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 94' ' ' LEU . . . . . . . . . . . . . 27.1 tp -98.2 118.49 34.95 Favored 'General case' 0 CA--C 1.515 -0.39 0 N-CA-C 106.823 -1.547 . . . . 0.0 106.823 173.854 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 95' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -80.71 -165.4 0.88 Allowed 'General case' 0 C--N 1.323 -0.569 0 C-N-CA 124.429 1.091 . . . . 0.0 109.494 165.846 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 96' ' ' ALA . . . . . . . . . . . . . . . -47.74 -52.13 19.67 Favored 'General case' 0 CA--C 1.541 0.633 0 O-C-N 120.524 -1.36 . . . . 0.0 113.143 -179.887 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 97' ' ' ASN . . . . . . . . . . . . . 0.0 OUTLIER -135.26 8.52 3.43 Favored 'General case' 0 N--CA 1.478 0.961 0 N-CA-C 114.05 1.129 . . . . 0.0 114.05 -177.942 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 98' ' ' GLN . . . . . . . . . . . . . 18.4 tt0 -136.79 124.78 22.79 Favored 'General case' 0 N--CA 1.453 -0.294 0 O-C-N 121.233 -0.917 . . . . 0.0 109.371 -170.111 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 99' ' ' LEU . . . . . 0.461 HD22 ' CD2' ' A' ' 101' ' ' LEU . 1.0 OUTLIER -88.45 142.24 27.88 Favored 'General case' 0 N--CA 1.449 -0.515 0 C-N-CA 125.453 1.501 . . . . 0.0 109.229 175.521 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild core ' A' A ' 100' ' ' THR . . . . . . . . . . . . . 79.3 m -122.99 115.55 22.07 Favored 'General case' 0 C--N 1.322 -0.622 0 N-CA-C 105.436 -2.061 . . . . 0.0 105.436 171.685 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 101' ' ' LEU . . . . . 0.461 ' CD2' HD22 ' A' ' 99' ' ' LEU . 0.6 OUTLIER -112.93 101.35 9.41 Favored 'General case' 0 CA--C 1.51 -0.585 0 C-N-CA 126.109 1.764 . . . . 0.0 107.153 -179.05 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild core ' A' A ' 102' ' ' ALA . . . . . . . . . . . . . . . -117.69 152.49 35.12 Favored 'General case' 0 C--N 1.326 -0.444 0 C-N-CA 123.284 0.634 . . . . 0.0 109.59 -177.622 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 103' ' ' THR . . . . . . . . . . . . . 0.4 OUTLIER -159.09 176.12 12.66 Favored 'General case' 0 N--CA 1.44 -0.97 0 C-N-CA 126.481 1.912 . . . . 0.0 106.659 176.147 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 104' ' ' ALA . . . . . . . . . . . . . . . -62.58 -14.01 37.82 Favored 'General case' 0 CA--C 1.536 0.424 0 N-CA-C 113.338 0.866 . . . . 0.0 113.338 173.669 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 105' ' ' LYS . . . . . . . . . . . . . 12.6 tppt? -73.79 -75.76 0.14 Allowed 'General case' 0 N--CA 1.437 -1.084 0 C-N-CA 125.302 1.441 . . . . 0.0 107.461 176.154 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 106' ' ' GLN . . . . . . . . . . . . . 14.5 mt-30 -165.27 178.78 6.66 Favored 'General case' 0 CA--C 1.542 0.646 0 C-N-CA 128.605 2.762 . . . . 0.0 104.834 -169.213 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 107' ' ' THR . . . . . . . . . . . . . 4.6 t -131.42 141.85 49.92 Favored 'General case' 0 CA--C 1.539 0.547 0 C-N-CA 124.796 1.238 . . . . 0.0 110.237 -173.533 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 108' ' ' LEU . . . . . . . . . . . . . 8.9 mp -126.21 154.34 43.41 Favored 'General case' 0 C--O 1.234 0.265 0 C-N-CA 128.419 2.687 . . . . 0.0 108.596 -171.146 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 109' ' ' THR . . . . . . . . . . . . . 27.2 m -123.01 117.74 26.17 Favored 'General case' 0 N--CA 1.466 0.363 0 C-N-CA 123.409 0.684 . . . . 0.0 109.238 173.911 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 110' ' ' TYR . . . . . . . . . . . . . 73.9 m-85 -108.86 160.72 15.76 Favored 'General case' 0 CA--C 1.539 0.523 0 C-N-CA 123.461 0.704 . . . . 0.0 109.508 174.772 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 111' ' ' LYS . . . . . . . . . . . . . 2.1 tppt? -114.83 147.69 39.5 Favored 'General case' 0 N--CA 1.467 0.413 0 C-N-CA 124.603 1.161 . . . . 0.0 110.068 -178.944 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 112' ' ' LEU . . . . . . . . . . . . . 23.9 tp -73.43 38.33 0.09 Allowed 'General case' 0 CA--C 1.542 0.654 0 C-N-CA 127.379 2.272 . . . . 0.0 111.871 171.76 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 113' ' ' ALA . . . . . . . . . . . . . . . -77.05 88.06 3.56 Favored 'General case' 0 C--N 1.324 -0.535 0 O-C-N 119.234 -2.166 . . . . 0.0 109.453 -176.878 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 114' ' ' ASP . . . . . . . . . . . . 0.31 29.8 p-10 . . . . . 0 N--CA 1.464 0.264 0 CA-C-O 123.712 1.72 . . . . 0.0 113.324 -173.134 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 24.6 tpp . . . . . 0 C--O 1.24 0.597 0 N-CA-C 108.895 -0.78 . . . . 0.0 108.895 . . . . . . . . . 0 0 . 1 . 017 nuclear nobuild core ' A' A ' 2' ' ' VAL . . . . . . . . . . . . . 10.0 p -53.9 118.71 1.25 Allowed 'Isoleucine or valine' 0 N--CA 1.449 -0.485 0 C-N-CA 123.884 0.873 . . . . 0.0 109.128 -178.016 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 3' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -128.56 157.53 74.71 Favored Pre-proline 0 N--CA 1.449 -0.501 0 N-CA-C 109.287 -0.634 . . . . 0.0 109.287 -167.776 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 4' ' ' PRO . . . . . . . . . . . . . 21.7 Cg_endo -63.62 -48.45 5.66 Favored 'Trans proline' 0 N--CA 1.456 -0.691 0 C-N-CA 122.74 2.293 . . . . 0.0 111.787 -176.469 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 5' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER -68.17 -12.66 61.32 Favored 'General case' 0 C--N 1.325 -0.491 0 N-CA-C 113.722 1.008 . . . . 0.0 113.722 -173.007 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 6' ' ' GLN . . . . . . . . . . . . . 11.1 pt20 -93.85 15.21 17.18 Favored 'General case' 0 CA--C 1.54 0.566 0 N-CA-C 113.908 1.077 . . . . 0.0 113.908 167.442 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 7' ' ' LEU . . . . . . . . . . . . . 90.6 mt -129.88 -44.76 1.18 Allowed 'General case' 0 N--CA 1.469 0.508 0 C-N-CA 124.569 1.148 . . . . 0.0 111.949 -175.639 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 8' ' ' GLN . . . . . . . . . . . . . 1.5 mp0 -56.64 2.32 0.02 OUTLIER 'General case' 0 N--CA 1.472 0.671 0 N-CA-C 118.353 2.723 . . . . 0.0 118.353 -176.059 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 9' ' ' HIS . . . . . . . . . . . . . 5.7 m-70 -139.66 10.58 2.46 Favored 'General case' 0 C--N 1.319 -0.739 0 C-N-CA 127.946 2.498 . . . . 0.0 112.516 179.95 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 10' ' ' HIS . . . . . . . . . . . . . 27.8 m-70 -133.25 110.54 10.17 Favored 'General case' 0 N--CA 1.455 -0.214 0 C-N-CA 124.153 0.981 . . . . 0.0 108.687 -161.462 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 11' ' ' ARG . . . . . . . . . . . . . 20.7 ttt-85 -68.74 147.11 52.28 Favored 'General case' 0 N--CA 1.465 0.315 0 N-CA-C 108.444 -0.947 . . . . 0.0 108.444 172.915 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 12' ' ' PHE . . . . . . . . . . . . . 46.5 m-85 -127.83 161.07 29.87 Favored 'General case' 0 N--CA 1.45 -0.448 0 N-CA-C 107.648 -1.242 . . . . 0.0 107.648 165.502 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 13' ' ' VAL . . . . . 0.425 ' HA ' ' HA ' ' A' ' 30' ' ' GLU . 7.5 p -131.44 143.17 41.33 Favored 'Isoleucine or valine' 0 CA--C 1.512 -0.484 0 N-CA-C 108.188 -1.041 . . . . 0.0 108.188 172.045 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 14' ' ' LEU . . . . . . . . . . . . . 5.6 tt -70.04 110.19 4.96 Favored 'General case' 0 N--CA 1.441 -0.903 0 N-CA-C 107.874 -1.158 . . . . 0.0 107.874 179.977 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 15' ' ' GLU . . . . . 0.432 ' H ' ' HA ' ' A' ' 110' ' ' TYR . 3.1 tt0 -86.0 -42.05 14.33 Favored 'General case' 0 N--CA 1.438 -1.043 0 O-C-N 124.013 0.821 . . . . 0.0 110.217 -169.371 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 12.6 p -154.33 142.81 20.66 Favored 'General case' 0 N--CA 1.448 -0.555 0 CA-C-O 121.735 0.779 . . . . 0.0 109.834 168.369 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 17' ' ' VAL . . . . . 0.574 HG12 ' H ' ' A' ' 18' ' ' ASN . 23.2 t -75.62 175.08 0.76 Allowed 'Isoleucine or valine' 0 CA--C 1.536 0.409 0 N-CA-C 107.028 -1.471 . . . . 0.0 107.028 168.401 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 18' ' ' ASN . . . . . 0.574 ' H ' HG12 ' A' ' 17' ' ' VAL . 10.6 t30 -43.9 -51.6 7.44 Favored 'General case' 0 C--N 1.34 0.194 0 C-N-CA 124.533 1.133 . . . . 0.0 112.628 -171.554 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . -78.29 -66.21 1.77 Allowed Glycine 0 N--CA 1.444 -0.812 0 O-C-N 123.725 0.641 . . . . 0.0 111.609 176.28 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 0.8 OUTLIER -139.68 165.75 29.06 Favored Pre-proline 0 CA--C 1.532 0.259 0 CA-C-N 117.752 0.776 . . . . 0.0 112.917 -159.126 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 21' ' ' PRO . . . . . . . . . . . . . 56.5 Cg_endo -61.46 -176.9 0.19 Allowed 'Trans proline' 0 N--CA 1.457 -0.654 0 C-N-CA 124.094 3.196 . . . . 0.0 113.185 176.627 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 22' ' ' VAL . . . . . . . . . . . . . 81.6 t -120.86 155.36 24.36 Favored 'Isoleucine or valine' 0 N--CA 1.448 -0.544 0 C-N-CA 126.576 1.95 . . . . 0.0 109.208 -179.227 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 23' ' ' THR . . . . . . . . . . . . . 11.3 t -141.17 114.36 8.63 Favored 'General case' 0 C--O 1.235 0.292 0 CA-C-O 123.259 1.504 . . . . 0.0 111.844 168.169 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 24' ' ' SER . . . . . . . . . . . . . 39.1 t -158.18 94.91 1.33 Allowed 'General case' 0 C--N 1.319 -0.74 0 N-CA-C 105.017 -2.216 . . . . 0.0 105.017 172.433 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 25' ' ' ASP . . . . . . . . . . . . . 0.7 OUTLIER -80.06 38.97 0.42 Allowed 'General case' 0 N--CA 1.468 0.451 0 C-N-CA 125.467 1.507 . . . . 0.0 110.552 -176.297 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 26' ' ' LYS . . . . . . . . . . . . . 33.0 ttpt -151.28 -46.73 0.11 Allowed 'General case' 0 CA--C 1.508 -0.654 0 O-C-N 120.268 -1.52 . . . . 0.0 112.083 178.181 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 27' ' ' ASN . . . . . . . . . . . . . 0.0 OUTLIER -150.79 83.27 5.8 Favored Pre-proline 0 C--N 1.319 -0.739 0 N-CA-C 106.708 -1.59 . . . . 0.0 106.708 176.644 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 28' ' ' PRO . . . . . . . . . . . . . 75.2 Cg_endo -71.19 170.74 17.48 Favored 'Trans proline' 0 N--CA 1.454 -0.83 0 C-N-CA 122.171 1.914 . . . . 0.0 109.257 167.561 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 29' ' ' PRO . . . . . . . . . . . . . 37.6 Cg_endo -70.85 63.91 2.43 Favored 'Trans proline' 0 N--CA 1.457 -0.656 0 C-N-CA 124.065 3.177 . . . . 0.0 111.063 173.469 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 30' ' ' GLU . . . . . 0.425 ' HA ' ' HA ' ' A' ' 13' ' ' VAL . 2.4 pt-20 -78.66 168.82 19.2 Favored 'General case' 0 C--O 1.239 0.505 0 O-C-N 120.09 -1.631 . . . . 0.0 109.2 172.608 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 31' ' ' ILE . . . . . . . . . . . . . 14.4 tt -144.16 152.68 15.62 Favored 'Isoleucine or valine' 0 C--O 1.237 0.434 0 N-CA-C 107.641 -1.244 . . . . 0.0 107.641 -177.202 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 32' ' ' SER . . . . . . . . . . . . . 41.1 p -147.09 165.89 28.55 Favored 'General case' 0 N--CA 1.444 -0.747 0 CA-C-O 121.666 0.746 . . . . 0.0 109.372 178.154 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 33' ' ' PHE . . . . . . . . . . . . . 78.5 m-85 -146.13 125.67 13.27 Favored 'General case' 0 N--CA 1.445 -0.713 0 N-CA-C 105.623 -1.992 . . . . 0.0 105.623 -168.373 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 34' ' ' GLY . . . . . . . . . . . . . . . -156.19 167.13 33.31 Favored Glycine 0 CA--C 1.53 1.02 0 N-CA-C 109.631 -1.387 . . . . 0.0 109.631 160.729 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 35' ' ' GLU . . . . . . . . . . . . . 4.6 mt-10 56.54 89.63 0.04 OUTLIER 'General case' 0 N--CA 1.468 0.438 0 C-N-CA 126.945 2.098 . . . . 0.0 113.869 168.641 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 44.3 mtmt 74.14 32.35 1.03 Allowed 'General case' 0 N--CA 1.474 0.769 0 C-N-CA 127.472 2.309 . . . . 0.0 113.204 176.097 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 37' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER 59.03 33.86 23.21 Favored 'General case' 0 CA--C 1.54 0.585 0 C-N-CA 123.791 0.836 . . . . 0.0 110.21 -176.931 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 38' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -67.5 171.38 6.22 Favored 'General case' 0 N--CA 1.453 -0.278 0 O-C-N 120.902 -1.124 . . . . 0.0 111.115 170.535 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 39' ' ' ILE . . . . . . . . . . . . . 27.6 mt -137.33 109.34 6.72 Favored 'Isoleucine or valine' 0 C--O 1.235 0.325 0 N-CA-C 108.061 -1.089 . . . . 0.0 108.061 -176.452 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 40' ' ' SER . . . . . . . . . . . . . 34.7 m -90.1 137.93 31.94 Favored 'General case' 0 C--N 1.33 -0.246 0 C-N-CA 123.601 0.76 . . . . 0.0 109.027 158.642 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 41' ' ' GLY . . . . . . . . . . . . . . . -160.6 -179.33 35.29 Favored Glycine 0 CA--C 1.525 0.668 0 N-CA-C 110.254 -1.139 . . . . 0.0 110.254 165.257 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 42' ' ' SER . . . . . 0.508 ' HB3' ' HA ' ' A' ' 46' ' ' ARG . 1.8 p -160.34 92.78 1.0 Allowed 'General case' 0 N--CA 1.454 -0.24 0 CA-C-N 118.841 1.32 . . . . 0.0 111.254 174.439 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 43' ' ' MET . . . . . . . . . . . . . 9.2 mmt -64.73 -66.94 0.48 Allowed 'General case' 0 C--O 1.232 0.149 0 N-CA-C 109.498 -0.556 . . . . 0.0 109.498 175.316 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 44' ' ' CYS . . . . . 1.283 ' SG ' ' SG ' ' A' ' 70' ' ' CYS . 44.8 t -132.72 -59.83 0.89 Allowed 'General case' 0 N--CA 1.452 -0.358 0 N-CA-C 106.426 -1.694 . . . . 0.0 106.426 168.449 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 45' ' ' ASN . . . . . . . . . . . . . 4.8 m120 -80.34 27.56 0.34 Allowed 'General case' 0 C--N 1.328 -0.329 0 C-N-CA 128.665 2.786 . . . . 0.0 112.064 -165.453 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 46' ' ' ARG . . . . . 0.508 ' HA ' ' HB3' ' A' ' 42' ' ' SER . 0.0 OUTLIER 52.55 -166.19 0.06 Allowed 'General case' 0 C--N 1.327 -0.41 0 C-N-CA 124.769 1.228 . . . . 0.0 108.021 -157.275 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild core ' A' A ' 47' ' ' PHE . . . . . 0.481 ' HA ' ' HB3' ' A' ' 65' ' ' MET . 6.3 p90 -178.42 170.43 1.69 Allowed 'General case' 0 C--O 1.237 0.446 0 C-N-CA 129.19 2.996 . . . . 0.0 107.984 147.616 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 48' ' ' SER . . . . . . . . . . . . . 1.5 p -166.1 160.63 16.53 Favored 'General case' 0 C--N 1.322 -0.6 0 C-N-CA 126.192 1.797 . . . . 0.0 108.751 178.153 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 49' ' ' GLY . . . . . . . . . . . . . . . 177.83 163.1 28.98 Favored Glycine 0 C--N 1.332 0.337 0 N-CA-C 110.721 -0.951 . . . . 0.0 110.721 163.16 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 50' ' ' GLU . . . . . . . . . . . . . 11.1 pt-20 -68.52 100.31 1.09 Allowed 'General case' 0 N--CA 1.449 -0.493 0 CA-C-O 122.048 0.928 . . . . 0.0 108.721 173.525 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 51' ' ' GLY . . . . . . . . . . . . . . . -77.04 171.88 55.14 Favored Glycine 0 CA--C 1.529 0.945 0 C-N-CA 124.224 0.916 . . . . 0.0 111.912 171.421 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 52' ' ' LYS . . . . . . . . . . . . . 6.2 ttpm? -156.9 148.62 22.57 Favored 'General case' 0 N--CA 1.464 0.247 0 C-N-CA 124.916 1.287 . . . . 0.0 108.066 166.444 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 53' ' ' LEU . . . . . . . . . . . . . 50.7 tp -148.37 142.65 26.18 Favored 'General case' 0 C--N 1.338 0.069 0 C-N-CA 124.512 1.125 . . . . 0.0 109.141 174.655 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 23.1 t -156.21 -61.88 0.1 Allowed 'General case' 0 CA--C 1.535 0.393 0 C-N-CA 125.389 1.475 . . . . 0.0 107.792 173.599 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 55' ' ' ASN . . . . . . . . . . . . . 20.7 p-10 -65.46 -58.67 5.25 Favored 'General case' 0 N--CA 1.464 0.265 0 C-N-CA 125.711 1.604 . . . . 0.0 113.016 177.818 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 56' ' ' GLY . . . . . . . . . . . . . . . 150.96 14.16 0.08 OUTLIER Glycine 0 CA--C 1.529 0.944 0 C-N-CA 123.489 0.566 . . . . 0.0 111.911 -163.573 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 57' ' ' GLU . . . . . . . . . . . . . 26.8 tt0 -131.96 115.84 16.37 Favored 'General case' 0 CA--C 1.533 0.29 0 CA-C-N 118.185 0.992 . . . . 0.0 109.146 -175.654 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 58' ' ' LEU . . . . . . . . . . . . . 37.8 tp -93.13 102.4 14.71 Favored 'General case' 0 C--O 1.236 0.366 0 C-N-CA 127.291 2.237 . . . . 0.0 110.159 -177.503 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 59' ' ' THR . . . . . . . . . . . . . 18.2 p -94.68 163.59 13.31 Favored 'General case' 0 CA--C 1.533 0.313 0 C-N-CA 122.945 0.498 . . . . 0.0 110.036 168.122 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 60' ' ' ALA . . . . . . . . . . . . . . . -147.24 103.48 3.58 Favored 'General case' 0 C--N 1.342 0.273 0 C-N-CA 123.673 0.789 . . . . 0.0 111.218 155.465 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 61' ' ' LYS . . . . . . . . . . . . . 73.6 tttt -86.47 77.62 9.4 Favored 'General case' 0 N--CA 1.463 0.18 0 C-N-CA 124.496 1.118 . . . . 0.0 109.48 178.201 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 62' ' ' GLY . . . . . . . . . . . . . . . 148.01 80.44 0.03 OUTLIER Glycine 0 N--CA 1.464 0.526 0 N-CA-C 110.161 -1.176 . . . . 0.0 110.161 175.14 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 63' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -117.47 83.22 1.95 Allowed 'General case' 0 N--CA 1.439 -0.98 0 C-N-CA 124.294 1.038 . . . . 0.0 110.065 -159.609 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 64' ' ' ALA . . . . . . . . . . . . . . . -77.68 96.17 4.79 Favored 'General case' 0 C--O 1.244 0.777 0 C-N-CA 126.034 1.733 . . . . 0.0 112.134 179.756 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 65' ' ' MET . . . . . 0.481 ' HB3' ' HA ' ' A' ' 47' ' ' PHE 0.259 6.5 ptm -124.61 172.3 9.35 Favored 'General case' 0 CA--C 1.531 0.235 0 C-N-CA 123.706 0.803 . . . . 0.0 109.787 170.611 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild core ' A' A ' 66' ' ' THR . . . . . . . . . . . . . 15.8 p -104.85 -165.09 1.1 Allowed 'General case' 0 C--N 1.326 -0.455 0 C-N-CA 124.371 1.068 . . . . 0.0 109.503 -162.25 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 67' ' ' ARG . . . . . . . . . . . . . 0.5 OUTLIER -133.5 26.03 4.09 Favored 'General case' 0 C--O 1.237 0.404 0 C-N-CA 125.416 1.486 . . . . 0.0 112.075 -178.181 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 68' ' ' MET . . . . . . . . . . . . . 18.2 ptm -73.26 -169.68 0.67 Allowed 'General case' 0 CA--C 1.536 0.436 0 C-N-CA 125.321 1.448 . . . . 0.0 110.467 172.693 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 69' ' ' MET . . . . . . . . . . . . . 0.8 OUTLIER -142.6 -179.16 6.14 Favored 'General case' 0 C--O 1.238 0.49 0 C-N-CA 127.157 2.183 . . . . 0.0 109.03 -179.715 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 70' ' ' CYS . . . . . 1.283 ' SG ' ' SG ' ' A' ' 44' ' ' CYS . 70.0 m -149.21 163.71 36.86 Favored 'General case' 0 N--CA 1.455 -0.194 0 C-N-CA 124.417 1.087 . . . . 0.0 111.157 -176.581 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 71' ' ' ALA . . . . . . . . . . . . . . . -69.65 11.9 0.23 Allowed 'General case' 0 CA--C 1.54 0.592 0 C-N-CA 126.377 1.871 . . . . 0.0 113.874 178.214 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 72' ' ' ASN . . . . . . . . . . . . . 13.7 t30 -147.3 143.72 18.53 Favored Pre-proline 0 C--O 1.235 0.305 0 O-C-N 120.667 -1.27 . . . . 0.0 108.598 179.991 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 73' ' ' PRO . . . . . . . . . . . . . 68.1 Cg_endo -75.63 -25.42 10.92 Favored 'Trans proline' 0 N--CA 1.459 -0.556 0 C-N-CA 122.055 1.837 . . . . 0.0 111.601 179.919 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 74' ' ' GLN . . . . . . . . . . . . . 54.1 tt0 -70.13 -48.53 57.1 Favored 'General case' 0 N--CA 1.451 -0.385 0 C-N-CA 124.129 0.971 . . . . 0.0 109.606 -179.341 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 75' ' ' LEU . . . . . . . . . . . . . 41.5 mt -54.71 -45.15 73.97 Favored 'General case' 0 N--CA 1.471 0.612 0 CA-C-N 118.873 0.761 . . . . 0.0 109.149 174.528 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 76' ' ' ASN . . . . . . . . . . . . . 15.0 t-20 -61.07 -39.62 90.58 Favored 'General case' 0 CA--C 1.535 0.366 0 C-N-CA 124.236 1.015 . . . . 0.0 111.166 -175.787 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 77' ' ' GLU . . . . . . . . . . . . . 5.8 tm-20 -81.45 -30.8 33.33 Favored 'General case' 0 N--CA 1.455 -0.221 0 C-N-CA 125.721 1.608 . . . . 0.0 113.349 -177.889 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 78' ' ' LEU . . . . . . . . . . . . . 9.2 mt -61.12 -25.92 67.32 Favored 'General case' 0 N--CA 1.466 0.341 0 C-N-CA 123.231 0.612 . . . . 0.0 112.393 -179.796 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 79' ' ' ASP . . . . . . . . . . . . . 4.2 t70 -47.64 -49.56 26.94 Favored 'General case' 0 CA--C 1.517 -0.295 0 C-N-CA 125.912 1.685 . . . . 0.0 111.416 165.632 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 80' ' ' ASN . . . . . . . . . . . . . 2.7 m120 -74.34 -36.55 63.65 Favored 'General case' 0 N--CA 1.448 -0.568 0 CA-C-O 118.364 -0.827 . . . . 0.0 109.714 -175.234 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 81' ' ' THR . . . . . . . . . . . . . 89.9 m -54.11 -63.06 1.27 Allowed 'General case' 0 C--N 1.344 0.357 0 N-CA-C 108.054 -1.091 . . . . 0.0 108.054 172.152 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 82' ' ' ILE . . . . . 0.4 HD12 ' SD ' ' A' ' 85' ' ' MET . 10.9 tp -65.76 -39.05 83.7 Favored 'Isoleucine or valine' 0 N--CA 1.449 -0.506 0 CA-C-O 118.97 -0.538 . . . . 0.0 110.433 -165.643 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 83' ' ' SER . . . . . . . . . . . . . 8.6 t -61.55 -49.37 76.95 Favored 'General case' 0 N--CA 1.447 -0.592 0 N-CA-C 109.312 -0.625 . . . . 0.0 109.312 -177.842 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 84' ' ' GLU . . . . . . . . . . . . . 3.6 tp10 -67.55 -22.38 65.41 Favored 'General case' 0 CA--C 1.537 0.455 0 C-N-CA 123.738 0.815 . . . . 0.0 111.856 179.813 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 85' ' ' MET . . . . . 0.449 ' HA ' HG21 ' A' ' 103' ' ' THR . 7.1 ptm -87.6 -41.3 13.53 Favored 'General case' 0 CA--C 1.515 -0.388 0 N-CA-C 106.236 -1.765 . . . . 0.0 106.236 -171.691 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 86' ' ' LEU . . . . . . . . . . . . . 2.3 mm? -67.56 -25.57 65.86 Favored 'General case' 0 N--CA 1.439 -1.011 0 C-N-CA 119.272 -0.971 . . . . 0.0 111.926 -173.043 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 87' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -64.87 -53.95 38.62 Favored 'General case' 0 N--CA 1.448 -0.56 0 CA-C-O 118.799 -0.62 . . . . 0.0 110.785 -175.09 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 88' ' ' GLU . . . . . . . . . . . . . 12.4 pt-20 -71.49 -41.76 68.91 Favored 'General case' 0 C--O 1.234 0.255 0 CA-C-O 118.876 -0.583 . . . . 0.0 112.41 -176.092 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 89' ' ' GLY . . . . . . . . . . . . . . . 126.53 93.96 0.89 Allowed Glycine 0 C--N 1.334 0.457 0 N-CA-C 108.879 -1.689 . . . . 0.0 108.879 -173.405 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 90' ' ' ALA . . . . . . . . . . . . . . . -69.4 136.79 52.14 Favored 'General case' 0 N--CA 1.447 -0.612 0 N-CA-C 108.818 -0.808 . . . . 0.0 108.818 176.805 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 91' ' ' GLN . . . . . . . . . . . . . 29.0 mm-40 -74.89 92.71 2.57 Favored 'General case' 0 N--CA 1.446 -0.64 0 N-CA-C 105.011 -2.218 . . . . 0.0 105.011 177.974 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 92' ' ' VAL . . . . . . . . . . . . . 7.5 p -86.67 132.13 33.08 Favored 'Isoleucine or valine' 0 N--CA 1.443 -0.78 0 N-CA-C 106.007 -1.849 . . . . 0.0 106.007 179.955 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 93' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -137.61 152.43 49.35 Favored 'General case' 0 C--N 1.323 -0.559 0 N-CA-C 106.489 -1.671 . . . . 0.0 106.489 167.334 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 94' ' ' LEU . . . . . . . . . . . . . 54.1 tp -132.69 100.51 4.96 Favored 'General case' 0 CA--C 1.514 -0.429 0 CA-C-O 121.7 0.762 . . . . 0.0 108.968 -179.463 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 95' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -64.18 169.47 4.47 Favored 'General case' 0 C--N 1.323 -0.547 0 CA-C-N 113.718 -1.583 . . . . 0.0 109.831 164.099 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 96' ' ' ALA . . . . . . . . . . . . . . . -44.67 -24.54 0.2 Allowed 'General case' 0 N--CA 1.469 0.499 0 C-N-CA 127.952 2.501 . . . . 0.0 116.95 -170.93 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 97' ' ' ASN . . . . . . . . . . . . . 0.0 OUTLIER -155.39 6.71 0.24 Allowed 'General case' 0 CA--C 1.542 0.653 0 C-N-CA 126.551 1.94 . . . . 0.0 111.09 170.299 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 98' ' ' GLN . . . . . . . . . . . . . 25.7 tt0 -127.69 110.44 12.66 Favored 'General case' 0 N--CA 1.469 0.498 0 C-N-CA 125.383 1.473 . . . . 0.0 110.643 -170.382 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 99' ' ' LEU . . . . . 0.548 ' HB3' ' HB2' ' A' ' 110' ' ' TYR . 11.1 tp -75.01 143.72 43.44 Favored 'General case' 0 C--N 1.321 -0.667 0 C-N-CA 127.573 2.349 . . . . 0.0 108.037 173.606 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 100' ' ' THR . . . . . . . . . . . . . 4.6 m -132.81 118.91 19.58 Favored 'General case' 0 C--N 1.327 -0.378 0 N-CA-C 106.669 -1.604 . . . . 0.0 106.669 175.342 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 101' ' ' LEU . . . . . . . . . . . . . 2.7 mm? -115.59 111.08 20.14 Favored 'General case' 0 CA--C 1.513 -0.459 0 N-CA-C 106.099 -1.815 . . . . 0.0 106.099 174.521 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 102' ' ' ALA . . . . . . . . . . . . . . . -106.15 158.08 17.09 Favored 'General case' 0 C--N 1.326 -0.421 0 N-CA-C 108.331 -0.989 . . . . 0.0 108.331 162.775 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 103' ' ' THR . . . . . 0.449 HG21 ' HA ' ' A' ' 85' ' ' MET . 1.8 m -157.09 -179.28 8.05 Favored 'General case' 0 N--CA 1.436 -1.163 0 N-CA-C 105.596 -2.002 . . . . 0.0 105.596 171.853 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 104' ' ' ALA . . . . . . . . . . . . . . . -50.6 -39.01 48.8 Favored 'General case' 0 N--CA 1.451 -0.394 0 C-N-CA 122.683 0.393 . . . . 0.0 111.379 172.14 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 105' ' ' LYS . . . . . . . . . . . . . 4.5 tmtt? -61.69 -67.19 0.43 Allowed 'General case' 0 CA--C 1.532 0.279 0 N-CA-C 114.56 1.318 . . . . 0.0 114.56 -177.67 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 106' ' ' GLN . . . . . . . . . . . . . 8.9 pt20 -167.01 -173.45 2.35 Favored 'General case' 0 C--O 1.238 0.474 0 C-N-CA 126.477 1.911 . . . . 0.0 107.997 -178.993 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 107' ' ' THR . . . . . . . . . . . . . 14.8 t -118.47 140.26 50.15 Favored 'General case' 0 CA--C 1.534 0.345 0 C-N-CA 123.314 0.645 . . . . 0.0 109.869 174.008 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 108' ' ' LEU . . . . . . . . . . . . . 53.5 mt -125.11 138.15 54.17 Favored 'General case' 0 C--O 1.236 0.348 0 C-N-CA 127.726 2.41 . . . . 0.0 106.521 -178.513 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 109' ' ' THR . . . . . . . . . . . . . 31.5 m -112.38 144.96 40.94 Favored 'General case' 0 C--O 1.235 0.3 0 N-CA-C 107.793 -1.188 . . . . 0.0 107.793 179.992 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 110' ' ' TYR . . . . . 0.548 ' HB2' ' HB3' ' A' ' 99' ' ' LEU . 34.4 m-85 -130.5 172.77 11.54 Favored 'General case' 0 C--O 1.233 0.209 0 C-N-CA 123.987 0.915 . . . . 0.0 111.158 -178.918 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 111' ' ' LYS . . . . . . . . . . . . . 8.8 tppt? -125.79 143.87 50.88 Favored 'General case' 0 CA--C 1.514 -0.414 0 C-N-CA 124.885 1.274 . . . . 0.0 109.679 173.202 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 112' ' ' LEU . . . . . . . . . . . . . 43.7 tp -74.07 51.91 0.43 Allowed 'General case' 0 CA--C 1.539 0.535 0 C-N-CA 125.999 1.72 . . . . 0.0 108.93 165.159 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 113' ' ' ALA . . . . . . . . . . . . . . . -85.32 91.27 8.13 Favored 'General case' 0 N--CA 1.451 -0.406 0 O-C-N 119.84 -1.788 . . . . 0.0 106.421 170.238 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 114' ' ' ASP . . . . . . . . . . . . . 43.5 t0 . . . . . 0 CA--C 1.513 -0.457 0 CA-C-O 123.664 1.697 . . . . 0.0 109.243 -178.59 . . . . . . . . 0 0 . 1 . 018 nuclear nobuild core ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 29.5 ttm . . . . . 0 N--CA 1.452 -0.355 0 CA-C-O 121.157 0.503 . . . . 0.0 109.877 . . . . . . . . . 0 0 . 1 . 018 nuclear nobuild core ' A' A ' 2' ' ' VAL . . . . . . . . . . . . . 7.7 p -50.18 151.73 0.6 Allowed 'Isoleucine or valine' 0 CA--C 1.536 0.419 0 C-N-CA 127.377 2.271 . . . . 0.0 111.838 173.238 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 3' ' ' THR . . . . . . . . . . . . . 20.6 p -134.95 165.05 39.62 Favored Pre-proline 0 CA--C 1.533 0.316 0 C-N-CA 123.382 0.673 . . . . 0.0 110.581 177.468 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 4' ' ' PRO . . . . . . . . . . . . . 9.7 Cg_endo -58.28 -36.33 97.81 Favored 'Trans proline' 0 C--O 1.235 0.343 0 C-N-CA 122.999 2.466 . . . . 0.0 113.452 175.828 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 5' ' ' GLU . . . . . . . . . . . . . 0.2 OUTLIER -61.18 -44.29 97.53 Favored 'General case' 0 CA--C 1.538 0.505 0 C-N-CA 124.198 0.999 . . . . 0.0 111.765 -174.947 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 6' ' ' GLN . . . . . . . . . . . . . 15.7 pt20 -75.14 18.94 0.17 Allowed 'General case' 0 CA--C 1.542 0.642 0 C-N-CA 125.306 1.442 . . . . 0.0 112.573 177.279 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 7' ' ' LEU . . . . . . . . . . . . . 81.4 mt -136.71 -51.35 0.68 Allowed 'General case' 0 N--CA 1.469 0.485 0 CA-C-N 119.843 1.202 . . . . 0.0 113.073 -174.12 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 8' ' ' GLN . . . . . . . . . . . . . 0.2 OUTLIER -44.04 -28.75 0.51 Allowed 'General case' 0 N--CA 1.473 0.679 0 N-CA-C 115.712 1.745 . . . . 0.0 115.712 -176.16 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 9' ' ' HIS . . . . . . . . . . . . . 79.5 m-70 -131.43 32.27 4.22 Favored 'General case' 0 C--O 1.238 0.489 0 C-N-CA 123.392 0.677 . . . . 0.0 111.82 -173.562 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 10' ' ' HIS . . . . . . . . . . . . . 98.4 m-70 -129.34 113.67 15.25 Favored 'General case' 0 N--CA 1.452 -0.339 0 C-N-CA 124.995 1.318 . . . . 0.0 109.634 176.537 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 11' ' ' ARG . . . . . . . . . . . . . 17.0 ttt180 -69.64 150.09 47.4 Favored 'General case' 0 C--O 1.233 0.214 0 N-CA-C 108.678 -0.86 . . . . 0.0 108.678 166.511 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 12' ' ' PHE . . . . . . . . . . . . . 99.0 m-85 -138.89 157.98 45.05 Favored 'General case' 0 CA--C 1.503 -0.84 0 CA-C-O 123.994 1.854 . . . . 0.0 108.655 171.018 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 13' ' ' VAL . . . . . 0.405 ' HA ' ' HA ' ' A' ' 30' ' ' GLU . 0.0 OUTLIER -126.7 131.36 71.24 Favored 'Isoleucine or valine' 0 C--N 1.311 -1.103 0 CA-C-N 113.008 -1.906 . . . . 0.0 106.09 -176.358 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild core ' A' A ' 14' ' ' LEU . . . . . . . . . . . . . 26.5 tp -65.64 102.61 0.75 Allowed 'General case' 0 CA--C 1.515 -0.375 0 N-CA-C 107.629 -1.248 . . . . 0.0 107.629 175.963 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -86.2 -52.87 5.38 Favored 'General case' 0 N--CA 1.443 -0.822 0 N-CA-C 107.652 -1.24 . . . . 0.0 107.652 -172.188 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -138.15 123.95 19.95 Favored 'General case' 0 C--O 1.235 0.33 0 CA-C-O 121.573 0.701 . . . . 0.0 110.248 -173.9 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 17' ' ' VAL . . . . . . . . . . . . . 11.3 t -75.86 170.52 1.47 Allowed 'Isoleucine or valine' 0 C--O 1.237 0.437 0 N-CA-C 107.621 -1.252 . . . . 0.0 107.621 172.847 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 18' ' ' ASN . . . . . . . . . . . . . 0.3 OUTLIER -58.17 -20.57 42.0 Favored 'General case' 0 CA--C 1.536 0.424 0 CA-C-O 117.873 -1.06 . . . . 0.0 112.896 168.475 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . -106.85 -64.53 0.61 Allowed Glycine 0 C--N 1.341 0.856 0 C-N-CA 125.491 1.52 . . . . 0.0 111.887 -174.896 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 25.1 mmtm -136.04 164.45 43.04 Favored Pre-proline 0 N--CA 1.469 0.495 0 CA-C-N 118.814 1.307 . . . . 0.0 110.55 -176.86 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 21' ' ' PRO . . . . . . . . . . . . . 57.2 Cg_endo -66.4 153.38 78.25 Favored 'Trans proline' 0 CA--C 1.537 0.659 0 N-CA-C 108.605 -1.344 . . . . 0.0 108.605 159.632 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 22' ' ' VAL . . . . . . . . . . . . . 11.7 t -89.51 158.4 2.96 Favored 'Isoleucine or valine' 0 C--O 1.24 0.601 0 N-CA-C 108.961 -0.755 . . . . 0.0 108.961 176.563 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 23' ' ' THR . . . . . . . . . . . . . 3.1 m -130.7 124.38 31.4 Favored 'General case' 0 CA--C 1.532 0.259 0 C-N-CA 125.143 1.377 . . . . 0.0 107.954 178.453 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 24' ' ' SER . . . . . . . . . . . . . 5.4 m -153.6 136.08 15.07 Favored 'General case' 0 N--CA 1.452 -0.331 0 C-N-CA 127.46 2.304 . . . . 0.0 106.921 -167.595 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 25' ' ' ASP . . . . . . . . . . . . . 2.9 t70 -47.95 -84.06 0.01 OUTLIER 'General case' 0 N--CA 1.472 0.634 0 C-N-CA 127.281 2.232 . . . . 0.0 110.266 -179.752 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 26' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -135.62 -1.36 2.53 Favored 'General case' 0 CA--C 1.531 0.214 0 C-N-CA 125.484 1.514 . . . . 0.0 112.753 173.923 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 27' ' ' ASN . . . . . . . . . . . . . 60.6 m-80 -115.62 81.25 8.92 Favored Pre-proline 0 CA--C 1.532 0.286 0 C-N-CA 126.092 1.757 . . . . 0.0 107.426 -179.038 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 28' ' ' PRO . . . . . . . . . . . . . 19.0 Cg_endo -68.76 169.09 18.36 Favored 'Trans proline' 0 CA--C 1.534 0.506 0 C-N-CA 123.067 2.511 . . . . 0.0 113.659 177.093 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 29' ' ' PRO . . . . . . . . . . . . . 13.6 Cg_endo -62.43 109.91 0.96 Allowed 'Trans proline' 0 N--CA 1.449 -1.131 0 N-CA-C 107.226 -1.875 . . . . 0.0 107.226 145.763 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 30' ' ' GLU . . . . . 0.405 ' HA ' ' HA ' ' A' ' 13' ' ' VAL . 10.4 pt-20 -130.21 165.04 23.2 Favored 'General case' 0 C--N 1.318 -0.767 0 C-N-CA 127.996 2.519 . . . . 0.0 106.046 175.847 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 31' ' ' ILE . . . . . . . . . . . . . 20.3 tt -145.47 146.13 19.88 Favored 'Isoleucine or valine' 0 N--CA 1.447 -0.609 0 C-N-CA 125.556 1.542 . . . . 0.0 107.189 -177.401 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 32' ' ' SER . . . . . . . . . . . . . 27.5 p -133.07 172.85 12.09 Favored 'General case' 0 N--CA 1.441 -0.905 0 C-N-CA 126.022 1.729 . . . . 0.0 107.373 168.223 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 33' ' ' PHE . . . . . . . . . . . . . 98.8 m-85 -137.13 -173.22 3.4 Favored 'General case' 0 N--CA 1.448 -0.535 0 N-CA-C 107.919 -1.141 . . . . 0.0 107.919 -174.663 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 34' ' ' GLY . . . . . . . . . . . . . . . 176.42 -160.43 28.05 Favored Glycine 0 N--CA 1.451 -0.333 0 N-CA-C 109.385 -1.486 . . . . 0.0 109.385 170.545 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 35' ' ' GLU . . . . . . . . . . . . . 1.9 tt0 -52.95 154.25 2.98 Favored 'General case' 0 N--CA 1.448 -0.56 0 C-N-CA 125.016 1.326 . . . . 0.0 111.84 -167.894 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 11.7 mtpt 52.78 26.99 4.92 Favored 'General case' 0 CA--C 1.536 0.423 0 CA-C-O 117.956 -1.021 . . . . 0.0 112.195 -169.193 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 37' ' ' MET . . . . . . . . . . . . . 31.4 mmm 54.95 26.48 7.99 Favored 'General case' 0 CA--C 1.542 0.659 0 C-N-CA 124.823 1.249 . . . . 0.0 111.14 -174.95 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 38' ' ' MET . . . . . . . . . . . . . 25.3 mmm -56.0 155.69 6.09 Favored 'General case' 0 CA--C 1.519 -0.213 0 O-C-N 121.055 -1.028 . . . . 0.0 110.444 175.521 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 39' ' ' ILE . . . . . . . . . . . . . 10.4 mt -123.91 135.61 62.96 Favored 'Isoleucine or valine' 0 N--CA 1.449 -0.511 0 C-N-CA 124.793 1.237 . . . . 0.0 107.815 -175.073 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 40' ' ' SER . . . . . . . . . . . . . 66.6 m -131.04 121.09 24.42 Favored 'General case' 0 N--CA 1.45 -0.437 0 N-CA-C 106.495 -1.669 . . . . 0.0 106.495 169.233 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 41' ' ' GLY . . . . . . . . . . . . . . . -164.82 165.2 37.43 Favored Glycine 0 C--O 1.237 0.291 0 N-CA-C 108.994 -1.642 . . . . 0.0 108.994 179.331 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 42' ' ' SER . . . . . 0.628 ' HA ' ' HA ' ' A' ' 46' ' ' ARG . 92.0 p -157.56 108.41 2.26 Favored 'General case' 0 N--CA 1.444 -0.752 0 CA-C-N 117.596 0.698 . . . . 0.0 111.681 -176.667 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 43' ' ' MET . . . . . . . . . . . . . 7.2 mmt -87.4 -58.43 2.58 Favored 'General case' 0 N--CA 1.451 -0.401 0 C-N-CA 124.121 0.968 . . . . 0.0 109.322 -177.533 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 44' ' ' CYS . . . . . 1.301 ' SG ' ' SG ' ' A' ' 70' ' ' CYS . 43.6 t -155.29 -19.11 0.11 Allowed 'General case' 0 CA--C 1.535 0.379 0 N-CA-C 112.442 0.534 . . . . 0.0 112.442 -179.406 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 45' ' ' ASN . . . . . . . . . . . . . 2.8 m-80 -125.95 16.36 7.96 Favored 'General case' 0 N--CA 1.473 0.687 0 C-N-CA 125.997 1.719 . . . . 0.0 109.413 179.68 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 46' ' ' ARG . . . . . 0.628 ' HA ' ' HA ' ' A' ' 42' ' ' SER 0.376 6.0 ptt180 44.05 -172.48 0.01 OUTLIER 'General case' 0 CA--C 1.536 0.413 0 C-N-CA 127.469 2.308 . . . . 0.0 113.623 -161.956 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild core ' A' A ' 47' ' ' PHE . . . . . . . . . . . . . 21.5 p90 -173.5 162.96 4.33 Favored 'General case' 0 N--CA 1.472 0.646 0 C-N-CA 125.672 1.589 . . . . 0.0 109.151 164.33 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 48' ' ' SER . . . . . . . . . . . . . 7.6 p -155.02 135.1 13.04 Favored 'General case' 0 N--CA 1.449 -0.512 0 C-N-CA 123.998 0.919 . . . . 0.0 108.649 178.134 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 49' ' ' GLY . . . . . . . . . . . . . . . -169.0 165.39 38.89 Favored Glycine 0 C--N 1.337 0.616 0 N-CA-C 110.014 -1.234 . . . . 0.0 110.014 171.519 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 50' ' ' GLU . . . . . . . . . . . . . 2.4 pt-20 -83.48 103.17 12.62 Favored 'General case' 0 N--CA 1.442 -0.867 0 CA-C-O 122.619 1.199 . . . . 0.0 108.796 178.588 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 51' ' ' GLY . . . . . . . . . . . . . . . -58.23 174.97 2.47 Favored Glycine 0 CA--C 1.539 1.559 0 CA-C-N 114.647 -1.16 . . . . 0.0 111.112 163.223 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 52' ' ' LYS . . . . . . . . . . . . . 29.8 ttpt -142.71 159.01 43.06 Favored 'General case' 0 C--N 1.329 -0.315 0 N-CA-C 106.006 -1.85 . . . . 0.0 106.006 156.651 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 53' ' ' LEU . . . . . . . . . . . . . 49.5 tp -148.08 95.29 2.45 Favored 'General case' 0 N--CA 1.447 -0.62 0 N-CA-C 107.195 -1.409 . . . . 0.0 107.195 170.23 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 2.4 t -137.58 6.37 2.73 Favored 'General case' 0 CA--C 1.533 0.3 0 CA-C-N 115.498 -0.773 . . . . 0.0 111.196 174.627 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 55' ' ' ASN . . . . . 0.45 HD21 ' CB ' ' A' ' 57' ' ' GLU . 7.9 p-10 -142.74 -21.15 0.66 Allowed 'General case' 0 C--O 1.222 -0.394 0 CA-C-O 117.672 -1.156 . . . . 0.0 114.035 175.725 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 56' ' ' GLY . . . . . . . . . . . . . . . 119.28 7.92 9.72 Favored Glycine 0 CA--C 1.529 0.943 0 CA-C-N 119.29 0.95 . . . . 0.0 112.945 -172.099 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 57' ' ' GLU . . . . . 0.45 ' CB ' HD21 ' A' ' 55' ' ' ASN . 41.3 tt0 -127.16 128.37 46.04 Favored 'General case' 0 C--O 1.235 0.303 0 CA-C-N 118.841 1.32 . . . . 0.0 108.299 -173.836 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 58' ' ' LEU . . . . . . . . . . . . . 52.5 tp -100.42 94.25 6.06 Favored 'General case' 0 CA--C 1.531 0.216 0 C-N-CA 125.628 1.571 . . . . 0.0 108.924 177.505 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 59' ' ' THR . . . . . . . . . . . . . 40.8 p -91.42 146.51 23.75 Favored 'General case' 0 C--O 1.235 0.327 0 N-CA-C 108.129 -1.063 . . . . 0.0 108.129 162.745 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 60' ' ' ALA . . . . . . . . . . . . . . . -140.93 102.37 4.25 Favored 'General case' 0 C--N 1.334 -0.1 0 C-N-CA 124.491 1.116 . . . . 0.0 108.392 166.998 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 61' ' ' LYS . . . . . . . . . . . . . 49.6 mttp -65.4 -60.88 2.49 Favored 'General case' 0 N--CA 1.442 -0.837 0 C-N-CA 124.545 1.138 . . . . 0.0 111.856 -171.148 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 62' ' ' GLY . . . . . . . . . . . . . . . -55.35 -59.93 9.66 Favored Glycine 0 C--O 1.227 -0.282 0 C-N-CA 125.047 1.308 . . . . 0.0 111.262 -165.388 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 63' ' ' LEU . . . . . . . . . . . . . 3.8 tp 49.17 60.86 3.46 Favored 'General case' 0 N--CA 1.445 -0.696 0 C-N-CA 127.646 2.379 . . . . 0.0 113.817 168.962 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 64' ' ' ALA . . . . . . . . . . . . . . . -78.88 135.06 36.9 Favored 'General case' 0 C--N 1.324 -0.525 0 CA-C-N 115.845 -0.616 . . . . 0.0 111.192 -178.004 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 65' ' ' MET . . . . . . . . . . . . . 66.4 mtp -133.57 -175.17 3.73 Favored 'General case' 0 CA--C 1.547 0.84 0 C-N-CA 124.985 1.314 . . . . 0.0 111.288 -172.874 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 66' ' ' THR . . . . . . . . . . . . . 30.0 p -107.78 -164.81 1.0 Allowed 'General case' 0 N--CA 1.47 0.565 0 C-N-CA 127.604 2.361 . . . . 0.0 110.887 177.807 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 67' ' ' ARG . . . . . . . . . . . . . 2.1 mpp_? -132.81 87.44 2.41 Favored 'General case' 0 C--O 1.232 0.15 0 C-N-CA 126.821 2.048 . . . . 0.0 107.215 173.187 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 68' ' ' MET . . . . . . . . . . . . . 10.0 mtm -139.43 162.44 35.03 Favored 'General case' 0 N--CA 1.467 0.418 0 C-N-CA 123.878 0.871 . . . . 0.0 113.061 -173.017 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 69' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -119.01 164.17 15.87 Favored 'General case' 0 C--O 1.235 0.302 0 C-N-CA 127.492 2.317 . . . . 0.0 106.991 171.953 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 70' ' ' CYS . . . . . 1.301 ' SG ' ' SG ' ' A' ' 44' ' ' CYS . 57.5 m -140.36 23.89 2.32 Favored 'General case' 0 N--CA 1.474 0.733 0 C-N-CA 124.033 0.933 . . . . 0.0 112.73 -175.149 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 71' ' ' ALA . . . . . . . . . . . . . . . 54.6 -1.29 0.02 OUTLIER 'General case' 0 CA--C 1.511 -0.534 0 N-CA-C 117.586 2.439 . . . . 0.0 117.586 -176.602 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 72' ' ' ASN . . . . . . . . . . . . . 0.0 OUTLIER -138.58 144.05 40.64 Favored Pre-proline 0 N--CA 1.441 -0.913 0 CA-C-N 118.833 0.742 . . . . 0.0 109.512 167.928 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 73' ' ' PRO . . . . . . . . . . . . . 74.5 Cg_endo -74.97 -20.64 16.73 Favored 'Trans proline' 0 N--CA 1.45 -1.086 0 C-N-CA 121.944 1.763 . . . . 0.0 111.853 -178.056 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 74' ' ' GLN . . . . . . . . . . . . . 39.4 tt0 -58.54 -45.82 88.1 Favored 'General case' 0 CA--C 1.531 0.248 0 CA-C-N 120.606 1.548 . . . . 0.0 110.607 -177.184 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 75' ' ' LEU . . . . . . . . . . . . . 83.4 mt -66.75 -41.51 87.68 Favored 'General case' 0 CA--C 1.522 -0.117 0 C-N-CA 123.843 0.857 . . . . 0.0 110.122 175.911 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 76' ' ' ASN . . . . . . . . . . . . . 3.0 t-20 -59.79 -45.33 92.65 Favored 'General case' 0 C--O 1.219 -0.505 0 C-N-CA 124.052 0.941 . . . . 0.0 110.294 -177.403 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 77' ' ' GLU . . . . . . . . . . . . . 29.7 mt-10 -56.46 -43.01 79.13 Favored 'General case' 0 N--CA 1.448 -0.542 0 C-N-CA 125.508 1.523 . . . . 0.0 111.02 175.43 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 78' ' ' LEU . . . . . . . . . . . . . 0.7 OUTLIER -61.08 -32.05 71.71 Favored 'General case' 0 C--N 1.339 0.121 0 CA-C-O 118.253 -0.879 . . . . 0.0 112.355 -177.808 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 79' ' ' ASP . . . . . . . . . . . . . 0.0 OUTLIER -54.26 -39.82 67.2 Favored 'General case' 0 CA--C 1.535 0.398 0 C-N-CA 124.127 0.971 . . . . 0.0 112.902 174.311 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 80' ' ' ASN . . . . . . . . . . . . . 6.9 p30 -87.29 -37.8 16.86 Favored 'General case' 0 CA--C 1.518 -0.272 0 CA-C-N 119.001 0.819 . . . . 0.0 109.849 175.834 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 81' ' ' THR . . . . . . . . . . . . . 32.7 m -53.24 -54.44 36.14 Favored 'General case' 0 N--CA 1.455 -0.186 0 O-C-N 123.856 0.723 . . . . 0.0 109.18 -174.513 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 82' ' ' ILE . . . . . . . . . . . . . 10.7 tp -64.54 -32.94 59.87 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.475 0 C-N-CA 122.824 0.45 . . . . 0.0 111.356 -176.968 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 83' ' ' SER . . . . . . . . . . . . . 36.4 p -64.08 -53.41 50.24 Favored 'General case' 0 N--CA 1.443 -0.775 0 N-CA-C 109.647 -0.501 . . . . 0.0 109.647 -171.35 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 84' ' ' GLU . . . . . . . . . . . . . 2.4 tp10 -62.72 -42.08 99.47 Favored 'General case' 0 N--CA 1.449 -0.502 0 C-N-CA 124.734 1.213 . . . . 0.0 109.261 -176.421 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 85' ' ' MET . . . . . . . . . . . . . 78.9 mtp -60.28 -41.41 93.29 Favored 'General case' 0 C--N 1.343 0.323 0 C-N-CA 123.778 0.831 . . . . 0.0 110.18 179.141 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 86' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -80.44 -19.35 46.32 Favored 'General case' 0 C--N 1.332 -0.19 0 O-C-N 121.436 -0.79 . . . . 0.0 112.096 -176.657 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 87' ' ' LYS . . . . . . . . . . . . . 2.4 mptm? -76.46 -55.4 5.57 Favored 'General case' 0 N--CA 1.447 -0.584 0 CA-C-O 118.198 -0.906 . . . . 0.0 109.537 169.622 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 88' ' ' GLU . . . . . . . . . . . . . 21.1 pt-20 -69.06 -24.66 64.19 Favored 'General case' 0 CA--C 1.535 0.368 0 CA-C-N 118.768 0.713 . . . . 0.0 111.376 -177.004 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 89' ' ' GLY . . . . . . . . . . . . . . . 106.57 99.14 2.6 Favored Glycine 0 C--N 1.337 0.591 0 N-CA-C 110.106 -1.198 . . . . 0.0 110.106 174.848 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 90' ' ' ALA . . . . . . . . . . . . . . . -74.1 133.67 42.86 Favored 'General case' 0 N--CA 1.446 -0.665 0 C-N-CA 123.075 0.55 . . . . 0.0 110.158 -175.68 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 91' ' ' GLN . . . . . . . . . . . . . 1.8 mp0 -73.04 125.2 27.08 Favored 'General case' 0 N--CA 1.452 -0.356 0 N-CA-C 105.447 -2.057 . . . . 0.0 105.447 170.403 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 92' ' ' VAL . . . . . . . . . . . . . 25.5 t -122.21 126.72 74.7 Favored 'Isoleucine or valine' 0 N--CA 1.446 -0.628 0 N-CA-C 107.743 -1.206 . . . . 0.0 107.743 -174.579 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 93' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -135.38 80.7 1.85 Allowed 'General case' 0 N--CA 1.451 -0.376 0 N-CA-C 106.767 -1.568 . . . . 0.0 106.767 177.679 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 94' ' ' LEU . . . . . . . . . . . . . 1.6 tm? -84.75 102.79 13.29 Favored 'General case' 0 CA--C 1.514 -0.432 0 N-CA-C 107.433 -1.321 . . . . 0.0 107.433 173.726 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 95' ' ' THR . . . . . . . . . . . . . 1.1 m -82.58 177.71 8.57 Favored 'General case' 0 C--N 1.322 -0.611 0 CA-C-N 114.064 -1.425 . . . . 0.0 108.244 178.45 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 96' ' ' ALA . . . . . . . . . . . . . . . -52.62 -20.17 2.86 Favored 'General case' 0 CA--C 1.539 0.554 0 N-CA-C 114.574 1.324 . . . . 0.0 114.574 -173.607 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 97' ' ' ASN . . . . . . . . . . . . . 17.4 p30 -146.62 -10.15 0.47 Allowed 'General case' 0 N--CA 1.467 0.419 0 N-CA-C 116.553 2.057 . . . . 0.0 116.553 160.388 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 98' ' ' GLN . . . . . . . . . . . . . 6.2 tt0 -112.9 128.96 56.61 Favored 'General case' 0 N--CA 1.47 0.549 0 CA-C-N 122.092 2.223 . . . . 0.0 111.356 -178.526 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 99' ' ' LEU . . . . . 0.452 HD22 ' CD2' ' A' ' 101' ' ' LEU . 0.3 OUTLIER -84.24 122.97 29.62 Favored 'General case' 0 C--O 1.235 0.299 0 C-N-CA 125.012 1.325 . . . . 0.0 107.768 170.293 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild core ' A' A ' 100' ' ' THR . . . . . . . . . . . . . 5.1 m -110.18 127.82 55.14 Favored 'General case' 0 C--N 1.326 -0.444 0 N-CA-C 107.239 -1.393 . . . . 0.0 107.239 171.52 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 101' ' ' LEU . . . . . 0.452 ' CD2' HD22 ' A' ' 99' ' ' LEU . 2.7 mm? -114.49 143.12 45.46 Favored 'General case' 0 CA--C 1.514 -0.431 0 C-N-CA 125.464 1.506 . . . . 0.0 108.959 172.353 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 102' ' ' ALA . . . . . . . . . . . . . . . -144.8 159.62 42.59 Favored 'General case' 0 C--O 1.235 0.303 0 C-N-CA 124.936 1.295 . . . . 0.0 108.432 161.693 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 103' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -160.61 174.83 13.42 Favored 'General case' 0 N--CA 1.443 -0.781 0 C-N-CA 126.308 1.843 . . . . 0.0 108.014 170.416 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 104' ' ' ALA . . . . . . . . . . . . . . . -62.25 -28.72 69.91 Favored 'General case' 0 C--O 1.235 0.296 0 O-C-N 121.743 -0.598 . . . . 0.0 111.588 176.395 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 105' ' ' LYS . . . . . . . . . . . . . 8.9 mmtm -69.58 -84.77 0.03 OUTLIER 'General case' 0 N--CA 1.45 -0.434 0 C-N-CA 123.505 0.722 . . . . 0.0 109.769 167.014 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 106' ' ' GLN . . . . . . . . . . . . . 23.3 mt-30 -141.37 -169.83 2.95 Favored 'General case' 0 C--N 1.328 -0.362 0 C-N-CA 123.656 0.782 . . . . 0.0 109.364 -158.711 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 107' ' ' THR . . . . . . . . . . . . . 1.1 t -149.69 147.31 27.92 Favored 'General case' 0 N--CA 1.45 -0.455 0 N-CA-C 106.287 -1.746 . . . . 0.0 106.287 -168.773 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 108' ' ' LEU . . . . . . . . . . . . . 36.8 mt -144.87 160.74 40.81 Favored 'General case' 0 N--CA 1.465 0.324 0 N-CA-C 107.634 -1.247 . . . . 0.0 107.634 -177.503 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 109' ' ' THR . . . . . . . . . . . . . 63.6 m -133.0 133.91 43.76 Favored 'General case' 0 C--O 1.236 0.353 0 N-CA-C 107.609 -1.256 . . . . 0.0 107.609 169.649 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 110' ' ' TYR . . . . . . . . . . . . . 19.1 m-85 -118.32 178.86 4.29 Favored 'General case' 0 C--O 1.236 0.345 0 C-N-CA 124.231 1.013 . . . . 0.0 108.981 178.77 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 111' ' ' LYS . . . . . . . . . . . . . 1.0 OUTLIER -139.13 138.83 37.35 Favored 'General case' 0 N--CA 1.455 -0.215 0 CA-C-O 118.02 -0.99 . . . . 0.0 110.879 178.045 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 112' ' ' LEU . . . . . . . . . . . . . 22.5 tp -60.53 19.68 0.01 OUTLIER 'General case' 0 CA--C 1.544 0.718 0 C-N-CA 131.309 3.843 . . . . 0.0 114.839 175.643 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 113' ' ' ALA . . . . . . . . . . . . . . . -67.82 84.59 0.21 Allowed 'General case' 0 CA--C 1.541 0.609 0 O-C-N 120.233 -1.542 . . . . 0.0 111.082 179.91 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 114' ' ' ASP . . . . . . . . . . . . . 23.4 t0 . . . . . 0 N--CA 1.47 0.541 0 CA-C-O 122.974 1.368 . . . . 0.0 110.791 -176.447 . . . . . . . . 0 0 . 1 . 019 nuclear nobuild core ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 C--O 1.237 0.429 0 N-CA-C 111.097 0.036 . . . . 0.0 111.097 . . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 2' ' ' VAL . . . . . 0.451 HG23 HE21 ' A' ' 6' ' ' GLN . 7.2 p -57.92 139.25 17.81 Favored 'Isoleucine or valine' 0 C--O 1.238 0.455 0 O-C-N 123.595 0.56 . . . . 0.0 110.063 175.834 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 3' ' ' THR . . . . . . . . . . . . . 0.8 OUTLIER -121.9 165.05 21.68 Favored Pre-proline 0 N--CA 1.448 -0.53 0 C-N-CA 124.01 0.924 . . . . 0.0 110.173 179.3 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 4' ' ' PRO . . . . . . . . . . . . . 18.3 Cg_endo -61.78 -50.63 4.99 Favored 'Trans proline' 0 N--CA 1.454 -0.832 0 C-N-CA 122.281 1.987 . . . . 0.0 111.133 174.338 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 5' ' ' GLU . . . . . . . . . . . . . 13.9 tt0 -55.01 -40.31 70.02 Favored 'General case' 0 CA--C 1.536 0.407 0 C-N-CA 124.244 1.018 . . . . 0.0 112.613 -168.513 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 6' ' ' GLN . . . . . 0.451 HE21 HG23 ' A' ' 2' ' ' VAL . 12.1 pt20 -73.14 14.65 0.28 Allowed 'General case' 0 CA--C 1.538 0.518 0 C-N-CA 125.433 1.493 . . . . 0.0 113.938 179.96 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 7' ' ' LEU . . . . . . . . . . . . . 88.6 mt -129.74 -46.29 1.16 Allowed 'General case' 0 C--N 1.34 0.168 0 C-N-CA 125.081 1.352 . . . . 0.0 110.478 -176.017 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 8' ' ' GLN . . . . . . . . . . . . . 2.3 mp0 -49.01 -15.34 0.1 Allowed 'General case' 0 N--CA 1.473 0.715 0 C-N-CA 127.078 2.151 . . . . 0.0 116.697 -178.944 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 9' ' ' HIS . . . . . . . . . . . . . 94.6 m-70 -130.23 13.5 5.62 Favored 'General case' 0 C--N 1.325 -0.473 0 C-N-CA 124.828 1.251 . . . . 0.0 112.492 -175.819 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 10' ' ' HIS . . . . . . . . . . . . . 46.9 m-70 -125.66 138.9 53.92 Favored 'General case' 0 C--O 1.238 0.462 0 C-N-CA 124.815 1.246 . . . . 0.0 107.987 -173.325 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 11' ' ' ARG . . . . . . . . . . . . . 21.6 ttt180 -95.0 146.7 24.07 Favored 'General case' 0 N--CA 1.465 0.279 0 C-N-CA 125.531 1.533 . . . . 0.0 109.754 174.277 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 12' ' ' PHE . . . . . . . . . . . . . 35.5 m-85 -134.26 156.14 48.93 Favored 'General case' 0 N--CA 1.441 -0.914 0 CA-C-O 123.675 1.702 . . . . 0.0 109.253 175.198 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 13' ' ' VAL . . . . . . . . . . . . . 0.0 OUTLIER -138.96 130.82 36.36 Favored 'Isoleucine or valine' 0 C--N 1.313 -1.002 0 CA-C-N 113.03 -1.895 . . . . 0.0 107.242 -172.713 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 14' ' ' LEU . . . . . . . . . . . . . 11.6 tp -64.86 102.72 0.62 Allowed 'General case' 0 N--CA 1.45 -0.475 0 N-CA-C 106.392 -1.707 . . . . 0.0 106.392 176.148 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 15' ' ' GLU . . . . . 0.484 ' HG3' ' HE2' ' A' ' 111' ' ' LYS . 1.3 tm-20 -85.33 -41.38 15.55 Favored 'General case' 0 N--CA 1.449 -0.495 0 N-CA-C 108.91 -0.774 . . . . 0.0 108.91 -173.826 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 5.8 p -151.92 142.71 22.91 Favored 'General case' 0 N--CA 1.442 -0.833 0 CA-C-O 122.442 1.115 . . . . 0.0 109.342 169.229 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 17' ' ' VAL . . . . . 0.51 HG12 ' H ' ' A' ' 18' ' ' ASN . 2.2 t -70.22 175.86 0.57 Allowed 'Isoleucine or valine' 0 CA--C 1.54 0.582 0 N-CA-C 107.111 -1.44 . . . . 0.0 107.111 168.253 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 18' ' ' ASN . . . . . 0.51 ' H ' HG12 ' A' ' 17' ' ' VAL . 0.6 OUTLIER -44.88 -24.01 0.18 Allowed 'General case' 0 CA--C 1.539 0.53 0 C-N-CA 127.473 2.309 . . . . 0.0 116.391 -172.467 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild core ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . -163.89 17.54 0.12 Allowed Glycine 0 CA--C 1.532 1.141 0 CA-C-O 118.356 -1.247 . . . . 0.0 113.413 170.512 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 40.9 mtmt -145.97 155.54 51.47 Favored Pre-proline 0 N--CA 1.469 0.523 0 CA-C-N 120.412 2.106 . . . . 0.0 109.519 -178.032 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 21' ' ' PRO . . . . . . . . . . . . . 80.9 Cg_endo -72.34 171.59 16.66 Favored 'Trans proline' 0 N--CA 1.45 -1.053 0 C-N-CA 122.118 1.879 . . . . 0.0 110.812 176.544 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 22' ' ' VAL . . . . . . . . . . . . . 3.8 p -120.1 165.37 15.58 Favored 'Isoleucine or valine' 0 CA--C 1.54 0.581 0 C-N-CA 124.349 1.059 . . . . 0.0 111.973 178.184 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 23' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -77.15 -175.8 3.78 Favored 'General case' 0 CA--C 1.545 0.778 0 C-N-CA 127.26 2.224 . . . . 0.0 112.503 -175.525 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 24' ' ' SER . . . . . . . . . . . . . 19.6 m 69.17 67.11 0.27 Allowed 'General case' 0 N--CA 1.452 -0.344 0 C-N-CA 128.995 2.918 . . . . 0.0 114.663 160.574 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 25' ' ' ASP . . . . . . . . . . . . . 6.5 m-20 -46.54 -38.9 10.03 Favored 'General case' 0 CA--C 1.538 0.483 0 C-N-CA 125.699 1.6 . . . . 0.0 113.308 176.324 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 26' ' ' LYS . . . . . . . . . . . . . 77.9 tttt -95.42 -17.9 21.15 Favored 'General case' 0 N--CA 1.466 0.335 0 O-C-N 120.874 -1.141 . . . . 0.0 112.501 -175.853 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 27' ' ' ASN . . . . . . . . . . . . . 4.1 p30 -150.44 69.62 8.83 Favored Pre-proline 0 CA--C 1.534 0.335 0 C-N-CA 124.136 0.974 . . . . 0.0 110.437 -177.015 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 28' ' ' PRO . . . . . . . . . . . . . 40.8 Cg_endo -65.38 162.49 33.38 Favored 'Trans proline' 0 N--CA 1.46 -0.5 0 C-N-CA 122.126 1.884 . . . . 0.0 111.279 -176.802 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 29' ' ' PRO . . . . . . . . . . . . . 18.6 Cg_endo -62.52 87.02 0.11 Allowed 'Trans proline' 0 N--CA 1.453 -0.873 0 C-N-CA 123.562 2.842 . . . . 0.0 109.416 160.211 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 30' ' ' GLU . . . . . . . . . . . . . 1.1 pt-20 -97.23 158.74 15.3 Favored 'General case' 0 N--CA 1.447 -0.576 0 C-N-CA 124.765 1.226 . . . . 0.0 108.292 173.504 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 31' ' ' ILE . . . . . . . . . . . . . 16.4 tt -139.06 137.09 42.36 Favored 'Isoleucine or valine' 0 N--CA 1.443 -0.777 0 N-CA-C 105.456 -2.053 . . . . 0.0 105.456 179.558 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 32' ' ' SER . . . . . . . . . . . . . 68.7 p -136.46 160.12 39.72 Favored 'General case' 0 C--N 1.321 -0.663 0 N-CA-C 106.804 -1.554 . . . . 0.0 106.804 170.151 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 33' ' ' PHE . . . . . . . . . . . . . 58.1 m-85 -118.38 164.67 14.89 Favored 'General case' 0 C--N 1.326 -0.445 0 N-CA-C 108.088 -1.078 . . . . 0.0 108.088 179.462 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 34' ' ' GLY . . . . . . . . . . . . . . . 167.91 142.4 3.47 Favored Glycine 0 N--CA 1.448 -0.542 0 N-CA-C 109.017 -1.633 . . . . 0.0 109.017 177.305 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 35' ' ' GLU . . . . . . . . . . . . . 0.3 OUTLIER 57.28 116.01 0.01 OUTLIER 'General case' 0 CA--C 1.537 0.461 0 C-N-CA 129.264 3.026 . . . . 0.0 114.481 168.947 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 8.6 mtmm 59.08 18.31 6.27 Favored 'General case' 0 N--CA 1.473 0.694 0 O-C-N 120.453 -1.404 . . . . 0.0 113.057 -173.091 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 37' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER 58.85 35.73 24.35 Favored 'General case' 0 CA--C 1.535 0.398 0 C-N-CA 124.843 1.257 . . . . 0.0 110.242 -174.163 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 38' ' ' MET . . . . . . . . . . . . . 9.2 mtp -69.05 164.49 22.32 Favored 'General case' 0 N--CA 1.45 -0.428 0 O-C-N 121.469 -0.77 . . . . 0.0 110.307 167.947 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 39' ' ' ILE . . . . . . . . . . . . . 9.3 mt -122.59 139.93 47.94 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.439 0 C-N-CA 126.485 1.914 . . . . 0.0 106.92 179.115 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 40' ' ' SER . . . . . . . . . . . . . 73.1 m -124.14 149.16 46.58 Favored 'General case' 0 N--CA 1.454 -0.239 0 C-N-CA 125.604 1.562 . . . . 0.0 108.364 163.223 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 41' ' ' GLY . . . . . . . . . . . . . . . 172.84 -178.8 44.69 Favored Glycine 0 CA--C 1.523 0.592 0 N-CA-C 109.221 -1.552 . . . . 0.0 109.221 172.199 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 42' ' ' SER . . . . . . . . . . . . . 40.4 t -142.0 154.61 45.14 Favored 'General case' 0 N--CA 1.449 -0.496 0 N-CA-C 107.303 -1.369 . . . . 0.0 107.303 162.569 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 43' ' ' MET . . . . . . . . . . . . . 14.9 mmt -107.03 -53.01 2.67 Favored 'General case' 0 N--CA 1.454 -0.247 0 N-CA-C 107.43 -1.322 . . . . 0.0 107.43 159.211 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 44' ' ' CYS . . . . . 1.298 ' SG ' ' SG ' ' A' ' 70' ' ' CYS . 12.7 t -151.06 -50.57 0.12 Allowed 'General case' 0 CA--C 1.534 0.338 0 N-CA-C 107.114 -1.439 . . . . 0.0 107.114 176.738 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 45' ' ' ASN . . . . . . . . . . . . . 14.1 m-80 -88.39 16.06 6.94 Favored 'General case' 0 CA--C 1.518 -0.25 0 C-N-CA 125.276 1.43 . . . . 0.0 113.967 -175.837 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 46' ' ' ARG . . . . . . . . . . . . . 3.9 mmt180 58.23 172.26 0.06 Allowed 'General case' 0 N--CA 1.465 0.277 0 C-N-CA 123.86 0.864 . . . . 0.0 110.459 -168.775 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 47' ' ' PHE . . . . . . . . . . . . . 48.7 p90 -163.59 172.35 14.47 Favored 'General case' 0 C--O 1.241 0.618 0 C-N-CA 123.841 0.856 . . . . 0.0 109.712 161.232 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 48' ' ' SER . . . . . . . . . . . . . 1.7 p -173.93 143.99 0.99 Allowed 'General case' 0 N--CA 1.449 -0.518 0 C-N-CA 124.898 1.279 . . . . 0.0 108.863 177.205 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 49' ' ' GLY . . . . . . . . . . . . . . . -176.91 169.83 42.35 Favored Glycine 0 CA--C 1.524 0.628 0 O-C-N 121.25 -0.906 . . . . 0.0 112.455 172.776 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 50' ' ' GLU . . . . . . . . . . . . . 17.3 mt-10 -72.31 94.83 1.64 Allowed 'General case' 0 N--CA 1.461 0.092 0 C-N-CA 124.922 1.289 . . . . 0.0 108.257 171.851 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 51' ' ' GLY . . . . . . . . . . . . . . . -58.98 -65.91 3.16 Favored Glycine 0 C--O 1.226 -0.385 0 C-N-CA 125.818 1.675 . . . . 0.0 113.193 -177.555 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 52' ' ' LYS . . . . . . . . . . . . . 2.5 ttmp? 70.57 138.48 0.04 OUTLIER 'General case' 0 C--N 1.326 -0.443 0 C-N-CA 128.041 2.537 . . . . 0.0 112.655 178.018 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 53' ' ' LEU . . . . . . . . . . . . . 24.8 tp -147.09 102.55 3.52 Favored 'General case' 0 C--O 1.236 0.347 0 C-N-CA 123.637 0.775 . . . . 0.0 109.801 179.734 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 2.0 t -153.09 19.48 0.57 Allowed 'General case' 0 CA--C 1.54 0.574 0 C-N-CA 123.775 0.83 . . . . 0.0 111.658 176.525 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 55' ' ' ASN . . . . . . . . . . . . . 11.9 p30 -146.03 3.69 0.94 Allowed 'General case' 0 N--CA 1.47 0.55 0 N-CA-C 113.847 1.055 . . . . 0.0 113.847 164.985 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 56' ' ' GLY . . . . . . . . . . . . . . . 95.68 16.14 40.51 Favored Glycine 0 CA--C 1.527 0.814 0 CA-C-N 119.495 1.043 . . . . 0.0 112.511 -175.695 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 57' ' ' GLU . . . . . . . . . . . . . 23.6 tt0 -136.04 156.67 48.38 Favored 'General case' 0 CA--C 1.537 0.472 0 C-N-CA 124.426 1.09 . . . . 0.0 108.331 -174.618 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 58' ' ' LEU . . . . . . . . . . . . . 38.9 tp -129.62 97.22 4.46 Favored 'General case' 0 CA--C 1.541 0.597 0 C-N-CA 125.182 1.393 . . . . 0.0 110.502 -173.109 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 59' ' ' THR . . . . . . . . . . . . . 2.7 p -113.07 104.99 12.93 Favored 'General case' 0 N--CA 1.474 0.746 0 C-N-CA 127.575 2.35 . . . . 0.0 112.203 -175.448 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 60' ' ' ALA . . . . . . . . . . . . . . . -72.73 126.05 28.97 Favored 'General case' 0 C--O 1.233 0.201 0 O-C-N 122.119 -0.363 . . . . 0.0 110.917 176.583 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 61' ' ' LYS . . . . . . . . . . . . . 16.2 ttpt -77.96 46.25 0.57 Allowed 'General case' 0 CA--C 1.543 0.692 0 C-N-CA 124.909 1.284 . . . . 0.0 113.68 -177.866 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 62' ' ' GLY . . . . . . . . . . . . . . . 134.33 -21.95 3.8 Favored Glycine 0 N--CA 1.474 1.207 0 O-C-N 120.708 -1.245 . . . . 0.0 114.84 170.732 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 63' ' ' LEU . . . . . . . . . . . . . 1.6 tp 44.89 80.06 0.04 OUTLIER 'General case' 0 CA--C 1.546 0.816 0 C-N-CA 128.008 2.523 . . . . 0.0 114.424 169.143 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 64' ' ' ALA . . . . . . . . . . . . . . . -65.18 100.03 0.42 Allowed 'General case' 0 CA--C 1.545 0.765 0 C-N-CA 127.166 2.187 . . . . 0.0 114.056 -175.132 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 65' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -108.55 175.3 5.51 Favored 'General case' 0 N--CA 1.484 1.263 0 C-N-CA 125.11 1.364 . . . . 0.0 111.433 -173.02 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 66' ' ' THR . . . . . . . . . . . . . 17.0 p -118.12 -165.65 1.13 Allowed 'General case' 0 N--CA 1.478 0.926 0 C-N-CA 126.146 1.778 . . . . 0.0 111.462 -177.618 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 67' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -142.79 75.99 1.51 Allowed 'General case' 0 N--CA 1.474 0.733 0 C-N-CA 125.463 1.505 . . . . 0.0 109.559 177.897 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 68' ' ' MET . . . . . . . . . . . . . 51.5 mtm -126.12 164.72 20.29 Favored 'General case' 0 C--N 1.326 -0.434 0 C-N-CA 129.592 3.157 . . . . 0.0 108.604 -179.423 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 69' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -113.63 163.32 15.12 Favored 'General case' 0 N--CA 1.449 -0.523 0 C-N-CA 126.246 1.819 . . . . 0.0 107.016 173.302 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 70' ' ' CYS . . . . . 1.298 ' SG ' ' SG ' ' A' ' 44' ' ' CYS . 0.5 OUTLIER -121.89 -6.94 9.01 Favored 'General case' 0 C--N 1.323 -0.548 0 C-N-CA 126.284 1.833 . . . . 0.0 114.276 -170.081 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild core ' A' A ' 71' ' ' ALA . . . . . . . . . . . . . . . 61.17 4.2 0.84 Allowed 'General case' 0 CA--C 1.538 0.503 0 C-N-CA 125.361 1.464 . . . . 0.0 114.597 -172.403 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 72' ' ' ASN . . . . . . . . . . . . . 25.0 t30 -132.61 142.5 45.08 Favored Pre-proline 0 N--CA 1.472 0.641 0 CA-C-N 120.67 1.577 . . . . 0.0 108.575 160.457 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 73' ' ' PRO . . . . . . . . . . . . . 70.0 Cg_endo -79.25 -29.36 3.17 Favored 'Trans proline' 0 C--N 1.346 0.401 0 C-N-CA 122.124 1.883 . . . . 0.0 112.179 -169.986 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 74' ' ' GLN . . . . . . . . . . . . . 31.8 tt0 -60.52 -39.63 88.53 Favored 'General case' 0 C--O 1.221 -0.42 0 CA-C-N 116.691 -0.231 . . . . 0.0 110.419 -179.751 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 75' ' ' LEU . . . . . . . . . . . . . 69.5 mt -66.84 -37.73 85.03 Favored 'General case' 0 N--CA 1.467 0.399 0 O-C-N 121.834 -0.541 . . . . 0.0 109.895 174.328 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 76' ' ' ASN . . . . . . . . . . . . . 2.2 t-20 -64.52 -46.37 83.19 Favored 'General case' 0 C--O 1.22 -0.491 0 C-N-CA 125.182 1.393 . . . . 0.0 111.45 -177.663 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 77' ' ' GLU . . . . . . . . . . . . . 8.2 pt-20 -71.3 -30.2 65.95 Favored 'General case' 0 N--CA 1.468 0.455 0 CA-C-N 119.564 1.074 . . . . 0.0 111.935 177.237 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 78' ' ' LEU . . . . . . . . . . . . . 1.0 OUTLIER -61.09 -35.94 78.35 Favored 'General case' 0 C--N 1.329 -0.308 0 C-N-CA 124.13 0.972 . . . . 0.0 109.346 177.388 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 79' ' ' ASP . . . . . . . . . . . . . 0.0 OUTLIER -59.12 -29.03 67.09 Favored 'General case' 0 N--CA 1.463 0.188 0 C-N-CA 124.074 0.95 . . . . 0.0 112.489 173.603 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 80' ' ' ASN . . . . . . . . . . . . . 10.9 t30 -97.68 -20.04 17.87 Favored 'General case' 0 N--CA 1.452 -0.37 0 C-N-CA 124.082 0.953 . . . . 0.0 111.366 -178.842 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 81' ' ' THR . . . . . . . . . . . . . 20.4 m -69.8 -57.95 4.48 Favored 'General case' 0 N--CA 1.448 -0.545 0 N-CA-C 107.051 -1.462 . . . . 0.0 107.051 172.208 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 82' ' ' ILE . . . . . . . . . . . . . 8.9 tp -66.74 -39.91 84.81 Favored 'Isoleucine or valine' 0 N--CA 1.454 -0.269 0 C-N-CA 124.058 0.943 . . . . 0.0 111.333 -170.264 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 83' ' ' SER . . . . . . . . . . . . . 43.3 p -50.15 -49.23 52.78 Favored 'General case' 0 C--O 1.236 0.389 0 C-N-CA 124.542 1.137 . . . . 0.0 110.621 -176.141 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 84' ' ' GLU . . . . . . . . . . . . . 0.9 OUTLIER -70.94 -40.29 72.13 Favored 'General case' 0 N--CA 1.447 -0.582 0 CA-C-O 117.386 -1.293 . . . . 0.0 112.108 178.919 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 85' ' ' MET . . . . . . . . . . . . . 91.8 mtp -58.81 -41.37 86.61 Favored 'General case' 0 C--N 1.347 0.472 0 CA-C-N 120.94 1.7 . . . . 0.0 109.117 -176.279 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 86' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -77.56 -27.77 51.58 Favored 'General case' 0 C--O 1.232 0.179 0 C-N-CA 123.899 0.88 . . . . 0.0 112.043 -175.859 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 87' ' ' LYS . . . . . . . . . . . . . 64.5 mttt -76.34 -52.0 10.82 Favored 'General case' 0 N--CA 1.446 -0.672 0 N-CA-C 108.601 -0.888 . . . . 0.0 108.601 176.765 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 88' ' ' GLU . . . . . . . . . . . . . 18.0 mm-40 -51.19 -51.34 54.69 Favored 'General case' 0 CA--C 1.527 0.072 0 C-N-CA 125.242 1.417 . . . . 0.0 109.511 176.641 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 89' ' ' GLY . . . . . . . . . . . . . . . 106.67 133.16 7.28 Favored Glycine 0 C--N 1.335 0.523 0 N-CA-C 107.677 -2.169 . . . . 0.0 107.677 -166.653 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 90' ' ' ALA . . . . . . . . . . . . . . . -138.19 142.72 40.02 Favored 'General case' 0 CA--C 1.516 -0.35 0 C-N-CA 123.708 0.803 . . . . 0.0 109.695 -168.333 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 91' ' ' GLN . . . . . . . . . . . . . 6.0 mp0 -72.31 129.15 37.74 Favored 'General case' 0 N--CA 1.444 -0.775 0 N-CA-C 105.206 -2.146 . . . . 0.0 105.206 -177.098 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 92' ' ' VAL . . . . . . . . . . . . . 7.5 p -122.14 127.35 75.23 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.325 0 N-CA-C 106.947 -1.501 . . . . 0.0 106.947 -175.9 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 93' ' ' ASP . . . . . . . . . . . . . 0.8 OUTLIER -142.76 94.54 2.65 Favored 'General case' 0 C--O 1.234 0.253 0 N-CA-C 107.822 -1.177 . . . . 0.0 107.822 -173.452 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 94' ' ' LEU . . . . . . . . . . . . . 0.9 OUTLIER -99.45 102.65 14.28 Favored 'General case' 0 CA--C 1.515 -0.371 0 N-CA-C 107.069 -1.456 . . . . 0.0 107.069 176.043 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 95' ' ' THR . . . . . . . . . . . . . 5.8 t -78.02 -168.81 1.36 Allowed 'General case' 0 CA--C 1.536 0.407 0 O-C-N 125.043 1.465 . . . . 0.0 107.9 178.975 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 96' ' ' ALA . . . . . . . . . . . . . . . -53.15 -23.29 7.87 Favored 'General case' 0 CA--C 1.541 0.599 0 N-CA-C 114.041 1.126 . . . . 0.0 114.041 -175.075 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 97' ' ' ASN . . . . . . . . . . . . . 30.2 p30 -158.19 6.35 0.13 Allowed 'General case' 0 N--CA 1.473 0.697 0 N-CA-C 116.247 1.943 . . . . 0.0 116.247 164.757 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 98' ' ' GLN . . . . . . . . . . . . . 3.2 tt0 -121.6 130.53 53.56 Favored 'General case' 0 N--CA 1.471 0.6 0 CA-C-N 121.216 1.826 . . . . 0.0 110.743 -176.766 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 99' ' ' LEU . . . . . 0.465 ' HB3' ' HB2' ' A' ' 110' ' ' TYR . 14.5 tp -83.77 138.84 33.06 Favored 'General case' 0 C--O 1.232 0.168 0 O-C-N 121.523 -0.736 . . . . 0.0 110.145 171.768 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 100' ' ' THR . . . . . . . . . . . . . 28.8 m -120.74 120.14 34.78 Favored 'General case' 0 N--CA 1.448 -0.556 0 N-CA-C 105.773 -1.936 . . . . 0.0 105.773 159.433 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 101' ' ' LEU . . . . . . . . . . . . . 3.2 mm? -96.77 138.59 34.1 Favored 'General case' 0 CA--C 1.505 -0.753 0 N-CA-C 106.661 -1.607 . . . . 0.0 106.661 149.376 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 102' ' ' ALA . . . . . . . . . . . . . . . -131.98 154.04 49.72 Favored 'General case' 0 C--N 1.327 -0.411 0 N-CA-C 107.319 -1.363 . . . . 0.0 107.319 165.529 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 103' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -162.94 172.2 15.44 Favored 'General case' 0 N--CA 1.442 -0.845 0 C-N-CA 127.815 2.446 . . . . 0.0 107.891 176.274 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 104' ' ' ALA . . . . . . . . . . . . . . . -53.47 -29.97 38.52 Favored 'General case' 0 CA--C 1.537 0.471 0 C-N-CA 124.16 0.984 . . . . 0.0 113.103 174.94 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 105' ' ' LYS . . . . . . . . . . . . . 53.2 mmtt -70.7 -72.39 0.21 Allowed 'General case' 0 C--O 1.232 0.138 0 C-N-CA 123.61 0.764 . . . . 0.0 111.815 175.143 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 106' ' ' GLN . . . . . . . . . . . . . 2.6 pt20 -154.57 -168.48 2.93 Favored 'General case' 0 C--O 1.232 0.168 0 C-N-CA 123.49 0.716 . . . . 0.0 110.169 -178.983 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 107' ' ' THR . . . . . . . . . . . . . 7.2 t -130.64 152.91 49.49 Favored 'General case' 0 N--CA 1.446 -0.637 0 C-N-CA 126.284 1.834 . . . . 0.0 107.583 176.264 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 108' ' ' LEU . . . . . . . . . . . . . 3.5 mm? -121.63 166.29 14.47 Favored 'General case' 0 C--O 1.237 0.442 0 C-N-CA 125.193 1.397 . . . . 0.0 109.995 174.179 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 109' ' ' THR . . . . . . . . . . . . . 9.4 m -130.96 106.6 8.52 Favored 'General case' 0 N--CA 1.448 -0.565 0 N-CA-C 107.94 -1.133 . . . . 0.0 107.94 166.225 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 110' ' ' TYR . . . . . 0.465 ' HB2' ' HB3' ' A' ' 99' ' ' LEU . 49.6 m-85 -98.96 165.26 11.84 Favored 'General case' 0 C--O 1.235 0.308 0 N-CA-C 108.946 -0.761 . . . . 0.0 108.946 172.668 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 111' ' ' LYS . . . . . 0.484 ' HE2' ' HG3' ' A' ' 15' ' ' GLU . 5.0 tppt? -122.39 146.18 47.58 Favored 'General case' 0 C--O 1.226 -0.134 0 C-N-CA 124.249 1.02 . . . . 0.0 110.144 178.932 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 112' ' ' LEU . . . . . . . . . . . . . 26.1 tp -69.65 17.82 0.05 OUTLIER 'General case' 0 CA--C 1.546 0.795 0 C-N-CA 128.813 2.845 . . . . 0.0 113.519 -177.736 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 113' ' ' ALA . . . . . . . . . . . . . . . -60.54 90.19 0.02 OUTLIER 'General case' 0 CA--C 1.534 0.361 0 C-N-CA 126.023 1.729 . . . . 0.0 111.794 -168.397 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 114' ' ' ASP . . . . . . . . . . . . . 27.2 t0 . . . . . 0 CA--C 1.51 -0.592 0 CA-C-O 122.901 1.334 . . . . 0.0 111.494 -168.864 . . . . . . . . 0 0 . 1 . 001 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 9.6 ttt . . . . . 0 C--O 1.234 0.252 0 N-CA-C 109.506 -0.553 . . . . 0.0 109.506 . . . . . . . . . 0 0 . 1 . 001 nuclear nobuild full ' A' A ' 2' ' ' VAL . . . . . . . . . . . . . 74.9 t -59.69 137.3 22.3 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.448 0 N-CA-C 108.382 -0.97 . . . . 0.0 108.382 173.403 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 3' ' ' THR . . . . . . . . . . . . . 0.1 OUTLIER -124.75 162.38 43.32 Favored Pre-proline 0 CA--C 1.537 0.444 0 C-N-CA 122.494 0.318 . . . . 0.0 110.98 177.107 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 4' ' ' PRO . . . . . . . . . . . . . 9.2 Cg_endo -71.22 -41.74 2.38 Favored 'Trans proline' 0 CA--C 1.532 0.41 0 C-N-CA 122.833 2.356 . . . . 0.0 112.58 -179.312 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 5' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -61.01 -44.59 97.19 Favored 'General case' 0 C--N 1.325 -0.48 0 C-N-CA 124.231 1.012 . . . . 0.0 110.576 -173.516 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 6' ' ' GLN . . . . . . . . . . . . . 12.7 pt20 -65.5 12.63 0.05 OUTLIER 'General case' 0 CA--C 1.541 0.612 0 C-N-CA 125.803 1.641 . . . . 0.0 114.678 175.135 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 7' ' ' LEU . . . . . . . . . . . . . 77.0 mt -130.97 -45.57 1.03 Allowed 'General case' 0 C--O 1.225 -0.187 0 C-N-CA 125.488 1.515 . . . . 0.0 110.354 -177.34 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 8' ' ' GLN . . . . . . . . . . . . . 19.3 mt-30 -62.12 -3.08 1.12 Allowed 'General case' 0 N--CA 1.469 0.487 0 N-CA-C 115.534 1.679 . . . . 0.0 115.534 -171.956 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 9' ' ' HIS . . . . . . . . . . . . . 97.7 m-70 -135.41 13.68 3.49 Favored 'General case' 0 C--N 1.326 -0.414 0 C-N-CA 125.181 1.393 . . . . 0.0 111.488 177.128 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 10' ' ' HIS . . . . . . . . . . . . . 94.7 m-70 -131.13 108.21 9.58 Favored 'General case' 0 N--CA 1.451 -0.404 0 C-N-CA 124.753 1.221 . . . . 0.0 109.353 -172.119 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 11' ' ' ARG . . . . . . . . . . . . . 9.5 ptt180 -74.83 163.34 27.77 Favored 'General case' 0 C--O 1.235 0.311 0 N-CA-C 108.976 -0.75 . . . . 0.0 108.976 174.617 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 12' ' ' PHE . . . . . . . . . . . . . 46.7 m-85 -139.19 146.8 40.98 Favored 'General case' 0 N--CA 1.448 -0.568 0 N-CA-C 108.416 -0.957 . . . . 0.0 108.416 173.137 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 13' ' ' VAL . . . . . 0.482 ' HA ' ' HA ' ' A' ' 30' ' ' GLU . 7.2 p -112.3 137.17 46.11 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.478 0 O-C-N 121.267 -0.895 . . . . 0.0 109.686 178.622 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 14' ' ' LEU . . . . . . . . . . . . . 26.7 tp -64.22 121.97 15.51 Favored 'General case' 0 N--CA 1.466 0.375 0 N-CA-C 107.254 -1.387 . . . . 0.0 107.254 178.669 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 1.6 tm-20 -105.63 -50.22 3.25 Favored 'General case' 0 C--N 1.326 -0.454 0 N-CA-C 108.134 -1.061 . . . . 0.0 108.134 -174.429 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 5.3 p -146.11 124.23 12.16 Favored 'General case' 0 N--CA 1.446 -0.663 0 CA-C-O 121.995 0.902 . . . . 0.0 110.713 179.833 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 17' ' ' VAL . . . . . . . . . . . . . 2.4 t -64.93 160.04 3.57 Favored 'Isoleucine or valine' 0 C--O 1.239 0.531 0 N-CA-C 107.137 -1.431 . . . . 0.0 107.137 161.776 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 18' ' ' ASN . . . . . . . . . . . . . 1.5 t30 -44.97 -43.31 8.97 Favored 'General case' 0 CA--C 1.53 0.203 0 C-N-CA 123.77 0.828 . . . . 0.0 111.864 165.115 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . -90.43 -33.67 8.49 Favored Glycine 0 CA--C 1.526 0.756 0 CA-C-O 117.686 -1.619 . . . . 0.0 114.389 -170.235 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 10.5 mttt -161.67 165.7 15.93 Favored Pre-proline 0 N--CA 1.469 0.496 0 CA-C-N 119.806 1.803 . . . . 0.0 110.321 -174.357 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 21' ' ' PRO . . . . . . . . . . . . . 97.0 Cg_endo -64.01 -179.96 0.94 Allowed 'Trans proline' 0 CA--C 1.537 0.639 0 C-N-CA 122.614 2.209 . . . . 0.0 110.953 163.121 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 22' ' ' VAL . . . . . . . . . . . . . 3.8 t -130.1 145.37 35.74 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.426 0 N-CA-C 107.909 -1.145 . . . . 0.0 107.909 169.837 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 23' ' ' THR . . . . . . . . . . . . . 0.1 OUTLIER -143.65 111.79 6.24 Favored 'General case' 0 C--O 1.233 0.213 0 C-N-CA 124.877 1.271 . . . . 0.0 108.273 178.107 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 24' ' ' SER . . . . . . . . . . . . . 2.9 m -134.16 45.12 2.64 Favored 'General case' 0 CA--C 1.535 0.378 0 CA-C-N 118.668 0.667 . . . . 0.0 112.244 -163.989 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 25' ' ' ASP . . . . . . . . . . . . . 1.0 OUTLIER 65.14 -81.17 0.03 OUTLIER 'General case' 0 N--CA 1.463 0.178 0 C-N-CA 128.695 2.798 . . . . 0.0 110.171 172.27 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 26' ' ' LYS . . . . . . . . . . . . . 21.3 ttpp -143.63 5.23 1.38 Allowed 'General case' 0 CA--C 1.535 0.373 0 C-N-CA 124.653 1.181 . . . . 0.0 112.008 171.085 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 27' ' ' ASN . . . . . . . . . . . . . 70.0 m-80 -122.41 70.05 33.32 Favored Pre-proline 0 C--O 1.233 0.202 0 C-N-CA 125.514 1.525 . . . . 0.0 108.158 -174.238 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 28' ' ' PRO . . . . . . . . . . . . . 93.0 Cg_endo -72.91 160.68 45.46 Favored 'Trans proline' 0 N--CA 1.454 -0.811 0 C-N-CA 121.986 1.791 . . . . 0.0 111.214 -178.623 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 29' ' ' PRO . . . . . . . . . . . . . 39.6 Cg_endo -68.17 64.84 1.04 Allowed 'Trans proline' 0 N--CA 1.458 -0.568 0 C-N-CA 123.864 3.043 . . . . 0.0 111.392 164.022 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 30' ' ' GLU . . . . . 0.482 ' HA ' ' HA ' ' A' ' 13' ' ' VAL . 14.7 pt-20 -72.71 170.07 15.33 Favored 'General case' 0 N--CA 1.446 -0.635 0 O-C-N 120.316 -1.49 . . . . 0.0 109.408 166.705 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 31' ' ' ILE . . . . . . . . . . . . . 20.0 tt -141.77 149.26 20.05 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.483 0 N-CA-C 106.983 -1.488 . . . . 0.0 106.983 178.475 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 32' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER -134.75 164.35 27.74 Favored 'General case' 0 N--CA 1.442 -0.829 0 CA-C-O 122.856 1.312 . . . . 0.0 109.083 172.929 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 33' ' ' PHE . . . . . . . . . . . . . 95.2 m-85 -133.02 167.13 20.85 Favored 'General case' 0 C--N 1.323 -0.58 0 CA-C-N 113.74 -1.573 . . . . 0.0 107.609 -177.233 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 34' ' ' GLY . . . . . . . . . . . . . . . -166.47 -170.69 31.7 Favored Glycine 0 N--CA 1.447 -0.615 0 N-CA-C 110.007 -1.237 . . . . 0.0 110.007 172.354 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 35' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -44.31 149.15 0.39 Allowed 'General case' 0 C--O 1.234 0.282 0 C-N-CA 126.707 2.003 . . . . 0.0 111.383 -173.261 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 32.7 mmtm 65.01 15.66 10.12 Favored 'General case' 0 CA--C 1.536 0.43 0 C-N-CA 125.574 1.549 . . . . 0.0 111.727 -170.919 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 37' ' ' MET . . . . . . . . . . . . . 11.5 mmm 59.7 20.97 9.68 Favored 'General case' 0 CA--C 1.54 0.576 0 C-N-CA 126.12 1.768 . . . . 0.0 113.272 -171.839 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 38' ' ' MET . . . . . . . . . . . . . 0.8 OUTLIER -61.19 160.01 11.1 Favored 'General case' 0 N--CA 1.452 -0.328 0 O-C-N 121.171 -0.956 . . . . 0.0 112.011 178.911 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 39' ' ' ILE . . . . . . . . . . . . . 10.4 mt -131.7 138.45 52.85 Favored 'Isoleucine or valine' 0 C--O 1.236 0.375 0 C-N-CA 124.851 1.26 . . . . 0.0 108.625 -168.473 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 40' ' ' SER . . . . . . . . . . . . . 13.7 m -135.89 132.83 37.03 Favored 'General case' 0 CA--C 1.531 0.232 0 N-CA-C 106.389 -1.708 . . . . 0.0 106.389 166.47 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 41' ' ' GLY . . . . . . . . . . . . . . . -157.91 172.35 35.08 Favored Glycine 0 C--N 1.334 0.439 0 CA-C-N 119.109 0.868 . . . . 0.0 111.49 -177.965 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 42' ' ' SER . . . . . . . . . . . . . 15.1 p -149.57 72.17 1.13 Allowed 'General case' 0 N--CA 1.452 -0.336 0 O-C-N 121.861 -0.788 . . . . 0.0 112.068 -165.283 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 43' ' ' MET . . . . . . . . . . . . . 6.3 mmt -66.48 -58.42 5.28 Favored 'General case' 0 CA--C 1.537 0.445 0 N-CA-C 109.315 -0.624 . . . . 0.0 109.315 178.207 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 44' ' ' CYS . . . . . 1.293 ' SG ' ' SG ' ' A' ' 70' ' ' CYS . 3.8 t -145.4 -57.32 0.32 Allowed 'General case' 0 N--CA 1.462 0.17 0 N-CA-C 107.128 -1.434 . . . . 0.0 107.128 161.247 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 45' ' ' ASN . . . . . . . . . . . . . 16.1 m-80 -74.42 7.17 3.06 Favored 'General case' 0 C--N 1.331 -0.211 0 C-N-CA 127.363 2.265 . . . . 0.0 113.267 -171.327 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 46' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER 57.9 150.1 0.01 OUTLIER 'General case' 0 C--O 1.225 -0.2 0 C-N-CA 126.831 2.052 . . . . 0.0 112.23 -166.115 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 47' ' ' PHE . . . . . . . . . . . . . 38.4 p90 -146.02 170.14 17.24 Favored 'General case' 0 N--CA 1.445 -0.706 0 CA-C-O 122.63 1.205 . . . . 0.0 109.392 167.963 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 48' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -161.66 161.9 29.71 Favored 'General case' 0 C--N 1.324 -0.531 0 C-N-CA 126.032 1.733 . . . . 0.0 106.83 174.996 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 49' ' ' GLY . . . . . . . . . . . . . . . 174.15 168.04 34.49 Favored Glycine 0 CA--C 1.523 0.591 0 CA-C-N 119.364 0.984 . . . . 0.0 111.976 166.178 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 50' ' ' GLU . . . . . . . . . . . . . 31.1 mt-10 -80.2 94.93 6.14 Favored 'General case' 0 C--O 1.236 0.368 0 C-N-CA 123.514 0.726 . . . . 0.0 109.874 -178.964 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 51' ' ' GLY . . . . . . . . . . . . . . . -69.71 173.37 37.79 Favored Glycine 0 CA--C 1.528 0.857 0 CA-C-O 122.797 1.221 . . . . 0.0 113.135 174.147 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 52' ' ' LYS . . . . . . . . . . . . . 1.4 ttmp? -151.63 154.28 36.09 Favored 'General case' 0 N--CA 1.454 -0.268 0 C-N-CA 126.205 1.802 . . . . 0.0 107.635 -179.66 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 53' ' ' LEU . . . . . . . . . . . . . 1.5 tm? -149.44 117.73 6.44 Favored 'General case' 0 N--CA 1.453 -0.29 0 N-CA-C 106.247 -1.76 . . . . 0.0 106.247 169.231 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 1.3 t -144.06 -26.15 0.54 Allowed 'General case' 0 CA--C 1.535 0.392 0 C-N-CA 124.431 1.092 . . . . 0.0 112.126 -179.341 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 55' ' ' ASN . . . . . . . . . . . . . 0.5 OUTLIER -140.19 -10.75 1.11 Allowed 'General case' 0 N--CA 1.473 0.678 0 CA-C-N 119.924 1.238 . . . . 0.0 113.489 177.246 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 56' ' ' GLY . . . . . . . . . . . . . . . 126.3 6.23 5.82 Favored Glycine 0 CA--C 1.532 1.095 0 O-C-N 121.242 -0.911 . . . . 0.0 112.069 -173.063 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 57' ' ' GLU . . . . . . . . . . . . . 28.1 tt0 -114.26 113.71 24.98 Favored 'General case' 0 C--O 1.237 0.426 0 C-N-CA 125.419 1.488 . . . . 0.0 108.387 -169.535 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 58' ' ' LEU . . . . . . . . . . . . . 47.6 tp -94.36 97.4 10.18 Favored 'General case' 0 CA--C 1.533 0.305 0 C-N-CA 122.878 0.471 . . . . 0.0 110.439 175.354 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 59' ' ' THR . . . . . . . . . . . . . 6.4 p -99.29 139.01 35.57 Favored 'General case' 0 C--O 1.237 0.422 0 C-N-CA 124.171 0.988 . . . . 0.0 110.057 168.66 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 60' ' ' ALA . . . . . . . . . . . . . . . -94.34 108.73 20.62 Favored 'General case' 0 C--O 1.234 0.253 0 C-N-CA 124.799 1.239 . . . . 0.0 109.594 171.523 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 61' ' ' LYS . . . . . . . . . . . . . 11.0 tttt -75.36 72.0 2.37 Favored 'General case' 0 C--O 1.235 0.338 0 C-N-CA 124.916 1.286 . . . . 0.0 108.786 170.06 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 62' ' ' GLY . . . . . . . . . . . . . . . 102.86 104.47 2.86 Favored Glycine 0 N--CA 1.451 -0.349 0 N-CA-C 107.721 -2.152 . . . . 0.0 107.721 -174.433 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 63' ' ' LEU . . . . . . . . . . . . . 1.8 tp -90.42 161.79 15.4 Favored 'General case' 0 N--CA 1.447 -0.619 0 N-CA-C 108.506 -0.924 . . . . 0.0 108.506 160.352 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 64' ' ' ALA . . . . . . . . . . . . . . . -153.8 144.14 22.26 Favored 'General case' 0 C--O 1.235 0.299 0 C-N-CA 124.363 1.065 . . . . 0.0 109.858 165.848 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 65' ' ' MET . . . . . . . . . . . . . 8.5 mtt -145.48 169.31 18.6 Favored 'General case' 0 N--CA 1.472 0.628 0 C-N-CA 127.014 2.126 . . . . 0.0 111.752 -172.313 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 66' ' ' THR . . . . . . . . . . . . . 6.7 p -105.33 -172.37 2.08 Favored 'General case' 0 CA--C 1.544 0.748 0 C-N-CA 124.781 1.232 . . . . 0.0 110.78 177.003 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 67' ' ' ARG . . . . . . . . . . . . . 64.9 mtm-85 -121.48 76.14 1.23 Allowed 'General case' 0 N--CA 1.47 0.571 0 C-N-CA 124.728 1.211 . . . . 0.0 109.604 169.943 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 68' ' ' MET . . . . . . . . . . . . . 78.6 mtm -102.79 178.33 4.6 Favored 'General case' 0 CA--C 1.533 0.322 0 C-N-CA 124.924 1.29 . . . . 0.0 110.81 171.95 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 69' ' ' MET . . . . . . . . . . . . . 0.4 OUTLIER -137.24 171.7 14.09 Favored 'General case' 0 C--O 1.237 0.434 0 C-N-CA 127.058 2.143 . . . . 0.0 105.233 166.54 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 70' ' ' CYS . . . . . 1.293 ' SG ' ' SG ' ' A' ' 44' ' ' CYS . 97.0 m -141.51 9.03 2.01 Favored 'General case' 0 C--N 1.328 -0.327 0 N-CA-C 115.251 1.574 . . . . 0.0 115.251 -168.438 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 71' ' ' ALA . . . . . . . . . . . . . . . 62.19 2.23 0.8 Allowed 'General case' 0 CA--C 1.536 0.43 0 C-N-CA 126.72 2.008 . . . . 0.0 115.037 179.088 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 72' ' ' ASN . . . . . . . . . . . . . 0.1 OUTLIER -121.83 157.12 58.2 Favored Pre-proline 0 N--CA 1.476 0.867 0 N-CA-C 106.53 -1.655 . . . . 0.0 106.53 156.368 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 73' ' ' PRO . . . . . . . . . . . . . 64.7 Cg_endo -77.38 -41.85 0.32 Allowed 'Trans proline' 0 N--CA 1.459 -0.519 0 C-N-CA 122.236 1.957 . . . . 0.0 111.817 -178.487 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 74' ' ' GLN . . . . . . . . . . . . . 40.1 tt0 -47.52 -60.57 2.44 Favored 'General case' 0 CA--C 1.532 0.271 0 C-N-CA 126.972 2.109 . . . . 0.0 110.609 -173.959 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 75' ' ' LEU . . . . . . . . . . . . . 82.4 mt -55.44 -40.65 71.81 Favored 'General case' 0 CA--C 1.536 0.42 0 C-N-CA 125.126 1.37 . . . . 0.0 110.537 -177.786 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 76' ' ' ASN . . . . . . . . . . . . . 23.7 t-20 -75.14 -19.93 59.64 Favored 'General case' 0 N--CA 1.467 0.384 0 C-N-CA 125.309 1.444 . . . . 0.0 112.379 -176.05 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 77' ' ' GLU . . . . . . . . . . . . . 0.3 OUTLIER -92.48 -31.35 15.28 Favored 'General case' 0 CA--C 1.535 0.376 0 C-N-CA 124.501 1.12 . . . . 0.0 111.821 174.338 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 78' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -61.21 -25.48 67.08 Favored 'General case' 0 CA--C 1.534 0.347 0 C-N-CA 126.503 1.921 . . . . 0.0 111.787 -176.982 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 79' ' ' ASP . . . . . . . . . . . . . 20.2 m-20 -56.58 -43.44 80.03 Favored 'General case' 0 C--O 1.237 0.395 0 C-N-CA 125.549 1.54 . . . . 0.0 111.254 170.959 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 80' ' ' ASN . . . . . . . . . . . . . 49.1 m-20 -72.85 -32.07 65.21 Favored 'General case' 0 N--CA 1.453 -0.294 0 C-N-CA 119.288 -0.965 . . . . 0.0 110.261 -177.193 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 81' ' ' THR . . . . . . . . . . . . . 0.9 OUTLIER -58.04 -54.1 50.79 Favored 'General case' 0 N--CA 1.452 -0.367 0 CA-C-N 118.835 0.743 . . . . 0.0 110.264 172.567 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 82' ' ' ILE . . . . . . . . . . . . . 7.3 tp -65.06 -36.46 77.86 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.277 0 C-N-CA 119.77 -0.772 . . . . 0.0 110.143 -175.321 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 83' ' ' SER . . . . . . . . . . . . . 6.4 m -56.61 -51.62 67.96 Favored 'General case' 0 N--CA 1.449 -0.525 0 C-N-CA 122.974 0.51 . . . . 0.0 111.474 176.681 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 84' ' ' GLU . . . . . . . . . . . . . 3.3 mm-40 -56.75 -54.92 40.71 Favored 'General case' 0 N--CA 1.452 -0.355 0 C-N-CA 126.059 1.744 . . . . 0.0 110.083 176.414 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 85' ' ' MET . . . . . . . . . . . . . 87.8 mtp -60.95 -41.66 96.72 Favored 'General case' 0 C--N 1.341 0.233 0 CA-C-O 121.863 0.839 . . . . 0.0 108.762 -169.721 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 86' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -77.35 -20.57 54.64 Favored 'General case' 0 C--N 1.331 -0.223 0 O-C-N 121.361 -0.837 . . . . 0.0 112.407 -177.289 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 87' ' ' LYS . . . . . . . . . . . . . 5.4 tttm -72.66 -54.77 8.12 Favored 'General case' 0 N--CA 1.452 -0.364 0 N-CA-C 108.195 -1.039 . . . . 0.0 108.195 170.304 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 88' ' ' GLU . . . . . . . . . . . . . 15.4 pt-20 -73.95 -33.87 64.07 Favored 'General case' 0 CA--C 1.534 0.362 0 CA-C-O 118.667 -0.682 . . . . 0.0 111.918 -168.433 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 89' ' ' GLY . . . . . . . . . . . . . . . 120.33 87.4 1.01 Allowed Glycine 0 C--N 1.335 0.519 0 N-CA-C 108.616 -1.794 . . . . 0.0 108.616 178.509 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 90' ' ' ALA . . . . . 0.697 ' HB1' HD12 ' A' ' 101' ' ' LEU . . . -69.07 119.3 13.15 Favored 'General case' 0 N--CA 1.443 -0.823 0 N-CA-C 107.535 -1.283 . . . . 0.0 107.535 -173.26 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 91' ' ' GLN . . . . . . . . . . . . . 58.9 mm-40 -79.76 116.02 19.69 Favored 'General case' 0 N--CA 1.447 -0.579 0 N-CA-C 105.48 -2.044 . . . . 0.0 105.48 -177.083 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 92' ' ' VAL . . . . . . . . . . . . . 24.2 t -103.55 108.69 25.06 Favored 'Isoleucine or valine' 0 N--CA 1.448 -0.536 0 C-N-CA 127.422 2.289 . . . . 0.0 109.201 -168.787 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 93' ' ' ASP . . . . . . . . . . . . . 5.1 t0 -107.54 68.59 0.72 Allowed 'General case' 0 C--O 1.238 0.489 0 C-N-CA 126.508 1.923 . . . . 0.0 109.051 174.674 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 94' ' ' LEU . . . . . . . . . . . . . 1.7 tm? -75.55 109.93 9.52 Favored 'General case' 0 N--CA 1.452 -0.327 0 N-CA-C 106.882 -1.525 . . . . 0.0 106.882 168.944 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 95' ' ' THR . . . . . . . . . . . . . 7.7 t -89.52 -163.74 1.05 Allowed 'General case' 0 C--N 1.326 -0.42 0 C-N-CA 125.539 1.536 . . . . 0.0 108.387 175.766 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 96' ' ' ALA . . . . . . . . . . . . . . . -44.76 -40.87 6.41 Favored 'General case' 0 CA--C 1.54 0.584 0 C-N-CA 124.609 1.164 . . . . 0.0 113.791 -174.357 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 97' ' ' ASN . . . . . . . . . . . . . 6.2 p30 -162.91 14.52 0.07 Allowed 'General case' 0 N--CA 1.47 0.536 0 C-N-CA 124.681 1.193 . . . . 0.0 113.207 -173.752 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 98' ' ' GLN . . . . . . . . . . . . . 6.0 tt0 -128.83 130.42 46.91 Favored 'General case' 0 C--N 1.333 -0.143 0 N-CA-C 106.555 -1.646 . . . . 0.0 106.555 174.913 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 99' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -81.3 136.13 35.75 Favored 'General case' 0 C--N 1.327 -0.409 0 N-CA-C 107.17 -1.418 . . . . 0.0 107.17 169.465 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 100' ' ' THR . . . . . . . . . . . . . 0.3 OUTLIER -128.84 137.91 51.75 Favored 'General case' 0 N--CA 1.45 -0.456 0 N-CA-C 106.12 -1.807 . . . . 0.0 106.12 165.228 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 101' ' ' LEU . . . . . 0.697 HD12 ' HB1' ' A' ' 90' ' ' ALA . 4.5 mm? -106.63 157.33 17.77 Favored 'General case' 0 N--CA 1.449 -0.502 0 N-CA-C 107.861 -1.163 . . . . 0.0 107.861 164.753 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 102' ' ' ALA . . . . . . . . . . . . . . . -155.31 109.47 2.89 Favored 'General case' 0 C--N 1.329 -0.283 0 N-CA-C 108.321 -0.992 . . . . 0.0 108.321 159.06 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 103' ' ' THR . . . . . . . . . . . . . 0.5 OUTLIER -121.37 -172.66 2.46 Favored 'General case' 0 C--O 1.238 0.476 0 N-CA-C 108.608 -0.886 . . . . 0.0 108.608 -175.687 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 104' ' ' ALA . . . . . . . . . . . . . . . -53.09 -44.17 67.35 Favored 'General case' 0 N--CA 1.454 -0.26 0 O-C-N 121.102 -0.998 . . . . 0.0 110.202 168.728 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 105' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -59.57 -66.7 0.47 Allowed 'General case' 0 C--O 1.234 0.265 0 N-CA-C 113.277 0.843 . . . . 0.0 113.277 -173.758 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 106' ' ' GLN . . . . . . . . . . . . . 7.8 pt20 -166.22 -172.77 2.36 Favored 'General case' 0 CA--C 1.535 0.393 0 C-N-CA 127.114 2.165 . . . . 0.0 108.139 178.76 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 107' ' ' THR . . . . . . . . . . . . . 4.5 t -100.2 157.45 16.57 Favored 'General case' 0 C--O 1.24 0.57 0 C-N-CA 125.441 1.497 . . . . 0.0 108.186 163.267 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 108' ' ' LEU . . . . . . . . . . . . . 76.6 mt -146.95 141.56 26.62 Favored 'General case' 0 C--N 1.332 -0.173 0 C-N-CA 127.071 2.148 . . . . 0.0 105.968 176.757 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 109' ' ' THR . . . . . . . . . . . . . 27.9 m -130.14 126.5 37.67 Favored 'General case' 0 C--O 1.237 0.411 0 N-CA-C 107.959 -1.126 . . . . 0.0 107.959 -174.147 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 110' ' ' TYR . . . . . . . . . . . . . 12.4 m-85 -124.43 158.58 32.43 Favored 'General case' 0 CA--C 1.531 0.237 0 C-N-CA 124.215 1.006 . . . . 0.0 109.375 -176.04 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 111' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -108.75 145.32 35.31 Favored 'General case' 0 CA--C 1.516 -0.362 0 C-N-CA 124.14 0.976 . . . . 0.0 109.905 -178.931 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 112' ' ' LEU . . . . . . . . . . . . . 25.7 tp -75.61 58.56 1.07 Allowed 'General case' 0 CA--C 1.54 0.582 0 C-N-CA 124.816 1.246 . . . . 0.0 108.515 166.917 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 113' ' ' ALA . . . . . . . . . . . . . . . -78.94 64.5 3.89 Favored 'General case' 0 CA--C 1.529 0.163 0 O-C-N 120.534 -1.354 . . . . 0.0 108.102 170.66 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 114' ' ' ASP . . . . . . . . . . . . . 25.2 t0 -84.44 14.55 4.37 Favored 'General case' 0 N--CA 1.465 0.316 0 CA-C-O 122.04 0.924 . . . . 0.0 113.322 -161.526 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 115' ' ' LEU . . . . . . . . . . . . . 15.3 mt 61.07 15.31 6.09 Favored 'General case' 0 CA--C 1.532 0.282 0 C-N-CA 127.407 2.283 . . . . 0.0 112.186 -172.828 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 116' ' ' MET . . . . . . . . . . . . . 9.8 tpt -120.84 96.16 5.0 Favored 'General case' 0 N--CA 1.448 -0.538 0 N-CA-C 105.807 -1.923 . . . . 0.0 105.807 176.313 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 117' ' ' ASN . . . . . . . . . . . . . 86.1 m-20 . . . . . 0 C--O 1.236 0.379 0 N-CA-C 108.132 -1.062 . . . . 0.0 108.132 178.106 . . . . . . . . 0 0 . 1 . 002 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 48.5 ttp . . . . . 0 N--CA 1.454 -0.239 0 N-CA-C 109.253 -0.647 . . . . 0.0 109.253 . . . . . . . . . 0 0 . 1 . 002 nuclear nobuild full ' A' A ' 2' ' ' VAL . . . . . . . . . . . . . 12.2 p -58.07 142.8 13.3 Favored 'Isoleucine or valine' 0 C--O 1.241 0.649 0 C-N-CA 124.197 0.999 . . . . 0.0 111.336 177.126 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 3' ' ' THR . . . . . 0.458 ' HB ' ' HD2' ' A' ' 4' ' ' PRO . 51.8 p -126.65 165.67 26.92 Favored Pre-proline 0 CA--C 1.535 0.371 0 C-N-CA 124.54 1.136 . . . . 0.0 110.223 179.467 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 4' ' ' PRO . . . . . 0.458 ' HD2' ' HB ' ' A' ' 3' ' ' THR . 45.2 Cg_endo -69.91 -34.45 14.05 Favored 'Trans proline' 0 CA--C 1.533 0.445 0 C-N-CA 122.672 2.248 . . . . 0.0 113.662 175.893 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 5' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -49.18 -59.97 3.2 Favored 'General case' 0 N--CA 1.477 0.88 0 C-N-CA 125.747 1.619 . . . . 0.0 110.121 -179.964 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 6' ' ' GLN . . . . . 0.413 HE21 HD23 ' A' ' 94' ' ' LEU . 19.9 pt20 -64.32 14.83 0.02 OUTLIER 'General case' 0 CA--C 1.542 0.64 0 C-N-CA 127.957 2.503 . . . . 0.0 114.789 176.946 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 7' ' ' LEU . . . . . . . . . . . . . 95.5 mt -132.77 -48.74 0.88 Allowed 'General case' 0 CA--C 1.518 -0.259 0 C-N-CA 124.758 1.223 . . . . 0.0 110.633 -175.734 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 8' ' ' GLN . . . . . . . . . . . . . 5.9 mt-30 -56.83 -5.76 0.27 Allowed 'General case' 0 CA--C 1.536 0.429 0 C-N-CA 126.024 1.73 . . . . 0.0 114.699 -175.725 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 9' ' ' HIS . . . . . . . . . . . . . 95.9 m-70 -125.11 0.63 7.87 Favored 'General case' 0 CA--C 1.532 0.27 0 CA-C-O 118.022 -0.99 . . . . 0.0 113.486 178.534 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 10' ' ' HIS . . . . . . . . . . . . . 98.2 m-70 -120.91 126.59 50.4 Favored 'General case' 0 C--O 1.234 0.253 0 CA-C-N 119.595 1.088 . . . . 0.0 111.919 -170.29 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 11' ' ' ARG . . . . . . . . . . . . . 32.8 ttt180 -70.4 154.38 41.96 Favored 'General case' 0 C--N 1.331 -0.212 0 C-N-CA 124.884 1.274 . . . . 0.0 109.06 162.929 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 12' ' ' PHE . . . . . . . . . . . . . 41.4 m-85 -130.83 165.83 22.15 Favored 'General case' 0 N--CA 1.444 -0.76 0 C-N-CA 125.727 1.611 . . . . 0.0 107.982 164.581 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 13' ' ' VAL . . . . . 0.501 ' HA ' ' HA ' ' A' ' 30' ' ' GLU . 7.3 p -128.86 145.83 35.11 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.436 0 O-C-N 120.924 -1.11 . . . . 0.0 108.562 174.495 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 14' ' ' LEU . . . . . . . . . . . . . 4.9 tp -77.86 86.93 4.08 Favored 'General case' 0 C--O 1.233 0.23 0 N-CA-C 107.452 -1.314 . . . . 0.0 107.452 176.838 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 15' ' ' GLU . . . . . 0.404 ' HG2' ' HE2' ' A' ' 111' ' ' LYS . 17.7 tp10 -70.49 -49.86 43.97 Favored 'General case' 0 C--N 1.323 -0.546 0 CA-C-N 115.718 -0.674 . . . . 0.0 109.455 -176.465 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 63.2 p -147.51 136.2 21.92 Favored 'General case' 0 N--CA 1.446 -0.642 0 CA-C-O 122.363 1.078 . . . . 0.0 111.386 176.408 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 17' ' ' VAL . . . . . . . . . . . . . 3.2 t -77.68 169.04 1.81 Allowed 'Isoleucine or valine' 0 C--O 1.238 0.486 0 C-N-CA 125.71 1.604 . . . . 0.0 107.355 174.324 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 18' ' ' ASN . . . . . . . . . . . . . 0.5 OUTLIER -51.23 -34.68 33.25 Favored 'General case' 0 CA--C 1.534 0.329 0 C-N-CA 123.469 0.707 . . . . 0.0 112.205 165.063 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . -93.01 -45.35 3.61 Favored Glycine 0 CA--C 1.527 0.788 0 CA-C-O 118.395 -1.225 . . . . 0.0 113.875 -170.892 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 13.9 mttt -160.28 166.09 16.39 Favored Pre-proline 0 N--CA 1.469 0.488 0 C-N-CA 126.145 1.778 . . . . 0.0 109.819 -173.261 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 21' ' ' PRO . . . . . . . . . . . . . 91.1 Cg_endo -63.5 -178.78 0.54 Allowed 'Trans proline' 0 CA--C 1.542 0.893 0 C-N-CA 122.718 2.279 . . . . 0.0 111.358 163.477 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 22' ' ' VAL . . . . . . . . . . . . . 4.0 t -131.59 154.74 40.93 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.377 0 C-N-CA 124.107 0.963 . . . . 0.0 108.445 172.881 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 23' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -148.63 112.91 5.25 Favored 'General case' 0 C--O 1.234 0.27 0 N-CA-C 105.791 -1.929 . . . . 0.0 105.791 170.832 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 24' ' ' SER . . . . . . . . . . . . . 15.3 m -121.33 48.94 1.58 Allowed 'General case' 0 N--CA 1.469 0.497 0 CA-C-N 119.505 1.048 . . . . 0.0 108.348 174.769 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 25' ' ' ASP . . . . . . . . . . . . . 38.4 t0 51.35 -83.77 0.01 OUTLIER 'General case' 0 N--CA 1.453 -0.308 0 C-N-CA 128.671 2.788 . . . . 0.0 110.852 -169.787 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 26' ' ' LYS . . . . . . . . . . . . . 32.6 tttm -130.5 -4.71 4.23 Favored 'General case' 0 CA--C 1.537 0.465 0 C-N-CA 125.698 1.599 . . . . 0.0 111.214 -172.121 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 27' ' ' ASN . . . . . . . . . . . . . 6.2 p30 -118.8 58.38 3.68 Favored Pre-proline 0 CA--C 1.545 0.753 0 C-N-CA 126.26 1.824 . . . . 0.0 112.885 177.735 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 28' ' ' PRO . . . . . . . . . . . . . 54.1 Cg_endo -71.09 168.07 24.3 Favored 'Trans proline' 0 CA--C 1.548 1.215 0 C-N-CA 123.72 2.947 . . . . 0.0 112.627 -176.6 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 29' ' ' PRO . . . . . . . . . . . . . 20.6 Cg_endo -73.2 63.71 4.3 Favored 'Trans proline' 0 C--N 1.355 0.873 0 C-N-CA 123.59 2.86 . . . . 0.0 113.525 179.067 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 30' ' ' GLU . . . . . 0.501 ' HA ' ' HA ' ' A' ' 13' ' ' VAL . 8.7 pt-20 -72.15 169.44 16.09 Favored 'General case' 0 CA--C 1.537 0.469 0 O-C-N 120.228 -1.545 . . . . 0.0 111.638 175.148 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 31' ' ' ILE . . . . . . . . . . . . . 16.6 tt -143.46 146.46 21.27 Favored 'Isoleucine or valine' 0 CA--C 1.529 0.166 0 N-CA-C 107.909 -1.145 . . . . 0.0 107.909 -179.39 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 32' ' ' SER . . . . . . . . . . . . . 14.7 p -137.48 157.26 46.94 Favored 'General case' 0 C--O 1.237 0.441 0 O-C-N 120.962 -1.086 . . . . 0.0 109.669 170.986 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 33' ' ' PHE . . . . . . . . . . . . . 86.5 m-85 -121.99 155.92 34.56 Favored 'General case' 0 N--CA 1.442 -0.857 0 N-CA-C 107.207 -1.405 . . . . 0.0 107.207 177.681 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 34' ' ' GLY . . . . . . . . . . . . . . . -149.87 -165.12 12.24 Favored Glycine 0 CA--C 1.516 0.12 0 N-CA-C 109.271 -1.532 . . . . 0.0 109.271 177.189 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 35' ' ' GLU . . . . . . . . . . . . . 0.2 OUTLIER -44.1 154.57 0.11 Allowed 'General case' 0 C--O 1.235 0.337 0 C-N-CA 126.745 2.018 . . . . 0.0 111.577 177.774 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 37.8 mtpt 55.92 13.92 1.24 Allowed 'General case' 0 CA--C 1.532 0.275 0 C-N-CA 124.778 1.231 . . . . 0.0 112.311 -171.659 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 37' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER 59.36 25.99 14.78 Favored 'General case' 0 CA--C 1.542 0.653 0 C-N-CA 124.872 1.269 . . . . 0.0 110.903 -175.135 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 38' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -61.86 164.54 6.27 Favored 'General case' 0 N--CA 1.444 -0.748 0 O-C-N 120.449 -1.407 . . . . 0.0 111.575 173.015 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 39' ' ' ILE . . . . . . . . . . . . . 10.6 mt -134.05 139.26 48.72 Favored 'Isoleucine or valine' 0 C--O 1.238 0.455 0 N-CA-C 106.732 -1.581 . . . . 0.0 106.732 -172.108 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 40' ' ' SER . . . . . . . . . . . . . 58.8 m -136.29 152.82 51.1 Favored 'General case' 0 C--O 1.234 0.266 0 N-CA-C 109.591 -0.522 . . . . 0.0 109.591 156.067 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 41' ' ' GLY . . . . . . . . . . . . . . . -164.98 -175.26 35.55 Favored Glycine 0 CA--C 1.527 0.835 0 C-N-CA 124.645 1.117 . . . . 0.0 110.323 172.532 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 42' ' ' SER . . . . . . . . . . . . . 22.1 p -151.27 87.43 1.39 Allowed 'General case' 0 N--CA 1.445 -0.713 0 C-N-CA 124.69 1.196 . . . . 0.0 110.02 177.737 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 43' ' ' MET . . . . . . . . . . . . . 6.2 mmt -61.11 -66.95 0.45 Allowed 'General case' 0 C--N 1.341 0.236 0 N-CA-C 108.455 -0.942 . . . . 0.0 108.455 169.601 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 44' ' ' CYS . . . . . 1.288 ' SG ' ' SG ' ' A' ' 70' ' ' CYS . 17.1 t -138.01 -57.04 0.67 Allowed 'General case' 0 N--CA 1.447 -0.586 0 N-CA-C 106.446 -1.687 . . . . 0.0 106.446 164.571 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 45' ' ' ASN . . . . . . . . . . . . . 5.8 m-80 -76.68 8.28 3.78 Favored 'General case' 0 N--CA 1.464 0.259 0 C-N-CA 127.4 2.28 . . . . 0.0 115.854 -168.394 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 46' ' ' ARG . . . . . . . . . . . . . 8.7 mtm180 53.37 160.24 0.01 OUTLIER 'General case' 0 CA--C 1.52 -0.176 0 C-N-CA 126.78 2.032 . . . . 0.0 112.362 -155.936 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 47' ' ' PHE . . . . . . . . . . . . . 48.8 p90 -159.32 153.1 23.01 Favored 'General case' 0 C--N 1.321 -0.657 0 CA-C-N 113.653 -1.612 . . . . 0.0 107.672 164.83 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 48' ' ' SER . . . . . . . . . . . . . 3.3 m -154.26 156.93 37.93 Favored 'General case' 0 N--CA 1.444 -0.754 0 C-N-CA 125.696 1.598 . . . . 0.0 106.823 176.391 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 49' ' ' GLY . . . . . . . . . . . . . . . 174.57 163.86 28.5 Favored Glycine 0 N--CA 1.448 -0.543 0 N-CA-C 111.193 -0.763 . . . . 0.0 111.193 167.994 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 50' ' ' GLU . . . . . . . . . . . . . 34.0 tt0 -64.66 100.12 0.36 Allowed 'General case' 0 N--CA 1.445 -0.685 0 C-N-CA 125.437 1.495 . . . . 0.0 108.985 171.985 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 51' ' ' GLY . . . . . . . . . . . . . . . -72.18 177.45 39.25 Favored Glycine 0 CA--C 1.527 0.79 0 N-CA-C 111.483 -0.647 . . . . 0.0 111.483 161.027 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 52' ' ' LYS . . . . . . . . . . . . . 16.6 tttp -162.77 151.24 14.38 Favored 'General case' 0 N--CA 1.455 -0.201 0 N-CA-C 106.985 -1.487 . . . . 0.0 106.985 171.281 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 53' ' ' LEU . . . . . . . . . . . . . 42.7 tp -146.9 119.36 8.45 Favored 'General case' 0 CA--C 1.517 -0.299 0 N-CA-C 107.436 -1.32 . . . . 0.0 107.436 173.808 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 2.1 t -157.64 14.63 0.23 Allowed 'General case' 0 CA--C 1.541 0.608 0 C-N-CA 123.158 0.583 . . . . 0.0 110.768 166.945 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 55' ' ' ASN . . . . . . . . . . . . . 18.2 p-10 -154.87 26.68 0.43 Allowed 'General case' 0 CA--C 1.537 0.446 0 C-N-CA 125.178 1.391 . . . . 0.0 111.528 -169.743 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 56' ' ' GLY . . . . . . . . . . . . . . . 63.62 17.08 59.69 Favored Glycine 0 CA--C 1.531 1.044 0 O-C-N 121.609 -0.682 . . . . 0.0 113.62 -179.605 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 57' ' ' GLU . . . . . . . . . . . . . 33.9 tt0 -129.74 151.12 50.67 Favored 'General case' 0 N--CA 1.451 -0.394 0 C-N-CA 125.633 1.573 . . . . 0.0 107.271 -174.24 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 58' ' ' LEU . . . . . . . . . . . . . 59.0 tp -131.6 107.91 9.17 Favored 'General case' 0 N--CA 1.455 -0.203 0 C-N-CA 125.717 1.607 . . . . 0.0 108.012 175.932 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 59' ' ' THR . . . . . . . . . . . . . 4.5 p -107.57 160.01 16.01 Favored 'General case' 0 CA--C 1.536 0.416 0 C-N-CA 125.726 1.611 . . . . 0.0 110.171 176.594 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 60' ' ' ALA . . . . . . . . . . . . . . . -110.14 102.37 11.08 Favored 'General case' 0 C--O 1.234 0.27 0 C-N-CA 124.851 1.26 . . . . 0.0 111.713 168.569 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 61' ' ' LYS . . . . . . . . . . . . . 0.3 OUTLIER -79.23 5.4 12.35 Favored 'General case' 0 CA--C 1.539 0.526 0 N-CA-C 112.755 0.65 . . . . 0.0 112.755 168.639 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 62' ' ' GLY . . . . . . . . . . . . . . . -167.91 48.68 0.24 Allowed Glycine 0 C--N 1.331 0.303 0 CA-C-N 121.384 1.902 . . . . 0.0 111.487 -177.567 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 63' ' ' LEU . . . . . . . . . . . . . 0.9 OUTLIER -61.29 140.03 58.05 Favored 'General case' 0 N--CA 1.45 -0.457 0 N-CA-C 108.351 -0.981 . . . . 0.0 108.351 171.438 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 64' ' ' ALA . . . . . . . . . . . . . . . -144.12 134.81 24.96 Favored 'General case' 0 N--CA 1.454 -0.25 0 N-CA-C 109.024 -0.732 . . . . 0.0 109.024 171.457 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 65' ' ' MET . . . . . . . . . . . . . 68.4 mtp -139.98 179.49 6.58 Favored 'General case' 0 C--O 1.24 0.604 0 C-N-CA 124.656 1.182 . . . . 0.0 110.094 -170.179 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 66' ' ' THR . . . . . . . . . . . . 0.282 3.3 p -120.4 -163.04 0.98 Allowed 'General case' 0 CA--C 1.551 0.992 0 C-N-CA 125.508 1.523 . . . . 0.0 112.671 -176.306 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 67' ' ' ARG . . . . . . . . . . . . . 17.7 mmt180 -130.15 62.25 1.57 Allowed 'General case' 0 N--CA 1.475 0.813 0 C-N-CA 126.6 1.96 . . . . 0.0 111.715 173.741 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 68' ' ' MET . . . . . . . . . . . . . 77.2 mtm -99.53 171.53 7.87 Favored 'General case' 0 N--CA 1.468 0.429 0 C-N-CA 125.837 1.655 . . . . 0.0 111.684 172.901 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 69' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -129.28 161.81 29.36 Favored 'General case' 0 C--O 1.237 0.402 0 C-N-CA 127.627 2.371 . . . . 0.0 108.489 -176.42 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 70' ' ' CYS . . . . . 1.288 ' SG ' ' SG ' ' A' ' 44' ' ' CYS . 66.2 m -145.74 13.08 1.32 Allowed 'General case' 0 N--CA 1.474 0.773 0 N-CA-C 116.585 2.069 . . . . 0.0 116.585 -170.125 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 71' ' ' ALA . . . . . . . . . . . . . . . 68.39 -28.04 0.15 Allowed 'General case' 0 N--CA 1.473 0.697 0 C-N-CA 127.741 2.416 . . . . 0.0 116.182 166.301 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 72' ' ' ASN . . . . . . . . . . . . . 1.1 t-20 -88.73 163.42 35.52 Favored Pre-proline 0 C--O 1.24 0.564 0 C-N-CA 127.235 2.214 . . . . 0.0 105.844 159.634 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 73' ' ' PRO . . . . . . . . . . . . . 24.6 Cg_endo -92.55 -19.68 0.6 Allowed 'Trans proline' 0 N--CA 1.451 -0.98 0 C-N-CA 121.596 1.531 . . . . 0.0 110.951 169.917 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 74' ' ' GLN . . . . . . . . . . . . . 63.3 tt0 -52.65 -62.62 1.53 Allowed 'General case' 0 C--N 1.343 0.312 0 C-N-CA 125.135 1.374 . . . . 0.0 110.586 -176.657 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 75' ' ' LEU . . . . . . . . . . . . . 19.9 mt -62.93 -28.0 69.76 Favored 'General case' 0 CA--C 1.538 0.481 0 C-N-CA 122.959 0.504 . . . . 0.0 110.451 -173.45 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 76' ' ' ASN . . . . . . . . . . . . . 2.0 t-20 -72.52 -34.64 67.73 Favored 'General case' 0 CA--C 1.532 0.27 0 C-N-CA 126.284 1.834 . . . . 0.0 111.811 -179.867 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 77' ' ' GLU . . . . . . . . . . . . . 1.1 mm-40 -78.99 -30.96 44.67 Favored 'General case' 0 C--O 1.234 0.24 0 C-N-CA 123.757 0.823 . . . . 0.0 110.694 172.451 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 78' ' ' LEU . . . . . . . . . . . . . 3.0 mp -62.68 -35.63 80.3 Favored 'General case' 0 N--CA 1.456 -0.155 0 C-N-CA 124.778 1.231 . . . . 0.0 110.442 -179.688 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 79' ' ' ASP . . . . . . . . . . . . . 74.2 m-20 -53.17 -47.55 68.7 Favored 'General case' 0 CA--C 1.517 -0.312 0 C-N-CA 124.207 1.003 . . . . 0.0 110.699 171.514 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 80' ' ' ASN . . . . . . . . . . . . . 37.4 m-20 -78.16 -35.08 49.26 Favored 'General case' 0 N--CA 1.452 -0.328 0 N-CA-C 108.801 -0.815 . . . . 0.0 108.801 -171.482 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 81' ' ' THR . . . . . . . . . . . . . 12.8 m -58.41 -56.22 24.88 Favored 'General case' 0 N--CA 1.445 -0.719 0 C-N-CA 123.814 0.846 . . . . 0.0 109.701 172.316 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 82' ' ' ILE . . . . . . . . . . . . . 10.2 tp -65.25 -34.35 69.91 Favored 'Isoleucine or valine' 0 C--N 1.34 0.195 0 CA-C-N 120.093 1.315 . . . . 0.0 110.905 -174.089 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 83' ' ' SER . . . . . . . . . . . . . 11.2 t -62.35 -54.25 43.13 Favored 'General case' 0 N--CA 1.446 -0.649 0 N-CA-C 109.249 -0.648 . . . . 0.0 109.249 -179.0 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 84' ' ' GLU . . . . . . . . . . . . . 4.5 mm-40 -57.56 -44.83 85.57 Favored 'General case' 0 N--CA 1.449 -0.484 0 C-N-CA 124.864 1.266 . . . . 0.0 110.127 174.99 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 85' ' ' MET . . . . . . . . . . . . . 95.4 mtp -73.02 -1.1 15.85 Favored 'General case' 0 CA--C 1.518 -0.284 0 CA-C-N 119.175 0.898 . . . . 0.0 112.665 -173.86 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 86' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -112.73 -16.19 12.82 Favored 'General case' 0 C--N 1.327 -0.398 0 CA-C-N 119.686 1.13 . . . . 0.0 110.786 170.941 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 87' ' ' LYS . . . . . . . . . . . . . 1.8 mptp? -79.3 -26.84 42.21 Favored 'General case' 0 N--CA 1.453 -0.286 0 CA-C-O 117.861 -1.066 . . . . 0.0 112.385 -173.578 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 88' ' ' GLU . . . . . . . . . . . . . 22.7 pt-20 -110.23 0.77 18.29 Favored 'General case' 0 CA--C 1.54 0.573 0 C-N-CA 124.977 1.311 . . . . 0.0 113.476 -170.778 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 89' ' ' GLY . . . . . . . . . . . . . . . 86.04 99.78 0.75 Allowed Glycine 0 C--N 1.338 0.679 0 C-N-CA 126.862 2.173 . . . . 0.0 110.256 -173.276 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 90' ' ' ALA . . . . . . . . . . . . . . . -71.87 139.68 48.95 Favored 'General case' 0 N--CA 1.465 0.309 0 N-CA-C 107.591 -1.263 . . . . 0.0 107.591 164.988 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 91' ' ' GLN . . . . . . . . . . . . . 78.1 mm-40 -74.17 145.89 43.87 Favored 'General case' 0 N--CA 1.445 -0.677 0 N-CA-C 105.771 -1.937 . . . . 0.0 105.771 158.359 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 92' ' ' VAL . . . . . . . . . . . . . 7.9 p -135.02 124.51 43.19 Favored 'Isoleucine or valine' 0 N--CA 1.449 -0.476 0 N-CA-C 106.645 -1.613 . . . . 0.0 106.645 -172.346 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 93' ' ' ASP . . . . . . . . . . . . . 4.1 m-20 -142.21 85.97 1.94 Allowed 'General case' 0 C--O 1.232 0.169 0 N-CA-C 107.893 -1.151 . . . . 0.0 107.893 -174.098 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 94' ' ' LEU . . . . . 0.413 HD23 HE21 ' A' ' 6' ' ' GLN . 42.7 tp -77.9 111.08 13.38 Favored 'General case' 0 N--CA 1.461 0.118 0 N-CA-C 107.474 -1.306 . . . . 0.0 107.474 169.891 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 95' ' ' THR . . . . . . . . . . . . . 8.9 t -77.73 -176.38 4.34 Favored 'General case' 0 CA--C 1.535 0.402 0 N-CA-C 109.292 -0.633 . . . . 0.0 109.292 165.258 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 96' ' ' ALA . . . . . . . . . . . . . . . -44.17 -41.1 5.49 Favored 'General case' 0 CA--C 1.532 0.27 0 C-N-CA 126.58 1.952 . . . . 0.0 113.053 -171.999 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 97' ' ' ASN . . . . . . . . . . . . . 12.9 p30 -161.41 70.25 0.35 Allowed 'General case' 0 N--CA 1.449 -0.516 0 C-N-CA 124.474 1.11 . . . . 0.0 108.174 168.532 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 98' ' ' GLN . . . . . . . . . . . . . 0.3 OUTLIER -170.25 135.31 1.28 Allowed 'General case' 0 N--CA 1.472 0.654 0 C-N-CA 125.836 1.654 . . . . 0.0 107.501 157.582 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 99' ' ' LEU . . . . . 0.699 HD22 ' CD2' ' A' ' 101' ' ' LEU . 0.5 OUTLIER -85.5 112.13 20.63 Favored 'General case' 0 N--CA 1.451 -0.383 0 C-N-CA 123.681 0.792 . . . . 0.0 109.736 174.775 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 100' ' ' THR . . . . . . . . . . . . . 53.4 m -89.42 115.66 27.03 Favored 'General case' 0 C--N 1.324 -0.504 0 N-CA-C 106.338 -1.727 . . . . 0.0 106.338 166.751 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 101' ' ' LEU . . . . . 0.699 ' CD2' HD22 ' A' ' 99' ' ' LEU . 1.7 mm? -109.7 141.67 41.95 Favored 'General case' 0 CA--C 1.507 -0.7 0 C-N-CA 124.656 1.182 . . . . 0.0 108.661 171.892 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 102' ' ' ALA . . . . . . . . . . . . . . . -145.0 143.55 30.56 Favored 'General case' 0 C--O 1.234 0.277 0 O-C-N 124.504 1.128 . . . . 0.0 110.351 178.573 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 103' ' ' THR . . . . . . . . . . . . . 0.6 OUTLIER -158.65 171.84 19.37 Favored 'General case' 0 N--CA 1.443 -0.818 0 C-N-CA 126.868 2.067 . . . . 0.0 108.278 174.35 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 104' ' ' ALA . . . . . . . . . . . . . . . -58.24 -35.39 71.65 Favored 'General case' 0 CA--C 1.533 0.326 0 O-C-N 121.34 -0.85 . . . . 0.0 111.275 178.117 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 105' ' ' LYS . . . . . . . . . . . . . 1.4 mmpt? -55.76 -72.58 0.07 Allowed 'General case' 0 CA--C 1.534 0.337 0 CA-C-O 118.424 -0.798 . . . . 0.0 113.005 170.992 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 106' ' ' GLN . . . . . . . . . . . . . 3.0 pt20 -159.8 -165.12 1.45 Allowed 'General case' 0 CA--C 1.536 0.41 0 C-N-CA 124.215 1.006 . . . . 0.0 110.129 -174.301 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 107' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -134.26 134.22 41.7 Favored 'General case' 0 CA--C 1.537 0.449 0 C-N-CA 126.564 1.945 . . . . 0.0 106.445 -179.5 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 108' ' ' LEU . . . . . . . . . . . . . 3.8 mm? -112.14 156.65 21.93 Favored 'General case' 0 C--O 1.235 0.315 0 C-N-CA 124.867 1.267 . . . . 0.0 109.065 174.585 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 109' ' ' THR . . . . . . . . . . . . . 3.3 m -127.52 87.77 2.68 Favored 'General case' 0 C--O 1.237 0.408 0 N-CA-C 105.946 -1.872 . . . . 0.0 105.946 -177.097 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 110' ' ' TYR . . . . . . . . . . . . . 91.4 m-85 -91.54 139.01 31.12 Favored 'General case' 0 CA--C 1.531 0.217 0 N-CA-C 109.42 -0.585 . . . . 0.0 109.42 -175.344 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 111' ' ' LYS . . . . . 0.404 ' HE2' ' HG2' ' A' ' 15' ' ' GLU . 2.5 tppt? -94.61 141.69 28.32 Favored 'General case' 0 N--CA 1.464 0.234 0 C-N-CA 123.733 0.813 . . . . 0.0 108.894 -178.47 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 112' ' ' LEU . . . . . . . . . . . . . 19.8 tp -75.07 49.67 0.45 Allowed 'General case' 0 CA--C 1.544 0.713 0 C-N-CA 126.572 1.949 . . . . 0.0 110.078 173.48 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 113' ' ' ALA . . . . . . . . . . . . . . . -84.25 78.46 9.78 Favored 'General case' 0 C--O 1.234 0.261 0 O-C-N 119.771 -1.83 . . . . 0.0 108.709 177.366 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 114' ' ' ASP . . . . . . . . . . . . . 1.9 p-10 -102.26 15.38 29.31 Favored 'General case' 0 C--N 1.328 -0.341 0 C-N-CA 124.098 0.959 . . . . 0.0 113.231 -170.759 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 115' ' ' LEU . . . . . . . . . . . . . 33.2 mt 65.9 4.91 3.17 Favored 'General case' 0 N--CA 1.467 0.397 0 C-N-CA 127.956 2.503 . . . . 0.0 114.229 177.005 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 116' ' ' MET . . . . . . . . . . . . . 7.8 tpt -97.21 93.47 6.55 Favored 'General case' 0 N--CA 1.45 -0.433 0 N-CA-C 107.085 -1.45 . . . . 0.0 107.085 179.618 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 117' ' ' ASN . . . . . . . . . . . . . 19.1 m-20 . . . . . 0 N--CA 1.467 0.412 0 O-C-N 121.581 -0.7 . . . . 0.0 110.783 -179.745 . . . . . . . . 0 0 . 1 . 003 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . 0.413 ' O ' HG12 ' A' ' 2' ' ' VAL . 0.0 OUTLIER . . . . . 0 C--O 1.234 0.239 0 N-CA-C 114.106 1.15 . . . . 0.0 114.106 . . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 2' ' ' VAL . . . . . 0.53 HG23 HE21 ' A' ' 6' ' ' GLN 0.267 10.0 p 54.68 165.7 0.0 OUTLIER 'Isoleucine or valine' 0 CA--C 1.547 0.857 0 C-N-CA 129.588 3.155 . . . . 0.0 111.705 -170.223 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 3' ' ' THR . . . . . . . . . . . . . 25.3 p -130.01 155.77 80.14 Favored Pre-proline 0 CA--C 1.533 0.307 0 O-C-N 119.628 -1.92 . . . . 0.0 109.774 170.942 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 4' ' ' PRO . . . . . . . . . . . . . 58.2 Cg_endo -62.28 -33.11 81.66 Favored 'Trans proline' 0 C--N 1.345 0.386 0 C-N-CA 124.139 3.226 . . . . 0.0 112.221 178.217 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 5' ' ' GLU . . . . . . . . . . . . . 11.8 tt0 -51.68 -36.29 45.89 Favored 'General case' 0 C--N 1.318 -0.778 0 C-N-CA 125.2 1.4 . . . . 0.0 112.197 171.343 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 6' ' ' GLN . . . . . 0.53 HE21 HG23 ' A' ' 2' ' ' VAL . 6.4 mt-30 -73.04 10.67 0.86 Allowed 'General case' 0 CA--C 1.545 0.783 0 C-N-CA 123.7 0.8 . . . . 0.0 112.265 173.725 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 7' ' ' LEU . . . . . 0.52 HD22 ' CE2' ' A' ' 33' ' ' PHE . 97.7 mt -136.54 -50.61 0.68 Allowed 'General case' 0 C--O 1.223 -0.335 0 C-N-CA 125.103 1.361 . . . . 0.0 112.56 -172.503 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 8' ' ' GLN . . . . . . . . . . . . . 1.8 mt-30 -53.01 -8.32 0.1 Allowed 'General case' 0 N--CA 1.481 1.106 0 C-N-CA 126.163 1.785 . . . . 0.0 115.748 -174.993 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 9' ' ' HIS . . . . . . . . . . . . . 98.1 m-70 -131.09 7.14 4.63 Favored 'General case' 0 CA--C 1.537 0.48 0 C-N-CA 125.017 1.327 . . . . 0.0 112.763 177.581 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 10' ' ' HIS . . . . . . . . . . . . . 95.1 m-70 -130.57 116.8 18.64 Favored 'General case' 0 C--O 1.233 0.212 0 C-N-CA 125.247 1.419 . . . . 0.0 110.464 -169.537 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 11' ' ' ARG . . . . . . . . . . . . . 32.3 ttm-85 -70.15 155.12 41.08 Favored 'General case' 0 CA--C 1.518 -0.263 0 C-N-CA 124.406 1.082 . . . . 0.0 108.64 169.656 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 12' ' ' PHE . . . . . . . . . . . . . 74.9 m-85 -139.06 153.87 48.12 Favored 'General case' 0 CA--C 1.501 -0.923 0 CA-C-O 122.732 1.253 . . . . 0.0 109.233 163.809 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 13' ' ' VAL . . . . . . . . . . . . . 0.0 OUTLIER -130.3 135.13 61.37 Favored 'Isoleucine or valine' 0 CA--C 1.494 -1.187 0 CA-C-N 113.286 -1.779 . . . . 0.0 114.99 -173.81 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 14' ' ' LEU . . . . . . . . . . . . . 2.2 tt -65.09 110.84 2.65 Favored 'General case' 0 CA--C 1.497 -1.091 0 O-C-N 126.135 2.147 . . . . 0.0 109.135 -173.144 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 0.9 OUTLIER -94.3 -52.46 4.34 Favored 'General case' 0 N--CA 1.426 -1.665 0 O-C-N 125.576 1.797 . . . . 0.0 108.446 -168.913 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 16' ' ' SER . . . . . 0.448 ' HA ' ' HA ' ' A' ' 21' ' ' PRO . 87.1 p -139.94 150.41 44.5 Favored 'General case' 0 N--CA 1.444 -0.738 0 CA-C-N 115.523 -0.762 . . . . 0.0 110.569 166.536 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 17' ' ' VAL . . . . . 0.55 HG12 ' H ' ' A' ' 18' ' ' ASN . 2.7 t -83.8 178.35 0.55 Allowed 'Isoleucine or valine' 0 N--CA 1.443 -0.779 0 N-CA-C 107.251 -1.389 . . . . 0.0 107.251 176.334 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 18' ' ' ASN . . . . . 0.55 ' H ' HG12 ' A' ' 17' ' ' VAL . 0.0 OUTLIER -50.44 -28.65 8.63 Favored 'General case' 0 N--CA 1.464 0.273 0 N-CA-C 114.633 1.346 . . . . 0.0 114.633 -178.812 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . -104.31 -76.96 1.13 Allowed Glycine 0 N--CA 1.445 -0.712 0 N-CA-C 109.652 -1.379 . . . . 0.0 109.652 171.167 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 16.3 mttt -125.07 165.73 24.28 Favored Pre-proline 0 N--CA 1.466 0.345 0 C-N-CA 124.702 1.201 . . . . 0.0 112.318 -167.473 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 21' ' ' PRO . . . . . 0.448 ' HA ' ' HA ' ' A' ' 16' ' ' SER . 56.1 Cg_endo -61.8 167.85 9.59 Favored 'Trans proline' 0 N--CA 1.458 -0.617 0 C-N-CA 123.607 2.871 . . . . 0.0 113.142 170.126 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 22' ' ' VAL . . . . . . . . . . . . . 7.9 p -141.1 157.47 22.52 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.357 0 C-N-CA 127.733 2.413 . . . . 0.0 105.731 -178.419 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 23' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -145.89 91.82 2.13 Favored 'General case' 0 C--O 1.236 0.38 0 N-CA-C 108.571 -0.9 . . . . 0.0 108.571 176.539 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 24' ' ' SER . . . . . . . . . . . . . 61.1 m -77.64 49.2 0.73 Allowed 'General case' 0 CA--C 1.533 0.29 0 C-N-CA 125.284 1.434 . . . . 0.0 110.271 178.467 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 25' ' ' ASP . . . . . . . . . . . . . 0.7 OUTLIER 56.8 -84.46 0.02 OUTLIER 'General case' 0 CA--C 1.514 -0.408 0 C-N-CA 127.728 2.411 . . . . 0.0 110.536 -169.602 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 26' ' ' LYS . . . . . . . . . . . . . 35.5 tttt -142.74 3.91 1.47 Allowed 'General case' 0 C--N 1.325 -0.483 0 C-N-CA 127.957 2.503 . . . . 0.0 110.29 -168.342 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 27' ' ' ASN . . . . . . . . . . . . . 70.6 m-80 -122.05 62.98 15.77 Favored Pre-proline 0 N--CA 1.453 -0.281 0 C-N-CA 127.156 2.182 . . . . 0.0 107.207 -173.165 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 28' ' ' PRO . . . . . . . . . . . . . 65.7 Cg_endo -64.54 159.14 46.06 Favored 'Trans proline' 0 C--O 1.24 0.622 0 C-N-CA 122.615 2.21 . . . . 0.0 110.864 -172.657 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 29' ' ' PRO . . . . . . . . . . . . . 28.0 Cg_endo -71.99 63.99 3.31 Favored 'Trans proline' 0 N--CA 1.456 -0.682 0 C-N-CA 122.829 2.352 . . . . 0.0 110.048 166.818 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 30' ' ' GLU . . . . . . . . . . . . . 1.6 pt-20 -72.09 166.23 22.71 Favored 'General case' 0 CA--C 1.542 0.664 0 N-CA-C 108.31 -0.996 . . . . 0.0 108.31 177.439 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 31' ' ' ILE . . . . . . . . . . . . . 10.6 tt -138.31 150.66 24.45 Favored 'Isoleucine or valine' 0 N--CA 1.445 -0.711 0 N-CA-C 105.627 -1.99 . . . . 0.0 105.627 172.789 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 32' ' ' SER . . . . . . . . . . . . . 78.0 p -144.97 174.3 11.14 Favored 'General case' 0 N--CA 1.432 -1.359 0 CA-C-O 122.691 1.234 . . . . 0.0 108.907 165.919 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 33' ' ' PHE . . . . . 0.52 ' CE2' HD22 ' A' ' 7' ' ' LEU . 77.0 m-85 -136.31 164.43 28.11 Favored 'General case' 0 N--CA 1.434 -1.246 0 N-CA-C 106.372 -1.714 . . . . 0.0 106.372 -173.371 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 34' ' ' GLY . . . . . . . . . . . . . . . 165.08 -168.83 39.42 Favored Glycine 0 N--CA 1.445 -0.765 0 N-CA-C 110.073 -1.211 . . . . 0.0 110.073 176.918 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 35' ' ' GLU . . . . . . . . . . . . . 3.4 mt-10 63.69 -86.14 0.02 OUTLIER 'General case' 0 C--N 1.331 -0.202 0 C-N-CA 125.813 1.645 . . . . 0.0 110.064 -178.396 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 29.7 mtpt -154.42 72.31 0.86 Allowed 'General case' 0 N--CA 1.44 -0.965 0 C-N-CA 126.926 2.09 . . . . 0.0 110.67 -176.277 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 37' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER 55.72 26.68 9.69 Favored 'General case' 0 CA--C 1.539 0.543 0 C-N-CA 123.998 0.919 . . . . 0.0 109.428 -178.036 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 38' ' ' MET . . . . . . . . . . . . . 10.4 mtp -73.82 164.89 26.04 Favored 'General case' 0 N--CA 1.448 -0.557 0 N-CA-C 108.246 -1.02 . . . . 0.0 108.246 172.279 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 39' ' ' ILE . . . . . . . . . . . . . 34.1 mt -135.93 134.4 50.85 Favored 'Isoleucine or valine' 0 C--O 1.235 0.323 0 N-CA-C 108.163 -1.051 . . . . 0.0 108.163 -178.428 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 40' ' ' SER . . . . . . . . . . . . . 34.5 t -142.02 144.83 33.83 Favored 'General case' 0 CA--C 1.536 0.405 0 C-N-CA 125.051 1.34 . . . . 0.0 108.824 177.377 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 41' ' ' GLY . . . . . . . . . . . . . . . -177.64 -176.35 45.6 Favored Glycine 0 CA--C 1.528 0.845 0 N-CA-C 111.333 -0.707 . . . . 0.0 111.333 177.98 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 42' ' ' SER . . . . . . . . . . . . . 34.0 p -143.81 80.3 1.65 Allowed 'General case' 0 CA--C 1.538 0.497 0 C-N-CA 123.007 0.523 . . . . 0.0 111.829 -171.89 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 43' ' ' MET . . . . . . . . . . . . . 3.1 mmt -63.79 -59.75 4.16 Favored 'General case' 0 N--CA 1.472 0.662 0 O-C-N 121.107 -0.996 . . . . 0.0 109.918 173.76 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 44' ' ' CYS . . . . . 1.288 ' SG ' ' SG ' ' A' ' 70' ' ' CYS . 41.9 t -129.06 -66.0 0.84 Allowed 'General case' 0 N--CA 1.451 -0.383 0 N-CA-C 108.156 -1.053 . . . . 0.0 108.156 151.298 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 45' ' ' ASN . . . . . . . . . . . . . 0.6 OUTLIER -87.84 19.78 3.36 Favored 'General case' 0 C--N 1.33 -0.259 0 N-CA-C 114.215 1.191 . . . . 0.0 114.215 -152.242 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 46' ' ' ARG . . . . . . . . . . . . . 17.4 mmm-85 57.46 162.74 0.03 OUTLIER 'General case' 0 CA--C 1.52 -0.178 0 C-N-CA 128.823 2.849 . . . . 0.0 112.025 -158.385 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 47' ' ' PHE . . . . . . . . . . . . . 53.9 p90 -158.28 162.4 37.77 Favored 'General case' 0 C--O 1.242 0.678 0 C-N-CA 125.513 1.525 . . . . 0.0 107.163 172.361 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 48' ' ' SER . . . . . . . . . . . . . 2.5 p -167.87 142.24 3.55 Favored 'General case' 0 C--O 1.236 0.381 0 C-N-CA 123.747 0.819 . . . . 0.0 109.073 -178.01 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 49' ' ' GLY . . . . . . . . . . . . . . . -171.12 169.63 42.62 Favored Glycine 0 C--N 1.337 0.633 0 CA-C-N 119.979 1.263 . . . . 0.0 110.648 -177.661 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 50' ' ' GLU . . . . . . . . . . . . . 36.7 mt-10 -83.01 102.55 11.83 Favored 'General case' 0 N--CA 1.446 -0.632 0 N-CA-C 106.412 -1.699 . . . . 0.0 106.412 177.767 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 51' ' ' GLY . . . . . . . . . . . . . . . -64.16 167.08 27.8 Favored Glycine 0 CA--C 1.528 0.85 0 CA-C-O 122.705 1.169 . . . . 0.0 112.859 165.312 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 52' ' ' LYS . . . . . . . . . . . . . 60.6 tttm -152.97 140.36 19.62 Favored 'General case' 0 C--N 1.331 -0.232 0 N-CA-C 105.543 -2.021 . . . . 0.0 105.543 164.538 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 53' ' ' LEU . . . . . . . . . . . . . 15.2 tp -142.37 133.23 25.65 Favored 'General case' 0 CA--C 1.52 -0.173 0 C-N-CA 123.968 0.907 . . . . 0.0 108.745 179.09 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER -149.52 -38.62 0.15 Allowed 'General case' 0 CA--C 1.541 0.616 0 C-N-CA 125.54 1.536 . . . . 0.0 110.144 177.489 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 55' ' ' ASN . . . . . . . . . . . . . 2.6 t30 -124.38 7.0 8.36 Favored 'General case' 0 N--CA 1.471 0.583 0 N-CA-C 115.49 1.663 . . . . 0.0 115.49 -157.115 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 56' ' ' GLY . . . . . . . . . . . . . . . 90.22 13.16 60.67 Favored Glycine 0 N--CA 1.468 0.769 0 O-C-N 121.185 -0.947 . . . . 0.0 112.148 -166.013 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 57' ' ' GLU . . . . . . . . . . . . . 42.3 tt0 -130.16 144.4 51.34 Favored 'General case' 0 N--CA 1.446 -0.663 0 C-N-CA 124.652 1.181 . . . . 0.0 109.036 179.326 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 58' ' ' LEU . . . . . 0.435 ' HB2' HG21 ' A' ' 92' ' ' VAL . 5.1 tp -127.99 159.11 36.02 Favored 'General case' 0 N--CA 1.447 -0.618 0 C-N-CA 126.376 1.87 . . . . 0.0 108.788 178.878 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 59' ' ' THR . . . . . . . . . . . . . 0.7 OUTLIER -141.61 174.98 10.05 Favored 'General case' 0 C--N 1.321 -0.649 0 C-N-CA 125.936 1.695 . . . . 0.0 106.988 171.201 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 60' ' ' ALA . . . . . . . . . . . . . . . -134.39 99.91 4.51 Favored 'General case' 0 CA--C 1.516 -0.337 0 N-CA-C 108.043 -1.095 . . . . 0.0 108.043 160.085 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 61' ' ' LYS . . . . . 0.423 ' HE2' ' N ' ' A' ' 62' ' ' GLY . 0.2 OUTLIER -55.74 123.19 13.32 Favored 'General case' 0 C--O 1.234 0.27 0 N-CA-C 107.06 -1.459 . . . . 0.0 107.06 172.017 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 62' ' ' GLY . . . . . 0.423 ' N ' ' HE2' ' A' ' 61' ' ' LYS . . . 96.23 -59.67 1.37 Allowed Glycine 0 CA--C 1.525 0.664 0 C-N-CA 124.981 1.276 . . . . 0.0 111.586 166.109 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 63' ' ' LEU . . . . . 0.439 HD22 ' HA ' ' A' ' 83' ' ' SER . 0.5 OUTLIER 47.07 90.69 0.02 OUTLIER 'General case' 0 CA--C 1.537 0.447 0 C-N-CA 129.187 2.995 . . . . 0.0 114.425 -178.003 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 64' ' ' ALA . . . . . . . . . . . . . . . -88.48 104.53 16.89 Favored 'General case' 0 C--O 1.237 0.411 0 C-N-CA 124.126 0.97 . . . . 0.0 111.026 -178.462 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 65' ' ' MET . . . . . . . . . . . . . 54.8 mtp -97.48 176.47 5.85 Favored 'General case' 0 N--CA 1.471 0.599 0 C-N-CA 123.622 0.769 . . . . 0.0 110.188 172.487 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 66' ' ' THR . . . . . . . . . . . . 0.348 1.5 p -113.77 -164.92 0.96 Allowed 'General case' 0 CA--C 1.556 1.193 0 C-N-CA 124.101 0.96 . . . . 0.0 110.171 178.214 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 67' ' ' ARG . . . . . . . . . . . . . 16.2 mtt180 -136.52 30.94 2.86 Favored 'General case' 0 N--CA 1.489 1.476 0 CA-C-N 120.816 1.644 . . . . 0.0 114.429 -170.808 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 68' ' ' MET . . . . . . . . . . . . . 44.1 mtm -77.81 176.71 8.8 Favored 'General case' 0 CA--C 1.537 0.471 0 O-C-N 120.265 -1.522 . . . . 0.0 111.206 176.646 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 69' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -86.01 170.17 12.52 Favored 'General case' 0 C--O 1.243 0.758 0 C-N-CA 128.693 2.797 . . . . 0.0 108.479 165.842 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 70' ' ' CYS . . . . . 1.288 ' SG ' ' SG ' ' A' ' 44' ' ' CYS . 0.1 OUTLIER -110.02 -177.86 3.37 Favored 'General case' 0 N--CA 1.454 -0.267 0 C-N-CA 125.847 1.659 . . . . 0.0 112.83 -177.869 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 71' ' ' ALA . . . . . . . . . . . . . . . -104.24 -12.45 16.65 Favored 'General case' 0 N--CA 1.466 0.328 0 N-CA-C 112.163 0.431 . . . . 0.0 112.163 165.5 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 72' ' ' ASN . . . . . . . . . . . . . 52.7 t30 -156.07 143.12 13.64 Favored Pre-proline 0 N--CA 1.466 0.357 0 N-CA-C 107.503 -1.295 . . . . 0.0 107.503 -174.353 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 73' ' ' PRO . . . . . . . . . . . . . 38.9 Cg_endo -75.67 -33.52 3.9 Favored 'Trans proline' 0 C--N 1.345 0.342 0 C-N-CA 121.736 1.624 . . . . 0.0 111.447 -167.627 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 74' ' ' GLN . . . . . . . . . . . . . 20.7 tt0 -57.92 -32.91 68.23 Favored 'General case' 0 CA--C 1.535 0.377 0 C-N-CA 124.638 1.175 . . . . 0.0 112.065 177.952 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 75' ' ' LEU . . . . . 0.52 ' HB2' ' SG ' ' A' ' 70' ' ' CYS . 82.3 mt -70.03 -43.34 71.5 Favored 'General case' 0 N--CA 1.465 0.301 0 O-C-N 121.83 -0.544 . . . . 0.0 110.129 172.648 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 76' ' ' ASN . . . . . . . . . . . . . 3.3 t-20 -68.24 -8.02 35.59 Favored 'General case' 0 CA--C 1.532 0.278 0 C-N-CA 125.681 1.592 . . . . 0.0 112.017 -178.913 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 77' ' ' GLU . . . . . . . . . . . . . 32.8 tt0 -102.46 -48.13 4.25 Favored 'General case' 0 N--CA 1.45 -0.459 0 C-N-CA 127.227 2.211 . . . . 0.0 109.295 178.39 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 78' ' ' LEU . . . . . 0.469 HD21 HG13 ' A' ' 17' ' ' VAL . 0.9 OUTLIER -58.02 -25.04 60.61 Favored 'General case' 0 N--CA 1.468 0.443 0 C-N-CA 124.083 0.953 . . . . 0.0 112.762 171.095 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 79' ' ' ASP . . . . . . . . . . . . . 13.4 t70 -46.0 -54.98 7.47 Favored 'General case' 0 N--CA 1.443 -0.777 0 C-N-CA 126.464 1.906 . . . . 0.0 111.236 166.952 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 80' ' ' ASN . . . . . . . . . . . . . 76.8 m-20 -78.77 -34.44 45.62 Favored 'General case' 0 N--CA 1.453 -0.312 0 CA-C-O 118.743 -0.646 . . . . 0.0 109.499 -174.093 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 81' ' ' THR . . . . . . . . . . . . . 13.7 m -49.72 -59.32 3.92 Favored 'General case' 0 CA--C 1.535 0.391 0 C-N-CA 123.898 0.879 . . . . 0.0 110.334 171.088 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 82' ' ' ILE . . . . . . . . . . . . . 7.8 tp -63.49 -35.79 73.82 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.393 0 CA-C-N 119.608 1.095 . . . . 0.0 110.667 -174.291 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 83' ' ' SER . . . . . 0.439 ' HA ' HD22 ' A' ' 63' ' ' LEU . 0.5 OUTLIER -66.78 -12.56 59.29 Favored 'General case' 0 C--O 1.234 0.277 0 C-N-CA 127.345 2.258 . . . . 0.0 113.939 179.128 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 84' ' ' GLU . . . . . . . . . . . . . 89.3 tt0 -114.79 -22.47 9.65 Favored 'General case' 0 C--N 1.324 -0.512 0 C-N-CA 124.888 1.275 . . . . 0.0 111.351 179.902 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 85' ' ' MET . . . . . . . . . . . . . 87.9 mtp -73.04 -55.17 6.88 Favored 'General case' 0 C--O 1.23 0.056 0 CA-C-O 122.682 1.23 . . . . 0.0 108.81 178.375 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 86' ' ' LEU . . . . . . . . . . . . . 1.4 mm? -73.92 -17.56 61.01 Favored 'General case' 0 N--CA 1.454 -0.233 0 C-N-CA 124.979 1.312 . . . . 0.0 111.654 -167.791 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 87' ' ' LYS . . . . . . . . . . . . . 25.1 tttt -72.14 -48.79 41.02 Favored 'General case' 0 N--CA 1.447 -0.603 0 C-N-CA 124.201 1.0 . . . . 0.0 109.156 177.667 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 88' ' ' GLU . . . . . . . . . . . . . 1.9 mm-40 -69.84 -62.9 1.2 Allowed 'General case' 0 N--CA 1.448 -0.548 0 O-C-N 124.254 0.971 . . . . 0.0 108.426 -178.806 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 89' ' ' GLY . . . . . . . . . . . . . . . 144.72 110.27 0.69 Allowed Glycine 0 C--N 1.336 0.557 0 N-CA-C 109.179 -1.568 . . . . 0.0 109.179 -176.276 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 90' ' ' ALA . . . . . . . . . . . . . . . -91.45 142.99 27.08 Favored 'General case' 0 C--N 1.333 -0.119 0 C-N-CA 124.061 0.945 . . . . 0.0 109.06 -178.807 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 91' ' ' GLN . . . . . . . . . . . . . 6.8 mm-40 -74.49 142.33 44.85 Favored 'General case' 0 N--CA 1.443 -0.824 0 N-CA-C 105.752 -1.944 . . . . 0.0 105.752 161.098 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 92' ' ' VAL . . . . . 0.435 HG21 ' HB2' ' A' ' 58' ' ' LEU . 26.6 t -137.45 107.71 5.17 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.491 0 N-CA-C 105.068 -2.197 . . . . 0.0 105.068 -170.761 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 93' ' ' ASP . . . . . . . . . . . . . 2.1 t0 -127.19 97.61 4.99 Favored 'General case' 0 N--CA 1.448 -0.527 0 N-CA-C 108.085 -1.08 . . . . 0.0 108.085 -157.148 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 94' ' ' LEU . . . . . . . . . . . . . 55.9 tp -98.24 104.15 16.16 Favored 'General case' 0 CA--C 1.511 -0.535 0 CA-C-O 122.046 0.927 . . . . 0.0 109.247 -175.045 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 95' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -65.67 174.19 2.43 Favored 'General case' 0 C--N 1.319 -0.726 0 CA-C-N 113.633 -1.621 . . . . 0.0 109.569 167.605 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 96' ' ' ALA . . . . . . . . . . . . . . . -48.51 -33.24 9.18 Favored 'General case' 0 CA--C 1.539 0.55 0 O-C-N 120.826 -1.172 . . . . 0.0 113.856 -172.565 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 97' ' ' ASN . . . . . . . . . . . . . 23.8 p30 -151.41 17.94 0.73 Allowed 'General case' 0 CA--C 1.539 0.526 0 C-N-CA 125.145 1.378 . . . . 0.0 113.559 172.324 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 98' ' ' GLN . . . . . . . . . . . . . 21.5 tt0 -137.32 121.04 17.39 Favored 'General case' 0 N--CA 1.461 0.119 0 O-C-N 120.821 -1.174 . . . . 0.0 110.654 177.323 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 99' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -69.19 140.86 54.62 Favored 'General case' 0 N--CA 1.451 -0.408 0 C-N-CA 126.019 1.728 . . . . 0.0 109.183 169.479 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 100' ' ' THR . . . . . . . . . . . . . 2.5 m -133.65 130.65 38.55 Favored 'General case' 0 C--N 1.323 -0.567 0 N-CA-C 106.795 -1.558 . . . . 0.0 106.795 167.789 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 101' ' ' LEU . . . . . . . . . . . . . 2.6 mp -108.97 158.67 17.48 Favored 'General case' 0 CA--C 1.509 -0.609 0 C-N-CA 125.209 1.404 . . . . 0.0 110.458 174.856 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 102' ' ' ALA . . . . . . . . . . . . . . . -152.18 158.56 43.07 Favored 'General case' 0 C--N 1.327 -0.385 0 C-N-CA 124.559 1.144 . . . . 0.0 108.228 164.558 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 103' ' ' THR . . . . . 0.425 HG22 ' H ' ' A' ' 104' ' ' ALA . 1.3 m -157.24 -172.08 3.87 Favored 'General case' 0 N--CA 1.441 -0.916 0 C-N-CA 127.484 2.314 . . . . 0.0 105.659 167.141 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 104' ' ' ALA . . . . . 0.425 ' H ' HG22 ' A' ' 103' ' ' THR . . . -62.3 -35.48 79.17 Favored 'General case' 0 C--N 1.34 0.196 0 CA-C-N 119.918 1.235 . . . . 0.0 111.536 168.623 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 105' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -59.74 -79.83 0.03 OUTLIER 'General case' 0 C--N 1.339 0.123 0 C-N-CA 123.59 0.756 . . . . 0.0 110.712 -178.03 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 106' ' ' GLN . . . . . . . . . . . . . 26.0 mt-30 -151.53 -176.88 5.78 Favored 'General case' 0 CA--C 1.536 0.424 0 C-N-CA 125.89 1.676 . . . . 0.0 107.301 -169.672 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 107' ' ' THR . . . . . . . . . . . . . 0.1 OUTLIER -138.56 134.47 33.9 Favored 'General case' 0 N--CA 1.453 -0.314 0 C-N-CA 125.943 1.697 . . . . 0.0 106.571 -177.222 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 108' ' ' LEU . . . . . . . . . . . . . 1.5 mm? -125.75 158.48 34.81 Favored 'General case' 0 C--O 1.233 0.197 0 C-N-CA 124.345 1.058 . . . . 0.0 108.401 179.413 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 109' ' ' THR . . . . . . . . . . . . . 27.8 m -122.63 137.52 54.88 Favored 'General case' 0 C--O 1.236 0.356 0 N-CA-C 107.797 -1.186 . . . . 0.0 107.797 177.086 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 110' ' ' TYR . . . . . . . . . . . . . 4.4 m-85 -135.92 145.19 46.0 Favored 'General case' 0 CA--C 1.535 0.395 0 C-N-CA 124.107 0.963 . . . . 0.0 111.761 -178.815 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 111' ' ' LYS . . . . . . . . . . . . . 4.1 tppt? -90.23 150.78 21.82 Favored 'General case' 0 N--CA 1.474 0.764 0 O-C-N 120.82 -1.175 . . . . 0.0 110.806 -179.367 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 112' ' ' LEU . . . . . . . . . . . . . 35.7 tp -74.6 46.47 0.28 Allowed 'General case' 0 CA--C 1.541 0.626 0 C-N-CA 124.792 1.237 . . . . 0.0 109.881 158.653 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 113' ' ' ALA . . . . . . . . . . . . . . . -84.02 102.34 12.42 Favored 'General case' 0 N--CA 1.444 -0.775 0 N-CA-C 104.383 -2.451 . . . . 0.0 104.383 162.147 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 114' ' ' ASP . . . . . . . . . . . . . 57.2 t0 -120.93 64.06 0.86 Allowed 'General case' 0 CA--C 1.516 -0.331 0 CA-C-O 122.287 1.041 . . . . 0.0 109.495 170.278 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 115' ' ' LEU . . . . . . . . . . . . . 57.6 mt 57.51 4.53 0.24 Allowed 'General case' 0 C--O 1.234 0.254 0 C-N-CA 128.178 2.591 . . . . 0.0 114.964 179.28 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 116' ' ' MET . . . . . . . . . . . . . 6.9 ttp 55.97 76.52 0.28 Allowed 'General case' 0 CA--C 1.53 0.179 0 C-N-CA 124.878 1.271 . . . . 0.0 108.709 -159.179 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 117' ' ' ASN . . . . . . . . . . . . . 2.8 t30 . . . . . 0 C--O 1.242 0.659 0 C-N-CA 124.13 0.972 . . . . 0.0 110.05 -178.062 . . . . . . . . 0 0 . 1 . 004 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 10.0 tpt . . . . . 0 C--O 1.235 0.326 0 N-CA-C 107.325 -1.361 . . . . 0.0 107.325 . . . . . . . . . 0 0 . 1 . 004 nuclear nobuild full ' A' A ' 2' ' ' VAL . . . . . . . . . . . . . 2.3 p -59.87 144.56 12.7 Favored 'Isoleucine or valine' 0 C--O 1.234 0.243 0 N-CA-C 108.399 -0.963 . . . . 0.0 108.399 170.227 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 3' ' ' THR . . . . . . . . . . . . . 0.6 OUTLIER -110.42 153.83 43.27 Favored Pre-proline 0 N--CA 1.445 -0.723 0 C-N-CA 123.163 0.585 . . . . 0.0 110.756 172.521 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 4' ' ' PRO . . . . . . . . . . . . . 52.7 Cg_endo -64.95 -33.73 50.66 Favored 'Trans proline' 0 N--CA 1.461 -0.386 0 C-N-CA 123.825 3.017 . . . . 0.0 111.91 -179.263 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 5' ' ' GLU . . . . . . . . . . . . . 65.3 tt0 -49.77 -35.32 22.08 Favored 'General case' 0 CA--C 1.549 0.928 0 C-N-CA 124.216 1.006 . . . . 0.0 111.647 169.759 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 6' ' ' GLN . . . . . . . . . . . . . 11.3 mt-30 -72.46 5.62 2.87 Favored 'General case' 0 CA--C 1.539 0.543 0 O-C-N 120.955 -1.091 . . . . 0.0 112.886 176.08 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 7' ' ' LEU . . . . . . . . . . . . . 93.6 mt -131.52 -54.91 1.02 Allowed 'General case' 0 C--O 1.225 -0.229 0 C-N-CA 125.533 1.533 . . . . 0.0 110.368 -171.615 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 8' ' ' GLN . . . . . . . . . . . . . 4.9 mt-30 -55.41 -6.72 0.19 Allowed 'General case' 0 N--CA 1.479 0.992 0 C-N-CA 127.686 2.394 . . . . 0.0 115.736 -172.815 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 9' ' ' HIS . . . . . . . . . . . . . 76.1 m-70 -139.38 30.31 2.16 Favored 'General case' 0 CA--C 1.54 0.558 0 C-N-CA 125.428 1.491 . . . . 0.0 111.491 178.394 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 10' ' ' HIS . . . . . . . . . . . . . 94.4 m-70 -140.87 142.18 34.55 Favored 'General case' 0 CA--C 1.534 0.344 0 C-N-CA 124.636 1.174 . . . . 0.0 110.917 176.891 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 11' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -88.5 149.03 23.85 Favored 'General case' 0 N--CA 1.463 0.19 0 C-N-CA 124.452 1.101 . . . . 0.0 108.824 167.669 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 12' ' ' PHE . . . . . . . . . . . . . 82.9 m-85 -139.91 154.57 47.27 Favored 'General case' 0 CA--C 1.494 -1.176 0 CA-C-O 122.525 1.155 . . . . 0.0 108.841 169.712 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 13' ' ' VAL . . . . . 0.461 ' CG2' ' HB3' ' A' ' 113' ' ' ALA . 0.0 OUTLIER -127.84 139.46 51.84 Favored 'Isoleucine or valine' 0 N--CA 1.434 -1.242 0 CA-C-N 113.983 -1.462 . . . . 0.0 107.059 -174.103 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 14' ' ' LEU . . . . . . . . . . . . . 19.1 tp -73.11 97.52 2.39 Favored 'General case' 0 N--CA 1.453 -0.321 0 N-CA-C 106.97 -1.493 . . . . 0.0 106.97 174.463 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 2.9 mm-40 -64.04 -54.88 27.28 Favored 'General case' 0 N--CA 1.451 -0.415 0 N-CA-C 108.434 -0.95 . . . . 0.0 108.434 176.962 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 10.1 m -156.14 153.24 28.99 Favored 'General case' 0 N--CA 1.451 -0.425 0 CA-C-O 121.927 0.87 . . . . 0.0 110.85 -174.011 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 17' ' ' VAL . . . . . . . . . . . . . 1.9 t -111.03 169.24 4.04 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.317 0 C-N-CA 126.097 1.759 . . . . 0.0 107.108 -171.832 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 18' ' ' ASN . . . . . . . . . . . . . 1.7 p-10 -57.32 -2.38 0.11 Allowed 'General case' 0 CA--C 1.54 0.578 0 N-CA-C 116.494 2.035 . . . . 0.0 116.494 179.949 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . -146.67 -2.64 0.55 Allowed Glycine 0 CA--C 1.527 0.793 0 CA-C-N 120.496 1.498 . . . . 0.0 115.8 -178.312 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 10.9 pttm 179.67 162.24 0.81 Allowed Pre-proline 0 N--CA 1.469 0.495 0 CA-C-N 119.952 1.876 . . . . 0.0 109.71 175.245 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 21' ' ' PRO . . . . . . . . . . . . . 55.3 Cg_endo -67.94 179.48 2.74 Favored 'Trans proline' 0 N--CA 1.459 -0.541 0 C-N-CA 123.753 2.969 . . . . 0.0 110.775 170.551 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 22' ' ' VAL . . . . . . . . . . . . . 90.1 t -110.15 153.5 11.91 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.384 0 N-CA-C 109.804 -0.443 . . . . 0.0 109.804 169.638 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 23' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -129.89 105.08 7.76 Favored 'General case' 0 CA--C 1.534 0.345 0 C-N-CA 126.548 1.939 . . . . 0.0 107.515 174.424 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 24' ' ' SER . . . . . . . . . . . . . 10.3 t -163.36 94.01 0.79 Allowed 'General case' 0 C--O 1.234 0.244 0 N-CA-C 108.55 -0.907 . . . . 0.0 108.55 168.633 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 25' ' ' ASP . . . . . . . . . . . . . 11.5 m-20 -79.24 -6.31 56.35 Favored 'General case' 0 CA--C 1.535 0.377 0 O-C-N 121.793 -0.567 . . . . 0.0 111.149 -172.748 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 26' ' ' LYS . . . . . . . . . . . . . 13.6 tttp -116.69 -32.88 5.02 Favored 'General case' 0 N--CA 1.471 0.59 0 CA-C-N 119.621 1.1 . . . . 0.0 113.225 -179.091 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 27' ' ' ASN . . . . . . . . . . . . . 1.4 p30 -138.3 77.41 35.68 Favored Pre-proline 0 C--N 1.323 -0.546 0 C-N-CA 123.848 0.859 . . . . 0.0 109.944 175.157 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 28' ' ' PRO . . . . . . . . . . . . . 70.6 Cg_endo -64.3 155.56 64.86 Favored 'Trans proline' 0 N--CA 1.455 -0.791 0 C-N-CA 121.689 1.592 . . . . 0.0 110.052 174.176 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 29' ' ' PRO . . . . . . . . . . . . . 18.1 Cg_endo -69.24 74.92 1.02 Allowed 'Trans proline' 0 N--CA 1.453 -0.883 0 C-N-CA 123.008 2.472 . . . . 0.0 108.505 159.606 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 30' ' ' GLU . . . . . 0.439 ' HA ' ' HA ' ' A' ' 13' ' ' VAL . 0.1 OUTLIER -87.86 163.98 16.12 Favored 'General case' 0 N--CA 1.446 -0.669 0 N-CA-C 108.391 -0.966 . . . . 0.0 108.391 168.445 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 31' ' ' ILE . . . . . . . . . . . . . 19.1 tt -130.69 142.4 43.76 Favored 'Isoleucine or valine' 0 N--CA 1.437 -1.082 0 C-N-CA 126.79 2.036 . . . . 0.0 105.534 172.658 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 32' ' ' SER . . . . . . . . . . . . . 19.9 m -138.65 163.91 30.87 Favored 'General case' 0 N--CA 1.443 -0.815 0 N-CA-C 106.294 -1.743 . . . . 0.0 106.294 171.347 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 33' ' ' PHE . . . . . . . . . . . . . 96.6 m-85 -144.64 143.28 30.68 Favored 'General case' 0 N--CA 1.439 -0.998 0 N-CA-C 106.043 -1.836 . . . . 0.0 106.043 -167.421 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 34' ' ' GLY . . . . . . . . . . . . . . . -166.39 152.22 21.11 Favored Glycine 0 CA--C 1.518 0.263 0 N-CA-C 109.746 -1.342 . . . . 0.0 109.746 160.958 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 35' ' ' GLU . . . . . . . . . . . . . 3.0 pt-20 44.94 145.93 0.0 OUTLIER 'General case' 0 C--O 1.219 -0.508 1 C-N-CA 134.756 5.222 . . . . 0.0 113.556 -171.864 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 52.8 mtpt 51.19 17.38 0.47 Allowed 'General case' 0 N--CA 1.475 0.818 0 O-C-N 120.002 -1.687 . . . . 0.0 114.852 170.387 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 37' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER 62.57 26.74 15.87 Favored 'General case' 0 CA--C 1.544 0.731 0 CA-C-N 120.432 1.469 . . . . 0.0 113.515 -167.837 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 38' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -63.01 158.75 18.63 Favored 'General case' 0 C--N 1.34 0.185 0 O-C-N 119.702 -1.873 . . . . 0.0 110.326 173.589 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 39' ' ' ILE . . . . . . . . . . . . . 37.8 mt -134.2 129.3 53.48 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.493 0 N-CA-C 107.261 -1.385 . . . . 0.0 107.261 -167.32 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 40' ' ' SER . . . . . . . . . . . . . 22.5 m -131.32 114.07 14.56 Favored 'General case' 0 N--CA 1.454 -0.251 0 C-N-CA 124.86 1.264 . . . . 0.0 107.928 176.181 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 41' ' ' GLY . . . . . . . . . . . . . . . -154.09 178.94 30.68 Favored Glycine 0 CA--C 1.523 0.576 0 N-CA-C 110.311 -1.116 . . . . 0.0 110.311 -179.226 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 42' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -161.47 92.86 0.91 Allowed 'General case' 0 N--CA 1.451 -0.376 0 O-C-N 121.302 -1.117 . . . . 0.0 108.961 -176.19 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 43' ' ' MET . . . . . . . . . . . . . 34.1 mmm -69.89 -53.0 19.97 Favored 'General case' 0 C--O 1.224 -0.238 0 N-CA-C 108.649 -0.871 . . . . 0.0 108.649 174.92 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 44' ' ' CYS . . . . . 1.287 ' SG ' ' SG ' ' A' ' 70' ' ' CYS . 11.6 t -152.79 -61.74 0.15 Allowed 'General case' 0 CA--C 1.517 -0.304 0 N-CA-C 107.959 -1.126 . . . . 0.0 107.959 176.336 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 45' ' ' ASN . . . . . . . . . . . . . 13.7 m120 -75.25 14.02 0.63 Allowed 'General case' 0 CA--C 1.536 0.41 0 C-N-CA 125.213 1.405 . . . . 0.0 113.109 -174.242 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 46' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER 53.35 169.15 0.02 OUTLIER 'General case' 0 N--CA 1.468 0.454 0 C-N-CA 127.278 2.231 . . . . 0.0 112.073 -157.675 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 47' ' ' PHE . . . . . . . . . . . . . 33.8 p90 -161.81 172.97 15.25 Favored 'General case' 0 C--O 1.24 0.579 0 C-N-CA 124.357 1.063 . . . . 0.0 110.922 164.162 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 48' ' ' SER . . . . . . . . . . . . . 1.7 p -179.89 150.07 0.37 Allowed 'General case' 0 N--CA 1.444 -0.733 0 C-N-CA 126.871 2.068 . . . . 0.0 109.086 178.142 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 49' ' ' GLY . . . . . . . . . . . . . . . 179.71 166.02 34.67 Favored Glycine 0 CA--C 1.525 0.697 0 N-CA-C 110.446 -1.062 . . . . 0.0 110.446 172.486 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 50' ' ' GLU . . . . . . . . . . . . . 19.2 mt-10 -80.17 97.26 6.83 Favored 'General case' 0 C--N 1.332 -0.18 0 C-N-CA 123.967 0.907 . . . . 0.0 108.97 176.451 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 51' ' ' GLY . . . . . . . . . . . . . . . -63.15 177.71 6.71 Favored Glycine 0 CA--C 1.53 0.983 0 C-N-CA 123.976 0.798 . . . . 0.0 112.263 163.689 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 52' ' ' LYS . . . . . . . . . . . . . 78.6 tttt -156.16 159.75 39.28 Favored 'General case' 0 CA--C 1.536 0.413 0 C-N-CA 125.026 1.33 . . . . 0.0 107.949 166.028 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 53' ' ' LEU . . . . . . . . . . . . . 18.6 tp -156.51 90.15 1.15 Allowed 'General case' 0 N--CA 1.466 0.337 0 C-N-CA 124.681 1.193 . . . . 0.0 109.127 175.306 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 16.3 t -139.53 35.46 2.03 Favored 'General case' 0 CA--C 1.534 0.363 0 C-N-CA 124.449 1.1 . . . . 0.0 108.726 -178.119 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 55' ' ' ASN . . . . . . . . . . . . . 3.7 p30 -165.11 -80.5 0.03 OUTLIER 'General case' 0 N--CA 1.452 -0.347 0 C-N-CA 127.597 2.359 . . . . 0.0 105.676 -167.549 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 56' ' ' GLY . . . . . . . . . . . . . . . 163.11 15.66 0.03 OUTLIER Glycine 0 CA--C 1.534 1.224 0 C-N-CA 128.966 3.174 . . . . 0.0 109.686 -173.124 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 57' ' ' GLU . . . . . . . . . . . . . 51.1 tt0 -135.33 131.57 36.58 Favored 'General case' 0 C--N 1.343 0.293 0 N-CA-C 108.026 -1.101 . . . . 0.0 108.026 -166.869 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 58' ' ' LEU . . . . . . . . . . . . . 65.5 tp -111.35 90.31 3.3 Favored 'General case' 0 CA--C 1.533 0.307 0 C-N-CA 126.692 1.997 . . . . 0.0 108.929 -177.102 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 59' ' ' THR . . . . . . . . . . . . . 17.7 p -95.37 131.36 41.58 Favored 'General case' 0 C--O 1.236 0.387 0 C-N-CA 124.29 1.036 . . . . 0.0 108.59 171.244 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 60' ' ' ALA . . . . . . . . . . . . . . . -76.87 137.34 39.1 Favored 'General case' 0 N--CA 1.454 -0.252 0 N-CA-C 108.742 -0.836 . . . . 0.0 108.742 167.27 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 61' ' ' LYS . . . . . . . . . . . . . 72.9 tttt -66.59 -22.86 66.13 Favored 'General case' 0 C--N 1.329 -0.304 0 O-C-N 121.913 -0.492 . . . . 0.0 112.003 172.622 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 62' ' ' GLY . . . . . . . . . . . . . . . 168.93 111.89 0.25 Allowed Glycine 0 C--N 1.332 0.316 0 N-CA-C 107.989 -2.044 . . . . 0.0 107.989 -178.523 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 63' ' ' LEU . . . . . 0.432 HD22 ' HA ' ' A' ' 83' ' ' SER . 0.3 OUTLIER -77.75 112.81 14.98 Favored 'General case' 0 N--CA 1.454 -0.239 0 N-CA-C 107.621 -1.251 . . . . 0.0 107.621 175.735 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 64' ' ' ALA . . . . . . . . . . . . . . . -90.31 90.77 8.21 Favored 'General case' 0 C--N 1.326 -0.456 0 C-N-CA 124.802 1.241 . . . . 0.0 111.25 168.408 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 65' ' ' MET . . . . . . . . . . . . . 51.7 mtp -94.58 -179.73 4.98 Favored 'General case' 0 CA--C 1.539 0.54 0 O-C-N 120.842 -1.161 . . . . 0.0 109.314 179.513 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 66' ' ' THR . . . . . . . . . . . . . 16.9 p -121.32 -164.51 1.14 Allowed 'General case' 0 CA--C 1.54 0.571 0 O-C-N 120.973 -1.08 . . . . 0.0 109.683 -172.211 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 67' ' ' ARG . . . . . . . . . . . . . 10.9 mmm180 -128.13 51.2 1.99 Allowed 'General case' 0 CA--C 1.542 0.645 0 C-N-CA 125.929 1.692 . . . . 0.0 109.732 -176.049 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 68' ' ' MET . . . . . . . . . . . . . 19.6 ptp -113.17 -176.44 2.9 Favored 'General case' 0 CA--C 1.54 0.563 0 C-N-CA 127.451 2.3 . . . . 0.0 111.292 -179.889 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 69' ' ' MET . . . . . . . . . . . . . 0.4 OUTLIER -140.9 175.67 9.43 Favored 'General case' 0 C--O 1.235 0.308 0 C-N-CA 126.717 2.007 . . . . 0.0 108.905 -178.942 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 70' ' ' CYS . . . . . 1.287 ' SG ' ' SG ' ' A' ' 44' ' ' CYS . 1.1 p -140.33 152.97 46.26 Favored 'General case' 0 C--N 1.33 -0.254 0 C-N-CA 126.544 1.938 . . . . 0.0 109.633 -168.179 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 71' ' ' ALA . . . . . . . . . . . . . . . -79.44 6.63 9.74 Favored 'General case' 0 CA--C 1.534 0.329 0 C-N-CA 124.747 1.219 . . . . 0.0 113.963 -178.202 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 72' ' ' ASN . . . . . . . . . . . . . 24.8 t30 -135.79 143.34 44.19 Favored Pre-proline 0 C--O 1.233 0.192 0 CA-C-N 119.885 1.221 . . . . 0.0 108.023 172.427 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 73' ' ' PRO . . . . . . . . . . . . . 36.7 Cg_endo -75.56 -34.94 3.03 Favored 'Trans proline' 0 N--CA 1.463 -0.314 0 C-N-CA 122.103 1.869 . . . . 0.0 113.071 -169.888 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 74' ' ' GLN . . . . . . . . . . . . . 34.8 tt0 -60.35 -37.34 80.39 Favored 'General case' 0 CA--C 1.537 0.475 0 C-N-CA 123.746 0.818 . . . . 0.0 110.61 175.788 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 75' ' ' LEU . . . . . . . . . . . . . 91.1 mt -59.09 -41.24 87.58 Favored 'General case' 0 N--CA 1.467 0.384 0 CA-C-N 119.421 1.01 . . . . 0.0 109.407 176.461 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 76' ' ' ASN . . . . . . . . . . . . . 0.6 OUTLIER -68.1 -22.11 64.92 Favored 'General case' 0 N--CA 1.466 0.366 0 C-N-CA 124.204 1.002 . . . . 0.0 111.683 -179.661 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 77' ' ' GLU . . . . . . . . . . . . . 1.6 mt-10 -80.36 -41.39 24.82 Favored 'General case' 0 CA--C 1.53 0.187 0 C-N-CA 123.704 0.802 . . . . 0.0 110.51 173.001 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 78' ' ' LEU . . . . . . . . . . . . . 27.5 mt -62.76 -13.01 27.92 Favored 'General case' 0 N--CA 1.464 0.258 0 C-N-CA 124.839 1.256 . . . . 0.0 113.204 -174.098 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 79' ' ' ASP . . . . . . . . . . . . . 4.6 t70 -44.59 -58.58 2.93 Favored 'General case' 0 C--O 1.232 0.135 0 C-N-CA 125.309 1.444 . . . . 0.0 111.18 162.653 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 80' ' ' ASN . . . . . . . . . . . . . 0.7 OUTLIER -68.7 -37.44 79.54 Favored 'General case' 0 CA--C 1.516 -0.36 0 C-N-CA 120.394 -0.522 . . . . 0.0 109.882 -175.469 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 81' ' ' THR . . . . . . . . . . . . . 7.1 m -58.5 -52.97 63.41 Favored 'General case' 0 N--CA 1.447 -0.625 0 N-CA-C 108.689 -0.856 . . . . 0.0 108.689 -175.958 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 82' ' ' ILE . . . . . . . . . . . . . 11.1 tp -68.85 -39.48 80.05 Favored 'Isoleucine or valine' 0 N--CA 1.456 -0.128 0 CA-C-N 119.107 0.867 . . . . 0.0 111.062 -177.319 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 83' ' ' SER . . . . . 0.432 ' HA ' HD22 ' A' ' 63' ' ' LEU . 5.4 t -60.42 -53.02 62.61 Favored 'General case' 0 N--CA 1.451 -0.378 0 N-CA-C 108.915 -0.772 . . . . 0.0 108.915 -175.138 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 84' ' ' GLU . . . . . . . . . . . . . 5.9 mm-40 -61.03 -44.79 96.87 Favored 'General case' 0 N--CA 1.446 -0.671 0 C-N-CA 124.835 1.254 . . . . 0.0 111.142 179.8 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 85' ' ' MET . . . . . . . . . . . . . 90.8 mtp -66.98 -17.51 64.95 Favored 'General case' 0 N--CA 1.451 -0.41 0 CA-C-N 118.023 0.374 . . . . 0.0 110.798 -175.269 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 86' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -105.79 -25.43 12.19 Favored 'General case' 0 N--CA 1.456 -0.137 0 C-N-CA 124.12 0.968 . . . . 0.0 111.754 -177.309 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 87' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -72.81 -55.38 6.79 Favored 'General case' 0 CA--C 1.518 -0.256 0 N-CA-C 108.466 -0.939 . . . . 0.0 108.466 172.456 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 88' ' ' GLU . . . . . . . . . . . . . 54.9 mt-10 -72.72 -28.13 62.47 Favored 'General case' 0 CA--C 1.53 0.184 0 C-N-CA 119.315 -0.954 . . . . 0.0 112.244 -170.788 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 89' ' ' GLY . . . . . . . . . . . . . . . 120.37 95.56 1.51 Allowed Glycine 0 C--N 1.338 0.681 0 C-N-CA 124.361 0.982 . . . . 0.0 110.685 173.996 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 90' ' ' ALA . . . . . . . . . . . . . . . -62.51 134.21 56.07 Favored 'General case' 0 N--CA 1.451 -0.392 0 CA-C-O 118.12 -0.943 . . . . 0.0 108.508 177.286 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 91' ' ' GLN . . . . . . . . . . . . . 11.6 mm-40 -73.87 140.94 46.05 Favored 'General case' 0 C--O 1.239 0.52 0 N-CA-C 104.801 -2.296 . . . . 0.0 104.801 154.998 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 92' ' ' VAL . . . . . . . . . . . . . 7.2 p -132.73 120.3 41.14 Favored 'Isoleucine or valine' 0 N--CA 1.448 -0.546 0 N-CA-C 105.522 -2.029 . . . . 0.0 105.522 -174.134 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 93' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -142.13 90.14 2.23 Favored 'General case' 0 C--N 1.332 -0.184 0 N-CA-C 107.284 -1.376 . . . . 0.0 107.284 -171.23 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 94' ' ' LEU . . . . . . . . . . . . . 1.1 tm? -97.79 110.36 22.94 Favored 'General case' 0 N--CA 1.464 0.252 0 N-CA-C 107.254 -1.387 . . . . 0.0 107.254 -179.29 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 95' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -76.91 -164.68 0.46 Allowed 'General case' 0 CA--C 1.542 0.669 0 C-N-CA 125.162 1.385 . . . . 0.0 109.278 175.313 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 96' ' ' ALA . . . . . . . . . . . . . . . -62.28 -7.25 4.0 Favored 'General case' 0 CA--C 1.541 0.624 0 O-C-N 119.864 -1.772 . . . . 0.0 115.266 -178.106 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 97' ' ' ASN . . . . . . . . . . . . . 2.0 p30 -173.9 4.49 0.01 OUTLIER 'General case' 0 N--CA 1.476 0.844 0 C-N-CA 125.904 1.681 . . . . 0.0 114.521 169.882 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 98' ' ' GLN . . . . . . . . . . . . . 8.6 tt0 -120.28 132.56 55.37 Favored 'General case' 0 N--CA 1.472 0.634 0 CA-C-N 121.011 1.732 . . . . 0.0 108.976 -178.877 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 99' ' ' LEU . . . . . 0.49 HD22 ' CD2' ' A' ' 101' ' ' LEU . 0.4 OUTLIER -98.91 116.25 30.72 Favored 'General case' 0 C--O 1.233 0.231 0 C-N-CA 124.529 1.132 . . . . 0.0 109.385 176.694 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 100' ' ' THR . . . . . . . . . . . . . 26.7 m -93.27 117.66 30.34 Favored 'General case' 0 C--N 1.322 -0.601 0 C-N-CA 125.386 1.474 . . . . 0.0 107.381 170.363 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 101' ' ' LEU . . . . . 0.49 ' CD2' HD22 ' A' ' 99' ' ' LEU . 3.2 mm? -111.19 120.32 41.9 Favored 'General case' 0 N--CA 1.464 0.239 0 N-CA-C 106.803 -1.554 . . . . 0.0 106.803 166.678 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 102' ' ' ALA . . . . . . . . . . . . . . . -123.82 145.9 48.74 Favored 'General case' 0 N--CA 1.467 0.378 0 C-N-CA 124.676 1.19 . . . . 0.0 109.37 169.375 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 103' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -150.99 174.51 13.06 Favored 'General case' 0 N--CA 1.448 -0.53 0 C-N-CA 125.063 1.345 . . . . 0.0 109.796 178.125 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 104' ' ' ALA . . . . . . . . . . . . . . . -51.34 -29.51 15.46 Favored 'General case' 0 CA--C 1.537 0.467 0 C-N-CA 124.948 1.299 . . . . 0.0 113.032 171.846 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 105' ' ' LYS . . . . . . . . . . . . . 3.7 mtpt -80.93 -73.67 0.36 Allowed 'General case' 0 C--N 1.342 0.258 0 O-C-N 121.343 -0.848 . . . . 0.0 110.721 173.95 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 106' ' ' GLN . . . . . . . . . . . . . 29.1 mt-30 -144.26 177.56 8.52 Favored 'General case' 0 C--N 1.329 -0.325 0 C-N-CA 124.103 0.961 . . . . 0.0 108.6 -156.692 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 107' ' ' THR . . . . . . . . . . . . . 1.0 OUTLIER -130.42 142.31 50.51 Favored 'General case' 0 CA--C 1.531 0.222 0 N-CA-C 108.132 -1.062 . . . . 0.0 108.132 170.332 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 108' ' ' LEU . . . . . . . . . . . . . 6.4 mp -126.61 161.89 27.0 Favored 'General case' 0 N--CA 1.447 -0.609 0 C-N-CA 127.657 2.383 . . . . 0.0 108.488 -179.357 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 109' ' ' THR . . . . . . . . . . . . . 1.3 m -131.51 110.06 10.71 Favored 'General case' 0 C--O 1.238 0.46 0 N-CA-C 108.07 -1.085 . . . . 0.0 108.07 174.732 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 110' ' ' TYR . . . . . . . . . . . . . 37.0 m-85 -98.15 163.98 12.51 Favored 'General case' 0 C--O 1.235 0.29 0 N-CA-C 109.143 -0.688 . . . . 0.0 109.143 174.093 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 111' ' ' LYS . . . . . . . . . . . . . 0.7 OUTLIER -131.05 137.61 49.23 Favored 'General case' 0 CA--C 1.521 -0.138 0 C-N-CA 125.371 1.468 . . . . 0.0 109.347 -173.898 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 112' ' ' LEU . . . . . . . . . . . . . 25.6 tp -67.84 62.84 0.08 Allowed 'General case' 0 CA--C 1.542 0.66 0 C-N-CA 128.309 2.644 . . . . 0.0 110.382 168.527 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 113' ' ' ALA . . . . . 0.461 ' HB3' ' CG2' ' A' ' 13' ' ' VAL . . . -88.46 79.75 7.58 Favored 'General case' 0 CA--C 1.528 0.134 0 N-CA-C 105.909 -1.886 . . . . 0.0 105.909 165.018 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 114' ' ' ASP . . . . . . . . . . . . . 23.4 t0 -82.33 19.07 1.28 Allowed 'General case' 0 CA--C 1.538 0.489 0 C-N-CA 125.324 1.45 . . . . 0.0 112.163 -167.807 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 115' ' ' LEU . . . . . . . . . . . . . 22.5 mt 60.14 17.08 6.52 Favored 'General case' 0 N--CA 1.467 0.388 0 C-N-CA 128.643 2.777 . . . . 0.0 112.626 -170.886 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 116' ' ' MET . . . . . . . . . . . . . 7.5 ttp -149.89 143.82 25.53 Favored 'General case' 0 N--CA 1.444 -0.728 0 N-CA-C 106.289 -1.745 . . . . 0.0 106.289 169.029 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 117' ' ' ASN . . . . . . . . . . . . . 70.9 m-80 . . . . . 0 C--O 1.233 0.212 0 CA-C-O 118.836 -0.602 . . . . 0.0 110.663 -175.008 . . . . . . . . 0 0 . 1 . 005 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 22.5 ttm . . . . . 0 C--O 1.237 0.424 0 N-CA-C 109.086 -0.709 . . . . 0.0 109.086 . . . . . . . . . 0 0 . 1 . 005 nuclear nobuild full ' A' A ' 2' ' ' VAL . . . . . 0.405 HG23 ' HB3' ' A' ' 94' ' ' LEU . 11.3 p -67.47 146.21 13.24 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.419 0 N-CA-C 109.517 -0.549 . . . . 0.0 109.517 177.794 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 3' ' ' THR . . . . . . . . . . . . . 6.1 p -135.34 162.57 56.6 Favored Pre-proline 0 CA--C 1.53 0.205 0 O-C-N 121.99 -0.444 . . . . 0.0 110.989 -173.977 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 4' ' ' PRO . . . . . . . . . . . . . 6.2 Cg_endo -59.68 -51.0 6.76 Favored 'Trans proline' 0 N--CA 1.454 -0.814 0 C-N-CA 122.059 1.839 . . . . 0.0 112.886 175.141 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 5' ' ' GLU . . . . . . . . . . . . . 6.5 mt-10 -58.73 -28.51 65.92 Favored 'General case' 0 CA--C 1.534 0.363 0 N-CA-C 113.74 1.015 . . . . 0.0 113.74 -170.747 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 6' ' ' GLN . . . . . . . . . . . . . 17.5 pt20 -79.89 9.08 5.72 Favored 'General case' 0 CA--C 1.533 0.31 0 N-CA-C 113.622 0.971 . . . . 0.0 113.622 175.939 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 7' ' ' LEU . . . . . . . . . . . . . 78.5 mt -127.17 -50.06 1.43 Allowed 'General case' 0 CA--C 1.52 -0.188 0 CA-C-N 119.272 0.942 . . . . 0.0 109.971 -170.322 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 8' ' ' GLN . . . . . . . . . . . . . 2.2 mp0 -55.38 -17.04 4.2 Favored 'General case' 0 N--CA 1.47 0.538 0 N-CA-C 114.985 1.476 . . . . 0.0 114.985 -175.977 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 9' ' ' HIS . . . . . . . . . . . . . 5.8 m170 -124.65 8.11 8.24 Favored 'General case' 0 CA--C 1.54 0.582 0 C-N-CA 124.234 1.014 . . . . 0.0 110.849 -172.582 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 10' ' ' HIS . . . . . . . . . . . . . 73.7 m-70 -131.75 108.68 9.63 Favored 'General case' 0 CA--C 1.533 0.299 0 C-N-CA 125.465 1.506 . . . . 0.0 109.454 -168.564 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 11' ' ' ARG . . . . . . . . . . . . . 1.5 ttt85 -65.61 154.37 38.95 Favored 'General case' 0 N--CA 1.465 0.276 0 C-N-CA 123.156 0.582 . . . . 0.0 110.674 176.676 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 12' ' ' PHE . . . . . . . . . . . . . 59.4 m-85 -131.87 158.0 42.5 Favored 'General case' 0 N--CA 1.447 -0.594 0 C-N-CA 124.47 1.108 . . . . 0.0 109.731 167.882 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 13' ' ' VAL . . . . . 0.485 ' HA ' ' HA ' ' A' ' 30' ' ' GLU . 7.6 p -129.44 136.52 59.14 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.373 0 N-CA-C 108.876 -0.787 . . . . 0.0 108.876 171.128 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 14' ' ' LEU . . . . . . . . . . . . . 20.2 tp -71.26 85.78 0.78 Allowed 'General case' 0 C--O 1.232 0.162 0 N-CA-C 106.784 -1.561 . . . . 0.0 106.784 176.654 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 2.7 mm-40 -67.9 -47.26 69.3 Favored 'General case' 0 C--N 1.325 -0.48 0 C-N-CA 124.098 0.959 . . . . 0.0 109.277 179.059 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 69.8 m -154.08 140.86 19.08 Favored 'General case' 0 N--CA 1.452 -0.35 0 O-C-N 121.139 -0.976 . . . . 0.0 112.184 -176.762 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 17' ' ' VAL . . . . . . . . . . . . . 85.8 t -98.98 171.12 1.31 Allowed 'Isoleucine or valine' 0 C--N 1.328 -0.328 0 C-N-CA 125.952 1.701 . . . . 0.0 108.601 -174.082 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 18' ' ' ASN . . . . . . . . . . . . . 1.3 t30 -44.36 -49.98 9.33 Favored 'General case' 0 C--N 1.337 0.059 0 C-N-CA 125.81 1.644 . . . . 0.0 112.02 -178.551 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . -79.65 -69.14 1.42 Allowed Glycine 0 CA--C 1.526 0.725 0 O-C-N 123.856 0.722 . . . . 0.0 111.459 177.269 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 30.2 mttm -136.72 165.68 33.3 Favored Pre-proline 0 CA--C 1.529 0.142 0 C-N-CA 125.728 1.611 . . . . 0.0 111.035 -164.273 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 21' ' ' PRO . . . . . . . . . . . . . 91.9 Cg_endo -67.37 176.41 4.85 Favored 'Trans proline' 0 N--CA 1.454 -0.852 0 C-N-CA 121.596 1.53 . . . . 0.0 110.045 162.728 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 22' ' ' VAL . . . . . . . . . . . . . 7.7 p -131.47 162.31 39.6 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.513 0 C-N-CA 124.834 1.254 . . . . 0.0 108.336 177.429 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 23' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -141.9 142.46 33.06 Favored 'General case' 0 CA--C 1.535 0.392 0 CA-C-N 119.008 0.822 . . . . 0.0 108.794 172.568 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 24' ' ' SER . . . . . . . . . . . . . 16.2 m -146.06 35.25 1.0 Allowed 'General case' 0 CA--C 1.537 0.448 0 C-N-CA 125.64 1.576 . . . . 0.0 110.483 -175.647 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 25' ' ' ASP . . . . . . . . . . . . . 18.0 m-20 53.13 52.68 13.24 Favored 'General case' 0 N--CA 1.47 0.563 0 C-N-CA 125.088 1.355 . . . . 0.0 110.801 -179.715 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 26' ' ' LYS . . . . . . . . . . . . . 5.0 tmtt? 64.71 9.24 5.05 Favored 'General case' 0 N--CA 1.45 -0.437 0 C-N-CA 124.456 1.102 . . . . 0.0 112.406 178.227 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 27' ' ' ASN . . . . . . . . . . . . . 73.3 m-20 -113.55 58.4 0.74 Allowed Pre-proline 0 CA--C 1.542 0.664 0 C-N-CA 125.151 1.38 . . . . 0.0 110.428 172.524 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 28' ' ' PRO . . . . . . . . . . . . . 23.2 Cg_endo -76.76 171.66 17.6 Favored 'Trans proline' 0 CA--C 1.543 0.936 0 C-N-CA 124.502 3.468 . . . . 0.0 113.457 -166.84 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 29' ' ' PRO . . . . . . . . . . . . . 19.5 Cg_endo -66.02 64.91 0.45 Allowed 'Trans proline' 0 C--N 1.357 0.978 0 C-N-CA 124.974 3.783 . . . . 0.0 111.811 170.984 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 30' ' ' GLU . . . . . 0.485 ' HA ' ' HA ' ' A' ' 13' ' ' VAL . 1.9 pt-20 -70.15 164.54 23.97 Favored 'General case' 0 C--O 1.239 0.525 0 O-C-N 120.222 -1.549 . . . . 0.0 109.339 172.28 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 31' ' ' ILE . . . . . . . . . . . . . 12.9 tt -139.94 147.63 23.57 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.474 0 CA-C-O 122.336 1.065 . . . . 0.0 108.492 176.935 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 32' ' ' SER . . . . . . . . . . . . . 5.0 p -138.75 154.29 48.52 Favored 'General case' 0 N--CA 1.443 -0.775 0 N-CA-C 107.064 -1.458 . . . . 0.0 107.064 -179.276 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 33' ' ' PHE . . . . . . . . . . . . . 91.7 m-85 -126.37 168.38 14.25 Favored 'General case' 0 N--CA 1.446 -0.638 0 N-CA-C 106.84 -1.541 . . . . 0.0 106.84 178.03 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 34' ' ' GLY . . . . . . . . . . . . . . . 157.85 170.49 22.69 Favored Glycine 0 CA--C 1.522 0.524 0 N-CA-C 109.197 -1.561 . . . . 0.0 109.197 -178.284 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 35' ' ' GLU . . . . . . . . . . . . . 25.1 mt-10 43.57 88.38 0.01 OUTLIER 'General case' 0 N--CA 1.467 0.406 0 C-N-CA 126.796 2.038 . . . . 0.0 113.38 163.647 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 29.3 mttm 69.67 24.42 5.49 Favored 'General case' 0 N--CA 1.466 0.369 0 C-N-CA 125.429 1.492 . . . . 0.0 112.609 -177.224 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 37' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER 64.98 21.66 12.34 Favored 'General case' 0 CA--C 1.542 0.673 0 CA-C-N 120.178 1.353 . . . . 0.0 109.878 -177.828 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 38' ' ' MET . . . . . . . . . . . . . 14.9 mtp -62.42 157.49 19.92 Favored 'General case' 0 N--CA 1.45 -0.445 0 O-C-N 120.959 -1.088 . . . . 0.0 110.006 171.406 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 39' ' ' ILE . . . . . . . . . . . . . 7.3 mt -119.26 131.22 72.56 Favored 'Isoleucine or valine' 0 N--CA 1.447 -0.587 0 C-N-CA 125.443 1.497 . . . . 0.0 107.2 -177.988 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 40' ' ' SER . . . . . . . . . . . . . 55.5 m -129.0 116.02 18.69 Favored 'General case' 0 N--CA 1.452 -0.363 0 C-N-CA 126.377 1.871 . . . . 0.0 107.182 178.78 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 41' ' ' GLY . . . . . . . . . . . . . . . -167.75 179.47 41.09 Favored Glycine 0 CA--C 1.526 0.738 0 N-CA-C 109.631 -1.388 . . . . 0.0 109.631 -179.395 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 42' ' ' SER . . . . . . . . . . . . . 1.0 OUTLIER -154.54 103.28 2.46 Favored 'General case' 0 N--CA 1.453 -0.283 0 O-C-N 121.989 -0.712 . . . . 0.0 109.257 -176.605 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 43' ' ' MET . . . . . . . . . . . . . 6.9 mmt -71.25 -43.55 67.02 Favored 'General case' 0 C--O 1.223 -0.335 0 N-CA-C 108.998 -0.741 . . . . 0.0 108.998 175.248 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 44' ' ' CYS . . . . . 1.275 ' SG ' ' SG ' ' A' ' 70' ' ' CYS . 38.7 t -153.84 -75.32 0.12 Allowed 'General case' 0 N--CA 1.453 -0.284 0 N-CA-C 104.61 -2.367 . . . . 0.0 104.61 172.878 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 45' ' ' ASN . . . . . . . . . . . . . 2.7 m120 -78.48 17.66 0.64 Allowed 'General case' 0 C--N 1.329 -0.3 0 C-N-CA 126.463 1.905 . . . . 0.0 112.494 -163.703 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 46' ' ' ARG . . . . . . . . . . . . . 3.9 mmm180 55.48 158.94 0.01 OUTLIER 'General case' 0 N--CA 1.465 0.299 0 C-N-CA 128.248 2.619 . . . . 0.0 112.631 -161.744 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 47' ' ' PHE . . . . . . . . . . . . . 47.3 p90 -152.69 171.74 17.73 Favored 'General case' 0 N--CA 1.448 -0.556 0 C-N-CA 125.352 1.461 . . . . 0.0 108.199 165.835 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 48' ' ' SER . . . . . . . . . . . . . 7.0 p -163.6 158.87 21.12 Favored 'General case' 0 N--CA 1.444 -0.765 0 N-CA-C 107.031 -1.47 . . . . 0.0 107.031 176.258 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 49' ' ' GLY . . . . . . . . . . . . . . . 173.62 169.17 35.64 Favored Glycine 0 C--N 1.34 0.756 0 CA-C-N 119.951 1.251 . . . . 0.0 112.265 164.7 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 50' ' ' GLU . . . . . . . . . . . . . 23.1 mt-10 -72.84 96.8 2.13 Favored 'General case' 0 C--O 1.239 0.503 0 C-N-CA 125.395 1.478 . . . . 0.0 108.884 171.607 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 51' ' ' GLY . . . . . . . . . . . . . . . -71.97 176.55 40.03 Favored Glycine 0 CA--C 1.527 0.818 0 CA-C-N 115.414 -0.812 . . . . 0.0 111.255 156.965 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 52' ' ' LYS . . . . . . . . . . . . . 29.9 ttpt -167.25 150.33 6.31 Favored 'General case' 0 CA--C 1.529 0.15 0 C-N-CA 126.21 1.804 . . . . 0.0 107.605 179.688 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 53' ' ' LEU . . . . . . . . . . . . . 46.7 tp -155.26 120.53 4.93 Favored 'General case' 0 C--O 1.232 0.142 0 C-N-CA 123.667 0.787 . . . . 0.0 109.345 177.132 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 1.2 t -162.21 39.56 0.12 Allowed 'General case' 0 CA--C 1.538 0.507 0 C-N-CA 123.639 0.776 . . . . 0.0 108.992 174.176 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 55' ' ' ASN . . . . . . . . . . . . . 15.8 p-10 -174.01 -51.4 0.01 OUTLIER 'General case' 0 N--CA 1.462 0.162 0 C-N-CA 124.779 1.232 . . . . 0.0 111.372 -161.497 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 56' ' ' GLY . . . . . . . . . . . . . . . 131.57 10.18 2.42 Favored Glycine 0 CA--C 1.529 0.91 0 C-N-CA 125.102 1.334 . . . . 0.0 113.128 -176.694 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 57' ' ' GLU . . . . . . . . . . . . . 51.7 tt0 -132.05 134.89 46.04 Favored 'General case' 0 C--O 1.233 0.233 0 CA-C-N 118.657 1.228 . . . . 0.0 109.118 -175.019 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 58' ' ' LEU . . . . . . . . . . . . . 38.1 tp -115.71 82.19 1.72 Allowed 'General case' 0 CA--C 1.535 0.393 0 C-N-CA 126.221 1.809 . . . . 0.0 110.685 -171.928 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 59' ' ' THR . . . . . . . . . . . . . 16.9 p -82.45 141.23 32.89 Favored 'General case' 0 C--O 1.237 0.427 0 O-C-N 121.445 -0.784 . . . . 0.0 110.931 177.366 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 60' ' ' ALA . . . . . 0.463 ' HB2' ' HB3' ' A' ' 86' ' ' LEU . . . -89.87 117.05 28.41 Favored 'General case' 0 CA--C 1.517 -0.309 0 C-N-CA 125.011 1.325 . . . . 0.0 110.584 173.604 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 61' ' ' LYS . . . . . . . . . . . . . 16.2 tttt -67.11 -9.47 40.03 Favored 'General case' 0 CA--C 1.543 0.683 0 N-CA-C 113.453 0.908 . . . . 0.0 113.453 176.05 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 62' ' ' GLY . . . . . . . . . . . . . . . 159.25 116.08 0.43 Allowed Glycine 0 CA--C 1.523 0.535 0 N-CA-C 108.606 -1.798 . . . . 0.0 108.606 179.597 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 63' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -97.59 108.54 21.28 Favored 'General case' 0 N--CA 1.452 -0.367 0 C-N-CA 124.227 1.011 . . . . 0.0 110.396 -173.07 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 64' ' ' ALA . . . . . . . . . . . . . . . -96.18 108.71 21.2 Favored 'General case' 0 C--N 1.324 -0.517 0 CA-C-N 115.634 -0.712 . . . . 0.0 110.114 -177.083 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 65' ' ' MET . . . . . . . . . . . . . 50.4 mtp -111.43 -178.72 3.52 Favored 'General case' 0 C--O 1.241 0.61 0 C-N-CA 126.091 1.756 . . . . 0.0 109.972 -174.588 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 66' ' ' THR . . . . . . . . . . . . . 10.1 p -122.6 -175.25 3.1 Favored 'General case' 0 CA--C 1.537 0.444 0 C-N-CA 123.625 0.77 . . . . 0.0 112.94 178.937 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 67' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -124.68 74.05 1.31 Allowed 'General case' 0 C--O 1.237 0.418 0 C-N-CA 126.727 2.011 . . . . 0.0 110.044 -174.622 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 68' ' ' MET . . . . . . . . . . . . . 2.0 ptt? -142.93 158.37 43.67 Favored 'General case' 0 N--CA 1.452 -0.343 0 C-N-CA 124.638 1.175 . . . . 0.0 111.694 172.824 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 69' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -104.92 134.67 47.65 Favored 'General case' 0 N--CA 1.448 -0.566 0 C-N-CA 127.388 2.275 . . . . 0.0 109.234 179.827 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 70' ' ' CYS . . . . . 1.275 ' SG ' ' SG ' ' A' ' 44' ' ' CYS . 60.0 m -100.05 -6.72 25.97 Favored 'General case' 0 N--CA 1.467 0.408 0 C-N-CA 125.611 1.564 . . . . 0.0 114.499 -173.489 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 71' ' ' ALA . . . . . . . . . . . . . . . 67.81 -45.04 0.49 Allowed 'General case' 0 C--O 1.234 0.248 0 C-N-CA 127.324 2.25 . . . . 0.0 113.936 -168.29 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 72' ' ' ASN . . . . . 0.68 ' HB3' HD22 ' A' ' 75' ' ' LEU . 43.4 t30 -68.38 142.71 94.81 Favored Pre-proline 0 C--O 1.234 0.26 0 CA-C-O 117.503 -1.237 . . . . 0.0 108.697 -177.598 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 73' ' ' PRO . . . . . . . . . . . . . 44.3 Cg_endo -78.92 -41.32 0.24 Allowed 'Trans proline' 0 N--CA 1.455 -0.756 0 C-N-CA 121.957 1.772 . . . . 0.0 110.999 178.414 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 74' ' ' GLN . . . . . . . . . . . . . 23.7 tt0 -61.58 -44.98 96.02 Favored 'General case' 0 CA--C 1.534 0.358 0 C-N-CA 123.126 0.57 . . . . 0.0 110.76 -169.506 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 75' ' ' LEU . . . . . 0.68 HD22 ' HB3' ' A' ' 72' ' ' ASN . 0.0 OUTLIER -52.31 -52.65 51.78 Favored 'General case' 0 N--CA 1.447 -0.605 0 C-N-CA 125.139 1.376 . . . . 0.0 110.583 169.543 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 76' ' ' ASN . . . . . . . . . . . . . 1.2 m-20 -71.18 -0.89 10.8 Favored 'General case' 0 N--CA 1.47 0.53 0 C-N-CA 126.657 1.983 . . . . 0.0 113.144 -174.767 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 77' ' ' GLU . . . . . . . . . . . . . 3.3 mm-40 -101.93 -40.31 6.95 Favored 'General case' 0 C--O 1.235 0.328 0 C-N-CA 126.214 1.806 . . . . 0.0 109.708 171.075 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 78' ' ' LEU . . . . . . . . . . . . . 4.9 mp -67.49 -24.24 65.56 Favored 'General case' 0 N--CA 1.456 -0.167 0 C-N-CA 125.589 1.556 . . . . 0.0 112.103 -178.58 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 79' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -58.24 -34.35 70.35 Favored 'General case' 0 C--O 1.232 0.171 0 C-N-CA 123.4 0.68 . . . . 0.0 111.695 175.233 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 80' ' ' ASN . . . . . . . . . . . . . 91.1 m-20 -87.17 -36.41 18.05 Favored 'General case' 0 CA--C 1.512 -0.496 0 CA-C-O 117.893 -1.051 . . . . 0.0 109.862 177.753 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 81' ' ' THR . . . . . . . . . . . . . 3.8 m -52.38 -55.33 22.41 Favored 'General case' 0 CA--C 1.531 0.246 0 CA-C-N 118.646 0.657 . . . . 0.0 109.985 174.657 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 82' ' ' ILE . . . . . . . . . . . . . 9.8 tp -66.56 -37.61 79.93 Favored 'Isoleucine or valine' 0 N--CA 1.454 -0.27 0 C-N-CA 119.808 -0.757 . . . . 0.0 111.361 -174.382 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 83' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER -59.75 -49.55 77.29 Favored 'General case' 0 N--CA 1.443 -0.802 0 N-CA-C 109.283 -0.636 . . . . 0.0 109.283 179.495 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 84' ' ' GLU . . . . . . . . . . . . . 36.8 tt0 -66.41 -46.31 76.99 Favored 'General case' 0 N--CA 1.449 -0.5 0 C-N-CA 125.065 1.346 . . . . 0.0 111.219 -176.725 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 85' ' ' MET . . . . . . . . . . . . . 85.0 mtp -58.21 -52.26 66.31 Favored 'General case' 0 C--N 1.342 0.265 0 C-N-CA 124.413 1.085 . . . . 0.0 109.318 -177.766 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 86' ' ' LEU . . . . . 0.463 ' HB3' ' HB2' ' A' ' 60' ' ' ALA . 0.1 OUTLIER -75.27 -22.97 57.39 Favored 'General case' 0 N--CA 1.453 -0.311 0 CA-C-N 115.906 -0.588 . . . . 0.0 111.329 -171.41 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 87' ' ' LYS . . . . . . . . . . . . . 9.5 mttt -67.14 -47.05 72.26 Favored 'General case' 0 N--CA 1.456 -0.172 0 N-CA-C 108.164 -1.05 . . . . 0.0 108.164 -178.797 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 88' ' ' GLU . . . . . . . . . . . . . 69.5 mt-10 -72.07 -51.45 21.54 Favored 'General case' 0 N--CA 1.454 -0.255 0 O-C-N 123.738 0.649 . . . . 0.0 110.077 177.567 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 89' ' ' GLY . . . . . . . . . . . . . . . 134.26 97.57 0.59 Allowed Glycine 0 C--N 1.337 0.597 0 N-CA-C 108.509 -1.836 . . . . 0.0 108.509 -169.732 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 90' ' ' ALA . . . . . . . . . . . . . . . -74.11 130.72 40.34 Favored 'General case' 0 N--CA 1.451 -0.387 0 N-CA-C 107.423 -1.325 . . . . 0.0 107.423 171.813 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 91' ' ' GLN . . . . . . . . . . . . . 82.1 mm-40 -62.64 130.91 47.14 Favored 'General case' 0 N--CA 1.442 -0.833 0 N-CA-C 106.109 -1.812 . . . . 0.0 106.109 159.239 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 92' ' ' VAL . . . . . . . . . . . . . 4.2 p -118.27 124.67 73.46 Favored 'Isoleucine or valine' 0 N--CA 1.44 -0.927 0 N-CA-C 104.069 -2.567 . . . . 0.0 104.069 -179.008 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 93' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -138.69 138.48 37.78 Favored 'General case' 0 N--CA 1.444 -0.739 0 N-CA-C 106.316 -1.735 . . . . 0.0 106.316 173.37 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 94' ' ' LEU . . . . . 0.556 ' HB2' HD12 ' A' ' 99' ' ' LEU . 10.8 tp -133.23 116.22 15.93 Favored 'General case' 0 N--CA 1.445 -0.687 0 N-CA-C 106.543 -1.651 . . . . 0.0 106.543 -178.923 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 95' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -82.59 -164.62 0.87 Allowed 'General case' 0 C--N 1.322 -0.619 0 CA-C-N 114.417 -1.265 . . . . 0.0 110.112 172.62 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 96' ' ' ALA . . . . . . . . . . . . . . . -49.59 -40.82 40.12 Favored 'General case' 0 CA--C 1.538 0.501 0 C-N-CA 124.611 1.164 . . . . 0.0 113.079 -178.004 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 97' ' ' ASN . . . . . . . . . . . . . 42.8 p30 -156.38 23.47 0.35 Allowed 'General case' 0 CA--C 1.541 0.63 0 N-CA-C 113.683 0.994 . . . . 0.0 113.683 -178.876 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 98' ' ' GLN . . . . . . . . . . . . . 13.7 tt0 -137.11 122.79 19.83 Favored 'General case' 0 N--CA 1.467 0.381 0 C-N-CA 124.45 1.1 . . . . 0.0 108.568 -177.735 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 99' ' ' LEU . . . . . 0.556 HD12 ' HB2' ' A' ' 94' ' ' LEU . 3.7 tp -82.38 130.81 35.19 Favored 'General case' 0 C--O 1.235 0.306 0 N-CA-C 107.709 -1.219 . . . . 0.0 107.709 170.723 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 100' ' ' THR . . . . . . . . . . . . . 5.0 m -117.73 114.32 23.15 Favored 'General case' 0 C--N 1.325 -0.471 0 C-N-CA 126.506 1.923 . . . . 0.0 106.743 171.371 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 101' ' ' LEU . . . . . . . . . . . . . 0.7 OUTLIER -115.54 123.82 49.47 Favored 'General case' 0 CA--C 1.505 -0.777 0 N-CA-C 106.832 -1.544 . . . . 0.0 106.832 -179.073 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 102' ' ' ALA . . . . . . . . . . . . . . . -139.14 158.48 44.1 Favored 'General case' 0 C--N 1.325 -0.488 0 C-N-CA 123.655 0.782 . . . . 0.0 108.97 178.577 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 103' ' ' THR . . . . . . . . . . . . . 0.6 OUTLIER -154.61 -179.95 8.47 Favored 'General case' 0 N--CA 1.443 -0.815 0 C-N-CA 126.438 1.895 . . . . 0.0 106.214 176.838 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 104' ' ' ALA . . . . . . . . . . . . . . . -60.53 -26.24 66.72 Favored 'General case' 0 C--O 1.236 0.363 0 O-C-N 120.992 -1.067 . . . . 0.0 112.284 174.613 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 105' ' ' LYS . . . . . . . . . . . . . 13.0 mmtt -77.63 -71.7 0.4 Allowed 'General case' 0 CA--C 1.512 -0.504 0 O-C-N 121.962 -0.461 . . . . 0.0 111.048 -179.992 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 106' ' ' GLN . . . . . . . . . . . . . 1.4 tt0 -154.07 -169.87 3.38 Favored 'General case' 0 N--CA 1.45 -0.446 0 N-CA-C 109.719 -0.475 . . . . 0.0 109.719 -166.435 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 107' ' ' THR . . . . . . . . . . . . . 10.0 t -143.74 164.13 31.35 Favored 'General case' 0 C--O 1.24 0.601 0 C-N-CA 123.431 0.692 . . . . 0.0 110.281 -173.682 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 108' ' ' LEU . . . . . . . . . . . . . 75.6 mt -150.05 134.05 16.99 Favored 'General case' 0 CA--C 1.536 0.434 0 C-N-CA 128.399 2.679 . . . . 0.0 106.123 -170.688 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 109' ' ' THR . . . . . . . . . . . . . 82.6 m -115.21 116.21 27.97 Favored 'General case' 0 C--O 1.237 0.398 0 N-CA-C 107.022 -1.473 . . . . 0.0 107.022 174.721 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 110' ' ' TYR . . . . . . . . . . . . . 21.7 m-85 -106.99 168.57 9.11 Favored 'General case' 0 C--O 1.237 0.424 0 CA-C-O 121.637 0.732 . . . . 0.0 109.811 176.652 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 111' ' ' LYS . . . . . . . . . . . . . 0.9 OUTLIER -130.03 143.71 50.94 Favored 'General case' 0 CA--C 1.519 -0.225 0 C-N-CA 126.013 1.725 . . . . 0.0 108.343 -170.847 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 112' ' ' LEU . . . . . . . . . . . . . 21.2 tp -70.71 60.63 0.23 Allowed 'General case' 0 CA--C 1.54 0.581 0 C-N-CA 126.222 1.809 . . . . 0.0 111.575 171.152 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 113' ' ' ALA . . . . . . . . . . . . . . . -88.04 103.34 15.63 Favored 'General case' 0 N--CA 1.453 -0.303 0 N-CA-C 105.297 -2.112 . . . . 0.0 105.297 163.251 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 114' ' ' ASP . . . . . . . . . . . . . 46.5 t0 -133.67 45.82 2.62 Favored 'General case' 0 C--N 1.33 -0.241 0 CA-C-O 122.918 1.342 . . . . 0.0 109.39 174.357 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 115' ' ' LEU . . . . . . . . . . . . . 48.8 mt 57.23 4.84 0.22 Allowed 'General case' 0 C--O 1.237 0.408 0 C-N-CA 128.102 2.561 . . . . 0.0 115.676 179.289 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 116' ' ' MET . . . . . . . . . . . . . 7.1 ttp 54.12 81.66 0.1 Allowed 'General case' 0 C--O 1.236 0.347 0 C-N-CA 127.131 2.172 . . . . 0.0 108.505 -160.441 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 117' ' ' ASN . . . . . . . . . . . . . 7.5 t-20 . . . . . 0 C--O 1.234 0.284 0 C-N-CA 124.181 0.992 . . . . 0.0 112.238 -175.282 . . . . . . . . 0 0 . 1 . 006 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 21.1 ttm . . . . . 0 N--CA 1.455 -0.181 0 N-CA-C 108.321 -0.992 . . . . 0.0 108.321 . . . . . . . . . 0 0 . 1 . 006 nuclear nobuild full ' A' A ' 2' ' ' VAL . . . . . 0.555 HG11 ' O ' ' A' ' 92' ' ' VAL . 8.2 p -57.64 142.3 13.51 Favored 'Isoleucine or valine' 0 CA--C 1.542 0.648 0 CA-C-N 115.951 -0.568 . . . . 0.0 110.251 173.237 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 3' ' ' THR . . . . . . . . . . . . . 21.5 p -123.03 163.9 30.61 Favored Pre-proline 0 C--O 1.226 -0.153 0 O-C-N 121.353 -0.842 . . . . 0.0 109.956 172.724 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 4' ' ' PRO . . . . . . . . . . . . . 31.1 Cg_endo -63.89 -36.63 49.05 Favored 'Trans proline' 0 N--CA 1.461 -0.427 0 C-N-CA 122.227 1.951 . . . . 0.0 112.183 174.377 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 5' ' ' GLU . . . . . . . . . . . . . 13.3 tt0 -57.27 -56.67 18.84 Favored 'General case' 0 CA--C 1.534 0.333 0 C-N-CA 123.524 0.729 . . . . 0.0 111.25 -172.721 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 6' ' ' GLN . . . . . 0.485 HE21 HD12 ' A' ' 94' ' ' LEU . 20.0 pt20 -64.05 18.3 0.01 OUTLIER 'General case' 0 CA--C 1.543 0.691 0 C-N-CA 128.174 2.59 . . . . 0.0 114.252 178.877 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 7' ' ' LEU . . . . . . . . . . . . . 72.9 mt -134.95 -50.3 0.76 Allowed 'General case' 0 N--CA 1.453 -0.313 0 C-N-CA 126.272 1.829 . . . . 0.0 109.58 -176.649 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 8' ' ' GLN . . . . . . . . . . . . . 5.4 mt-30 -57.65 -21.31 39.17 Favored 'General case' 0 N--CA 1.472 0.652 0 N-CA-C 114.114 1.153 . . . . 0.0 114.114 -177.182 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 9' ' ' HIS . . . . . . . . . . . . . 8.3 m170 -110.76 11.46 22.57 Favored 'General case' 0 CA--C 1.537 0.475 0 C-N-CA 123.421 0.688 . . . . 0.0 111.218 -179.916 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 10' ' ' HIS . . . . . . . . . . . . . 60.5 m-70 -136.33 112.25 9.57 Favored 'General case' 0 CA--C 1.535 0.39 0 C-N-CA 124.686 1.195 . . . . 0.0 109.223 -165.754 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 11' ' ' ARG . . . . . . . . . . . . . 4.6 ttt85 -69.11 152.61 44.95 Favored 'General case' 0 N--CA 1.466 0.351 0 O-C-N 121.304 -0.873 . . . . 0.0 108.961 172.159 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 12' ' ' PHE . . . . . . . . . . . . . 21.3 m-85 -139.11 156.6 47.03 Favored 'General case' 0 CA--C 1.512 -0.513 0 N-CA-C 108.387 -0.968 . . . . 0.0 108.387 173.676 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 13' ' ' VAL . . . . . 0.688 ' CG1' ' HB3' ' A' ' 113' ' ' ALA . 1.8 p -140.5 128.68 24.59 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.583 0 N-CA-C 113.135 0.791 . . . . 0.0 113.135 -179.339 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 14' ' ' LEU . . . . . . . . . . . . . 6.4 tt -57.32 119.91 7.25 Favored 'General case' 0 CA--C 1.508 -0.666 0 N-CA-C 107.512 -1.292 . . . . 0.0 107.512 178.055 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 15' ' ' GLU . . . . . 0.456 ' HG3' ' HE2' ' A' ' 111' ' ' LYS . 0.1 OUTLIER -106.12 -45.23 4.38 Favored 'General case' 0 N--CA 1.439 -0.978 0 CA-C-N 115.092 -0.958 . . . . 0.0 108.996 -173.229 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -143.56 152.18 41.11 Favored 'General case' 0 N--CA 1.443 -0.79 0 CA-C-O 121.972 0.891 . . . . 0.0 111.406 174.242 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 17' ' ' VAL . . . . . . . . . . . . . 10.5 t -76.93 175.68 0.73 Allowed 'Isoleucine or valine' 0 C--O 1.242 0.673 0 N-CA-C 106.871 -1.529 . . . . 0.0 106.871 173.1 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 18' ' ' ASN . . . . . . . . . . . . . 0.2 OUTLIER -44.79 -34.49 2.32 Favored 'General case' 0 CA--C 1.535 0.374 0 C-N-CA 126.773 2.029 . . . . 0.0 113.103 169.6 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . -115.3 -54.31 0.38 Allowed Glycine 0 CA--C 1.525 0.687 0 CA-C-O 118.937 -0.924 . . . . 0.0 113.339 -168.198 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 12.9 mttm -134.07 160.76 67.3 Favored Pre-proline 0 N--CA 1.466 0.331 0 CA-C-N 118.694 1.247 . . . . 0.0 111.702 178.08 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 21' ' ' PRO . . . . . . . . . . . . . 59.8 Cg_endo -67.06 160.72 46.0 Favored 'Trans proline' 0 N--CA 1.45 -1.029 0 C-N-CA 122.012 1.808 . . . . 0.0 110.321 162.468 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 22' ' ' VAL . . . . . . . . . . . . . 13.3 p -139.74 165.52 22.16 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.41 0 C-N-CA 124.536 1.134 . . . . 0.0 109.166 -179.265 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 23' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -130.07 157.98 40.89 Favored 'General case' 0 C--O 1.235 0.338 0 CA-C-O 121.528 0.68 . . . . 0.0 111.465 -179.166 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 24' ' ' SER . . . . . 0.422 ' HB3' ' HA ' ' A' ' 28' ' ' PRO . 32.2 t -150.9 47.88 0.85 Allowed 'General case' 0 CA--C 1.536 0.435 0 C-N-CA 126.462 1.905 . . . . 0.0 106.624 -178.397 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 25' ' ' ASP . . . . . . . . . . . . . 32.6 m-20 44.54 54.59 6.33 Favored 'General case' 0 N--CA 1.469 0.506 0 C-N-CA 126.044 1.737 . . . . 0.0 112.466 -176.391 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 26' ' ' LYS . . . . . . . . . . . . . 7.1 tmtm? 69.99 -2.57 2.01 Favored 'General case' 0 N--CA 1.471 0.605 0 O-C-N 120.91 -1.119 . . . . 0.0 112.664 176.619 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 27' ' ' ASN . . . . . . . . . . . . . 82.5 m-20 -113.43 71.03 1.56 Allowed Pre-proline 0 CA--C 1.537 0.471 0 C-N-CA 125.761 1.624 . . . . 0.0 107.471 175.455 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 28' ' ' PRO . . . . . 0.422 ' HA ' ' HB3' ' A' ' 24' ' ' SER . 60.2 Cg_endo -67.99 170.35 14.48 Favored 'Trans proline' 0 C--N 1.349 0.6 0 C-N-CA 124.664 3.576 . . . . 0.0 113.412 -173.335 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 29' ' ' PRO . . . . . 0.479 ' HB3' ' HA ' ' A' ' 43' ' ' MET . 12.2 Cg_endo -61.46 69.49 0.1 OUTLIER 'Trans proline' 0 CA--C 1.544 1.013 0 C-N-CA 125.167 3.911 . . . . 0.0 112.042 164.569 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 30' ' ' GLU . . . . . . . . . . . . . 11.7 pt-20 -95.74 168.95 10.35 Favored 'General case' 0 C--N 1.327 -0.379 0 O-C-N 119.768 -1.833 . . . . 0.0 111.105 177.512 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 31' ' ' ILE . . . . . 0.418 HD11 ' CG2' ' A' ' 39' ' ' ILE . 14.4 tt -147.64 165.62 5.83 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.399 0 C-N-CA 124.392 1.077 . . . . 0.0 108.307 -168.854 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 32' ' ' SER . . . . . . . . . . . . . 5.9 p -145.92 161.67 39.53 Favored 'General case' 0 N--CA 1.443 -0.824 0 N-CA-C 107.985 -1.117 . . . . 0.0 107.985 165.884 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 33' ' ' PHE . . . . . . . . . . . . . 84.6 m-85 -127.57 167.43 16.35 Favored 'General case' 0 N--CA 1.442 -0.874 0 N-CA-C 106.619 -1.623 . . . . 0.0 106.619 175.357 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 34' ' ' GLY . . . . . . . . . . . . . . . 165.57 -167.28 38.92 Favored Glycine 0 N--CA 1.447 -0.596 0 N-CA-C 105.815 -2.914 . . . . 0.0 105.815 -177.189 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 35' ' ' GLU . . . . . . . . . . . . . 37.7 mt-10 44.38 72.51 0.19 Allowed 'General case' 0 C--N 1.33 -0.242 0 C-N-CA 124.952 1.301 . . . . 0.0 112.41 161.658 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 24.9 mtmt 60.33 28.31 17.92 Favored 'General case' 0 CA--C 1.541 0.633 0 CA-C-N 115.182 -0.917 . . . . 0.0 112.224 174.635 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 37' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER 75.23 15.92 2.81 Favored 'General case' 0 N--CA 1.469 0.521 0 C-N-CA 128.152 2.581 . . . . 0.0 112.649 -175.867 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 38' ' ' MET . . . . . . . . . . . . . 19.6 mtp -55.92 147.44 19.48 Favored 'General case' 0 C--O 1.237 0.395 0 O-C-N 120.697 -1.252 . . . . 0.0 110.664 167.451 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 39' ' ' ILE . . . . . 0.418 ' CG2' HD11 ' A' ' 31' ' ' ILE . 7.5 mt -108.61 135.47 47.33 Favored 'Isoleucine or valine' 0 N--CA 1.447 -0.588 0 N-CA-C 107.158 -1.423 . . . . 0.0 107.158 -177.428 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 40' ' ' SER . . . . . . . . . . . . . 4.4 m -136.18 135.57 39.27 Favored 'General case' 0 N--CA 1.452 -0.36 0 N-CA-C 107.584 -1.265 . . . . 0.0 107.584 171.757 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 41' ' ' GLY . . . . . . . . . . . . . . . -178.08 -175.46 45.25 Favored Glycine 0 C--O 1.237 0.325 0 CA-C-N 119.179 0.9 . . . . 0.0 111.114 -178.474 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 42' ' ' SER . . . . . . . . . . . . . 15.7 t -143.54 167.62 21.79 Favored 'General case' 0 N--CA 1.444 -0.75 0 N-CA-C 108.197 -1.038 . . . . 0.0 108.197 165.548 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 43' ' ' MET . . . . . 0.479 ' HA ' ' HB3' ' A' ' 29' ' ' PRO . 36.4 mmm -126.79 -45.33 1.61 Allowed 'General case' 0 N--CA 1.447 -0.614 0 N-CA-C 107.86 -1.163 . . . . 0.0 107.86 162.014 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 44' ' ' CYS . . . . . 1.283 ' SG ' ' SG ' ' A' ' 70' ' ' CYS . 41.6 t -149.16 -51.21 0.15 Allowed 'General case' 0 CA--C 1.542 0.664 0 C-N-CA 126.112 1.765 . . . . 0.0 108.009 167.706 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 45' ' ' ASN . . . . . . . . . . . . . 8.0 m-80 -88.95 10.34 21.74 Favored 'General case' 0 N--CA 1.467 0.4 0 N-CA-C 115.898 1.814 . . . . 0.0 115.898 -174.203 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 46' ' ' ARG . . . . . . . . . . . . . 0.4 OUTLIER 60.99 164.78 0.08 Allowed 'General case' 0 N--CA 1.474 0.774 0 C-N-CA 125.809 1.644 . . . . 0.0 111.661 -169.737 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 47' ' ' PHE . . . . . . . . . . . . . 51.6 p90 -162.76 169.09 20.5 Favored 'General case' 0 C--O 1.238 0.492 0 C-N-CA 124.954 1.301 . . . . 0.0 108.887 167.852 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 48' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -157.23 162.21 39.25 Favored 'General case' 0 CA--C 1.541 0.608 0 C-N-CA 124.656 1.182 . . . . 0.0 108.673 164.731 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 49' ' ' GLY . . . . . . . . . . . . . . . -179.1 167.96 38.45 Favored Glycine 0 CA--C 1.532 1.109 0 CA-C-N 120.572 1.533 . . . . 0.0 113.156 171.104 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 50' ' ' GLU . . . . . . . . . . . . . 40.4 mt-10 -68.81 95.35 0.67 Allowed 'General case' 0 CA--C 1.534 0.329 0 C-N-CA 125.013 1.325 . . . . 0.0 110.193 170.473 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 51' ' ' GLY . . . . . . . . . . . . . . . -76.85 165.01 53.4 Favored Glycine 0 CA--C 1.529 0.951 0 N-CA-C 110.296 -1.122 . . . . 0.0 110.296 161.242 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 52' ' ' LYS . . . . . . . . . . . . . 62.3 tttt -168.85 137.01 2.03 Favored 'General case' 0 CA--C 1.517 -0.289 0 C-N-CA 126.833 2.053 . . . . 0.0 106.036 174.837 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 53' ' ' LEU . . . . . 0.464 HD12 ' N ' ' A' ' 54' ' ' SER . 16.1 tp -130.77 128.96 41.81 Favored 'General case' 0 CA--C 1.517 -0.316 0 CA-C-O 122.317 1.055 . . . . 0.0 110.391 -177.441 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 54' ' ' SER . . . . . 0.464 ' N ' HD12 ' A' ' 53' ' ' LEU . 21.1 t -144.94 -37.18 0.29 Allowed 'General case' 0 N--CA 1.443 -0.796 0 C-N-CA 125.433 1.493 . . . . 0.0 109.903 174.729 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 55' ' ' ASN . . . . . . . . . . . . . 65.9 t30 -121.64 23.23 10.31 Favored 'General case' 0 CA--C 1.538 0.502 0 C-N-CA 124.175 0.99 . . . . 0.0 113.647 -164.66 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 56' ' ' GLY . . . . . . . . . . . . . . . 78.03 5.28 86.9 Favored Glycine 0 CA--C 1.532 1.095 0 O-C-N 120.606 -1.309 . . . . 0.0 113.512 -176.089 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 57' ' ' GLU . . . . . . . . . . . . . 40.3 tt0 -123.67 148.6 46.36 Favored 'General case' 0 C--O 1.237 0.399 0 CA-C-N 118.612 1.206 . . . . 0.0 108.589 -174.13 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 58' ' ' LEU . . . . . . . . . . . . . 8.4 tp -132.51 138.83 47.67 Favored 'General case' 0 C--N 1.33 -0.251 0 C-N-CA 125.364 1.466 . . . . 0.0 110.54 178.421 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 59' ' ' THR . . . . . . . . . . . . . 1.6 p -125.82 167.11 15.66 Favored 'General case' 0 C--O 1.237 0.429 0 C-N-CA 125.76 1.624 . . . . 0.0 111.17 -176.66 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 60' ' ' ALA . . . . . . . . . . . . . . . -139.45 107.32 5.67 Favored 'General case' 0 CA--C 1.53 0.18 0 C-N-CA 125.505 1.522 . . . . 0.0 111.706 168.381 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 61' ' ' LYS . . . . . . . . . . . . . 24.7 tttt -72.55 77.23 1.07 Allowed 'General case' 0 CA--C 1.542 0.636 0 C-N-CA 124.027 0.931 . . . . 0.0 111.027 178.273 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 62' ' ' GLY . . . . . . . . . . . . . . . 124.29 -65.29 0.54 Allowed Glycine 0 N--CA 1.466 0.674 0 C-N-CA 125.68 1.61 . . . . 0.0 111.397 172.801 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 63' ' ' LEU . . . . . . . . . . . . . 6.0 tt 65.51 103.39 0.04 OUTLIER 'General case' 0 CA--C 1.535 0.4 0 C-N-CA 128.578 2.751 . . . . 0.0 114.243 174.003 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 64' ' ' ALA . . . . . . . . . . . . . . . -84.22 97.48 9.42 Favored 'General case' 0 CA--C 1.533 0.32 0 C-N-CA 126.759 2.024 . . . . 0.0 112.635 -169.693 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 65' ' ' MET . . . . . . . . . . . . . 3.0 mtt -98.2 -179.66 4.45 Favored 'General case' 0 CA--C 1.543 0.675 0 C-N-CA 124.684 1.194 . . . . 0.0 111.127 176.064 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 66' ' ' THR . . . . . . . . . . . . . 9.2 p -118.2 -163.89 0.98 Allowed 'General case' 0 CA--C 1.552 1.028 0 C-N-CA 125.989 1.715 . . . . 0.0 111.822 -179.744 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 67' ' ' ARG . . . . . . . . . . . . . 28.9 mmt180 -133.21 49.12 2.33 Favored 'General case' 0 CA--C 1.553 1.089 0 C-N-CA 126.296 1.838 . . . . 0.0 111.474 172.985 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 68' ' ' MET . . . . . . . . . . . . . 59.4 mtm -84.12 -175.0 5.59 Favored 'General case' 0 CA--C 1.544 0.743 0 C-N-CA 128.113 2.565 . . . . 0.0 110.612 167.942 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 69' ' ' MET . . . . . . . . . . . . . 1.4 pmm? -151.01 173.83 13.86 Favored 'General case' 0 N--CA 1.466 0.341 0 C-N-CA 126.255 1.822 . . . . 0.0 111.449 171.058 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 70' ' ' CYS . . . . . 1.283 ' SG ' ' SG ' ' A' ' 44' ' ' CYS . 86.0 m -141.36 148.05 39.04 Favored 'General case' 0 C--O 1.234 0.263 0 CA-C-O 122.041 0.924 . . . . 0.0 112.028 -169.74 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 71' ' ' ALA . . . . . . . . . . . . . . . -71.9 26.92 0.05 OUTLIER 'General case' 0 CA--C 1.543 0.705 0 C-N-CA 128.374 2.669 . . . . 0.0 112.265 175.927 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 72' ' ' ASN . . . . . . . . . . . . . 53.3 t-20 -146.96 141.38 15.92 Favored Pre-proline 0 CA--C 1.535 0.4 0 N-CA-C 103.859 -2.645 . . . . 0.0 103.859 156.114 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 73' ' ' PRO . . . . . . . . . . . . . 56.1 Cg_endo -83.94 -26.84 1.79 Allowed 'Trans proline' 0 N--CA 1.465 -0.158 0 C-N-CA 122.271 1.981 . . . . 0.0 111.759 -176.968 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 74' ' ' GLN . . . . . . . . . . . . . 11.2 tt0 -63.14 -26.18 68.7 Favored 'General case' 0 CA--C 1.538 0.508 0 O-C-N 121.669 -0.645 . . . . 0.0 110.852 179.807 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 75' ' ' LEU . . . . . . . . . . . . . 62.1 mt -69.45 -32.14 70.9 Favored 'General case' 0 N--CA 1.47 0.542 0 C-N-CA 123.71 0.804 . . . . 0.0 111.728 173.121 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 76' ' ' ASN . . . . . . . . . . . . . 2.1 t-20 -79.79 -20.87 45.17 Favored 'General case' 0 CA--C 1.531 0.237 0 C-N-CA 124.177 0.991 . . . . 0.0 111.261 -177.555 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 77' ' ' GLU . . . . . . . . . . . . . 4.3 mm-40 -78.49 -34.08 47.76 Favored 'General case' 0 CA--C 1.536 0.41 0 C-N-CA 123.944 0.898 . . . . 0.0 110.114 169.591 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 78' ' ' LEU . . . . . 0.417 HD12 ' HE2' ' A' ' 43' ' ' MET . 0.9 OUTLIER -57.05 -24.83 56.66 Favored 'General case' 0 C--N 1.345 0.407 0 O-C-N 121.513 -0.742 . . . . 0.0 111.869 176.369 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 79' ' ' ASP . . . . . . . . . . . . . 69.3 m-20 -64.35 -27.32 68.94 Favored 'General case' 0 N--CA 1.454 -0.273 0 C-N-CA 122.977 0.511 . . . . 0.0 111.991 -176.708 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 80' ' ' ASN . . . . . . . . . . . . . 10.7 p30 -101.76 -29.82 11.66 Favored 'General case' 0 N--CA 1.437 -1.106 0 CA-C-O 116.613 -1.661 . . . . 0.0 111.77 174.961 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 81' ' ' THR . . . . . . . . . . . . . 25.2 m -44.94 -74.42 0.04 OUTLIER 'General case' 0 CA--C 1.535 0.403 0 CA-C-N 119.164 0.893 . . . . 0.0 108.82 161.818 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 82' ' ' ILE . . . . . . . . . . . . . 5.2 tp -66.62 -34.58 71.02 Favored 'Isoleucine or valine' 0 N--CA 1.455 -0.205 0 O-C-N 121.012 -1.055 . . . . 0.0 111.448 -167.589 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 83' ' ' SER . . . . . . . . . . . . . 4.3 m -61.91 -45.07 95.34 Favored 'General case' 0 N--CA 1.445 -0.701 0 O-C-N 122.155 -0.341 . . . . 0.0 110.646 -177.662 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 84' ' ' GLU . . . . . . . . . . . . . 31.9 tt0 -77.94 -34.51 51.16 Favored 'General case' 0 N--CA 1.446 -0.669 0 CA-C-O 118.03 -0.986 . . . . 0.0 110.173 -178.032 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 85' ' ' MET . . . . . . . . . . . . . 86.8 mtp -54.64 -48.64 72.03 Favored 'General case' 0 C--N 1.343 0.297 0 CA-C-O 121.956 0.884 . . . . 0.0 108.728 174.709 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 86' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -76.63 -26.62 55.11 Favored 'General case' 0 N--CA 1.45 -0.457 0 CA-C-O 118.612 -0.708 . . . . 0.0 111.566 -176.648 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 87' ' ' LYS . . . . . . . . . . . . . 31.5 mttt -70.89 -38.14 73.03 Favored 'General case' 0 CA--C 1.532 0.284 0 CA-C-N 119.94 1.245 . . . . 0.0 108.938 178.203 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 88' ' ' GLU . . . . . . . . . . . . . 31.8 mm-40 -66.47 -63.79 1.0 Allowed 'General case' 0 CA--C 1.532 0.283 0 C-N-CA 125.274 1.43 . . . . 0.0 109.494 173.168 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 89' ' ' GLY . . . . . . . . . . . . . . . 135.55 99.22 0.58 Allowed Glycine 0 C--N 1.335 0.523 0 N-CA-C 107.517 -2.233 . . . . 0.0 107.517 -161.873 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 90' ' ' ALA . . . . . . . . . . . . . . . -90.47 139.88 30.26 Favored 'General case' 0 N--CA 1.455 -0.221 0 N-CA-C 108.996 -0.742 . . . . 0.0 108.996 -179.327 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 91' ' ' GLN . . . . . . . . . . . . . 41.9 mm-40 -78.63 134.99 37.11 Favored 'General case' 0 N--CA 1.442 -0.865 0 N-CA-C 106.075 -1.824 . . . . 0.0 106.075 174.916 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 92' ' ' VAL . . . . . 0.555 ' O ' HG11 ' A' ' 2' ' ' VAL . 24.2 t -130.14 98.0 3.6 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.476 0 C-N-CA 127.444 2.297 . . . . 0.0 106.144 -167.133 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 93' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -116.71 94.19 4.51 Favored 'General case' 0 C--O 1.235 0.335 0 CA-C-O 121.225 0.536 . . . . 0.0 110.317 -175.736 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 94' ' ' LEU . . . . . 0.485 HD12 HE21 ' A' ' 6' ' ' GLN . 1.5 tm? -93.2 106.66 18.6 Favored 'General case' 0 C--O 1.233 0.213 0 N-CA-C 108.479 -0.934 . . . . 0.0 108.479 174.856 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 95' ' ' THR . . . . . . . . . . . . . 5.8 t -85.55 -164.81 1.07 Allowed 'General case' 0 CA--C 1.543 0.69 0 C-N-CA 125.932 1.693 . . . . 0.0 108.724 171.108 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 96' ' ' ALA . . . . . . . . . . . . . . . -55.33 -22.74 20.38 Favored 'General case' 0 CA--C 1.545 0.775 0 N-CA-C 115.638 1.718 . . . . 0.0 115.638 -172.953 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 97' ' ' ASN . . . . . . . . . . . . . 0.0 OUTLIER -152.83 2.63 0.31 Allowed 'General case' 0 N--CA 1.477 0.922 0 CA-C-N 120.313 1.415 . . . . 0.0 113.941 176.395 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 98' ' ' GLN . . . . . . . . . . . . . 6.5 tt0 -140.14 136.37 33.44 Favored 'General case' 0 CA--C 1.53 0.211 0 O-C-N 120.423 -1.423 . . . . 0.0 109.525 -163.551 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 99' ' ' LEU . . . . . . . . . . . . . 20.2 tp -113.99 115.3 27.41 Favored 'General case' 0 N--CA 1.464 0.272 0 C-N-CA 126.84 2.056 . . . . 0.0 108.455 -172.468 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 100' ' ' THR . . . . . . . . . . . . . 0.9 OUTLIER -89.73 149.68 22.63 Favored 'General case' 0 CA--C 1.541 0.61 0 N-CA-C 104.787 -2.301 . . . . 0.0 104.787 177.044 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 101' ' ' LEU . . . . . . . . . . . . . 1.2 mm? -120.74 117.29 27.1 Favored 'General case' 0 N--CA 1.455 -0.189 0 C-N-CA 127.211 2.204 . . . . 0.0 106.583 163.125 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 102' ' ' ALA . . . . . . . . . . . . . . . -129.17 140.78 51.38 Favored 'General case' 0 N--CA 1.464 0.233 0 CA-C-N 119.406 1.003 . . . . 0.0 109.603 174.526 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 103' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -160.33 175.49 12.77 Favored 'General case' 0 N--CA 1.448 -0.554 0 C-N-CA 126.636 1.975 . . . . 0.0 108.336 171.599 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 104' ' ' ALA . . . . . . . . . . . . . . . -47.64 -36.34 10.82 Favored 'General case' 0 N--CA 1.453 -0.283 0 CA-C-O 117.549 -1.215 . . . . 0.0 112.855 173.391 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 105' ' ' LYS . . . . . 0.523 ' HE3' ' HA ' ' A' ' 105' ' ' LYS . 0.0 OUTLIER -55.98 -69.04 0.16 Allowed 'General case' 0 C--N 1.344 0.355 0 CA-C-N 120.004 1.274 . . . . 0.0 111.588 178.716 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 106' ' ' GLN . . . . . . . . . . . . . 10.2 pt20 -176.62 -164.95 0.12 Allowed 'General case' 0 C--N 1.329 -0.325 0 C-N-CA 127.303 2.241 . . . . 0.0 106.526 -174.69 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 107' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -135.42 138.9 43.7 Favored 'General case' 0 N--CA 1.443 -0.786 0 N-CA-C 107.663 -1.236 . . . . 0.0 107.663 -163.459 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 108' ' ' LEU . . . . . . . . . . . . . 1.1 mm? -133.58 162.84 30.81 Favored 'General case' 0 C--N 1.331 -0.226 0 C-N-CA 125.73 1.612 . . . . 0.0 107.401 174.039 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 109' ' ' THR . . . . . . . . . . . . . 81.1 m -139.64 116.7 11.07 Favored 'General case' 0 C--O 1.237 0.435 0 N-CA-C 108.307 -0.998 . . . . 0.0 108.307 174.746 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 110' ' ' TYR . . . . . . . . . . . . . 0.8 OUTLIER -94.68 157.04 16.14 Favored 'General case' 0 CA--C 1.536 0.409 0 C-N-CA 126.498 1.919 . . . . 0.0 109.012 177.731 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 111' ' ' LYS . . . . . 0.456 ' HE2' ' HG3' ' A' ' 15' ' ' GLU . 3.7 tppt? -102.02 150.69 22.98 Favored 'General case' 0 C--O 1.237 0.41 0 C-N-CA 126.795 2.038 . . . . 0.0 108.994 176.05 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 112' ' ' LEU . . . . . . . . . . . . . 44.4 tp -72.95 59.34 0.5 Allowed 'General case' 0 CA--C 1.54 0.58 0 C-N-CA 124.968 1.307 . . . . 0.0 108.649 158.967 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 113' ' ' ALA . . . . . 0.688 ' HB3' ' CG1' ' A' ' 13' ' ' VAL . . . -96.63 83.83 3.54 Favored 'General case' 0 C--N 1.328 -0.351 0 N-CA-C 106.112 -1.811 . . . . 0.0 106.112 164.97 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 114' ' ' ASP . . . . . . . . . . . . . 3.2 p-10 -104.15 20.7 17.82 Favored 'General case' 0 CA--C 1.53 0.183 0 C-N-CA 125.271 1.429 . . . . 0.0 111.886 -176.89 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 115' ' ' LEU . . . . . . . . . . . . . 22.2 mt 70.63 13.82 7.26 Favored 'General case' 0 CA--C 1.541 0.608 0 C-N-CA 127.298 2.239 . . . . 0.0 112.886 177.267 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 116' ' ' MET . . . . . . . . . . . . . 5.5 ppp? -57.81 173.51 0.3 Allowed 'General case' 0 CA--C 1.531 0.236 0 C-N-CA 126.823 2.049 . . . . 0.0 114.395 175.919 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 117' ' ' ASN . . . . . . . . . . . . . 14.2 t30 . . . . . 0 C--O 1.234 0.26 0 C-N-CA 125.195 1.398 . . . . 0.0 108.418 168.208 . . . . . . . . 0 0 . 1 . 007 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 0.2 OUTLIER . . . . . 0 N--CA 1.451 -0.389 0 N-CA-C 109.099 -0.704 . . . . 0.0 109.099 . . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 2' ' ' VAL . . . . . . . . . . . . . 7.6 p -59.5 144.76 12.18 Favored 'Isoleucine or valine' 0 C--O 1.237 0.418 0 CA-C-O 120.879 0.371 . . . . 0.0 110.877 175.713 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 3' ' ' THR . . . . . . . . . . . . . 4.3 p -132.39 164.48 43.1 Favored Pre-proline 0 N--CA 1.453 -0.301 0 C-N-CA 124.508 1.123 . . . . 0.0 110.297 -178.064 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 4' ' ' PRO . . . . . . . . . . . . . 29.6 Cg_endo -66.15 -38.99 19.61 Favored 'Trans proline' 0 N--CA 1.462 -0.368 0 C-N-CA 122.559 2.173 . . . . 0.0 113.032 178.121 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 5' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -58.48 -47.48 83.92 Favored 'General case' 0 C--N 1.328 -0.353 0 C-N-CA 123.433 0.693 . . . . 0.0 110.907 -174.857 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 6' ' ' GLN . . . . . 0.405 HE21 HD12 ' A' ' 94' ' ' LEU . 15.8 pt20 -69.75 15.55 0.08 Allowed 'General case' 0 CA--C 1.541 0.603 0 C-N-CA 124.975 1.31 . . . . 0.0 114.048 176.161 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 7' ' ' LEU . . . . . . . . . . . . . 94.4 mt -130.3 -47.02 1.09 Allowed 'General case' 0 CA--C 1.529 0.17 0 C-N-CA 125.475 1.51 . . . . 0.0 110.882 -178.149 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 8' ' ' GLN . . . . . . . . . . . . . 7.1 mt-30 -60.77 -6.34 1.7 Allowed 'General case' 0 N--CA 1.479 1.012 0 N-CA-C 114.945 1.461 . . . . 0.0 114.945 -175.356 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 9' ' ' HIS . . . . . . . . . . . . . 10.7 m170 -126.94 13.29 7.32 Favored 'General case' 0 C--N 1.323 -0.554 0 C-N-CA 124.701 1.2 . . . . 0.0 111.359 -175.667 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 10' ' ' HIS . . . . . . . . . . . . . 73.8 m-70 -137.82 106.4 5.86 Favored 'General case' 0 CA--C 1.542 0.636 0 C-N-CA 124.466 1.107 . . . . 0.0 110.583 -161.341 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 11' ' ' ARG . . . . . . . . . . . . . 1.8 ttt180 -69.65 144.73 52.83 Favored 'General case' 0 N--CA 1.472 0.659 0 O-C-N 121.241 -0.912 . . . . 0.0 109.909 173.87 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 12' ' ' PHE . . . . . . . . . . . . . 39.4 m-85 -133.84 117.6 17.02 Favored 'General case' 0 N--CA 1.454 -0.26 0 C-N-CA 125.571 1.548 . . . . 0.0 107.709 177.584 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 13' ' ' VAL . . . . . 0.458 ' HA ' ' HA ' ' A' ' 30' ' ' GLU . 11.8 p -89.73 146.22 6.45 Favored 'Isoleucine or valine' 0 C--O 1.237 0.423 0 O-C-N 120.939 -1.101 . . . . 0.0 109.53 171.836 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 14' ' ' LEU . . . . . . . . . . . . . 25.0 tp -71.59 94.79 1.35 Allowed 'General case' 0 N--CA 1.453 -0.291 0 N-CA-C 107.572 -1.27 . . . . 0.0 107.572 173.078 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 4.3 mm-40 -61.89 -57.27 12.41 Favored 'General case' 0 N--CA 1.452 -0.327 0 N-CA-C 107.68 -1.23 . . . . 0.0 107.68 168.822 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 40.8 p -144.11 134.68 24.82 Favored 'General case' 0 N--CA 1.45 -0.457 0 N-CA-C 114.023 1.12 . . . . 0.0 114.023 -170.38 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 17' ' ' VAL . . . . . . . . . . . . . 65.9 t -72.52 165.07 3.16 Favored 'Isoleucine or valine' 0 C--O 1.24 0.577 0 N-CA-C 107.148 -1.427 . . . . 0.0 107.148 168.916 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 18' ' ' ASN . . . . . . . . . . . . . 0.0 OUTLIER -44.81 -39.56 5.4 Favored 'General case' 0 CA--C 1.534 0.33 0 C-N-CA 124.701 1.2 . . . . 0.0 112.185 174.776 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . -79.68 -81.11 0.76 Allowed Glycine 0 CA--C 1.526 0.734 0 C-N-CA 124.848 1.213 . . . . 0.0 110.609 177.565 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 37.7 mttt -141.99 166.29 22.46 Favored Pre-proline 0 CA--C 1.534 0.354 0 C-N-CA 127.057 2.143 . . . . 0.0 109.771 -173.517 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 21' ' ' PRO . . . . . . . . . . . . . 30.8 Cg_endo -58.14 168.54 3.54 Favored 'Trans proline' 0 N--CA 1.453 -0.865 0 C-N-CA 122.283 1.989 . . . . 0.0 113.042 172.58 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 22' ' ' VAL . . . . . . . . . . . . . 10.1 p -117.36 166.79 11.34 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.48 0 C-N-CA 127.31 2.244 . . . . 0.0 107.747 -179.45 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 23' ' ' THR . . . . . . . . . . . . . 39.7 m -131.14 156.35 45.42 Favored 'General case' 0 C--O 1.238 0.454 0 O-C-N 120.019 -1.676 . . . . 0.0 110.09 -177.772 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 24' ' ' SER . . . . . . . . . . . . . 1.7 p -154.98 136.15 13.94 Favored 'General case' 0 N--CA 1.435 -1.216 0 C-N-CA 125.806 1.642 . . . . 0.0 108.783 -162.379 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 25' ' ' ASP . . . . . . . . . . . . . 3.2 m-20 -71.14 63.33 0.33 Allowed 'General case' 0 C--N 1.32 -0.713 0 C-N-CA 124.936 1.295 . . . . 0.0 108.472 165.049 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 26' ' ' LYS . . . . . . . . . . . . . 31.0 tttp 62.79 4.9 1.57 Allowed 'General case' 0 CA--C 1.546 0.802 0 C-N-CA 124.329 1.052 . . . . 0.0 113.487 -179.554 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 27' ' ' ASN . . . . . . . . . . . . . 84.7 m-20 -127.2 76.54 76.26 Favored Pre-proline 0 C--O 1.239 0.525 0 C-N-CA 125.89 1.676 . . . . 0.0 108.306 -178.213 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 28' ' ' PRO . . . . . . . . . . . . . 85.4 Cg_endo -77.67 165.88 26.32 Favored 'Trans proline' 0 N--CA 1.461 -0.434 0 C-N-CA 124.078 3.186 . . . . 0.0 111.791 -176.42 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 29' ' ' PRO . . . . . . . . . . . . . 38.5 Cg_endo -66.89 83.41 0.32 Allowed 'Trans proline' 0 N--CA 1.452 -0.938 0 C-N-CA 122.789 2.326 . . . . 0.0 108.392 161.946 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 30' ' ' GLU . . . . . 0.458 ' HA ' ' HA ' ' A' ' 13' ' ' VAL . 12.9 pt-20 -91.67 163.73 13.99 Favored 'General case' 0 C--O 1.239 0.54 0 O-C-N 120.725 -1.235 . . . . 0.0 108.763 163.17 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 31' ' ' ILE . . . . . . . . . . . . . 12.1 tt -130.42 153.97 39.83 Favored 'Isoleucine or valine' 0 N--CA 1.449 -0.49 0 N-CA-C 106.06 -1.83 . . . . 0.0 106.06 171.806 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 32' ' ' SER . . . . . . . . . . . . . 3.6 t -144.86 172.46 13.0 Favored 'General case' 0 N--CA 1.445 -0.722 0 N-CA-C 107.074 -1.454 . . . . 0.0 107.074 167.765 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 33' ' ' PHE . . . . . . . . . . . . . 66.1 m-85 -136.12 163.07 31.19 Favored 'General case' 0 N--CA 1.445 -0.687 0 N-CA-C 107.027 -1.472 . . . . 0.0 107.027 -179.328 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 34' ' ' GLY . . . . . . . . . . . . . . . 167.54 113.95 0.29 Allowed Glycine 0 CA--C 1.495 -1.164 0 C-N-CA 118.226 -1.94 . . . . 0.0 114.639 172.263 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 35' ' ' GLU . . . . . . . . . . . . . 2.4 pt-20 77.12 140.57 0.07 Allowed 'General case' 0 N--CA 1.443 -0.787 1 C-N-CA 134.381 5.073 . . . . 0.0 106.845 -169.121 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 8.8 mtpm? 47.12 20.27 0.13 Allowed 'General case' 0 CA--C 1.544 0.733 0 N-CA-C 116.245 1.943 . . . . 0.0 116.245 176.167 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 37' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER 53.56 33.97 17.49 Favored 'General case' 0 C--N 1.331 -0.235 0 C-N-CA 126.418 1.887 . . . . 0.0 113.155 -167.964 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 38' ' ' MET . . . . . . . . . . . . . 0.1 OUTLIER -62.83 166.17 5.88 Favored 'General case' 0 N--CA 1.45 -0.451 0 N-CA-C 108.943 -0.762 . . . . 0.0 108.943 168.342 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 39' ' ' ILE . . . . . . . . . . . . . 9.1 mt -134.97 128.27 49.56 Favored 'Isoleucine or valine' 0 C--O 1.239 0.51 0 N-CA-C 107.471 -1.307 . . . . 0.0 107.471 -168.288 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 40' ' ' SER . . . . . . . . . . . . . 27.6 m -119.82 148.0 43.98 Favored 'General case' 0 CA--C 1.532 0.274 0 C-N-CA 124.735 1.214 . . . . 0.0 108.082 166.734 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 41' ' ' GLY . . . . . . . . . . . . . . . 173.23 178.61 43.34 Favored Glycine 0 CA--C 1.522 0.493 0 N-CA-C 109.725 -1.35 . . . . 0.0 109.725 -177.817 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 42' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -163.27 96.09 0.86 Allowed 'General case' 0 CA--C 1.536 0.418 0 O-C-N 121.942 -0.74 . . . . 0.0 110.863 -176.566 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 43' ' ' MET . . . . . . . . . . . . . 13.0 mmt -71.47 -68.73 0.43 Allowed 'General case' 0 N--CA 1.469 0.481 0 CA-C-N 118.456 0.571 . . . . 0.0 110.391 173.862 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 44' ' ' CYS . . . . . 1.286 ' SG ' ' SG ' ' A' ' 70' ' ' CYS . 45.6 t -135.59 -58.97 0.77 Allowed 'General case' 0 CA--C 1.527 0.089 0 N-CA-C 106.469 -1.678 . . . . 0.0 106.469 171.452 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 45' ' ' ASN . . . . . . . . . . . . . 25.7 m-20 -78.38 22.74 0.32 Allowed 'General case' 0 C--O 1.233 0.214 0 C-N-CA 126.811 2.044 . . . . 0.0 114.315 -175.118 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 46' ' ' ARG . . . . . . . . . . . . . 5.7 mpt_? 53.64 -173.85 0.04 OUTLIER 'General case' 0 C--O 1.225 -0.214 0 C-N-CA 124.028 0.931 . . . . 0.0 109.447 -163.737 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 47' ' ' PHE . . . . . . . . . . . . . 6.7 p90 -178.09 145.76 0.38 Allowed 'General case' 0 C--O 1.238 0.456 0 C-N-CA 126.399 1.88 . . . . 0.0 107.309 156.854 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 48' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -153.36 146.18 24.38 Favored 'General case' 0 C--N 1.324 -0.521 0 N-CA-C 107.749 -1.204 . . . . 0.0 107.749 177.23 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 49' ' ' GLY . . . . . . . . . . . . . . . -179.34 163.91 31.68 Favored Glycine 0 C--N 1.336 0.572 0 C-N-CA 120.398 -0.906 . . . . 0.0 112.615 179.133 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 50' ' ' GLU . . . . . . . . . . . . . 35.6 mt-10 -70.16 97.14 1.16 Allowed 'General case' 0 C--O 1.238 0.475 0 C-N-CA 124.809 1.244 . . . . 0.0 108.041 166.965 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 51' ' ' GLY . . . . . . . . . . . . . . . -72.08 175.58 41.97 Favored Glycine 0 CA--C 1.523 0.579 0 N-CA-C 110.416 -1.074 . . . . 0.0 110.416 155.888 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 52' ' ' LYS . . . . . . . . . . . . . 50.8 tttm -164.16 152.65 13.09 Favored 'General case' 0 C--N 1.332 -0.189 0 C-N-CA 125.795 1.638 . . . . 0.0 106.739 168.025 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 53' ' ' LEU . . . . . . . . . . . . . 46.2 tp -131.26 130.63 43.1 Favored 'General case' 0 C--O 1.232 0.179 0 C-N-CA 124.505 1.122 . . . . 0.0 109.169 170.813 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 40.1 t -139.37 -27.24 0.8 Allowed 'General case' 0 CA--C 1.535 0.399 0 C-N-CA 125.04 1.336 . . . . 0.0 111.292 177.832 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 55' ' ' ASN . . . . . . . . . . . . . 16.7 p-10 -146.41 17.96 1.34 Allowed 'General case' 0 CA--C 1.534 0.331 0 C-N-CA 124.486 1.114 . . . . 0.0 113.397 -153.319 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 56' ' ' GLY . . . . . . . . . . . . . . . 81.12 22.69 60.5 Favored Glycine 0 CA--C 1.525 0.692 0 CA-C-N 118.818 0.736 . . . . 0.0 112.958 -177.266 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 57' ' ' GLU . . . . . . . . . . . . . 35.8 tt0 -146.58 142.4 27.93 Favored 'General case' 0 C--O 1.237 0.425 0 C-N-CA 124.954 1.302 . . . . 0.0 109.183 -174.084 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 58' ' ' LEU . . . . . . . . . . . . . 57.9 tp -122.77 102.17 7.88 Favored 'General case' 0 CA--C 1.53 0.181 0 C-N-CA 127.115 2.166 . . . . 0.0 110.668 176.706 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 59' ' ' THR . . . . . . . . . . . . . 13.6 p -88.18 167.35 13.68 Favored 'General case' 0 CA--C 1.54 0.564 0 C-N-CA 124.611 1.164 . . . . 0.0 109.898 164.692 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 60' ' ' ALA . . . . . . . . . . . . . . . -132.23 107.54 8.65 Favored 'General case' 0 CA--C 1.528 0.131 0 C-N-CA 124.934 1.294 . . . . 0.0 109.574 163.069 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 61' ' ' LYS . . . . . . . . . . . . . 12.8 mttt -67.24 6.78 0.51 Allowed 'General case' 0 CA--C 1.54 0.585 0 N-CA-C 115.355 1.613 . . . . 0.0 115.355 -173.016 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 62' ' ' GLY . . . . . . . . . . . . . . . -150.35 -71.11 0.01 OUTLIER Glycine 0 CA--C 1.522 0.48 0 CA-C-N 120.818 1.645 . . . . 0.0 109.417 179.877 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 63' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER 60.55 89.75 0.07 Allowed 'General case' 0 N--CA 1.444 -0.728 0 C-N-CA 129.993 3.317 . . . . 0.0 113.261 179.304 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 64' ' ' ALA . . . . . . . . . . . . . . . -75.97 103.37 6.0 Favored 'General case' 0 C--O 1.236 0.393 0 C-N-CA 124.88 1.272 . . . . 0.0 111.239 -178.141 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 65' ' ' MET . . . . . . . . . . . . . 5.2 mtt -108.21 168.67 9.14 Favored 'General case' 0 N--CA 1.466 0.361 0 C-N-CA 124.0 0.92 . . . . 0.0 112.211 172.523 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 66' ' ' THR . . . . . . . . . . . . . 72.5 p -107.34 -163.96 0.94 Allowed 'General case' 0 CA--C 1.54 0.57 0 C-N-CA 126.392 1.877 . . . . 0.0 111.167 -176.474 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 67' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -141.01 84.26 1.92 Allowed 'General case' 0 N--CA 1.467 0.378 0 C-N-CA 124.282 1.033 . . . . 0.0 109.685 172.604 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 68' ' ' MET . . . . . . . . . . . . . 51.0 mtm -134.79 176.83 8.29 Favored 'General case' 0 C--N 1.324 -0.529 0 C-N-CA 129.566 3.147 . . . . 0.0 108.536 -178.641 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 69' ' ' MET . . . . . . . . . . . . . 1.6 pmm? -134.31 177.57 7.66 Favored 'General case' 0 N--CA 1.451 -0.392 0 C-N-CA 126.766 2.026 . . . . 0.0 109.872 170.114 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 70' ' ' CYS . . . . . 1.286 ' SG ' ' SG ' ' A' ' 44' ' ' CYS . 65.6 m -143.57 149.48 37.46 Favored 'General case' 0 C--N 1.33 -0.265 0 C-N-CA 126.37 1.868 . . . . 0.0 109.081 -170.037 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 71' ' ' ALA . . . . . . . . . . . . . . . -77.73 20.68 0.33 Allowed 'General case' 0 CA--C 1.539 0.524 0 N-CA-C 114.098 1.147 . . . . 0.0 114.098 -169.188 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 72' ' ' ASN . . . . . . . . . . . . . 21.8 t30 -147.22 142.26 16.73 Favored Pre-proline 0 C--O 1.236 0.393 0 N-CA-C 106.087 -1.82 . . . . 0.0 106.087 162.425 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 73' ' ' PRO . . . . . . . . . . . . . 30.4 Cg_endo -70.85 -21.98 27.71 Favored 'Trans proline' 0 C--N 1.346 0.399 0 C-N-CA 122.329 2.019 . . . . 0.0 112.621 -172.089 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 74' ' ' GLN . . . . . . . . . . . . . 39.0 tt0 -52.97 -38.3 62.04 Favored 'General case' 0 CA--C 1.534 0.332 0 C-N-CA 124.001 0.921 . . . . 0.0 111.581 -179.111 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 75' ' ' LEU . . . . . . . . . . . . . 32.5 mt -76.58 -31.37 57.46 Favored 'General case' 0 CA--C 1.533 0.312 0 C-N-CA 123.677 0.791 . . . . 0.0 111.732 -178.768 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 76' ' ' ASN . . . . . . . . . . . . . 3.2 t-20 -79.82 -14.34 58.75 Favored 'General case' 0 N--CA 1.469 0.52 0 C-N-CA 125.25 1.42 . . . . 0.0 110.991 179.975 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 77' ' ' GLU . . . . . . . . . . . . . 5.5 mm-40 -80.99 -44.83 17.53 Favored 'General case' 0 C--O 1.236 0.372 0 C-N-CA 126.265 1.826 . . . . 0.0 109.867 163.101 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 78' ' ' LEU . . . . . . . . . . . . . 23.9 mt -66.06 -36.21 82.61 Favored 'General case' 0 CA--C 1.51 -0.562 0 O-C-N 121.658 -0.651 . . . . 0.0 112.482 -171.822 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 79' ' ' ASP . . . . . . . . . . . . . 0.0 OUTLIER -61.65 -34.99 76.66 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-O 119.155 -0.45 . . . . 0.0 111.49 176.033 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 80' ' ' ASN . . . . . . . . . . . . . 11.2 t30 -75.61 -48.59 21.55 Favored 'General case' 0 N--CA 1.447 -0.591 0 N-CA-C 108.595 -0.891 . . . . 0.0 108.595 179.618 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 81' ' ' THR . . . . . . . . . . . . . 36.6 m -46.79 -59.8 2.82 Favored 'General case' 0 N--CA 1.449 -0.511 0 C-N-CA 125.175 1.39 . . . . 0.0 109.212 176.976 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 82' ' ' ILE . . . . . . . . . . . . . 4.6 tp -69.33 -34.77 64.25 Favored 'Isoleucine or valine' 0 C--O 1.237 0.407 0 O-C-N 121.615 -0.678 . . . . 0.0 111.914 -172.865 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 83' ' ' SER . . . . . . . . . . . . . 0.6 OUTLIER -58.94 -47.36 85.34 Favored 'General case' 0 N--CA 1.452 -0.365 0 N-CA-C 109.166 -0.679 . . . . 0.0 109.166 179.594 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 84' ' ' GLU . . . . . 0.443 ' OE1' ' HE2' ' A' ' 105' ' ' LYS . 16.8 tt0 -67.21 -42.8 83.51 Favored 'General case' 0 N--CA 1.447 -0.591 0 C-N-CA 124.453 1.101 . . . . 0.0 110.689 -179.163 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 85' ' ' MET . . . . . . . . . . . . . 48.4 mtp -59.66 -47.91 83.73 Favored 'General case' 0 C--N 1.343 0.317 0 CA-C-N 119.611 1.096 . . . . 0.0 110.115 -174.89 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 86' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -76.57 -20.3 56.96 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-O 118.824 -0.608 . . . . 0.0 112.114 -175.702 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 87' ' ' LYS . . . . . . . . . . . . . 3.3 tptt -71.93 -37.36 70.05 Favored 'General case' 0 N--CA 1.45 -0.43 0 N-CA-C 109.027 -0.731 . . . . 0.0 109.027 174.462 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 88' ' ' GLU . . . . . . . . . . . . . 89.2 mt-10 -89.24 -28.74 19.73 Favored 'General case' 0 C--O 1.233 0.218 0 CA-C-O 117.76 -1.114 . . . . 0.0 112.895 -173.106 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 89' ' ' GLY . . . . . . . . . . . . . . . 112.52 97.25 2.32 Favored Glycine 0 C--N 1.337 0.603 0 N-CA-C 109.483 -1.447 . . . . 0.0 109.483 -176.472 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 90' ' ' ALA . . . . . . . . . . . . . . . -78.89 128.86 33.88 Favored 'General case' 0 N--CA 1.449 -0.489 0 N-CA-C 108.02 -1.104 . . . . 0.0 108.02 174.514 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 91' ' ' GLN . . . . . . . . . . . . . 2.6 mp0 -62.8 140.65 58.78 Favored 'General case' 0 C--N 1.327 -0.402 0 N-CA-C 107.334 -1.358 . . . . 0.0 107.334 169.015 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 92' ' ' VAL . . . . . 0.464 ' HA ' HD22 ' A' ' 101' ' ' LEU . 25.4 t -126.45 114.6 38.85 Favored 'Isoleucine or valine' 0 N--CA 1.444 -0.753 0 C-N-CA 125.623 1.569 . . . . 0.0 108.14 -172.399 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 93' ' ' ASP . . . . . . . . . . . . . 14.4 m-20 -137.37 72.21 1.42 Allowed 'General case' 0 CA--C 1.538 0.486 0 C-N-CA 126.568 1.947 . . . . 0.0 106.709 -179.213 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 94' ' ' LEU . . . . . 0.405 HD12 HE21 ' A' ' 6' ' ' GLN . 0.9 OUTLIER -74.93 107.82 7.26 Favored 'General case' 0 N--CA 1.464 0.265 0 N-CA-C 106.694 -1.595 . . . . 0.0 106.694 168.311 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 95' ' ' THR . . . . . . . . . . . . . 2.2 t -71.93 -164.51 0.13 Allowed 'General case' 0 CA--C 1.54 0.564 0 C-N-CA 125.062 1.345 . . . . 0.0 108.313 172.127 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 96' ' ' ALA . . . . . . . . . . . . . . . -44.56 -49.26 10.2 Favored 'General case' 0 CA--C 1.543 0.68 0 O-C-N 121.26 -0.9 . . . . 0.0 112.725 -177.665 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 97' ' ' ASN . . . . . . . . . . . . . 31.3 p30 -157.66 28.44 0.28 Allowed 'General case' 0 CA--C 1.542 0.662 0 C-N-CA 125.707 1.603 . . . . 0.0 113.28 -174.529 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 98' ' ' GLN . . . . . . . . . . . . . 11.4 tt0 -137.72 121.91 18.05 Favored 'General case' 0 N--CA 1.466 0.329 0 C-N-CA 124.924 1.289 . . . . 0.0 107.953 173.822 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 99' ' ' LEU . . . . . . . . . . . . . 6.8 tp -69.43 123.63 21.77 Favored 'General case' 0 N--CA 1.451 -0.378 0 N-CA-C 105.793 -1.928 . . . . 0.0 105.793 172.666 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 100' ' ' THR . . . . . . . . . . . . . 3.7 m -121.64 113.82 20.29 Favored 'General case' 0 N--CA 1.452 -0.336 0 N-CA-C 105.698 -1.964 . . . . 0.0 105.698 172.478 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 101' ' ' LEU . . . . . 0.464 HD22 ' HA ' ' A' ' 92' ' ' VAL . 0.2 OUTLIER -121.01 150.76 40.64 Favored 'General case' 0 C--O 1.234 0.271 0 N-CA-C 107.345 -1.354 . . . . 0.0 107.345 -177.387 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 102' ' ' ALA . . . . . . . . . . . . . . . -144.86 161.37 39.47 Favored 'General case' 0 C--N 1.33 -0.277 0 C-N-CA 124.988 1.315 . . . . 0.0 108.595 172.745 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 103' ' ' THR . . . . . 0.452 HG22 ' H ' ' A' ' 104' ' ' ALA . 2.9 m -155.78 -168.14 2.7 Favored 'General case' 0 N--CA 1.446 -0.656 0 C-N-CA 127.404 2.282 . . . . 0.0 105.331 170.178 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 104' ' ' ALA . . . . . 0.452 ' H ' HG22 ' A' ' 103' ' ' THR . . . -57.42 -46.56 83.37 Favored 'General case' 0 CA--C 1.535 0.396 0 O-C-N 120.313 -1.492 . . . . 0.0 110.971 161.874 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 105' ' ' LYS . . . . . 0.443 ' HE2' ' OE1' ' A' ' 84' ' ' GLU . 3.3 tmtt? -49.61 -64.8 0.7 Allowed 'General case' 0 N--CA 1.465 0.298 0 C-N-CA 125.257 1.423 . . . . 0.0 113.056 -170.685 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 106' ' ' GLN . . . . . . . . . . . . . 3.5 pt20 -166.83 -167.78 1.02 Allowed 'General case' 0 CA--C 1.536 0.411 0 C-N-CA 126.092 1.757 . . . . 0.0 108.437 -175.838 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 107' ' ' THR . . . . . . . . . . . . . 0.5 OUTLIER -124.0 149.05 46.47 Favored 'General case' 0 CA--C 1.533 0.324 0 N-CA-C 107.504 -1.295 . . . . 0.0 107.504 168.672 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 108' ' ' LEU . . . . . . . . . . . . . 9.5 mp -120.35 157.16 29.84 Favored 'General case' 0 C--O 1.239 0.53 0 C-N-CA 126.362 1.865 . . . . 0.0 108.979 178.307 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 109' ' ' THR . . . . . . . . . . . . . 3.5 m -136.69 93.4 2.86 Favored 'General case' 0 C--O 1.238 0.479 0 N-CA-C 108.935 -0.765 . . . . 0.0 108.935 176.14 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 110' ' ' TYR . . . . . . . . . . . . . 34.5 m-85 -90.21 155.92 18.68 Favored 'General case' 0 CA--C 1.534 0.337 0 CA-C-O 121.168 0.509 . . . . 0.0 109.795 172.451 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 111' ' ' LYS . . . . . . . . . . . . . 0.3 OUTLIER -108.83 143.66 37.73 Favored 'General case' 0 CA--C 1.518 -0.271 0 C-N-CA 124.857 1.263 . . . . 0.0 108.145 178.426 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 112' ' ' LEU . . . . . . . . . . . . . 45.8 tp -70.45 68.17 0.36 Allowed 'General case' 0 CA--C 1.543 0.689 0 C-N-CA 125.155 1.382 . . . . 0.0 109.578 168.158 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 113' ' ' ALA . . . . . . . . . . . . . . . -100.26 75.24 1.8 Allowed 'General case' 0 N--CA 1.464 0.265 0 N-CA-C 106.571 -1.64 . . . . 0.0 106.571 -179.956 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 114' ' ' ASP . . . . . . . . . . . . . 42.6 t0 -107.16 32.97 4.23 Favored 'General case' 0 C--N 1.326 -0.414 0 CA-C-O 121.539 0.685 . . . . 0.0 110.802 -160.256 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 115' ' ' LEU . . . . . . . . . . . . . 29.3 mt 63.71 12.2 6.42 Favored 'General case' 0 CA--C 1.535 0.366 0 C-N-CA 126.28 1.832 . . . . 0.0 113.322 173.67 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 116' ' ' MET . . . . . . . . . . . . . 0.3 OUTLIER -96.65 5.0 51.58 Favored 'General case' 0 C--N 1.33 -0.245 0 C-N-CA 125.051 1.341 . . . . 0.0 113.384 -175.634 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 117' ' ' ASN . . . . . . . . . . . . . 8.2 t-20 . . . . . 0 C--O 1.232 0.162 0 C-N-CA 124.14 0.976 . . . . 0.0 109.837 -173.968 . . . . . . . . 0 0 . 1 . 008 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 1.4 pmm? . . . . . 0 CA--C 1.536 0.427 0 N-CA-C 109.437 -0.579 . . . . 0.0 109.437 . . . . . . . . . 0 0 . 1 . 008 nuclear nobuild full ' A' A ' 2' ' ' VAL . . . . . . . . . . . . . 6.7 p -72.34 153.37 7.74 Favored 'Isoleucine or valine' 0 C--O 1.236 0.357 0 N-CA-C 109.363 -0.606 . . . . 0.0 109.363 174.202 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 3' ' ' THR . . . . . . . . . . . . . 0.5 OUTLIER -132.79 159.15 73.74 Favored Pre-proline 0 CA--C 1.532 0.25 0 C-N-CA 124.053 0.941 . . . . 0.0 109.976 171.829 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 4' ' ' PRO . . . . . . . . . . . . . 55.4 Cg_endo -64.77 -34.28 50.63 Favored 'Trans proline' 0 C--N 1.345 0.358 0 C-N-CA 123.102 2.534 . . . . 0.0 111.341 -176.728 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 5' ' ' GLU . . . . . . . . . . . . . 19.2 tt0 -52.21 -55.31 21.94 Favored 'General case' 0 N--CA 1.449 -0.476 0 C-N-CA 125.471 1.508 . . . . 0.0 110.146 175.636 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 6' ' ' GLN . . . . . . . . . . . . . 11.8 pt20 -70.14 20.79 0.04 OUTLIER 'General case' 0 CA--C 1.543 0.694 0 N-CA-C 114.243 1.201 . . . . 0.0 114.243 176.039 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 7' ' ' LEU . . . . . . . . . . . . . 76.0 mt -129.54 -56.1 1.15 Allowed 'General case' 0 N--CA 1.461 0.119 0 C-N-CA 124.87 1.268 . . . . 0.0 110.922 178.435 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 8' ' ' GLN . . . . . . . . . . . . . 6.3 mt-30 -44.59 -8.73 0.01 OUTLIER 'General case' 0 N--CA 1.474 0.759 0 C-N-CA 129.257 3.023 . . . . 0.0 117.969 -178.159 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 9' ' ' HIS . . . . . . . . . . . . . 19.4 p80 -148.88 35.72 0.77 Allowed 'General case' 0 C--N 1.325 -0.473 0 C-N-CA 123.531 0.733 . . . . 0.0 112.276 177.651 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 10' ' ' HIS . . . . . . . . . . . . . 91.5 m-70 -130.86 165.1 23.77 Favored 'General case' 0 C--O 1.235 0.3 0 CA-C-O 121.626 0.727 . . . . 0.0 110.695 174.972 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 11' ' ' ARG . . . . . . . . . . . . . 60.3 ttt180 -128.94 139.46 52.1 Favored 'General case' 0 C--O 1.235 0.317 0 C-N-CA 126.252 1.821 . . . . 0.0 107.057 -173.606 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 12' ' ' PHE . . . . . . . . . . . . . 45.0 m-85 -137.43 112.28 8.93 Favored 'General case' 0 N--CA 1.441 -0.883 0 C-N-CA 125.181 1.392 . . . . 0.0 107.341 -164.684 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 13' ' ' VAL . . . . . . . . . . . . . 2.8 t -103.67 144.31 14.31 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.482 0 N-CA-C 106.709 -1.589 . . . . 0.0 106.709 -174.401 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 14' ' ' LEU . . . . . . . . . . . . . 11.5 tp -79.08 96.08 5.71 Favored 'General case' 0 N--CA 1.449 -0.494 0 N-CA-C 109.513 -0.551 . . . . 0.0 109.513 -169.834 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 1.4 mm-40 -76.3 -39.14 54.95 Favored 'General case' 0 N--CA 1.452 -0.344 0 CA-C-O 118.46 -0.781 . . . . 0.0 111.292 -170.943 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 2.6 t -156.03 156.73 34.92 Favored 'General case' 0 C--O 1.237 0.417 0 CA-C-N 119.721 1.146 . . . . 0.0 111.126 161.126 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 17' ' ' VAL . . . . . . . . . . . . . 21.3 t -86.3 171.66 1.12 Allowed 'Isoleucine or valine' 0 CA--C 1.534 0.331 0 C-N-CA 126.017 1.727 . . . . 0.0 107.504 172.519 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 18' ' ' ASN . . . . . . . . . . . . . 20.6 t30 -53.16 -35.59 59.95 Favored 'General case' 0 CA--C 1.53 0.195 0 C-N-CA 124.304 1.041 . . . . 0.0 112.494 166.393 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . -93.97 -54.16 1.67 Allowed Glycine 0 CA--C 1.525 0.659 0 C-N-CA 123.755 0.693 . . . . 0.0 112.806 -170.336 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 16.6 ptpt -160.0 163.83 21.45 Favored Pre-proline 0 N--CA 1.465 0.307 0 C-N-CA 125.665 1.586 . . . . 0.0 108.806 -174.723 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 21' ' ' PRO . . . . . . . . . . . . . 59.1 Cg_endo -70.93 171.21 16.2 Favored 'Trans proline' 0 N--CA 1.454 -0.815 0 CA-C-N 120.806 1.324 . . . . 0.0 110.973 170.67 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 22' ' ' VAL . . . . . . . . . . . . . 2.7 p -135.56 136.31 50.73 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.369 0 C-N-CA 126.552 1.941 . . . . 0.0 107.155 -178.155 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 23' ' ' THR . . . . . . . . . . . . . 0.8 OUTLIER -144.92 123.99 12.83 Favored 'General case' 0 C--O 1.238 0.459 0 N-CA-C 107.005 -1.48 . . . . 0.0 107.005 -175.398 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 24' ' ' SER . . . . . . . . . . . . . 14.7 m -123.26 41.25 3.52 Favored 'General case' 0 C--O 1.235 0.333 0 C-N-CA 124.957 1.303 . . . . 0.0 110.146 -163.958 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 25' ' ' ASP . . . . . . . . . . . . . 38.7 m-20 62.45 -78.46 0.03 OUTLIER 'General case' 0 C--O 1.234 0.254 0 C-N-CA 127.972 2.509 . . . . 0.0 108.582 -167.953 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 26' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -131.4 -8.58 3.72 Favored 'General case' 0 CA--C 1.523 -0.067 0 N-CA-C 115.684 1.735 . . . . 0.0 115.684 178.198 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 27' ' ' ASN . . . . . . . . . . . . . 13.2 m120 -115.41 75.91 4.92 Favored Pre-proline 0 N--CA 1.471 0.595 0 CA-C-N 120.167 1.349 . . . . 0.0 111.328 -175.624 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 28' ' ' PRO . . . . . . . . . . . . . 49.0 Cg_endo -66.53 162.41 36.93 Favored 'Trans proline' 0 CA--C 1.539 0.769 0 C-N-CA 123.392 2.728 . . . . 0.0 113.051 -177.611 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 29' ' ' PRO . . . . . . . . . . . . . 19.5 Cg_endo -66.04 64.85 0.45 Allowed 'Trans proline' 0 CA--C 1.54 0.802 0 C-N-CA 125.088 3.859 . . . . 0.0 113.443 170.833 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 30' ' ' GLU . . . . . . . . . . . . . 10.8 pt-20 -76.38 169.77 17.62 Favored 'General case' 0 CA--C 1.544 0.733 0 O-C-N 119.709 -1.869 . . . . 0.0 111.301 177.779 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 31' ' ' ILE . . . . . . . . . . . . . 16.8 tt -139.04 159.77 29.54 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.406 0 C-N-CA 127.212 2.205 . . . . 0.0 107.013 170.96 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 32' ' ' SER . . . . . . . . . . . . . 45.4 p -149.33 177.02 10.04 Favored 'General case' 0 N--CA 1.444 -0.773 0 C-N-CA 125.747 1.619 . . . . 0.0 107.345 167.453 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 33' ' ' PHE . . . . . . . . . . . . . 39.8 m-85 -134.65 148.8 50.45 Favored 'General case' 0 N--CA 1.447 -0.575 0 N-CA-C 106.458 -1.682 . . . . 0.0 106.458 175.284 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 34' ' ' GLY . . . . . . . . . . . . . . . -163.68 -176.23 35.4 Favored Glycine 0 N--CA 1.445 -0.749 0 N-CA-C 107.453 -2.259 . . . . 0.0 107.453 178.419 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 35' ' ' GLU . . . . . . . . . . . . 0.275 1.9 mt-10 47.36 -162.95 0.03 OUTLIER 'General case' 0 CA--C 1.538 0.506 0 C-N-CA 124.569 1.148 . . . . 0.0 110.083 -171.329 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 6.6 mmpt? -69.29 56.15 0.11 Allowed 'General case' 0 CA--C 1.546 0.791 0 O-C-N 119.207 -2.183 . . . . 0.0 112.644 -174.499 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 37' ' ' MET . . . . . . . . . . . . . 79.4 mmm 46.89 86.69 0.02 OUTLIER 'General case' 0 CA--C 1.539 0.549 0 C-N-CA 126.055 1.742 . . . . 0.0 110.401 -156.698 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 38' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -123.6 4.29 8.94 Favored 'General case' 0 N--CA 1.476 0.836 0 N-CA-C 114.062 1.134 . . . . 0.0 114.062 -175.489 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 39' ' ' ILE . . . . . . . . . . . . . 24.2 mt 46.92 133.47 0.0 OUTLIER 'Isoleucine or valine' 0 CA--C 1.539 0.555 1 C-N-CA 133.135 4.574 . . . . 0.0 111.963 179.888 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 40' ' ' SER . . . . . . . . . . . . . 8.3 m -140.2 101.95 4.26 Favored 'General case' 0 C--N 1.329 -0.31 0 O-C-N 120.163 -1.585 . . . . 0.0 107.227 178.792 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 41' ' ' GLY . . . . . . . . . . . . . . . -145.2 174.2 25.33 Favored Glycine 0 C--N 1.336 0.579 0 CA-C-N 118.841 0.746 . . . . 0.0 112.558 179.286 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 42' ' ' SER . . . . . . . . . . . . . 13.3 p -149.79 85.44 1.42 Allowed 'General case' 0 N--CA 1.451 -0.388 0 C-N-CA 123.108 0.563 . . . . 0.0 110.665 -178.635 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 43' ' ' MET . . . . . . . . . . . . . 3.4 mmt -59.52 -46.5 88.66 Favored 'General case' 0 N--CA 1.462 0.158 0 CA-C-O 122.081 0.943 . . . . 0.0 108.61 167.675 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 44' ' ' CYS . . . . . 1.305 ' SG ' ' SG ' ' A' ' 70' ' ' CYS . 36.5 t -149.32 -66.87 0.22 Allowed 'General case' 0 N--CA 1.442 -0.869 0 C-N-CA 125.178 1.391 . . . . 0.0 107.311 161.363 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 45' ' ' ASN . . . . . . . . . . . . . 3.0 m120 -87.23 22.42 2.11 Favored 'General case' 0 C--N 1.327 -0.387 0 C-N-CA 124.244 1.018 . . . . 0.0 111.884 -155.792 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 46' ' ' ARG . . . . . . . . . . . . . 7.0 mmm180 51.41 162.26 0.0 OUTLIER 'General case' 0 N--CA 1.465 0.291 0 C-N-CA 127.461 2.304 . . . . 0.0 113.09 -162.853 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 47' ' ' PHE . . . . . . . . . . . . . 49.6 p90 -163.64 163.74 24.26 Favored 'General case' 0 C--N 1.324 -0.521 0 C-N-CA 124.826 1.251 . . . . 0.0 109.521 170.03 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 48' ' ' SER . . . . . . . . . . . . . 6.2 m -158.79 165.66 33.75 Favored 'General case' 0 N--CA 1.44 -0.94 0 C-N-CA 126.866 2.066 . . . . 0.0 108.113 173.134 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 49' ' ' GLY . . . . . . . . . . . . . . . -178.59 167.71 38.32 Favored Glycine 0 CA--C 1.519 0.31 0 N-CA-C 110.354 -1.098 . . . . 0.0 110.354 166.981 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 50' ' ' GLU . . . . . . . . . . . . . 32.6 mt-10 -61.69 98.46 0.09 Allowed 'General case' 0 C--N 1.33 -0.253 0 N-CA-C 109.3 -0.629 . . . . 0.0 109.3 176.621 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 51' ' ' GLY . . . . . . . . . . . . . . . -60.14 -67.91 1.93 Allowed Glycine 0 C--N 1.335 0.475 0 O-C-N 124.485 1.116 . . . . 0.0 110.998 -176.94 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 52' ' ' LYS . . . . . . . . . . . . . 0.4 OUTLIER 64.49 164.27 0.14 Allowed 'General case' 0 N--CA 1.453 -0.282 0 C-N-CA 125.173 1.389 . . . . 0.0 109.187 -166.73 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 53' ' ' LEU . . . . . . . . . . . . . 5.9 tp -164.58 111.08 1.02 Allowed 'General case' 0 N--CA 1.45 -0.435 0 N-CA-C 107.429 -1.322 . . . . 0.0 107.429 164.065 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 1.4 t -148.95 -11.59 0.32 Allowed 'General case' 0 C--O 1.234 0.282 0 CA-C-O 117.561 -1.209 . . . . 0.0 112.701 178.087 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 55' ' ' ASN . . . . . . . . . . . . . 0.8 OUTLIER -156.96 46.87 0.42 Allowed 'General case' 0 CA--C 1.538 0.501 0 C-N-CA 124.897 1.279 . . . . 0.0 109.347 -170.201 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 56' ' ' GLY . . . . . . . . . . . . . . . 66.65 5.87 32.87 Favored Glycine 0 CA--C 1.533 1.192 0 N-CA-C 115.968 1.147 . . . . 0.0 115.968 170.425 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 57' ' ' GLU . . . . . . . . . . . . . 18.3 tt0 -132.6 110.61 10.56 Favored 'General case' 0 C--O 1.239 0.504 0 CA-C-N 118.579 1.189 . . . . 0.0 109.183 -164.633 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 58' ' ' LEU . . . . . . . . . . . . . 27.2 tp -89.69 104.44 17.0 Favored 'General case' 0 C--O 1.234 0.267 0 C-N-CA 126.364 1.866 . . . . 0.0 108.148 177.912 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 59' ' ' THR . . . . . . . . . . . . . 0.8 OUTLIER -91.72 168.91 11.14 Favored 'General case' 0 C--N 1.327 -0.393 0 CA-C-O 121.809 0.814 . . . . 0.0 110.302 169.706 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 60' ' ' ALA . . . . . . . . . . . . . . . -123.52 131.62 53.68 Favored 'General case' 0 N--CA 1.45 -0.426 0 N-CA-C 107.173 -1.417 . . . . 0.0 107.173 148.593 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 61' ' ' LYS . . . . . . . . . . . . . 24.3 ttmt -79.54 82.6 5.64 Favored 'General case' 0 N--CA 1.454 -0.24 0 N-CA-C 107.841 -1.17 . . . . 0.0 107.841 173.909 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 62' ' ' GLY . . . . . . . . . . . . . . . 103.99 -48.68 0.98 Allowed Glycine 0 CA--C 1.529 0.958 0 CA-C-O 118.827 -0.985 . . . . 0.0 113.044 174.402 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 63' ' ' LEU . . . . . . . . . . . . . 3.5 tp 64.88 106.29 0.03 OUTLIER 'General case' 0 N--CA 1.442 -0.86 0 C-N-CA 130.804 3.642 . . . . 0.0 113.777 -176.789 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 64' ' ' ALA . . . . . . . . . . . . . . . -77.69 146.25 36.13 Favored 'General case' 0 CA--C 1.533 0.291 0 N-CA-C 108.961 -0.755 . . . . 0.0 108.961 171.206 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 65' ' ' MET . . . . . . . . . . . . . 76.0 mtp -140.83 -164.91 1.83 Allowed 'General case' 0 CA--C 1.542 0.668 0 C-N-CA 126.58 1.952 . . . . 0.0 108.491 179.261 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 66' ' ' THR . . . . . . . . . . . . . 27.2 p -130.76 -165.89 1.62 Allowed 'General case' 0 N--CA 1.472 0.625 0 CA-C-N 120.062 1.301 . . . . 0.0 109.909 168.149 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 67' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -136.55 76.92 1.62 Allowed 'General case' 0 C--O 1.233 0.188 0 C-N-CA 126.167 1.787 . . . . 0.0 108.822 -179.199 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 68' ' ' MET . . . . . . . . . . . . . 15.3 ptp -124.51 158.23 33.41 Favored 'General case' 0 CA--C 1.533 0.323 0 C-N-CA 124.297 1.039 . . . . 0.0 111.97 -177.028 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 69' ' ' MET . . . . . . . . . . . . . 0.1 OUTLIER -73.97 162.31 29.18 Favored 'General case' 0 CA--C 1.533 0.305 0 C-N-CA 123.643 0.777 . . . . 0.0 109.424 171.432 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 70' ' ' CYS . . . . . 1.305 ' SG ' ' SG ' ' A' ' 44' ' ' CYS . 1.2 m -119.01 -179.53 3.85 Favored 'General case' 0 CA--C 1.537 0.476 0 C-N-CA 126.284 1.834 . . . . 0.0 108.692 161.551 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 71' ' ' ALA . . . . . . . . . . . . . . . -82.79 -26.6 31.65 Favored 'General case' 0 CA--C 1.535 0.393 0 C-N-CA 124.555 1.142 . . . . 0.0 111.615 166.012 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 72' ' ' ASN . . . . . . . . . . . . . 1.2 m-20 -119.97 152.67 54.43 Favored Pre-proline 0 N--CA 1.467 0.397 0 C-N-CA 123.962 0.905 . . . . 0.0 110.474 -172.167 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 73' ' ' PRO . . . . . . . . . . . . . 49.0 Cg_endo -70.39 -46.2 1.04 Allowed 'Trans proline' 0 N--CA 1.458 -0.585 0 C-N-CA 124.008 3.138 . . . . 0.0 111.198 173.146 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 74' ' ' GLN . . . . . . . . . . . . . 64.3 tt0 -51.31 -35.34 37.38 Favored 'General case' 0 C--O 1.221 -0.424 0 C-N-CA 123.569 0.748 . . . . 0.0 110.85 -174.172 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 75' ' ' LEU . . . . . 0.402 ' HB3' ' HB2' ' A' ' 44' ' ' CYS . 87.5 mt -66.33 -38.88 88.7 Favored 'General case' 0 CA--C 1.538 0.519 0 C-N-CA 123.686 0.794 . . . . 0.0 111.701 -177.373 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 76' ' ' ASN . . . . . . . . . . . . . 3.0 m-80 -79.07 -20.46 48.74 Favored 'General case' 0 N--CA 1.475 0.791 0 CA-C-N 119.506 1.048 . . . . 0.0 111.478 174.994 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 77' ' ' GLU . . . . . . . . . . . . . 0.7 OUTLIER -65.48 -38.18 89.02 Favored 'General case' 0 CA--C 1.545 0.766 0 O-C-N 121.056 -1.027 . . . . 0.0 109.48 164.918 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 78' ' ' LEU . . . . . . . . . . . . . 32.4 mt -80.34 -17.62 51.47 Favored 'General case' 0 N--CA 1.453 -0.3 0 CA-C-O 118.039 -0.982 . . . . 0.0 113.364 -174.847 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 79' ' ' ASP . . . . . . . . . . . . . 4.8 t70 -46.72 -57.52 4.76 Favored 'General case' 0 N--CA 1.469 0.476 0 C-N-CA 125.165 1.386 . . . . 0.0 109.406 162.511 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 80' ' ' ASN . . . . . . . . . . . . . 69.8 m-80 -74.48 -36.8 63.3 Favored 'General case' 0 N--CA 1.448 -0.544 0 CA-C-N 115.258 -0.883 . . . . 0.0 108.973 -171.818 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 81' ' ' THR . . . . . . . . . . . . . 28.0 m -54.49 -51.03 66.36 Favored 'General case' 0 CA--C 1.54 0.579 0 C-N-CA 124.052 0.941 . . . . 0.0 110.117 177.679 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 82' ' ' ILE . . . . . . . . . . . . . 7.0 tp -73.86 -33.27 36.7 Favored 'Isoleucine or valine' 0 C--N 1.345 0.385 0 CA-C-N 119.719 1.145 . . . . 0.0 111.015 -179.251 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 83' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -58.4 -53.24 60.58 Favored 'General case' 0 C--O 1.236 0.371 0 N-CA-C 108.832 -0.803 . . . . 0.0 108.832 178.713 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 84' ' ' GLU . . . . . . . . . . . . . 14.2 tp10 -75.6 -3.01 31.97 Favored 'General case' 0 CA--C 1.542 0.64 0 C-N-CA 124.873 1.269 . . . . 0.0 112.07 -174.667 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 85' ' ' MET . . . . . . . . . . . . . 84.7 mtp -107.45 -5.16 17.83 Favored 'General case' 0 CA--C 1.535 0.383 0 C-N-CA 124.338 1.055 . . . . 0.0 113.212 174.307 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 86' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -105.55 -22.86 12.9 Favored 'General case' 0 N--CA 1.475 0.802 0 CA-C-N 120.639 1.563 . . . . 0.0 111.628 173.818 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 87' ' ' LYS . . . . . . . . . . . . . 8.1 tttm -68.36 -44.6 74.88 Favored 'General case' 0 CA--C 1.543 0.707 0 N-CA-C 110.172 -0.307 . . . . 0.0 110.172 -169.035 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 88' ' ' GLU . . . . . . . . . . . . . 35.4 mt-10 -82.36 -14.67 54.89 Favored 'General case' 0 N--CA 1.468 0.425 0 C-N-CA 126.562 1.945 . . . . 0.0 112.265 177.581 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 89' ' ' GLY . . . . . . . . . . . . . . . 98.54 105.03 2.49 Favored Glycine 0 C--N 1.337 0.617 0 N-CA-C 110.572 -1.011 . . . . 0.0 110.572 -175.934 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 90' ' ' ALA . . . . . . . . . . . . . . . -74.16 138.08 43.58 Favored 'General case' 0 C--O 1.232 0.15 0 N-CA-C 108.596 -0.89 . . . . 0.0 108.596 171.57 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 91' ' ' GLN . . . . . . . . . . . . . 0.4 OUTLIER -64.81 129.05 38.3 Favored 'General case' 0 C--O 1.239 0.542 0 N-CA-C 105.231 -2.137 . . . . 0.0 105.231 161.039 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 92' ' ' VAL . . . . . . . . . . . . . 7.6 p -125.53 107.69 18.31 Favored 'Isoleucine or valine' 0 N--CA 1.447 -0.588 0 N-CA-C 106.762 -1.57 . . . . 0.0 106.762 -170.235 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 93' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -122.17 81.63 1.86 Allowed 'General case' 0 C--N 1.324 -0.521 0 N-CA-C 106.716 -1.587 . . . . 0.0 106.716 -179.213 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 94' ' ' LEU . . . . . . . . . . . . . 2.3 tm? -82.9 98.52 9.24 Favored 'General case' 0 CA--C 1.51 -0.572 0 N-CA-C 106.034 -1.839 . . . . 0.0 106.034 166.961 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 95' ' ' THR . . . . . . . . . . . . . 3.1 m -83.05 170.87 14.38 Favored 'General case' 0 C--N 1.316 -0.868 0 CA-C-N 112.195 -2.275 . . . . 0.0 106.182 172.501 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 96' ' ' ALA . . . . . . . . . . . . . . . -44.84 -32.63 1.64 Allowed 'General case' 0 CA--C 1.545 0.761 0 N-CA-C 116.395 1.998 . . . . 0.0 116.395 -160.877 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 97' ' ' ASN . . . . . . . . . . . . . 0.2 OUTLIER -141.11 9.69 2.12 Favored 'General case' 0 N--CA 1.472 0.665 0 CA-C-N 120.74 1.609 . . . . 0.0 113.035 173.16 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 98' ' ' GLN . . . . . . . . . . . . . 12.9 tt0 -143.5 129.79 19.87 Favored 'General case' 0 CA--C 1.52 -0.182 0 O-C-N 120.484 -1.385 . . . . 0.0 109.216 -169.874 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 99' ' ' LEU . . . . . 0.677 HD22 ' CD2' ' A' ' 101' ' ' LEU . 0.4 OUTLIER -91.34 123.12 34.54 Favored 'General case' 0 N--CA 1.444 -0.765 0 C-N-CA 125.298 1.439 . . . . 0.0 109.045 179.642 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 100' ' ' THR . . . . . . . . . . . . . 79.7 m -98.87 115.87 29.82 Favored 'General case' 0 C--N 1.323 -0.584 0 C-N-CA 125.883 1.673 . . . . 0.0 106.495 165.83 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 101' ' ' LEU . . . . . 0.677 ' CD2' HD22 ' A' ' 99' ' ' LEU . 1.4 mm? -110.7 126.22 54.31 Favored 'General case' 0 CA--C 1.501 -0.924 0 N-CA-C 106.649 -1.612 . . . . 0.0 106.649 171.356 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 102' ' ' ALA . . . . . . . . . . . . . . . -138.02 153.21 49.4 Favored 'General case' 0 C--N 1.323 -0.545 0 O-C-N 124.396 1.06 . . . . 0.0 109.807 174.171 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 103' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -160.51 174.08 14.59 Favored 'General case' 0 N--CA 1.443 -0.78 0 C-N-CA 126.026 1.731 . . . . 0.0 108.04 177.526 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 104' ' ' ALA . . . . . . . . . . . . . . . -53.09 -34.6 57.35 Favored 'General case' 0 C--O 1.231 0.079 0 C-N-CA 123.662 0.785 . . . . 0.0 112.731 173.915 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 105' ' ' LYS . . . . . . . . . . . . . 1.6 mmpm? -62.84 -80.57 0.03 OUTLIER 'General case' 0 N--CA 1.455 -0.179 0 CA-C-N 118.545 0.611 . . . . 0.0 111.178 172.635 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 106' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -150.38 -172.73 4.25 Favored 'General case' 0 N--CA 1.453 -0.304 0 C-N-CA 125.812 1.645 . . . . 0.0 108.241 -164.523 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 107' ' ' THR . . . . . . . . . . . . . 15.3 t -144.36 145.78 32.16 Favored 'General case' 0 N--CA 1.451 -0.389 0 C-N-CA 124.826 1.25 . . . . 0.0 108.303 -174.895 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 108' ' ' LEU . . . . . . . . . . . . . 4.2 mp -134.4 162.16 32.99 Favored 'General case' 0 N--CA 1.449 -0.491 0 C-N-CA 128.018 2.527 . . . . 0.0 108.725 -165.788 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 109' ' ' THR . . . . . . . . . . . . . 57.8 m -133.66 110.3 9.77 Favored 'General case' 0 C--N 1.329 -0.315 0 N-CA-C 107.744 -1.206 . . . . 0.0 107.744 171.455 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 110' ' ' TYR . . . . . . . . . . . . . 95.2 m-85 -98.93 161.4 13.65 Favored 'General case' 0 N--CA 1.453 -0.301 0 N-CA-C 108.608 -0.886 . . . . 0.0 108.608 167.787 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 111' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -123.06 133.36 54.32 Favored 'General case' 0 CA--C 1.517 -0.316 0 CA-C-O 117.964 -1.017 . . . . 0.0 108.338 -175.614 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 112' ' ' LEU . . . . . . . . . . . . . 28.0 tp -58.8 103.47 0.17 Allowed 'General case' 0 C--O 1.232 0.175 0 N-CA-C 107.018 -1.475 . . . . 0.0 107.018 167.567 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 113' ' ' ALA . . . . . . . . . . . . . . . -147.17 77.03 1.44 Allowed 'General case' 0 C--N 1.33 -0.275 0 N-CA-C 107.267 -1.383 . . . . 0.0 107.267 -175.577 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 114' ' ' ASP . . . . . . . . . . . . 0.251 56.9 p30 -103.46 58.21 0.75 Allowed 'General case' 0 C--N 1.331 -0.199 0 CA-C-O 124.205 1.955 . . . . 0.0 112.02 -173.927 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 115' ' ' LEU . . . . . 0.415 ' H ' HD23 ' A' ' 115' ' ' LEU . 0.0 OUTLIER -64.6 3.83 0.46 Allowed 'General case' 0 CA--C 1.535 0.403 0 C-N-CA 128.659 2.784 . . . . 0.0 113.861 170.875 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 116' ' ' MET . . . . . . . . . . . . . 7.5 ttp -166.08 143.84 5.51 Favored 'General case' 0 N--CA 1.443 -0.824 0 C-N-CA 130.545 3.538 . . . . 0.0 105.571 176.63 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 117' ' ' ASN . . . . . . . . . . . . . 0.7 OUTLIER . . . . . 0 CA--C 1.532 0.279 0 C-N-CA 124.602 1.161 . . . . 0.0 109.865 -175.95 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 11.6 ttp . . . . . 0 CA--C 1.534 0.346 0 N-CA-C 113.226 0.825 . . . . 0.0 113.226 . . . . . . . . . 0 0 . 1 . 009 nuclear nobuild full ' A' A ' 2' ' ' VAL . . . . . 0.432 HG22 HD11 ' A' ' 7' ' ' LEU . 7.1 p 42.96 66.85 0.12 Allowed 'Isoleucine or valine' 0 C--N 1.334 -0.109 0 C-N-CA 124.744 1.218 . . . . 0.0 111.233 145.581 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 3' ' ' THR . . . . . . . . . . . . . 71.5 p -79.86 161.72 65.12 Favored Pre-proline 0 C--N 1.328 -0.363 0 C-N-CA 118.034 -1.466 . . . . 0.0 108.976 -167.599 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 4' ' ' PRO . . . . . . . . . . . . . 15.7 Cg_endo -54.37 -42.3 68.94 Favored 'Trans proline' 0 CA--C 1.532 0.411 0 C-N-CA 122.236 1.957 . . . . 0.0 112.644 175.066 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 5' ' ' GLU . . . . . . . . . . . . . 1.2 tm-20 -51.13 -60.61 2.91 Favored 'General case' 0 C--N 1.329 -0.322 0 C-N-CA 126.068 1.747 . . . . 0.0 111.539 -175.951 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 6' ' ' GLN . . . . . . . . . . . . . 18.1 pt20 -66.03 15.42 0.03 OUTLIER 'General case' 0 CA--C 1.54 0.558 0 C-N-CA 127.333 2.253 . . . . 0.0 114.242 -177.711 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 7' ' ' LEU . . . . . 0.432 HD11 HG22 ' A' ' 2' ' ' VAL . 67.3 mt -133.93 -48.03 0.8 Allowed 'General case' 0 CA--C 1.522 -0.115 0 C-N-CA 125.345 1.458 . . . . 0.0 111.254 -172.57 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 8' ' ' GLN . . . . . . . . . . . . . 17.5 mt-30 -57.74 -4.1 0.26 Allowed 'General case' 0 CA--C 1.543 0.701 0 N-CA-C 115.681 1.734 . . . . 0.0 115.681 -179.54 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 9' ' ' HIS . . . . . . . . . . . . . 9.4 m-70 -133.26 15.4 4.15 Favored 'General case' 0 CA--C 1.538 0.511 0 C-N-CA 124.569 1.148 . . . . 0.0 112.624 174.333 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 10' ' ' HIS . . . . . . . . . . . . . 63.8 m-70 -130.55 109.99 11.09 Favored 'General case' 0 CA--C 1.539 0.554 0 C-N-CA 125.136 1.374 . . . . 0.0 109.885 -169.118 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 11' ' ' ARG . . . . . . . . . . . . . 32.3 ttt180 -68.64 150.69 47.66 Favored 'General case' 0 N--CA 1.474 0.732 0 C-N-CA 125.231 1.412 . . . . 0.0 110.765 175.127 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 12' ' ' PHE . . . . . . . . . . . . . 23.0 m-85 -136.48 157.55 46.52 Favored 'General case' 0 N--CA 1.451 -0.411 0 CA-C-O 121.693 0.758 . . . . 0.0 109.3 169.351 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 13' ' ' VAL . . . . . . . . . . . . . 11.4 p -132.97 150.59 33.04 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.336 0 O-C-N 120.992 -1.068 . . . . 0.0 109.958 175.754 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 14' ' ' LEU . . . . . . . . . . . . . 30.6 tp -80.1 97.57 6.91 Favored 'General case' 0 N--CA 1.454 -0.258 0 N-CA-C 108.001 -1.111 . . . . 0.0 108.001 177.53 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 3.1 mm-40 -68.24 -55.96 10.38 Favored 'General case' 0 C--N 1.323 -0.546 0 C-N-CA 125.184 1.393 . . . . 0.0 109.584 172.737 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 6.1 p -148.56 164.53 33.96 Favored 'General case' 0 N--CA 1.449 -0.478 0 CA-C-O 122.445 1.117 . . . . 0.0 110.219 -175.75 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 17' ' ' VAL . . . . . 0.463 HG12 ' H ' ' A' ' 18' ' ' ASN . 1.7 t -109.78 -164.64 0.21 Allowed 'Isoleucine or valine' 0 N--CA 1.445 -0.681 0 N-CA-C 104.892 -2.262 . . . . 0.0 104.892 -172.07 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 18' ' ' ASN . . . . . 0.463 ' H ' HG12 ' A' ' 17' ' ' VAL . 2.0 p-10 -44.47 -38.48 4.12 Favored 'General case' 0 CA--C 1.538 0.482 0 C-N-CA 126.902 2.081 . . . . 0.0 113.485 -171.465 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . -141.78 -44.89 0.06 OUTLIER Glycine 0 CA--C 1.523 0.543 0 C-N-CA 125.22 1.39 . . . . 0.0 110.539 169.616 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 0.5 OUTLIER -81.14 158.07 70.2 Favored Pre-proline 0 CA--C 1.534 0.336 0 C-N-CA 123.857 0.863 . . . . 0.0 111.472 -170.11 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 21' ' ' PRO . . . . . . . . . . . . . 80.2 Cg_endo -79.21 172.58 14.52 Favored 'Trans proline' 0 N--CA 1.457 -0.655 0 C-N-CA 123.223 2.615 . . . . 0.0 110.954 178.803 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 22' ' ' VAL . . . . . . . . . . . . . 88.7 t -94.81 157.17 3.08 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.422 0 N-CA-C 107.691 -1.226 . . . . 0.0 107.691 162.938 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 23' ' ' THR . . . . . . . . . . . . . 7.5 p -134.58 87.83 2.39 Favored 'General case' 0 N--CA 1.444 -0.75 0 N-CA-C 107.35 -1.352 . . . . 0.0 107.35 166.513 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 24' ' ' SER . . . . . 0.458 ' HB3' ' HA ' ' A' ' 28' ' ' PRO . 0.6 OUTLIER -159.89 135.19 8.16 Favored 'General case' 0 N--CA 1.447 -0.612 0 N-CA-C 105.669 -1.975 . . . . 0.0 105.669 172.234 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 25' ' ' ASP . . . . . . . . . . . . . 54.9 t0 -136.41 -42.18 0.63 Allowed 'General case' 0 C--N 1.324 -0.523 0 C-N-CA 126.678 1.991 . . . . 0.0 108.959 -174.086 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 26' ' ' LYS . . . . . . . . . . . . . 17.9 pttt -48.45 -45.98 37.25 Favored 'General case' 0 CA--C 1.516 -0.349 0 C-N-CA 125.496 1.518 . . . . 0.0 111.797 177.79 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 27' ' ' ASN . . . . . . . . . . . . . 0.2 OUTLIER -162.14 87.07 1.49 Allowed Pre-proline 0 C--N 1.325 -0.486 0 C-N-CA 130.022 3.329 . . . . 0.0 107.443 174.319 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 28' ' ' PRO . . . . . 0.458 ' HA ' ' HB3' ' A' ' 24' ' ' SER . 17.0 Cg_endo -60.03 162.2 17.1 Favored 'Trans proline' 0 C--N 1.349 0.583 0 C-N-CA 122.972 2.448 . . . . 0.0 113.737 177.154 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 29' ' ' PRO . . . . . . . . . . . . . 17.9 Cg_endo -60.69 103.15 0.21 Allowed 'Trans proline' 0 N--CA 1.445 -1.359 0 C-N-CA 122.104 1.869 . . . . 0.0 108.401 152.388 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 30' ' ' GLU . . . . . . . . . . . . . 20.2 pt-20 -126.11 170.27 11.94 Favored 'General case' 0 C--N 1.323 -0.584 0 C-N-CA 125.578 1.551 . . . . 0.0 109.708 -179.905 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 31' ' ' ILE . . . . . 0.501 HD11 ' CG2' ' A' ' 39' ' ' ILE . 15.7 tt -141.15 157.02 22.24 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.412 0 N-CA-C 107.883 -1.154 . . . . 0.0 107.883 177.66 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 32' ' ' SER . . . . . . . . . . . . . 8.2 t -149.84 171.92 15.99 Favored 'General case' 0 C--N 1.323 -0.572 0 N-CA-C 106.64 -1.615 . . . . 0.0 106.64 166.2 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 33' ' ' PHE . . . . . . . . . . . . . 67.5 m-85 -141.07 168.21 20.34 Favored 'General case' 0 N--CA 1.447 -0.583 0 C-N-CA 124.004 0.921 . . . . 0.0 109.415 -173.895 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 34' ' ' GLY . . . . . . . . . . . . . . . -168.6 -165.0 25.26 Favored Glycine 0 C--N 1.332 0.345 0 C-N-CA 125.549 1.547 . . . . 0.0 109.332 168.092 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 35' ' ' GLU . . . . . . . . . . . . . 1.1 tm-20 -47.33 156.89 0.23 Allowed 'General case' 0 C--N 1.326 -0.445 0 C-N-CA 126.961 2.104 . . . . 0.0 112.96 -171.222 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 29.6 mtmm 52.59 26.52 4.39 Favored 'General case' 0 CA--C 1.531 0.221 0 C-N-CA 124.606 1.162 . . . . 0.0 112.015 -164.193 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 37' ' ' MET . . . . . . . . . . . . . 10.4 mmm 56.91 26.45 11.73 Favored 'General case' 0 CA--C 1.54 0.594 0 C-N-CA 124.3 1.04 . . . . 0.0 109.885 178.873 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 38' ' ' MET . . . . . . . . . . . . . 19.0 mtp -54.67 151.47 8.15 Favored 'General case' 0 N--CA 1.45 -0.437 0 C-N-CA 123.798 0.839 . . . . 0.0 110.113 176.473 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 39' ' ' ILE . . . . . 0.501 ' CG2' HD11 ' A' ' 31' ' ' ILE . 9.8 mt -134.13 116.22 22.5 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.465 0 N-CA-C 105.101 -2.185 . . . . 0.0 105.101 -176.664 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 40' ' ' SER . . . . . . . . . . . . . 66.8 m -141.7 119.63 11.96 Favored 'General case' 0 C--N 1.328 -0.33 0 N-CA-C 108.418 -0.956 . . . . 0.0 108.418 -172.479 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 41' ' ' GLY . . . . . . . . . . . . . . . -156.84 -165.36 14.73 Favored Glycine 0 CA--C 1.525 0.663 0 C-N-CA 124.42 1.009 . . . . 0.0 111.565 -171.111 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 42' ' ' SER . . . . . . . . . . . . . 28.7 t -157.43 123.37 4.74 Favored 'General case' 0 CA--C 1.511 -0.524 0 O-C-N 121.808 -0.819 . . . . 0.0 108.942 165.792 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 43' ' ' MET . . . . . . . . . . . . . 5.1 mmm -86.65 -43.15 12.86 Favored 'General case' 0 N--CA 1.45 -0.448 0 O-C-N 124.15 0.906 . . . . 0.0 111.18 160.142 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 44' ' ' CYS . . . . . 1.28 ' SG ' ' SG ' ' A' ' 70' ' ' CYS . 54.0 t -157.15 -71.23 0.1 Allowed 'General case' 0 CA--C 1.534 0.346 0 N-CA-C 107.413 -1.329 . . . . 0.0 107.413 177.907 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 45' ' ' ASN . . . . . . . . . . . . . 33.2 m-80 -77.66 26.81 0.17 Allowed 'General case' 0 N--CA 1.472 0.653 0 C-N-CA 127.488 2.315 . . . . 0.0 113.19 -179.054 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 46' ' ' ARG . . . . . . . . . . . . . 34.3 mtp85 53.08 -170.15 0.04 OUTLIER 'General case' 0 C--N 1.332 -0.194 0 C-N-CA 125.972 1.709 . . . . 0.0 108.973 -169.51 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 47' ' ' PHE . . . . . . . . . . . . . 29.6 p90 -178.99 153.11 0.6 Allowed 'General case' 0 C--O 1.238 0.493 0 C-N-CA 126.764 2.025 . . . . 0.0 108.516 160.753 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 48' ' ' SER . . . . . . . . . . . . . 6.3 p -163.93 143.13 7.85 Favored 'General case' 0 N--CA 1.449 -0.518 0 CA-C-O 117.695 -1.145 . . . . 0.0 110.669 179.184 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 49' ' ' GLY . . . . . . . . . . . . . . . -177.6 163.66 32.26 Favored Glycine 0 C--N 1.337 0.614 0 CA-C-N 119.647 1.112 . . . . 0.0 110.864 177.541 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 50' ' ' GLU . . . . . . . . . . . . . 38.1 mt-10 -75.84 100.45 4.78 Favored 'General case' 0 C--O 1.235 0.315 0 N-CA-C 109.241 -0.651 . . . . 0.0 109.241 173.902 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 51' ' ' GLY . . . . . . . . . . . . . . . -66.17 166.81 36.66 Favored Glycine 0 CA--C 1.529 0.921 0 CA-C-O 121.87 0.706 . . . . 0.0 112.343 170.199 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 52' ' ' LYS . . . . . . . . . . . . . 0.5 OUTLIER -132.71 143.16 49.43 Favored 'General case' 0 C--N 1.328 -0.356 0 C-N-CA 126.422 1.889 . . . . 0.0 107.301 165.982 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 53' ' ' LEU . . . . . . . . . . . . . 32.8 tp -156.66 151.77 26.3 Favored 'General case' 0 C--O 1.235 0.292 0 C-N-CA 126.286 1.834 . . . . 0.0 107.508 176.144 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 11.7 t -161.66 -24.26 0.05 Allowed 'General case' 0 CA--C 1.538 0.5 0 C-N-CA 124.818 1.247 . . . . 0.0 111.424 173.72 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 55' ' ' ASN . . . . . . . . . . . . . 17.8 p-10 -153.71 28.53 0.48 Allowed 'General case' 0 CA--C 1.54 0.562 0 C-N-CA 126.332 1.853 . . . . 0.0 112.304 -148.367 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 56' ' ' GLY . . . . . . . . . . . . . . . 71.89 27.12 71.2 Favored Glycine 0 CA--C 1.534 1.221 0 O-C-N 120.918 -1.114 . . . . 0.0 112.271 -177.721 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 57' ' ' GLU . . . . . . . . . . . . . 29.8 tt0 -135.02 142.83 46.5 Favored 'General case' 0 CA--C 1.533 0.303 0 N-CA-C 107.929 -1.138 . . . . 0.0 107.929 173.403 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 58' ' ' LEU . . . . . . . . . . . . . 31.7 tp -134.33 101.66 5.08 Favored 'General case' 0 C--O 1.234 0.287 0 C-N-CA 125.805 1.642 . . . . 0.0 109.403 -172.467 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 59' ' ' THR . . . . . . . . . . . . . 4.4 p -106.02 145.22 31.65 Favored 'General case' 0 C--N 1.328 -0.342 0 C-N-CA 124.345 1.058 . . . . 0.0 109.854 175.213 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 60' ' ' ALA . . . . . . . . . . . . . . . -95.41 130.06 42.34 Favored 'General case' 0 CA--C 1.531 0.225 0 C-N-CA 124.548 1.139 . . . . 0.0 110.202 169.781 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 61' ' ' LYS . . . . . . . . . . . . . 18.4 tttt -79.8 -15.23 57.85 Favored 'General case' 0 N--CA 1.473 0.684 0 N-CA-C 113.852 1.056 . . . . 0.0 113.852 177.853 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 62' ' ' GLY . . . . . . . . . . . . . . . 169.75 123.64 0.69 Allowed Glycine 0 C--N 1.332 0.33 0 N-CA-C 108.579 -1.808 . . . . 0.0 108.579 -178.86 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 63' ' ' LEU . . . . . . . . . . . . . 0.9 OUTLIER -128.26 94.24 3.85 Favored 'General case' 0 N--CA 1.45 -0.45 0 C-N-CA 124.769 1.228 . . . . 0.0 110.599 -151.971 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 64' ' ' ALA . . . . . . . . . . . . . . . -78.74 109.39 12.93 Favored 'General case' 0 C--O 1.236 0.361 0 C-N-CA 124.136 0.975 . . . . 0.0 111.601 -172.018 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 65' ' ' MET . . . . . . . . . . . . . 67.3 mtp -120.63 159.62 24.92 Favored 'General case' 0 CA--C 1.537 0.459 0 C-N-CA 124.24 1.016 . . . . 0.0 110.217 176.993 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 66' ' ' THR . . . . . . . . . . . . . 28.3 p -100.09 -164.89 1.16 Allowed 'General case' 0 CA--C 1.543 0.704 0 C-N-CA 125.444 1.498 . . . . 0.0 111.953 -169.379 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 67' ' ' ARG . . . . . . . . . . . . . 5.7 mmm180 -133.36 68.3 1.5 Allowed 'General case' 0 N--CA 1.471 0.597 0 C-N-CA 125.467 1.507 . . . . 0.0 109.968 -178.855 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 68' ' ' MET . . . . . . . . . . . . . 27.2 ptm -133.53 -172.22 2.91 Favored 'General case' 0 CA--C 1.538 0.506 0 C-N-CA 127.147 2.179 . . . . 0.0 110.369 -175.307 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 69' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -138.69 176.87 8.32 Favored 'General case' 0 C--O 1.236 0.35 0 C-N-CA 125.575 1.55 . . . . 0.0 110.061 -173.815 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 70' ' ' CYS . . . . . 1.28 ' SG ' ' SG ' ' A' ' 44' ' ' CYS . 60.2 m -138.05 4.88 2.53 Favored 'General case' 0 CA--C 1.54 0.582 0 N-CA-C 114.409 1.263 . . . . 0.0 114.409 -175.392 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 71' ' ' ALA . . . . . . . . . . . . . . . 58.61 3.98 0.33 Allowed 'General case' 0 N--CA 1.472 0.665 0 C-N-CA 125.743 1.617 . . . . 0.0 113.983 -177.057 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 72' ' ' ASN . . . . . . . . . . . . . 43.3 t-20 -143.19 142.05 20.75 Favored Pre-proline 0 C--O 1.238 0.498 0 N-CA-C 106.684 -1.599 . . . . 0.0 106.684 172.645 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 73' ' ' PRO . . . . . . . . . . . . . 37.3 Cg_endo -78.71 -27.65 4.77 Favored 'Trans proline' 0 C--O 1.221 -0.363 0 C-N-CA 121.564 1.509 . . . . 0.0 113.041 -169.189 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 74' ' ' GLN . . . . . . . . . . . . . 41.0 tt0 -51.43 -46.44 62.96 Favored 'General case' 0 N--CA 1.47 0.569 0 CA-C-N 119.501 1.046 . . . . 0.0 111.486 -177.435 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 75' ' ' LEU . . . . . . . . . . . . . 49.9 mt -70.02 -36.83 75.38 Favored 'General case' 0 C--N 1.329 -0.309 0 C-N-CA 124.914 1.286 . . . . 0.0 110.906 -178.286 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 76' ' ' ASN . . . . . . . . . . . . . 1.0 OUTLIER -78.9 2.11 21.28 Favored 'General case' 0 CA--C 1.541 0.599 0 C-N-CA 127.179 2.191 . . . . 0.0 112.325 178.046 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 77' ' ' GLU . . . . . . . . . . . . . 1.5 mm-40 -109.47 -39.82 5.06 Favored 'General case' 0 C--N 1.331 -0.212 0 C-N-CA 127.421 2.288 . . . . 0.0 108.338 173.819 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 78' ' ' LEU . . . . . . . . . . . . . 55.8 mt -56.29 -27.4 55.31 Favored 'General case' 0 C--N 1.343 0.319 0 C-N-CA 122.881 0.472 . . . . 0.0 110.653 168.285 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 79' ' ' ASP . . . . . . . . . . . . . 0.0 OUTLIER -63.76 -13.57 44.95 Favored 'General case' 0 CA--C 1.539 0.541 0 C-N-CA 126.3 1.84 . . . . 0.0 112.653 177.369 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 80' ' ' ASN . . . . . . . . . . . . . 67.8 m-20 -105.54 -44.84 4.59 Favored 'General case' 0 N--CA 1.465 0.277 0 C-N-CA 124.478 1.111 . . . . 0.0 109.962 169.452 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 81' ' ' THR . . . . . . . . . . . . . 85.9 m -44.59 -70.16 0.11 Allowed 'General case' 0 CA--C 1.535 0.38 0 C-N-CA 125.836 1.654 . . . . 0.0 111.273 -179.143 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 82' ' ' ILE . . . . . . . . . . . . . 8.2 tp -72.37 -29.72 32.5 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.347 0 O-C-N 121.428 -0.795 . . . . 0.0 111.088 -167.072 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 83' ' ' SER . . . . . . . . . . . . . 30.0 t -52.68 -60.09 3.67 Favored 'General case' 0 C--O 1.236 0.38 0 C-N-CA 124.735 1.214 . . . . 0.0 109.409 171.096 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 84' ' ' GLU . . . . . . . . . . . . . 30.8 tp10 -67.97 -39.03 83.42 Favored 'General case' 0 N--CA 1.449 -0.482 0 CA-C-O 118.209 -0.901 . . . . 0.0 110.875 -173.216 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 85' ' ' MET . . . . . . . . . . . . . 78.6 mtp -60.58 -42.78 97.4 Favored 'General case' 0 N--CA 1.464 0.275 0 CA-C-O 122.402 1.096 . . . . 0.0 109.309 -176.136 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 86' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -75.95 -23.71 55.4 Favored 'General case' 0 C--N 1.33 -0.257 0 C-N-CA 124.262 1.025 . . . . 0.0 111.722 -178.643 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 87' ' ' LYS . . . . . . . . . . . . . 3.0 tppt? -75.96 -52.29 10.58 Favored 'General case' 0 N--CA 1.441 -0.886 0 C-N-CA 124.589 1.156 . . . . 0.0 109.188 177.847 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 88' ' ' GLU . . . . . . . . . . . . . 17.3 pt-20 -64.95 -38.78 92.1 Favored 'General case' 0 CA--C 1.539 0.546 0 CA-C-O 118.927 -0.559 . . . . 0.0 110.536 178.124 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 89' ' ' GLY . . . . . . . . . . . . . . . 120.15 105.75 2.08 Favored Glycine 0 C--N 1.339 0.746 0 C-N-CA 126.743 2.116 . . . . 0.0 108.732 173.161 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 90' ' ' ALA . . . . . 0.426 ' HB1' HD13 ' A' ' 101' ' ' LEU . . . -77.18 133.29 38.97 Favored 'General case' 0 N--CA 1.448 -0.541 0 CA-C-O 118.457 -0.783 . . . . 0.0 109.566 -176.072 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 91' ' ' GLN . . . . . . . . . . . . . 59.1 mm-40 -65.21 139.2 58.63 Favored 'General case' 0 C--O 1.239 0.503 0 N-CA-C 105.099 -2.185 . . . . 0.0 105.099 152.533 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 92' ' ' VAL . . . . . . . . . . . . . 10.4 p -135.78 134.48 51.25 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.56 0 N-CA-C 106.154 -1.795 . . . . 0.0 106.154 -176.448 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 93' ' ' ASP . . . . . . . . . . . . . 0.7 OUTLIER -142.09 91.88 2.38 Favored 'General case' 0 N--CA 1.452 -0.373 0 N-CA-C 107.911 -1.144 . . . . 0.0 107.911 -170.442 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 94' ' ' LEU . . . . . 0.403 ' H ' ' HB ' ' A' ' 2' ' ' VAL . 0.4 OUTLIER -96.91 109.49 22.2 Favored 'General case' 0 C--O 1.235 0.31 0 N-CA-C 106.922 -1.51 . . . . 0.0 106.922 174.395 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 95' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -70.13 -163.77 0.07 Allowed 'General case' 0 CA--C 1.542 0.664 0 N-CA-C 108.173 -1.047 . . . . 0.0 108.173 166.139 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 96' ' ' ALA . . . . . . . . . . . . . . . -56.97 -27.86 61.73 Favored 'General case' 0 CA--C 1.536 0.437 0 O-C-N 119.291 -2.131 . . . . 0.0 113.138 -178.616 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 97' ' ' ASN . . . . . . . . . . . . . 28.4 p30 -167.41 18.69 0.03 OUTLIER 'General case' 0 CA--C 1.539 0.538 0 C-N-CA 124.072 0.949 . . . . 0.0 112.705 -168.766 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 98' ' ' GLN . . . . . . . . . . . . . 2.3 tt0 -130.93 124.35 30.88 Favored 'General case' 0 N--CA 1.47 0.527 0 CA-C-N 120.297 1.408 . . . . 0.0 107.724 169.997 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 99' ' ' LEU . . . . . 0.433 ' HB3' ' HB2' ' A' ' 110' ' ' TYR . 15.3 tp -86.13 139.89 30.69 Favored 'General case' 0 C--O 1.233 0.185 0 C-N-CA 124.238 1.015 . . . . 0.0 109.519 170.109 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 100' ' ' THR . . . . . . . . . . . . . 15.8 m -123.38 126.17 46.34 Favored 'General case' 0 C--N 1.322 -0.592 0 C-N-CA 126.308 1.843 . . . . 0.0 107.127 171.346 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 101' ' ' LEU . . . . . 0.426 HD13 ' HB1' ' A' ' 90' ' ' ALA . 0.7 OUTLIER -114.23 135.45 54.04 Favored 'General case' 0 C--N 1.334 -0.071 0 C-N-CA 127.502 2.321 . . . . 0.0 106.04 167.9 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 102' ' ' ALA . . . . . . . . . . . . . . . -157.23 82.5 0.92 Allowed 'General case' 0 CA--C 1.536 0.417 0 CA-C-N 120.057 1.299 . . . . 0.0 111.325 178.852 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 103' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -98.87 171.01 8.34 Favored 'General case' 0 C--O 1.236 0.374 0 C-N-CA 125.947 1.699 . . . . 0.0 110.392 179.867 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 104' ' ' ALA . . . . . . . . . . . . . . . -56.16 -28.14 56.93 Favored 'General case' 0 C--O 1.233 0.213 0 CA-C-O 118.466 -0.778 . . . . 0.0 112.239 176.705 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 105' ' ' LYS . . . . . . . . . . . . . 32.8 mmtt -58.81 -80.5 0.02 OUTLIER 'General case' 0 CA--C 1.531 0.24 0 CA-C-N 119.244 0.929 . . . . 0.0 110.927 165.345 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 106' ' ' GLN . . . . . . . . . . . . . 7.1 mt-30 -157.0 -170.36 3.26 Favored 'General case' 0 CA--C 1.536 0.428 0 C-N-CA 125.098 1.359 . . . . 0.0 109.803 -173.136 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 107' ' ' THR . . . . . . . . . . . . . 3.4 t -130.32 140.4 50.64 Favored 'General case' 0 CA--C 1.537 0.444 0 C-N-CA 126.376 1.87 . . . . 0.0 108.29 -174.949 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 108' ' ' LEU . . . . . . . . . . . . . 4.8 mp -134.09 153.16 51.99 Favored 'General case' 0 C--O 1.235 0.325 0 C-N-CA 130.097 3.359 . . . . 0.0 108.461 -172.665 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 109' ' ' THR . . . . . . . . . . . . . 7.1 m -138.6 96.97 3.25 Favored 'General case' 0 CA--C 1.539 0.534 0 N-CA-C 109.419 -0.586 . . . . 0.0 109.419 -175.771 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 110' ' ' TYR . . . . . 0.433 ' HB2' ' HB3' ' A' ' 99' ' ' LEU . 66.9 m-85 -99.08 155.83 17.25 Favored 'General case' 0 N--CA 1.464 0.259 0 C-N-CA 124.056 0.943 . . . . 0.0 110.712 -175.244 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 111' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -114.5 145.21 42.19 Favored 'General case' 0 C--N 1.331 -0.199 0 C-N-CA 125.703 1.601 . . . . 0.0 108.758 -171.487 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 112' ' ' LEU . . . . . . . . . . . . . 54.4 tp -75.62 60.98 1.29 Allowed 'General case' 0 CA--C 1.534 0.36 0 C-N-CA 127.957 2.503 . . . . 0.0 108.396 175.558 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 113' ' ' ALA . . . . . . . . . . . . . . . -93.31 94.69 8.89 Favored 'General case' 0 N--CA 1.448 -0.544 0 N-CA-C 106.189 -1.782 . . . . 0.0 106.189 177.299 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 114' ' ' ASP . . . . . . . . . . . . . 37.9 t0 -128.35 45.57 2.74 Favored 'General case' 0 CA--C 1.515 -0.39 0 CA-C-O 121.62 0.724 . . . . 0.0 110.993 -178.927 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 115' ' ' LEU . . . . . . . . . . . . . 19.0 mt 60.15 13.01 3.57 Favored 'General case' 0 CA--C 1.534 0.334 0 C-N-CA 124.817 1.247 . . . . 0.0 113.008 167.88 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 116' ' ' MET . . . . . . . . . . . . . 0.5 OUTLIER -114.88 112.03 22.11 Favored 'General case' 0 N--CA 1.449 -0.49 0 C-N-CA 125.058 1.343 . . . . 0.0 107.797 -172.221 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 117' ' ' ASN . . . . . . . . . . . . . 55.2 m-20 . . . . . 0 C--O 1.234 0.288 0 C-N-CA 124.222 1.009 . . . . 0.0 110.45 -169.774 . . . . . . . . 0 0 . 1 . 010 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 4.4 ptm . . . . . 0 CA--C 1.535 0.391 0 CA-C-O 121.471 0.653 . . . . 0.0 111.065 . . . . . . . . . 0 0 . 1 . 010 nuclear nobuild full ' A' A ' 2' ' ' VAL . . . . . . . . . . . . . 14.6 p -61.92 155.24 4.73 Favored 'Isoleucine or valine' 0 CA--C 1.54 0.561 0 C-N-CA 125.622 1.569 . . . . 0.0 111.127 175.575 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 3' ' ' THR . . . . . 0.41 ' HB ' ' HD2' ' A' ' 4' ' ' PRO . 31.5 p -124.45 163.8 34.26 Favored Pre-proline 0 CA--C 1.535 0.368 0 C-N-CA 124.292 1.037 . . . . 0.0 108.64 173.269 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 4' ' ' PRO . . . . . 0.41 ' HD2' ' HB ' ' A' ' 3' ' ' THR . 57.9 Cg_endo -67.38 -34.8 25.7 Favored 'Trans proline' 0 N--CA 1.459 -0.5 0 C-N-CA 121.524 1.483 . . . . 0.0 111.046 170.066 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 5' ' ' GLU . . . . . . . . . . . . . 28.6 tt0 -56.14 -54.64 42.69 Favored 'General case' 0 C--N 1.328 -0.338 0 C-N-CA 125.005 1.322 . . . . 0.0 109.992 -174.918 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 6' ' ' GLN . . . . . 0.752 HE21 HD23 ' A' ' 94' ' ' LEU . 21.7 pt20 -63.87 6.4 0.17 Allowed 'General case' 0 CA--C 1.536 0.412 0 C-N-CA 125.318 1.447 . . . . 0.0 114.314 -179.48 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 7' ' ' LEU . . . . . 0.631 HD21 HD22 ' A' ' 94' ' ' LEU . 95.4 mt -123.77 -50.91 1.83 Allowed 'General case' 0 N--CA 1.451 -0.416 0 C-N-CA 125.895 1.678 . . . . 0.0 110.02 -177.763 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 8' ' ' GLN . . . . . 0.464 ' HG2' ' CD2' ' A' ' 9' ' ' HIS . 0.0 OUTLIER -61.37 -6.22 2.13 Favored 'General case' 0 N--CA 1.468 0.471 0 N-CA-C 113.967 1.099 . . . . 0.0 113.967 -169.794 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 9' ' ' HIS . . . . . 0.464 ' CD2' ' HG2' ' A' ' 8' ' ' GLN . 16.8 m170 -124.6 9.68 8.38 Favored 'General case' 0 CA--C 1.543 0.705 0 C-N-CA 127.078 2.151 . . . . 0.0 110.301 -171.002 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 10' ' ' HIS . . . . . . . . . . . . . 94.5 m-70 -132.99 154.97 49.99 Favored 'General case' 0 C--O 1.236 0.389 0 CA-C-N 119.438 1.017 . . . . 0.0 111.614 -175.771 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 11' ' ' ARG . . . . . . . . . . . . . 63.4 ttt180 -96.9 147.03 24.38 Favored 'General case' 0 CA--C 1.513 -0.445 0 C-N-CA 124.525 1.13 . . . . 0.0 108.694 173.821 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 12' ' ' PHE . . . . . . . . . . . . . 60.2 m-85 -126.24 161.4 27.84 Favored 'General case' 0 N--CA 1.45 -0.468 0 N-CA-C 108.953 -0.758 . . . . 0.0 108.953 165.487 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 13' ' ' VAL . . . . . . . . . . . . . 8.8 p -129.6 155.48 41.36 Favored 'Isoleucine or valine' 0 CA--C 1.545 0.782 0 C-N-CA 125.333 1.453 . . . . 0.0 109.797 166.889 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 14' ' ' LEU . . . . . 0.53 ' HG ' HG21 ' A' ' 22' ' ' VAL . 1.3 tp -85.75 100.61 12.14 Favored 'General case' 0 N--CA 1.47 0.527 0 C-N-CA 125.519 1.528 . . . . 0.0 108.909 -175.673 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 4.9 tm-20 -88.45 -36.21 16.62 Favored 'General case' 0 CA--C 1.534 0.329 0 C-N-CA 122.653 0.381 . . . . 0.0 110.056 -174.006 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -152.12 146.26 25.36 Favored 'General case' 0 C--O 1.234 0.247 0 CA-C-O 122.656 1.217 . . . . 0.0 109.97 -177.907 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 17' ' ' VAL . . . . . 0.629 HG12 ' H ' ' A' ' 18' ' ' ASN . 3.0 t -79.65 -164.64 0.07 OUTLIER 'Isoleucine or valine' 0 CA--C 1.546 0.807 0 C-N-CA 126.071 1.748 . . . . 0.0 107.597 172.095 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 18' ' ' ASN . . . . . 0.629 ' H ' HG12 ' A' ' 17' ' ' VAL . 40.3 t30 -51.83 -9.54 0.09 Allowed 'General case' 0 CA--C 1.547 0.853 0 C-N-CA 127.731 2.413 . . . . 0.0 115.648 170.207 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . 156.9 32.2 0.02 OUTLIER Glycine 0 CA--C 1.524 0.594 0 O-C-N 120.92 -1.113 . . . . 0.0 112.373 -179.122 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 26.0 mttp -150.73 156.02 35.95 Favored Pre-proline 0 C--O 1.236 0.387 0 C-N-CA 126.975 2.11 . . . . 0.0 108.05 176.18 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 21' ' ' PRO . . . . . . . . . . . . . 72.7 Cg_endo -86.06 172.5 7.39 Favored 'Trans proline' 0 N--CA 1.448 -1.195 0 C-N-CA 122.212 1.942 . . . . 0.0 111.426 -179.498 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 22' ' ' VAL . . . . . 0.53 HG21 ' HG ' ' A' ' 14' ' ' LEU . 54.4 t -115.18 127.39 72.76 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.342 0 C-N-CA 125.192 1.397 . . . . 0.0 109.449 -166.76 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 23' ' ' THR . . . . . . . . . . . . . 2.5 p -105.61 95.71 6.0 Favored 'General case' 0 CA--C 1.534 0.351 0 C-N-CA 125.219 1.407 . . . . 0.0 111.506 -167.637 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 24' ' ' SER . . . . . . . . . . . . . 34.7 t -163.4 135.34 5.06 Favored 'General case' 0 N--CA 1.449 -0.476 0 N-CA-C 108.069 -1.086 . . . . 0.0 108.069 172.714 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 25' ' ' ASP . . . . . . . . . . . . . 13.6 m-20 -107.26 -3.47 19.72 Favored 'General case' 0 N--CA 1.472 0.666 0 C-N-CA 124.567 1.147 . . . . 0.0 112.111 166.478 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 26' ' ' LYS . . . . . . . . . . . . . 92.2 mttt -142.97 129.5 20.15 Favored 'General case' 0 C--N 1.345 0.376 0 O-C-N 120.162 -1.586 . . . . 0.0 110.04 -176.667 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 27' ' ' ASN . . . . . . . . . . . . . 2.4 m-80 45.53 68.07 3.67 Favored Pre-proline 0 CA--C 1.535 0.382 0 C-N-CA 125.634 1.574 . . . . 0.0 109.443 -179.979 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 28' ' ' PRO . . . . . . . . . . . . . 18.0 Cg_endo -63.79 172.76 5.41 Favored 'Trans proline' 0 C--O 1.236 0.387 0 C-N-CA 123.314 2.676 . . . . 0.0 112.37 -173.361 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 29' ' ' PRO . . . . . . . . . . . . . 42.2 Cg_endo -74.05 62.71 5.03 Favored 'Trans proline' 0 N--CA 1.454 -0.826 0 C-N-CA 121.333 1.355 . . . . 0.0 110.435 166.497 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 30' ' ' GLU . . . . . . . . . . . . . 0.3 OUTLIER -81.37 169.85 16.72 Favored 'General case' 0 CA--C 1.536 0.42 0 O-C-N 120.581 -1.325 . . . . 0.0 108.897 174.812 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 31' ' ' ILE . . . . . . . . . . . . . 7.5 tt -146.17 105.86 0.66 Allowed 'Isoleucine or valine' 0 N--CA 1.452 -0.328 0 N-CA-C 105.665 -1.976 . . . . 0.0 105.665 169.6 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 32' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER -80.45 129.66 34.65 Favored 'General case' 0 N--CA 1.445 -0.706 0 N-CA-C 106.604 -1.628 . . . . 0.0 106.604 160.17 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 33' ' ' PHE . . . . . . . . . . . . . 59.7 m-85 -93.42 156.44 16.77 Favored 'General case' 0 C--O 1.239 0.512 0 N-CA-C 106.803 -1.554 . . . . 0.0 106.803 158.673 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 34' ' ' GLY . . . . . . . . . . . . . . . -167.53 122.34 1.03 Allowed Glycine 0 C--O 1.219 -0.803 0 CA-C-O 117.107 -1.941 . . . . 0.0 109.713 -177.221 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 35' ' ' GLU . . . . . . . . . . . . . 1.8 tm-20 70.24 114.46 0.05 OUTLIER 'General case' 0 CA--C 1.542 0.659 0 CA-C-N 120.341 2.071 . . . . 0.0 111.436 178.986 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 44.9 mtmt 63.91 -50.21 0.26 Allowed 'General case' 0 N--CA 1.477 0.913 0 C-N-CA 130.578 3.551 . . . . 0.0 116.478 176.751 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 37' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER 171.27 8.18 0.0 OUTLIER 'General case' 0 CA--C 1.543 0.676 1 C-N-CA 132.347 4.259 . . . . 0.0 111.342 177.173 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 38' ' ' MET . . . . . . . . . . . . . 65.5 mmm -57.02 157.32 5.92 Favored 'General case' 0 N--CA 1.473 0.683 0 CA-C-N 120.667 1.576 . . . . 0.0 111.596 -169.478 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 39' ' ' ILE . . . . . . . . . . . . . 52.9 mt -124.57 124.91 69.23 Favored 'Isoleucine or valine' 0 C--O 1.235 0.327 0 C-N-CA 126.641 1.976 . . . . 0.0 106.662 -166.687 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 40' ' ' SER . . . . . . . . . . . . . 59.8 p -138.21 123.39 19.23 Favored 'General case' 0 C--O 1.241 0.635 0 C-N-CA 125.309 1.444 . . . . 0.0 108.334 177.554 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 41' ' ' GLY . . . . . . . . . . . . . . . -171.93 178.44 44.16 Favored Glycine 0 CA--C 1.529 0.926 0 CA-C-N 119.974 1.261 . . . . 0.0 112.959 -173.677 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 42' ' ' SER . . . . . . . . . . . . . 20.6 t -154.47 109.98 3.15 Favored 'General case' 0 C--O 1.236 0.393 0 O-C-N 121.622 -0.929 . . . . 0.0 109.859 169.012 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 43' ' ' MET . . . . . . . . . . . . . 15.3 mmt -65.91 -64.58 0.83 Allowed 'General case' 0 N--CA 1.455 -0.185 0 N-CA-C 106.998 -1.482 . . . . 0.0 106.998 159.597 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 44' ' ' CYS . . . . . 1.296 ' SG ' ' SG ' ' A' ' 70' ' ' CYS . 19.7 t -146.37 -61.99 0.31 Allowed 'General case' 0 N--CA 1.454 -0.253 0 N-CA-C 108.807 -0.812 . . . . 0.0 108.807 -178.245 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 45' ' ' ASN . . . . . . . . . . . . . 2.9 m120 -77.24 15.95 0.66 Allowed 'General case' 0 CA--C 1.544 0.738 0 C-N-CA 125.731 1.612 . . . . 0.0 113.139 -175.371 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 46' ' ' ARG . . . . . . . . . . . . . 1.2 mtt180 56.94 164.93 0.03 OUTLIER 'General case' 0 N--CA 1.472 0.644 0 C-N-CA 126.765 2.026 . . . . 0.0 113.164 -156.421 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 47' ' ' PHE . . . . . . . . . . . . . 39.1 p90 -160.65 166.04 29.54 Favored 'General case' 0 C--O 1.234 0.249 0 C-N-CA 124.152 0.981 . . . . 0.0 110.416 153.873 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 48' ' ' SER . . . . . . . . . . . . . 0.2 OUTLIER -167.92 162.41 13.47 Favored 'General case' 0 C--O 1.236 0.366 0 C-N-CA 124.305 1.042 . . . . 0.0 109.457 174.545 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 49' ' ' GLY . . . . . . . . . . . . . . . -176.66 173.74 46.51 Favored Glycine 0 CA--C 1.53 1.021 0 CA-C-N 119.925 1.239 . . . . 0.0 113.23 175.573 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 50' ' ' GLU . . . . . . . . . . . . . 47.1 mt-10 -79.31 94.09 5.41 Favored 'General case' 0 C--O 1.238 0.452 0 C-N-CA 125.008 1.323 . . . . 0.0 107.771 167.263 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 51' ' ' GLY . . . . . . . . . . . . . . . -69.59 164.39 51.02 Favored Glycine 0 C--O 1.238 0.375 0 N-CA-C 110.995 -0.842 . . . . 0.0 110.995 168.455 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 52' ' ' LYS . . . . . . . . . . . . . 2.0 tttp -162.6 151.34 14.82 Favored 'General case' 0 N--CA 1.457 -0.084 0 C-N-CA 123.378 0.671 . . . . 0.0 110.06 169.915 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 53' ' ' LEU . . . . . . . . . . . . . 23.6 tp -148.68 135.13 19.54 Favored 'General case' 0 C--N 1.333 -0.12 0 N-CA-C 107.04 -1.467 . . . . 0.0 107.04 174.731 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 2.8 t -157.42 11.57 0.21 Allowed 'General case' 0 CA--C 1.543 0.687 0 CA-C-N 118.435 0.562 . . . . 0.0 111.929 170.123 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 55' ' ' ASN . . . . . . . . . . . . . 40.1 p30 -151.83 -2.02 0.3 Allowed 'General case' 0 N--CA 1.471 0.61 0 N-CA-C 114.232 1.197 . . . . 0.0 114.232 -172.572 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 56' ' ' GLY . . . . . . . . . . . . . . . 107.39 -2.24 34.75 Favored Glycine 0 CA--C 1.532 1.139 0 C-N-CA 125.437 1.494 . . . . 0.0 113.574 -175.049 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 57' ' ' GLU . . . . . . . . . . . . . 28.0 tt0 -119.25 142.79 47.73 Favored 'General case' 0 CA--C 1.539 0.524 0 CA-C-N 118.678 1.239 . . . . 0.0 109.542 -177.215 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 58' ' ' LEU . . . . . . . . . . . . . 57.2 tp -117.6 122.84 44.68 Favored 'General case' 0 C--O 1.232 0.175 0 C-N-CA 126.086 1.754 . . . . 0.0 109.713 175.919 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 59' ' ' THR . . . . . . . . . . . . . 63.5 p -109.24 166.24 11.0 Favored 'General case' 0 CA--C 1.534 0.331 0 C-N-CA 124.223 1.009 . . . . 0.0 110.782 165.103 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 60' ' ' ALA . . . . . . . . . . . . . . . -129.76 86.32 2.4 Favored 'General case' 0 C--O 1.235 0.301 0 CA-C-O 122.415 1.102 . . . . 0.0 108.67 150.266 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 61' ' ' LYS . . . . . . . . . . . . . 74.7 tttt -74.85 100.02 3.95 Favored 'General case' 0 C--O 1.236 0.38 0 N-CA-C 107.601 -1.259 . . . . 0.0 107.601 168.18 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 62' ' ' GLY . . . . . . . . . . . . . . . 111.87 48.18 0.69 Allowed Glycine 0 CA--C 1.525 0.716 0 C-N-CA 124.105 0.859 . . . . 0.0 111.744 -176.638 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 63' ' ' LEU . . . . . . . . . . . . . 4.0 tp -67.33 168.57 10.37 Favored 'General case' 0 CA--C 1.539 0.542 0 C-N-CA 125.071 1.348 . . . . 0.0 110.516 172.654 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 64' ' ' ALA . . . . . . . . . . . . . . . -143.4 160.92 39.68 Favored 'General case' 0 C--N 1.329 -0.316 0 O-C-N 119.885 -1.76 . . . . 0.0 107.395 159.731 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 65' ' ' MET . . . . . . . . . . . . . 68.3 mtp -152.82 -171.39 3.92 Favored 'General case' 0 CA--C 1.54 0.56 0 C-N-CA 126.848 2.059 . . . . 0.0 107.777 179.38 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 66' ' ' THR . . . . . . . . . . . . . 0.9 OUTLIER -131.86 -164.87 1.5 Allowed 'General case' 0 CA--C 1.545 0.755 0 C-N-CA 124.239 1.016 . . . . 0.0 109.36 164.993 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 67' ' ' ARG . . . . . . . . . . . . . 3.1 ppt_? -125.11 52.56 1.58 Allowed 'General case' 0 N--CA 1.466 0.347 0 C-N-CA 124.964 1.306 . . . . 0.0 110.931 176.916 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 68' ' ' MET . . . . . . . . . . . . . 22.5 ptp -102.56 163.08 12.43 Favored 'General case' 0 CA--C 1.52 -0.207 0 O-C-N 121.29 -0.881 . . . . 0.0 109.205 167.007 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 69' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -124.42 155.67 38.45 Favored 'General case' 0 C--N 1.323 -0.582 0 C-N-CA 126.772 2.029 . . . . 0.0 108.316 -170.639 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 70' ' ' CYS . . . . . 1.296 ' SG ' ' SG ' ' A' ' 44' ' ' CYS . 1.6 p -116.67 160.59 20.49 Favored 'General case' 0 C--N 1.324 -0.541 0 C-N-CA 125.528 1.531 . . . . 0.0 110.097 -174.984 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 71' ' ' ALA . . . . . . . . . . . . . . . -78.96 16.86 0.82 Allowed 'General case' 0 CA--C 1.54 0.591 0 C-N-CA 124.29 1.036 . . . . 0.0 112.097 176.548 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 72' ' ' ASN . . . . . . . . . . . . . 17.3 t-20 -136.17 143.62 44.63 Favored Pre-proline 0 CA--C 1.534 0.348 0 O-C-N 120.509 -1.369 . . . . 0.0 108.464 -173.589 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 73' ' ' PRO . . . . . . . . . . . . . 48.4 Cg_endo -71.72 -52.63 0.2 Allowed 'Trans proline' 0 C--N 1.349 0.587 0 C-N-CA 122.965 2.443 . . . . 0.0 111.455 179.721 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 74' ' ' GLN . . . . . . . . . . . . . 45.7 tt0 -57.83 -45.31 86.36 Favored 'General case' 0 C--O 1.22 -0.498 0 C-N-CA 124.277 1.031 . . . . 0.0 109.798 -175.691 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 75' ' ' LEU . . . . . . . . . . . . . 98.2 mt -61.29 -39.16 89.43 Favored 'General case' 0 CA--C 1.535 0.371 0 CA-C-N 118.966 0.803 . . . . 0.0 111.106 -177.331 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 76' ' ' ASN . . . . . . . . . . . . . 1.4 m-80 -64.46 -50.47 67.37 Favored 'General case' 0 N--CA 1.468 0.426 0 C-N-CA 124.554 1.142 . . . . 0.0 110.018 174.749 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 77' ' ' GLU . . . . . . . . . . . . . 18.5 tt0 -54.08 -34.75 60.97 Favored 'General case' 0 CA--C 1.539 0.542 0 C-N-CA 126.0 1.72 . . . . 0.0 111.145 175.082 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 78' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -73.88 -20.74 60.32 Favored 'General case' 0 N--CA 1.446 -0.655 0 CA-C-O 116.836 -1.554 . . . . 0.0 112.696 -175.116 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 79' ' ' ASP . . . . . . . . . . . . . 0.0 OUTLIER -54.49 -45.45 73.25 Favored 'General case' 0 N--CA 1.471 0.617 0 CA-C-N 120.474 1.488 . . . . 0.0 110.433 176.23 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 80' ' ' ASN . . . . . . . . . . . . . 3.1 p30 -99.15 -23.78 15.11 Favored 'General case' 0 N--CA 1.441 -0.887 0 C-N-CA 124.402 1.081 . . . . 0.0 109.811 -168.013 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 81' ' ' THR . . . . . . . . . . . . . 15.3 m -57.44 -57.24 13.55 Favored 'General case' 0 CA--C 1.541 0.618 0 N-CA-C 109.157 -0.683 . . . . 0.0 109.157 161.539 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 82' ' ' ILE . . . . . . . . . . . . . 10.8 tp -66.38 -37.94 80.72 Favored 'Isoleucine or valine' 0 C--N 1.345 0.372 0 CA-C-N 119.855 1.207 . . . . 0.0 111.089 -172.107 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 83' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -57.21 -46.63 82.73 Favored 'General case' 0 CA--C 1.533 0.319 0 CA-C-N 119.236 0.926 . . . . 0.0 110.529 -176.053 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 84' ' ' GLU . . . . . . . . . . . . . 4.0 mt-10 -81.56 -5.24 57.81 Favored 'General case' 0 N--CA 1.448 -0.547 0 CA-C-O 118.448 -0.787 . . . . 0.0 112.864 179.536 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 85' ' ' MET . . . . . . . . . . . . . 90.0 mtp -90.71 -4.21 56.89 Favored 'General case' 0 CA--C 1.537 0.445 0 CA-C-N 120.07 1.305 . . . . 0.0 111.985 164.8 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 86' ' ' LEU . . . . . . . . . . . . . 3.4 mm? -113.13 -32.36 6.35 Favored 'General case' 0 C--N 1.333 -0.112 0 O-C-N 121.231 -0.918 . . . . 0.0 112.071 178.043 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 87' ' ' LYS . . . . . . . . . . . . . 76.9 mttt -72.14 -49.4 36.22 Favored 'General case' 0 N--CA 1.448 -0.554 0 CA-C-N 118.817 0.735 . . . . 0.0 110.501 -177.408 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 88' ' ' GLU . . . . . . . . . . . . . 7.3 mm-40 -80.81 -3.31 50.65 Favored 'General case' 0 CA--C 1.54 0.591 0 C-N-CA 126.097 1.759 . . . . 0.0 112.642 -174.87 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 89' ' ' GLY . . . . . . . . . . . . . . . 84.5 106.04 0.6 Allowed Glycine 0 CA--C 1.524 0.656 0 CA-C-N 120.137 1.335 . . . . 0.0 110.916 -179.762 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 90' ' ' ALA . . . . . . . . . . . . . . . -79.87 152.25 29.76 Favored 'General case' 0 CA--C 1.516 -0.33 0 N-CA-C 109.014 -0.736 . . . . 0.0 109.014 170.632 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 91' ' ' GLN . . . . . . . . . . . . . 93.2 mm-40 -73.62 141.75 46.55 Favored 'General case' 0 N--CA 1.442 -0.858 0 N-CA-C 105.398 -2.075 . . . . 0.0 105.398 156.206 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 92' ' ' VAL . . . . . . . . . . . . . 7.4 p -128.9 108.8 17.74 Favored 'Isoleucine or valine' 0 N--CA 1.443 -0.821 0 N-CA-C 104.967 -2.234 . . . . 0.0 104.967 -179.502 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 93' ' ' ASP . . . . . . . . . . . . . 0.7 OUTLIER -124.81 75.48 1.43 Allowed 'General case' 0 C--N 1.327 -0.37 0 N-CA-C 106.444 -1.687 . . . . 0.0 106.444 -167.552 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 94' ' ' LEU . . . . . 0.752 HD23 HE21 ' A' ' 6' ' ' GLN . 42.0 tp -77.45 121.52 23.93 Favored 'General case' 0 C--O 1.234 0.254 0 N-CA-C 107.923 -1.14 . . . . 0.0 107.923 -178.188 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 95' ' ' THR . . . . . . . . . . . . . 1.4 m -86.65 -167.22 1.8 Allowed 'General case' 0 C--N 1.319 -0.743 0 C-N-CA 126.496 1.918 . . . . 0.0 108.057 168.238 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 96' ' ' ALA . . . . . . . . . . . . . . . -50.55 -37.87 41.87 Favored 'General case' 0 CA--C 1.543 0.676 0 O-C-N 119.563 -1.96 . . . . 0.0 113.729 -171.647 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 97' ' ' ASN . . . . . . . . . . . . . 1.3 p30 -157.3 18.48 0.29 Allowed 'General case' 0 CA--C 1.54 0.577 0 C-N-CA 125.783 1.633 . . . . 0.0 111.479 -173.363 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 98' ' ' GLN . . . . . . . . . . . . . 12.3 tt0 -136.03 116.87 14.11 Favored 'General case' 0 C--N 1.339 0.149 0 O-C-N 121.137 -0.977 . . . . 0.0 109.813 -177.673 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 99' ' ' LEU . . . . . 0.467 ' HB3' ' HB2' ' A' ' 110' ' ' TYR . 7.5 tp -77.2 117.94 19.22 Favored 'General case' 0 C--O 1.237 0.421 0 C-N-CA 127.509 2.324 . . . . 0.0 108.02 176.854 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 100' ' ' THR . . . . . . . . . . . . . 8.8 m -94.63 106.76 18.76 Favored 'General case' 0 CA--C 1.537 0.462 0 N-CA-C 106.758 -1.571 . . . . 0.0 106.758 165.192 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 101' ' ' LEU . . . . . . . . . . . . . 1.6 mm? -95.18 116.77 29.17 Favored 'General case' 0 CA--C 1.515 -0.373 0 N-CA-C 107.534 -1.284 . . . . 0.0 107.534 167.006 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 102' ' ' ALA . . . . . . . . . . . . . . . -126.71 139.47 53.12 Favored 'General case' 0 C--O 1.233 0.196 0 C-N-CA 123.499 0.719 . . . . 0.0 109.578 176.365 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 103' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -155.25 171.75 19.31 Favored 'General case' 0 N--CA 1.444 -0.755 0 C-N-CA 126.296 1.839 . . . . 0.0 107.959 178.346 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 104' ' ' ALA . . . . . . . . . . . . . . . -64.27 -22.14 66.84 Favored 'General case' 0 CA--C 1.539 0.536 0 N-CA-C 112.911 0.708 . . . . 0.0 112.911 178.025 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 105' ' ' LYS . . . . . . . . . . . . . 0.3 OUTLIER -67.61 -75.25 0.1 Allowed 'General case' 0 C--N 1.345 0.391 0 CA-C-N 119.19 0.905 . . . . 0.0 109.687 174.491 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 106' ' ' GLN . . . . . . . . . . . . . 7.8 mt-30 -147.29 178.5 8.36 Favored 'General case' 0 CA--C 1.536 0.431 0 C-N-CA 127.47 2.308 . . . . 0.0 107.825 -177.119 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 107' ' ' THR . . . . . . . . . . . . . 1.0 OUTLIER -128.7 158.22 39.19 Favored 'General case' 0 CA--C 1.542 0.636 0 C-N-CA 125.672 1.589 . . . . 0.0 107.467 171.333 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 108' ' ' LEU . . . . . . . . . . . . . 87.1 mt -145.76 162.56 37.34 Favored 'General case' 0 N--CA 1.468 0.455 0 C-N-CA 126.085 1.754 . . . . 0.0 110.491 -170.901 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 109' ' ' THR . . . . . . . . . . . . . 99.5 m -122.13 115.43 22.42 Favored 'General case' 0 C--O 1.238 0.456 0 C-N-CA 125.203 1.401 . . . . 0.0 108.196 172.293 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 110' ' ' TYR . . . . . 0.467 ' HB2' ' HB3' ' A' ' 99' ' ' LEU . 95.6 m-85 -109.68 143.32 39.61 Favored 'General case' 0 C--O 1.232 0.16 0 N-CA-C 109.617 -0.512 . . . . 0.0 109.617 171.461 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 111' ' ' LYS . . . . . . . . . . . . . 11.0 tppt? -99.08 142.97 29.89 Favored 'General case' 0 C--O 1.234 0.248 0 C-N-CA 123.954 0.902 . . . . 0.0 109.064 -178.134 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 112' ' ' LEU . . . . . . . . . . . . . 15.6 tp -73.95 60.01 0.73 Allowed 'General case' 0 CA--C 1.536 0.435 0 C-N-CA 125.275 1.43 . . . . 0.0 108.731 167.343 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 113' ' ' ALA . . . . . . . . . . . . . . . -81.8 75.43 8.74 Favored 'General case' 0 N--CA 1.449 -0.51 0 N-CA-C 106.863 -1.532 . . . . 0.0 106.863 167.67 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 114' ' ' ASP . . . . . . . . . . . . 0.269 19.5 p-10 -94.52 55.15 1.91 Allowed 'General case' 0 CA--C 1.522 -0.102 0 CA-C-O 123.085 1.421 . . . . 0.0 112.307 -178.773 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 115' ' ' LEU . . . . . 0.471 ' H ' HD23 ' A' ' 115' ' ' LEU . 0.1 OUTLIER -64.51 3.66 0.47 Allowed 'General case' 0 CA--C 1.538 0.493 0 C-N-CA 126.959 2.104 . . . . 0.0 113.774 172.706 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 116' ' ' MET . . . . . . . . . . . . . 8.1 tpt -66.19 108.29 2.23 Favored 'General case' 0 N--CA 1.451 -0.417 0 C-N-CA 126.493 1.917 . . . . 0.0 108.733 -172.268 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 117' ' ' ASN . . . . . . . . . . . . . 8.0 m120 . . . . . 0 C--O 1.233 0.214 0 CA-C-O 121.189 0.518 . . . . 0.0 110.741 -176.654 . . . . . . . . 0 0 . 1 . 011 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 20.8 ttt . . . . . 0 CA--C 1.536 0.427 0 CA-C-O 121.396 0.617 . . . . 0.0 110.878 . . . . . . . . . 0 0 . 1 . 011 nuclear nobuild full ' A' A ' 2' ' ' VAL . . . . . 0.449 HG11 HG12 ' A' ' 92' ' ' VAL . 14.7 p -52.77 158.12 0.48 Allowed 'Isoleucine or valine' 0 CA--C 1.545 0.777 0 C-N-CA 128.088 2.555 . . . . 0.0 112.271 171.906 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 3' ' ' THR . . . . . . . . . . . . . 57.1 p -133.82 164.99 40.06 Favored Pre-proline 0 N--CA 1.467 0.425 0 O-C-N 121.24 -0.913 . . . . 0.0 111.071 178.367 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 4' ' ' PRO . . . . . . . . . . . . . 37.9 Cg_endo -62.84 -38.94 44.92 Favored 'Trans proline' 0 C--N 1.344 0.311 0 C-N-CA 123.565 2.843 . . . . 0.0 113.058 170.243 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 5' ' ' GLU . . . . . . . . . . . . . 8.7 tt0 -63.92 -44.73 92.02 Favored 'General case' 0 C--N 1.329 -0.284 0 C-N-CA 122.583 0.353 . . . . 0.0 111.019 -173.757 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 6' ' ' GLN . . . . . . . . . . . . . 13.5 pt20 -71.95 13.81 0.26 Allowed 'General case' 0 CA--C 1.541 0.611 0 C-N-CA 123.53 0.732 . . . . 0.0 112.744 179.542 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 7' ' ' LEU . . . . . . . . . . . . . 95.6 mt -126.52 -51.36 1.49 Allowed 'General case' 0 N--CA 1.452 -0.361 0 C-N-CA 125.928 1.691 . . . . 0.0 110.441 -176.58 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 8' ' ' GLN . . . . . . . . . . . . 0.267 0.0 OUTLIER -54.97 -12.07 0.76 Allowed 'General case' 0 N--CA 1.478 0.929 0 N-CA-C 115.098 1.518 . . . . 0.0 115.098 -173.303 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' A' A ' 9' ' ' HIS . . . . . . . . . . . . . 10.3 m170 -125.63 13.84 8.09 Favored 'General case' 0 N--CA 1.443 -0.815 0 C-N-CA 125.44 1.496 . . . . 0.0 110.469 -169.509 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 10' ' ' HIS . . . . . . . . . . . . . 81.2 m-70 -141.42 126.02 17.86 Favored 'General case' 0 CA--C 1.538 0.483 0 C-N-CA 124.844 1.258 . . . . 0.0 112.162 -175.196 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 11' ' ' ARG . . . . . . . . . . . . . 39.3 ttt180 -68.66 149.63 48.88 Favored 'General case' 0 N--CA 1.467 0.417 0 C-N-CA 123.7 0.8 . . . . 0.0 110.004 165.63 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 12' ' ' PHE . . . . . . . . . . . . . 30.9 m-85 -129.64 167.07 18.53 Favored 'General case' 0 CA--C 1.538 0.489 0 C-N-CA 124.314 1.046 . . . . 0.0 109.66 163.417 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 13' ' ' VAL . . . . . 0.409 ' HA ' ' HA ' ' A' ' 30' ' ' GLU . 12.7 p -135.44 147.15 28.99 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.619 0 O-C-N 121.053 -1.029 . . . . 0.0 110.313 176.346 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 14' ' ' LEU . . . . . . . . . . . . . 43.6 tp -73.17 97.58 2.43 Favored 'General case' 0 N--CA 1.456 -0.155 0 N-CA-C 107.763 -1.199 . . . . 0.0 107.763 172.011 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 4.9 mm-40 -79.36 -50.64 10.54 Favored 'General case' 0 C--N 1.324 -0.503 0 N-CA-C 108.983 -0.747 . . . . 0.0 108.983 173.527 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 77.5 p -147.72 165.38 30.67 Favored 'General case' 0 C--O 1.236 0.365 0 CA-C-O 122.236 1.017 . . . . 0.0 112.595 -176.643 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 17' ' ' VAL . . . . . . . . . . . . . 13.3 t -132.83 161.85 40.91 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.53 0 C-N-CA 127.04 2.136 . . . . 0.0 107.16 -164.73 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 18' ' ' ASN . . . . . 0.403 ' HB2' ' H ' ' A' ' 107' ' ' THR . 30.9 t30 -56.41 -36.45 68.96 Favored 'General case' 0 N--CA 1.468 0.436 0 C-N-CA 124.272 1.029 . . . . 0.0 113.424 -177.379 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . -94.09 -31.73 7.9 Favored Glycine 0 C--N 1.335 0.473 0 CA-C-O 118.593 -1.115 . . . . 0.0 113.919 -167.521 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 1.3 pttt 174.47 154.85 0.31 Allowed Pre-proline 0 N--CA 1.465 0.317 0 C-N-CA 127.922 2.489 . . . . 0.0 107.012 -177.636 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 21' ' ' PRO . . . . . . . . . . . . . 72.0 Cg_endo -71.29 177.29 6.79 Favored 'Trans proline' 0 N--CA 1.454 -0.816 0 C-N-CA 121.537 1.492 . . . . 0.0 111.289 -179.13 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 22' ' ' VAL . . . . . . . . . . . . . 7.0 p -129.8 164.67 31.84 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.408 0 C-N-CA 125.403 1.481 . . . . 0.0 108.497 -172.792 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 23' ' ' THR . . . . . . . . . . . . . 0.6 OUTLIER -146.64 129.56 16.32 Favored 'General case' 0 CA--C 1.534 0.342 0 N-CA-C 107.11 -1.441 . . . . 0.0 107.11 174.671 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 24' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER -152.29 84.85 1.26 Allowed 'General case' 0 C--N 1.328 -0.347 0 N-CA-C 104.448 -2.427 . . . . 0.0 104.448 171.134 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 25' ' ' ASP . . . . . . . . . . . . . 0.8 OUTLIER -51.51 -40.7 60.11 Favored 'General case' 0 C--N 1.33 -0.25 0 C-N-CA 123.976 0.91 . . . . 0.0 109.492 175.441 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 26' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -91.4 107.18 19.03 Favored 'General case' 0 N--CA 1.449 -0.492 0 C-N-CA 125.829 1.652 . . . . 0.0 108.893 177.99 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 27' ' ' ASN . . . . . . . . . . . . . 73.9 m-80 47.75 73.37 1.01 Allowed Pre-proline 0 CA--C 1.537 0.456 0 C-N-CA 127.356 2.262 . . . . 0.0 112.116 173.228 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 28' ' ' PRO . . . . . . . . . . . . . 52.2 Cg_endo -66.59 170.76 11.83 Favored 'Trans proline' 0 C--O 1.242 0.678 0 C-N-CA 122.839 2.359 . . . . 0.0 112.615 -176.545 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 29' ' ' PRO . . . . . . . . . . . . . 43.6 Cg_endo -71.22 63.64 2.69 Favored 'Trans proline' 0 CA--C 1.538 0.705 0 C-N-CA 123.747 2.964 . . . . 0.0 111.615 173.411 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 30' ' ' GLU . . . . . 0.409 ' HA ' ' HA ' ' A' ' 13' ' ' VAL . 16.4 pt-20 -81.64 166.49 20.13 Favored 'General case' 0 C--O 1.24 0.557 0 O-C-N 120.461 -1.399 . . . . 0.0 109.927 174.275 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 31' ' ' ILE . . . . . . . . . . . . . 12.7 tt -139.57 138.23 39.6 Favored 'Isoleucine or valine' 0 N--CA 1.455 -0.224 0 N-CA-C 107.632 -1.247 . . . . 0.0 107.632 -179.969 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 32' ' ' SER . . . . . . . . . . . . . 36.8 p -124.01 120.97 33.99 Favored 'General case' 0 N--CA 1.445 -0.689 0 N-CA-C 106.627 -1.62 . . . . 0.0 106.627 176.882 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 33' ' ' PHE . . . . . . . . . . . . . 75.3 m-85 -86.88 137.55 32.29 Favored 'General case' 0 N--CA 1.448 -0.536 0 N-CA-C 105.035 -2.209 . . . . 0.0 105.035 171.97 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 34' ' ' GLY . . . . . . . . . . . . . . . -156.97 163.95 32.53 Favored Glycine 0 C--N 1.335 0.504 0 O-C-N 121.063 -1.023 . . . . 0.0 110.663 178.46 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 35' ' ' GLU . . . . . . . . . . . . . 3.9 tt0 63.73 -161.98 0.28 Allowed 'General case' 0 N--CA 1.452 -0.363 0 CA-C-N 118.675 1.238 . . . . 0.0 110.525 175.432 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 2.8 mtpt -59.32 71.71 0.01 OUTLIER 'General case' 0 CA--C 1.539 0.557 0 C-N-CA 127.046 2.139 . . . . 0.0 111.503 -177.005 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 37' ' ' MET . . . . . . . . . . . . 0.297 0.0 OUTLIER 50.71 19.36 0.59 Allowed 'General case' 0 N--CA 1.445 -0.688 0 C-N-CA 128.19 2.596 . . . . 0.0 115.449 -169.52 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' A' A ' 38' ' ' MET . . . . . . . . . . . . . 0.7 OUTLIER -67.34 165.4 16.47 Favored 'General case' 0 N--CA 1.443 -0.777 0 O-C-N 120.877 -1.139 . . . . 0.0 110.757 -174.772 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 39' ' ' ILE . . . . . . . . . . . . . 5.2 mt -135.11 126.46 46.32 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.368 0 N-CA-C 105.75 -1.944 . . . . 0.0 105.75 -169.754 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 40' ' ' SER . . . . . . . . . . . . . 7.4 m -129.92 151.59 50.31 Favored 'General case' 0 CA--C 1.531 0.235 0 N-CA-C 107.819 -1.178 . . . . 0.0 107.819 169.039 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 41' ' ' GLY . . . . . . . . . . . . . . . 178.46 173.91 44.25 Favored Glycine 0 C--O 1.237 0.316 0 N-CA-C 109.599 -1.4 . . . . 0.0 109.599 -178.34 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 42' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -147.38 83.61 1.55 Allowed 'General case' 0 N--CA 1.451 -0.405 0 O-C-N 122.226 -0.573 . . . . 0.0 111.134 179.982 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 43' ' ' MET . . . . . . . . . . . . . 6.1 mmt -47.82 -55.71 9.12 Favored 'General case' 0 C--N 1.342 0.266 0 C-N-CA 123.68 0.792 . . . . 0.0 109.006 169.14 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 44' ' ' CYS . . . . . 1.293 ' SG ' ' SG ' ' A' ' 70' ' ' CYS . 18.0 p -163.26 -27.38 0.04 OUTLIER 'General case' 0 N--CA 1.443 -0.819 0 C-N-CA 125.115 1.366 . . . . 0.0 110.989 176.093 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 45' ' ' ASN . . . . . . . . . . . . . 0.5 OUTLIER -121.38 20.23 11.26 Favored 'General case' 0 N--CA 1.47 0.559 0 C-N-CA 126.265 1.826 . . . . 0.0 112.217 -167.107 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 46' ' ' ARG . . . . . . . . . . . . . 34.3 mtm180 48.35 166.88 0.0 OUTLIER 'General case' 0 C--N 1.329 -0.312 0 C-N-CA 127.011 2.124 . . . . 0.0 111.661 -155.124 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 47' ' ' PHE . . . . . . . . . . . . . 6.0 p90 -164.41 147.93 9.29 Favored 'General case' 0 C--N 1.317 -0.819 0 N-CA-C 106.127 -1.805 . . . . 0.0 106.127 166.029 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 48' ' ' SER . . . . . . . . . . . . . 1.5 p -160.75 151.79 18.82 Favored 'General case' 0 C--N 1.314 -0.954 0 N-CA-C 107.304 -1.369 . . . . 0.0 107.304 179.529 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 49' ' ' GLY . . . . . . . . . . . . . . . -172.51 163.05 35.01 Favored Glycine 0 CA--C 1.524 0.635 0 N-CA-C 106.574 -2.61 . . . . 0.0 106.574 165.852 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 50' ' ' GLU . . . . . . . . . . . . . 25.8 mt-10 -64.27 115.68 5.28 Favored 'General case' 0 C--O 1.238 0.498 0 N-CA-C 107.781 -1.192 . . . . 0.0 107.781 172.109 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 51' ' ' GLY . . . . . . . . . . . . . . . -61.42 161.36 26.48 Favored Glycine 0 CA--C 1.531 1.064 0 O-C-N 123.628 0.58 . . . . 0.0 113.388 174.545 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 52' ' ' LYS . . . . . . . . . . . . . 25.9 ttpt -133.4 135.53 44.71 Favored 'General case' 0 N--CA 1.464 0.227 0 O-C-N 121.692 -0.887 . . . . 0.0 109.219 165.894 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 53' ' ' LEU . . . . . . . . . . . . . 9.6 tp -160.47 93.76 1.04 Allowed 'General case' 0 N--CA 1.453 -0.31 0 C-N-CA 123.511 0.724 . . . . 0.0 109.881 -176.356 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 2.5 t -136.74 -12.45 1.75 Allowed 'General case' 0 C--N 1.326 -0.445 0 C-N-CA 123.721 0.808 . . . . 0.0 111.047 168.765 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 55' ' ' ASN . . . . . . . . . . . . . 4.3 t30 -136.6 24.67 3.14 Favored 'General case' 0 CA--C 1.541 0.602 0 C-N-CA 127.114 2.165 . . . . 0.0 109.944 -171.851 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 56' ' ' GLY . . . . . . . . . . . . . . . 73.66 -3.55 33.8 Favored Glycine 0 CA--C 1.532 1.096 0 O-C-N 120.584 -1.322 . . . . 0.0 114.716 -175.968 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 57' ' ' GLU . . . . . . . . . . . . . 30.9 tt0 -110.45 105.28 14.2 Favored 'General case' 0 N--CA 1.452 -0.363 0 CA-C-N 118.747 1.274 . . . . 0.0 110.159 -161.539 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 58' ' ' LEU . . . . . 0.612 ' HB2' HG21 ' A' ' 92' ' ' VAL . 21.2 tp -75.99 93.83 3.32 Favored 'General case' 0 CA--C 1.536 0.408 0 C-N-CA 125.222 1.409 . . . . 0.0 112.251 176.84 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 59' ' ' THR . . . . . . . . . . . . . 14.9 p -108.02 127.74 54.04 Favored 'General case' 0 N--CA 1.474 0.742 0 C-N-CA 124.815 1.246 . . . . 0.0 109.955 172.916 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 60' ' ' ALA . . . . . . . . . . . . . . . -132.0 87.34 2.43 Favored 'General case' 0 N--CA 1.454 -0.226 0 C-N-CA 124.443 1.097 . . . . 0.0 109.504 173.571 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 61' ' ' LYS . . . . . . . . . . . . . 47.6 tttm -44.89 -62.4 1.24 Allowed 'General case' 0 C--N 1.331 -0.209 0 C-N-CA 125.817 1.647 . . . . 0.0 110.082 167.745 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 62' ' ' GLY . . . . . . . . . . . . . . . -79.38 45.57 2.87 Favored Glycine 0 CA--C 1.521 0.441 0 C-N-CA 125.251 1.405 . . . . 0.0 112.725 -176.52 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 63' ' ' LEU . . . . . . . . . . . . . 5.7 tp -63.56 142.6 58.34 Favored 'General case' 0 N--CA 1.441 -0.879 0 CA-C-N 118.474 1.137 . . . . 0.0 108.248 166.641 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 64' ' ' ALA . . . . . . . . . . . . . . . -128.88 93.11 3.53 Favored 'General case' 0 N--CA 1.455 -0.223 0 C-N-CA 124.727 1.211 . . . . 0.0 109.741 -173.351 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 65' ' ' MET . . . . . . . . . . . . . 74.9 mtp -115.64 156.36 26.01 Favored 'General case' 0 N--CA 1.467 0.406 0 C-N-CA 124.717 1.207 . . . . 0.0 110.346 -177.377 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 66' ' ' THR . . . . . . . . . . . . . 34.7 p -88.73 -172.06 3.57 Favored 'General case' 0 CA--C 1.544 0.717 0 C-N-CA 123.933 0.893 . . . . 0.0 109.736 173.245 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 67' ' ' ARG . . . . . . . . . . . . . 34.0 mtm180 -130.45 14.34 5.52 Favored 'General case' 0 N--CA 1.47 0.564 0 C-N-CA 124.005 0.922 . . . . 0.0 112.97 170.614 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 68' ' ' MET . . . . . . . . . . . . . 4.0 mpp? -61.5 166.53 4.0 Favored 'General case' 0 CA--C 1.532 0.254 0 O-C-N 120.033 -1.667 . . . . 0.0 111.688 178.367 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 69' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -58.02 111.08 1.06 Allowed 'General case' 0 N--CA 1.445 -0.677 0 C-N-CA 125.96 1.704 . . . . 0.0 108.291 171.305 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 70' ' ' CYS . . . . . 1.293 ' SG ' ' SG ' ' A' ' 44' ' ' CYS . 69.7 m -62.12 -14.09 33.34 Favored 'General case' 0 C--O 1.231 0.111 0 CA-C-O 118.485 -0.769 . . . . 0.0 112.86 170.585 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 71' ' ' ALA . . . . . . . . . . . . . . . 61.03 3.98 0.76 Allowed 'General case' 0 CA--C 1.533 0.295 0 C-N-CA 126.69 1.996 . . . . 0.0 115.38 163.941 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 72' ' ' ASN . . . . . . . . . . . . . 7.4 t30 -142.73 143.4 25.72 Favored Pre-proline 0 N--CA 1.466 0.373 0 N-CA-C 107.775 -1.194 . . . . 0.0 107.775 158.315 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 73' ' ' PRO . . . . . . . . . . . . . 19.0 Cg_endo -63.83 -47.02 7.54 Favored 'Trans proline' 0 C--N 1.346 0.411 0 C-N-CA 123.148 2.565 . . . . 0.0 111.815 -165.963 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 74' ' ' GLN . . . . . . . . . . . . . 48.2 tt0 -59.79 -38.65 82.5 Favored 'General case' 0 CA--C 1.532 0.272 0 CA-C-O 119.238 -0.41 . . . . 0.0 110.616 -179.052 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 75' ' ' LEU . . . . . 0.425 ' HB3' ' HB3' ' A' ' 44' ' ' CYS . 36.7 mt -72.24 -41.99 66.17 Favored 'General case' 0 CA--C 1.533 0.301 0 N-CA-C 109.269 -0.641 . . . . 0.0 109.269 -178.115 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 76' ' ' ASN . . . . . 0.416 ' CB ' ' HB2' ' A' ' 70' ' ' CYS . 4.1 t-20 -63.14 -37.85 88.86 Favored 'General case' 0 N--CA 1.469 0.494 0 C-N-CA 123.104 0.562 . . . . 0.0 111.188 -179.721 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 77' ' ' GLU . . . . . . . . . . . . . 0.7 OUTLIER -60.53 -24.33 65.28 Favored 'General case' 0 CA--C 1.542 0.647 0 N-CA-C 113.331 0.863 . . . . 0.0 113.331 175.257 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 78' ' ' LEU . . . . . . . . . . . . . 94.3 mt -89.37 -15.42 33.36 Favored 'General case' 0 CA--C 1.522 -0.128 0 CA-C-O 118.352 -0.832 . . . . 0.0 111.585 -176.375 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 79' ' ' ASP . . . . . . . . . . . . . 35.5 t70 -55.9 -42.26 75.74 Favored 'General case' 0 CA--C 1.518 -0.26 0 C-N-CA 124.952 1.301 . . . . 0.0 111.895 175.58 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 80' ' ' ASN . . . . . . . . . . . . . 71.6 m-20 -77.16 -55.49 5.39 Favored 'General case' 0 N--CA 1.451 -0.398 0 N-CA-C 107.47 -1.307 . . . . 0.0 107.47 -179.104 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 81' ' ' THR . . . . . . . . . . . . . 22.5 m -45.23 -54.95 6.34 Favored 'General case' 0 CA--C 1.536 0.405 0 C-N-CA 126.241 1.816 . . . . 0.0 110.938 -176.931 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 82' ' ' ILE . . . . . . . . . . . . . 9.5 tp -64.93 -40.74 90.08 Favored 'Isoleucine or valine' 0 C--O 1.236 0.362 0 CA-C-N 119.089 0.859 . . . . 0.0 111.373 -175.529 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 83' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -64.86 -38.63 91.61 Favored 'General case' 0 N--CA 1.449 -0.513 0 N-CA-C 109.083 -0.71 . . . . 0.0 109.083 -175.893 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 84' ' ' GLU . . . . . . . . . . . . . 94.7 mt-10 -74.75 -34.1 62.46 Favored 'General case' 0 N--CA 1.446 -0.631 0 C-N-CA 126.705 2.002 . . . . 0.0 111.374 -177.402 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 85' ' ' MET . . . . . . . . . . . . . 84.3 mtp -67.31 -55.09 15.29 Favored 'General case' 0 C--N 1.34 0.192 0 CA-C-O 122.131 0.967 . . . . 0.0 108.556 -179.678 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 86' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -66.6 -20.79 66.09 Favored 'General case' 0 C--N 1.333 -0.122 0 C-N-CA 123.657 0.783 . . . . 0.0 111.98 -173.93 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 87' ' ' LYS . . . . . . . . . . . . . 2.5 tptt -71.19 -40.49 71.16 Favored 'General case' 0 N--CA 1.453 -0.321 0 CA-C-O 117.668 -1.158 . . . . 0.0 111.303 179.153 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 88' ' ' GLU . . . . . . . . . . . . . 0.6 OUTLIER -84.54 -37.94 20.62 Favored 'General case' 0 C--N 1.341 0.225 0 O-C-N 124.282 0.989 . . . . 0.0 112.169 -175.615 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 89' ' ' GLY . . . . . . . . . . . . . . . 122.09 84.94 0.75 Allowed Glycine 0 CA--C 1.503 -0.7 0 N-CA-C 109.937 -1.265 . . . . 0.0 109.937 -174.031 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 90' ' ' ALA . . . . . . . . . . . . . . . -67.33 139.43 57.23 Favored 'General case' 0 N--CA 1.447 -0.616 0 N-CA-C 108.441 -0.948 . . . . 0.0 108.441 175.336 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 91' ' ' GLN . . . . . . . . . . . . . 6.9 mp0 -67.33 141.94 56.97 Favored 'General case' 0 N--CA 1.439 -1.01 0 N-CA-C 105.305 -2.109 . . . . 0.0 105.305 164.897 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 92' ' ' VAL . . . . . 0.612 HG21 ' HB2' ' A' ' 58' ' ' LEU . 79.5 t -130.01 117.76 41.91 Favored 'Isoleucine or valine' 0 N--CA 1.447 -0.607 0 N-CA-C 105.561 -2.015 . . . . 0.0 105.561 178.597 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 93' ' ' ASP . . . . . . . . . . . . . 31.4 m-20 -128.0 84.79 2.28 Favored 'General case' 0 C--N 1.327 -0.375 0 C-N-CA 127.065 2.146 . . . . 0.0 105.309 -171.764 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 94' ' ' LEU . . . . . . . . . . . . . 57.8 tp -85.2 109.17 18.12 Favored 'General case' 0 CA--C 1.516 -0.359 0 CA-C-O 122.336 1.065 . . . . 0.0 108.568 173.131 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 95' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -77.75 179.27 6.74 Favored 'General case' 0 C--N 1.315 -0.933 0 C-N-CA 127.022 2.129 . . . . 0.0 109.115 169.086 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 96' ' ' ALA . . . . . . . . . . . . . . . -44.52 -41.94 6.81 Favored 'General case' 0 CA--C 1.535 0.373 0 C-N-CA 125.021 1.328 . . . . 0.0 114.026 -163.918 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 97' ' ' ASN . . . . . . . . . . . . . 17.0 p30 -150.96 31.55 0.62 Allowed 'General case' 0 CA--C 1.535 0.376 0 C-N-CA 125.352 1.461 . . . . 0.0 111.993 170.92 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 98' ' ' GLN . . . . . . . . . . . . . 13.7 tt0 -147.8 125.57 11.89 Favored 'General case' 0 N--CA 1.457 -0.122 0 O-C-N 121.484 -0.76 . . . . 0.0 109.83 -178.62 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 99' ' ' LEU . . . . . . . . . . . . . 22.5 tp -90.22 129.64 36.45 Favored 'General case' 0 C--N 1.327 -0.399 0 C-N-CA 126.615 1.966 . . . . 0.0 110.448 -177.007 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 100' ' ' THR . . . . . . . . . . . . . 74.5 m -104.58 128.64 52.63 Favored 'General case' 0 N--CA 1.454 -0.271 0 C-N-CA 123.815 0.846 . . . . 0.0 109.593 158.931 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 101' ' ' LEU . . . . . . . . . . . . . 1.0 OUTLIER -98.13 141.93 30.45 Favored 'General case' 0 CA--C 1.519 -0.222 0 C-N-CA 126.175 1.79 . . . . 0.0 107.126 159.881 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 102' ' ' ALA . . . . . . . . . . . . . . . -143.76 148.13 35.18 Favored 'General case' 0 C--N 1.328 -0.362 0 C-N-CA 124.814 1.246 . . . . 0.0 107.831 172.015 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 103' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -162.54 173.42 14.01 Favored 'General case' 0 N--CA 1.442 -0.838 0 C-N-CA 126.89 2.076 . . . . 0.0 107.651 173.591 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 104' ' ' ALA . . . . . . . . . . . . . . . -51.17 -36.64 42.11 Favored 'General case' 0 CA--C 1.531 0.214 0 C-N-CA 123.803 0.841 . . . . 0.0 112.146 173.868 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 105' ' ' LYS . . . . . . . . . . . . . 12.5 mmtp -63.33 -74.61 0.09 Allowed 'General case' 0 C--N 1.339 0.113 0 CA-C-O 118.683 -0.675 . . . . 0.0 111.162 174.706 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 106' ' ' GLN . . . . . . . . . . . . . 2.6 pt20 -152.73 -172.04 4.12 Favored 'General case' 0 CA--C 1.534 0.355 0 CA-C-N 118.625 0.648 . . . . 0.0 111.667 -176.261 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 107' ' ' THR . . . . . 0.403 ' H ' ' HB2' ' A' ' 18' ' ' ASN . 1.8 t -128.58 135.81 49.87 Favored 'General case' 0 CA--C 1.534 0.345 0 C-N-CA 126.321 1.848 . . . . 0.0 107.875 177.498 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 108' ' ' LEU . . . . . 0.401 HD23 ' CE1' ' A' ' 110' ' ' TYR . 5.9 mp -123.78 149.83 45.17 Favored 'General case' 0 C--O 1.233 0.229 0 C-N-CA 128.346 2.658 . . . . 0.0 107.604 -173.838 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 109' ' ' THR . . . . . . . . . . . . . 1.3 m -132.08 102.19 5.71 Favored 'General case' 0 C--O 1.238 0.45 0 CA-C-O 121.746 0.784 . . . . 0.0 109.469 -176.367 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 110' ' ' TYR . . . . . 0.401 ' CE1' HD23 ' A' ' 108' ' ' LEU . 51.5 m-85 -103.26 144.61 31.11 Favored 'General case' 0 N--CA 1.453 -0.318 0 C-N-CA 124.925 1.29 . . . . 0.0 110.375 -173.893 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 111' ' ' LYS . . . . . . . . . . . . . 0.8 OUTLIER -98.81 142.65 30.07 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-O 117.739 -1.124 . . . . 0.0 109.398 -176.769 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 112' ' ' LEU . . . . . . . . . . . . . 39.1 tp -74.14 56.91 0.63 Allowed 'General case' 0 CA--C 1.542 0.644 0 C-N-CA 124.017 0.927 . . . . 0.0 109.214 162.586 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 113' ' ' ALA . . . . . . . . . . . . . . . -92.22 63.68 4.34 Favored 'General case' 0 C--O 1.236 0.368 0 CA-C-O 122.487 1.137 . . . . 0.0 108.456 -177.625 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 114' ' ' ASP . . . . . . . . . . . . . 5.1 p-10 -90.17 16.21 8.92 Favored 'General case' 0 C--N 1.326 -0.43 0 CA-C-N 114.633 -1.167 . . . . 0.0 113.203 -157.202 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 115' ' ' LEU . . . . . . . . . . . . . 46.7 mt 75.6 11.16 3.3 Favored 'General case' 0 C--O 1.23 0.062 0 C-N-CA 130.999 3.719 . . . . 0.0 114.573 -171.024 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 116' ' ' MET . . . . . . . . . . . . . 6.9 tpt 75.4 148.76 0.1 Allowed 'General case' 0 N--CA 1.463 0.2 0 C-N-CA 126.666 1.986 . . . . 0.0 109.497 -174.997 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 117' ' ' ASN . . . . . . . . . . . . . 10.9 t-20 . . . . . 0 C--O 1.237 0.413 0 C-N-CA 126.291 1.836 . . . . 0.0 113.755 -156.599 . . . . . . . . 0 0 . 1 . 012 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 53.0 ttp . . . . . 0 N--CA 1.452 -0.371 0 N-CA-C 108.853 -0.795 . . . . 0.0 108.853 . . . . . . . . . 0 0 . 1 . 012 nuclear nobuild full ' A' A ' 2' ' ' VAL . . . . . 0.426 HG23 ' HB3' ' A' ' 94' ' ' LEU . 13.4 p -67.44 160.46 4.31 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.366 0 C-N-CA 123.986 0.914 . . . . 0.0 111.177 175.117 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 3' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -124.66 156.52 67.99 Favored Pre-proline 0 CA--C 1.541 0.616 0 C-N-CA 125.601 1.56 . . . . 0.0 111.093 163.885 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 4' ' ' PRO . . . . . . . . . . . . . 93.9 Cg_endo -72.72 -33.15 8.53 Favored 'Trans proline' 0 C--N 1.347 0.493 0 C-N-CA 124.001 3.134 . . . . 0.0 111.704 -174.943 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 5' ' ' GLU . . . . . . . . . . . . . 49.6 tt0 -44.51 -44.91 8.97 Favored 'General case' 0 CA--C 1.537 0.443 0 C-N-CA 124.304 1.041 . . . . 0.0 109.277 169.847 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 6' ' ' GLN . . . . . . . . . . . . . 10.6 mt-30 -70.35 4.88 2.0 Favored 'General case' 0 CA--C 1.538 0.503 0 N-CA-C 114.364 1.246 . . . . 0.0 114.364 -179.351 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 7' ' ' LEU . . . . . . . . . . . . . 19.7 mt -125.75 -48.98 1.63 Allowed 'General case' 0 C--N 1.333 -0.123 0 C-N-CA 125.712 1.605 . . . . 0.0 110.299 -174.922 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 8' ' ' GLN . . . . . . . . . . . . . 14.4 mt-30 -58.21 -2.73 0.2 Allowed 'General case' 0 CA--C 1.54 0.573 0 C-N-CA 127.395 2.278 . . . . 0.0 115.682 -171.708 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 9' ' ' HIS . . . . . . . . . . . . . 56.3 m-70 -141.15 8.07 2.03 Favored 'General case' 0 CA--C 1.537 0.461 0 C-N-CA 125.204 1.402 . . . . 0.0 112.809 173.296 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 10' ' ' HIS . . . . . . . . . . . . . 95.8 m-70 -122.6 120.17 32.97 Favored 'General case' 0 CA--C 1.529 0.152 0 CA-C-N 119.339 0.972 . . . . 0.0 109.937 -169.798 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 11' ' ' ARG . . . . . 0.464 HH21 ' CD ' ' A' ' 30' ' ' GLU . 1.2 ttt85 -81.76 150.79 27.76 Favored 'General case' 0 CA--C 1.517 -0.317 0 C-N-CA 124.049 0.94 . . . . 0.0 111.226 -179.577 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 12' ' ' PHE . . . . . 0.439 ' HB3' ' HB3' ' A' ' 110' ' ' TYR . 95.7 m-85 -139.11 159.08 43.0 Favored 'General case' 0 N--CA 1.438 -1.026 0 C-N-CA 125.829 1.652 . . . . 0.0 108.634 174.539 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 13' ' ' VAL . . . . . 0.411 ' HA ' ' HA ' ' A' ' 30' ' ' GLU . 0.0 OUTLIER -136.02 140.06 44.69 Favored 'Isoleucine or valine' 0 C--N 1.312 -1.025 0 C-N-CA 128.346 2.658 . . . . 0.0 106.391 -170.236 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' A' A ' 14' ' ' LEU . . . . . . . . . . . . . 15.2 tp -77.48 77.82 4.0 Favored 'General case' 0 N--CA 1.465 0.287 0 CA-C-O 122.407 1.099 . . . . 0.0 110.376 -177.958 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 7.3 tp10 -63.79 -41.01 98.02 Favored 'General case' 0 C--N 1.324 -0.536 0 C-N-CA 127.03 2.132 . . . . 0.0 110.655 -174.241 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 2.6 p -154.78 147.55 24.39 Favored 'General case' 0 CA--C 1.535 0.365 0 N-CA-C 113.949 1.092 . . . . 0.0 113.949 167.811 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 17' ' ' VAL . . . . . . . . . . . . . 13.7 t -95.9 166.96 1.75 Allowed 'Isoleucine or valine' 0 N--CA 1.462 0.157 0 C-N-CA 125.467 1.507 . . . . 0.0 108.177 176.842 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 18' ' ' ASN . . . . . . . . . . . . . 15.0 t30 -44.8 -23.54 0.14 Allowed 'General case' 0 CA--C 1.536 0.409 0 C-N-CA 128.476 2.71 . . . . 0.0 114.857 168.846 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . -112.01 -54.88 0.48 Allowed Glycine 0 C--N 1.335 0.498 0 C-N-CA 124.256 0.932 . . . . 0.0 112.789 179.761 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -153.99 161.92 28.07 Favored Pre-proline 0 CA--C 1.533 0.3 0 C-N-CA 124.696 1.198 . . . . 0.0 108.821 -166.856 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 21' ' ' PRO . . . . . . . . . . . . . 59.4 Cg_endo -71.95 173.54 12.66 Favored 'Trans proline' 0 N--CA 1.456 -0.688 0 C-N-CA 121.772 1.648 . . . . 0.0 110.995 175.165 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 22' ' ' VAL . . . . . . . . . . . . . 3.9 t -119.9 145.38 26.25 Favored 'Isoleucine or valine' 0 C--O 1.233 0.223 0 N-CA-C 106.917 -1.512 . . . . 0.0 106.917 175.465 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 23' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -145.37 117.55 8.38 Favored 'General case' 0 C--N 1.324 -0.527 0 N-CA-C 108.112 -1.07 . . . . 0.0 108.112 172.959 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 24' ' ' SER . . . . . . . . . . . . . 70.4 p -117.2 4.24 12.65 Favored 'General case' 0 N--CA 1.462 0.169 0 O-C-N 120.971 -1.081 . . . . 0.0 112.746 175.932 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 25' ' ' ASP . . . . . . . . . . . . . 1.7 t70 62.21 -37.61 0.13 Allowed 'General case' 0 N--CA 1.475 0.791 0 C-N-CA 131.183 3.793 . . . . 0.0 114.464 -179.209 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 26' ' ' LYS . . . . . . . . . . . . . 7.0 tptp -134.98 155.45 50.73 Favored 'General case' 0 N--CA 1.438 -1.072 0 C-N-CA 128.223 2.609 . . . . 0.0 105.468 171.435 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 27' ' ' ASN . . . . . . . . . . . . . 76.6 m-20 49.13 68.07 3.88 Favored Pre-proline 0 C--N 1.325 -0.469 0 C-N-CA 126.232 1.813 . . . . 0.0 110.28 177.382 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 28' ' ' PRO . . . . . . . . . . . . . 54.7 Cg_endo -64.51 155.1 68.28 Favored 'Trans proline' 0 N--CA 1.455 -0.738 0 C-N-CA 122.559 2.172 . . . . 0.0 110.633 177.108 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 29' ' ' PRO . . . . . . . . . . . . . 30.1 Cg_endo -69.13 78.95 0.77 Allowed 'Trans proline' 0 N--CA 1.455 -0.776 0 C-N-CA 123.045 2.496 . . . . 0.0 108.841 166.155 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 30' ' ' GLU . . . . . 0.464 ' CD ' HH21 ' A' ' 11' ' ' ARG . 8.4 pt-20 -106.49 150.03 26.5 Favored 'General case' 0 C--N 1.319 -0.735 0 C-N-CA 127.66 2.384 . . . . 0.0 106.38 -178.829 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 31' ' ' ILE . . . . . . . . . . . . . 16.6 tt -132.14 144.8 36.03 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.467 0 N-CA-C 107.001 -1.481 . . . . 0.0 107.001 -173.752 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 32' ' ' SER . . . . . . . . . . . . . 65.6 p -138.5 164.69 28.76 Favored 'General case' 0 N--CA 1.447 -0.602 0 N-CA-C 107.199 -1.408 . . . . 0.0 107.199 172.71 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 33' ' ' PHE . . . . . . . . . . . . . 59.2 m-85 -125.78 163.68 22.33 Favored 'General case' 0 N--CA 1.447 -0.623 0 N-CA-C 109.018 -0.734 . . . . 0.0 109.018 176.505 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 34' ' ' GLY . . . . . . . . . . . . . . . -151.4 -171.85 19.74 Favored Glycine 0 N--CA 1.451 -0.301 0 N-CA-C 109.033 -1.627 . . . . 0.0 109.033 172.748 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 35' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -44.34 150.69 0.29 Allowed 'General case' 0 CA--C 1.531 0.24 0 C-N-CA 126.374 1.87 . . . . 0.0 111.106 -175.577 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 36' ' ' LYS . . . . . 0.433 ' HE3' ' HA ' ' A' ' 36' ' ' LYS . 0.0 OUTLIER 57.1 26.83 12.52 Favored 'General case' 0 CA--C 1.533 0.316 0 C-N-CA 124.496 1.118 . . . . 0.0 111.0 -169.486 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' A' A ' 37' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER 51.6 28.66 4.85 Favored 'General case' 0 CA--C 1.542 0.658 0 C-N-CA 125.587 1.555 . . . . 0.0 111.573 -178.126 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 38' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -57.6 141.64 47.43 Favored 'General case' 0 N--CA 1.444 -0.761 0 C-N-CA 125.536 1.534 . . . . 0.0 109.633 -179.606 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 39' ' ' ILE . . . . . . . . . . . . . 18.8 mt -112.37 126.09 69.73 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.703 0 C-N-CA 126.429 1.892 . . . . 0.0 106.504 -170.099 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 40' ' ' SER . . . . . . . . . . . . . 69.4 m -135.71 135.7 40.26 Favored 'General case' 0 C--O 1.236 0.357 0 C-N-CA 124.213 1.005 . . . . 0.0 110.749 -178.964 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 41' ' ' GLY . . . . . . . . . . . . . . . 167.88 176.87 38.8 Favored Glycine 0 CA--C 1.534 1.245 0 C-N-CA 124.139 0.876 . . . . 0.0 112.225 -174.868 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 42' ' ' SER . . . . . . . . . . . . . 39.9 t -147.52 109.19 4.38 Favored 'General case' 0 N--CA 1.445 -0.725 0 C-N-CA 126.761 2.024 . . . . 0.0 107.901 169.873 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 43' ' ' MET . . . . . . . . . . . . . 11.8 mmt -62.17 -45.03 95.22 Favored 'General case' 0 C--O 1.222 -0.361 0 C-N-CA 120.603 -0.439 . . . . 0.0 110.804 164.339 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 44' ' ' CYS . . . . . 1.304 ' SG ' ' SG ' ' A' ' 70' ' ' CYS . 2.7 t -157.27 -60.87 0.09 Allowed 'General case' 0 CA--C 1.513 -0.444 0 N-CA-C 105.022 -2.214 . . . . 0.0 105.022 -172.32 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 45' ' ' ASN . . . . . . . . . . . . . 1.9 m-20 -101.34 12.85 36.69 Favored 'General case' 0 C--N 1.328 -0.328 0 C-N-CA 125.53 1.532 . . . . 0.0 114.746 -164.541 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 46' ' ' ARG . . . . . . . . . . . . . 18.1 mmm-85 61.38 152.26 0.03 OUTLIER 'General case' 0 C--O 1.218 -0.56 0 C-N-CA 128.191 2.596 . . . . 0.0 112.979 -164.512 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 47' ' ' PHE . . . . . . . . . . . . . 2.9 p90 -158.38 170.86 21.28 Favored 'General case' 0 CA--C 1.515 -0.401 0 C-N-CA 124.62 1.168 . . . . 0.0 107.919 169.639 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 48' ' ' SER . . . . . . . . . . . . . 19.4 m -160.62 163.34 32.67 Favored 'General case' 0 C--N 1.317 -0.824 0 N-CA-C 106.128 -1.804 . . . . 0.0 106.128 179.616 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 49' ' ' GLY . . . . . . . . . . . . . . . -175.91 170.07 42.9 Favored Glycine 0 N--CA 1.445 -0.755 0 CA-C-N 120.532 1.515 . . . . 0.0 110.739 155.487 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 50' ' ' GLU . . . . . . . . . . . . . 27.0 tt0 -74.17 111.68 9.57 Favored 'General case' 0 N--CA 1.441 -0.88 0 N-CA-C 107.266 -1.383 . . . . 0.0 107.266 162.79 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 51' ' ' GLY . . . . . . . . . . . . . . . -82.24 179.93 53.04 Favored Glycine 0 CA--C 1.536 1.377 0 C-N-CA 123.765 0.698 . . . . 0.0 112.927 158.317 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 52' ' ' LYS . . . . . . . . . . . . . 37.9 tttt -162.74 156.83 20.85 Favored 'General case' 0 N--CA 1.473 0.714 0 C-N-CA 126.554 1.941 . . . . 0.0 107.689 168.304 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 53' ' ' LEU . . . . . . . . . . . . . 1.2 tm? -123.89 115.47 21.35 Favored 'General case' 0 C--O 1.234 0.283 0 C-N-CA 124.143 0.977 . . . . 0.0 109.044 176.411 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 28.5 t -134.92 -54.25 0.81 Allowed 'General case' 0 CA--C 1.534 0.365 0 CA-C-O 118.429 -0.796 . . . . 0.0 111.19 175.541 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 55' ' ' ASN . . . . . . . . . . . . . 4.7 p30 -110.6 13.07 22.64 Favored 'General case' 0 N--CA 1.475 0.781 0 N-CA-C 113.55 0.944 . . . . 0.0 113.55 -178.237 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 56' ' ' GLY . . . . . . . . . . . . . . . 91.18 4.86 68.25 Favored Glycine 0 CA--C 1.528 0.887 0 C-N-CA 124.283 0.944 . . . . 0.0 111.911 -172.653 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 57' ' ' GLU . . . . . . . . . . . . . 39.5 tt0 -113.97 109.36 18.36 Favored 'General case' 0 N--CA 1.451 -0.394 0 C-N-CA 124.513 1.125 . . . . 0.0 108.672 -166.13 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 58' ' ' LEU . . . . . . . . . . . . . 35.7 tp -80.42 95.97 6.58 Favored 'General case' 0 N--CA 1.454 -0.257 0 C-N-CA 124.571 1.148 . . . . 0.0 109.074 173.609 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 59' ' ' THR . . . . . . . . . . . . . 1.2 p -95.11 146.86 24.0 Favored 'General case' 0 C--O 1.238 0.461 0 C-N-CA 123.749 0.82 . . . . 0.0 109.805 168.281 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 60' ' ' ALA . . . . . . . . . . . . . . . -68.84 170.28 9.9 Favored 'General case' 0 CA--C 1.537 0.477 0 CA-C-O 121.912 0.863 . . . . 0.0 110.955 163.931 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 61' ' ' LYS . . . . . . . . . . . . . 23.6 tttt -155.02 -9.76 0.12 Allowed 'General case' 0 CA--C 1.535 0.402 0 C-N-CA 128.191 2.596 . . . . 0.0 112.231 179.685 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 62' ' ' GLY . . . . . . . . . . . . . . . 171.03 77.34 0.04 OUTLIER Glycine 0 C--N 1.334 0.464 0 N-CA-C 106.279 -2.728 . . . . 0.0 106.279 -172.827 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 63' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -115.32 146.98 41.0 Favored 'General case' 0 N--CA 1.449 -0.512 0 C-N-CA 124.963 1.305 . . . . 0.0 109.326 -171.915 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 64' ' ' ALA . . . . . . . . . . . . . . . -120.87 167.13 12.87 Favored 'General case' 0 N--CA 1.45 -0.472 0 C-N-CA 125.025 1.33 . . . . 0.0 109.226 -175.01 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 65' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -150.85 -178.66 6.71 Favored 'General case' 0 C--O 1.238 0.456 0 C-N-CA 126.327 1.851 . . . . 0.0 107.223 171.354 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 66' ' ' THR . . . . . . . . . . . . . 4.0 p -129.83 179.53 5.79 Favored 'General case' 0 CA--C 1.538 0.515 0 CA-C-N 119.181 0.9 . . . . 0.0 110.206 164.268 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 67' ' ' ARG . . . . . . . . . . . . . 10.0 mmt85 -127.55 81.29 2.01 Favored 'General case' 0 CA--C 1.529 0.152 0 C-N-CA 125.953 1.701 . . . . 0.0 108.088 179.599 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 68' ' ' MET . . . . . . . . . . . . . 61.5 mtm -118.06 -174.4 2.64 Favored 'General case' 0 CA--C 1.538 0.501 0 C-N-CA 129.242 3.017 . . . . 0.0 109.389 170.933 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 69' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -104.69 173.1 6.45 Favored 'General case' 0 N--CA 1.465 0.284 0 C-N-CA 127.821 2.448 . . . . 0.0 108.709 168.244 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 70' ' ' CYS . . . . . 1.304 ' SG ' ' SG ' ' A' ' 44' ' ' CYS . 68.1 m -142.53 150.01 39.86 Favored 'General case' 0 C--O 1.233 0.214 0 C-N-CA 123.87 0.868 . . . . 0.0 110.265 174.854 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 71' ' ' ALA . . . . . . . . . . . . . . . -84.3 36.7 0.59 Allowed 'General case' 0 CA--C 1.538 0.489 0 C-N-CA 124.149 0.98 . . . . 0.0 111.398 179.074 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 72' ' ' ASN . . . . . . . . . . . . . 4.0 t30 -166.6 150.15 6.52 Favored Pre-proline 0 N--CA 1.465 0.324 0 C-N-CA 124.298 1.039 . . . . 0.0 108.821 159.302 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 73' ' ' PRO . . . . . . . . . . . . . 96.2 Cg_endo -84.2 -33.64 0.3 Allowed 'Trans proline' 0 N--CA 1.461 -0.424 0 C-N-CA 122.352 2.035 . . . . 0.0 113.288 -171.128 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 74' ' ' GLN . . . . . . . . . . . . . 43.2 tt0 -60.88 -37.4 82.06 Favored 'General case' 0 N--CA 1.465 0.317 0 O-C-N 121.671 -0.643 . . . . 0.0 111.541 -175.644 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 75' ' ' LEU . . . . . . . . . . . . . 50.2 mt -53.58 -43.61 68.67 Favored 'General case' 0 CA--C 1.535 0.382 0 C-N-CA 124.968 1.307 . . . . 0.0 108.678 173.186 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 76' ' ' ASN . . . . . . . . . . . . . 0.7 OUTLIER -77.85 5.07 10.33 Favored 'General case' 0 N--CA 1.47 0.528 0 C-N-CA 128.137 2.575 . . . . 0.0 112.4 -174.518 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 77' ' ' GLU . . . . . . . . . . . . . 0.2 OUTLIER -101.72 -46.02 5.06 Favored 'General case' 0 CA--C 1.535 0.394 0 C-N-CA 126.754 2.021 . . . . 0.0 107.79 168.901 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 78' ' ' LEU . . . . . . . . . . . . . 15.3 mt -65.41 -29.03 69.68 Favored 'General case' 0 CA--C 1.53 0.202 0 C-N-CA 124.977 1.311 . . . . 0.0 111.284 176.937 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 79' ' ' ASP . . . . . . . . . . . . . 0.0 OUTLIER -61.56 -6.48 2.47 Favored 'General case' 0 N--CA 1.469 0.498 0 C-N-CA 126.463 1.905 . . . . 0.0 114.467 168.835 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 80' ' ' ASN . . . . . . . . . . . . . 85.6 m-20 -106.95 -40.31 5.5 Favored 'General case' 0 CA--C 1.531 0.242 0 C-N-CA 124.614 1.166 . . . . 0.0 111.223 164.345 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 81' ' ' THR . . . . . . . . . . . . . 6.9 m -55.43 -65.02 0.66 Allowed 'General case' 0 C--N 1.347 0.493 0 CA-C-N 119.997 1.271 . . . . 0.0 111.524 -176.689 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 82' ' ' ILE . . . . . 0.501 HG13 HD12 ' A' ' 86' ' ' LEU . 9.4 tp -60.43 -37.08 73.36 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.297 0 CA-C-N 119.324 0.965 . . . . 0.0 110.345 -168.455 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 83' ' ' SER . . . . . . . . . . . . . 4.4 m -58.17 -46.82 85.05 Favored 'General case' 0 N--CA 1.446 -0.64 0 C-N-CA 124.891 1.276 . . . . 0.0 110.156 -178.857 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 84' ' ' GLU . . . . . . . . . . . . . 29.3 tt0 -76.8 -41.27 45.14 Favored 'General case' 0 N--CA 1.445 -0.704 0 C-N-CA 126.023 1.729 . . . . 0.0 110.368 -176.781 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 85' ' ' MET . . . . . . . . . . . . . 6.3 ptm -66.74 -40.28 88.27 Favored 'General case' 0 CA--C 1.516 -0.357 0 C-N-CA 123.923 0.889 . . . . 0.0 108.614 -176.59 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 86' ' ' LEU . . . . . 0.501 HD12 HG13 ' A' ' 82' ' ' ILE . 0.3 OUTLIER -71.32 -31.54 67.52 Favored 'General case' 0 N--CA 1.447 -0.577 0 C-N-CA 118.292 -1.363 . . . . 0.0 111.696 -171.138 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' A' A ' 87' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -55.92 -49.89 72.23 Favored 'General case' 0 N--CA 1.45 -0.468 0 N-CA-C 107.859 -1.163 . . . . 0.0 107.859 177.953 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 88' ' ' GLU . . . . . . . . . . . . . 28.0 mt-10 -69.12 -26.58 64.97 Favored 'General case' 0 N--CA 1.445 -0.699 0 CA-C-O 117.235 -1.364 . . . . 0.0 112.544 174.978 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 89' ' ' GLY . . . . . . . . . . . . . . . 94.25 104.23 1.81 Allowed Glycine 0 CA--C 1.499 -0.935 0 CA-C-N 120.474 1.488 . . . . 0.0 109.395 -171.865 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 90' ' ' ALA . . . . . . . . . . . . . . . -80.22 136.04 36.38 Favored 'General case' 0 N--CA 1.445 -0.724 0 N-CA-C 108.668 -0.864 . . . . 0.0 108.668 173.346 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 91' ' ' GLN . . . . . . . . . . . . . 86.3 mm-40 -65.89 138.54 57.93 Favored 'General case' 0 N--CA 1.448 -0.57 0 N-CA-C 106.205 -1.776 . . . . 0.0 106.205 163.558 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 92' ' ' VAL . . . . . . . . . . . . . 76.1 t -131.62 119.8 43.42 Favored 'Isoleucine or valine' 0 N--CA 1.445 -0.692 0 N-CA-C 105.746 -1.946 . . . . 0.0 105.746 -178.975 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 93' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -136.62 94.67 3.02 Favored 'General case' 0 N--CA 1.446 -0.629 0 CA-C-O 122.62 1.2 . . . . 0.0 108.796 170.589 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 94' ' ' LEU . . . . . 0.426 ' HB3' HG23 ' A' ' 2' ' ' VAL . 0.4 OUTLIER -65.93 108.73 2.27 Favored 'General case' 0 N--CA 1.446 -0.656 0 N-CA-C 106.661 -1.607 . . . . 0.0 106.661 165.85 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' A' A ' 95' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -71.21 -178.32 2.0 Allowed 'General case' 0 C--N 1.317 -0.811 0 C-N-CA 126.286 1.834 . . . . 0.0 106.862 168.987 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 96' ' ' ALA . . . . . . . . . . . . . . . -44.93 -34.22 2.31 Favored 'General case' 0 CA--C 1.542 0.668 0 N-CA-C 114.328 1.233 . . . . 0.0 114.328 -179.432 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 97' ' ' ASN . . . . . . . . . . . . . 14.2 p30 -152.02 22.43 0.67 Allowed 'General case' 0 N--CA 1.47 0.547 0 N-CA-C 114.459 1.281 . . . . 0.0 114.459 170.788 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 98' ' ' GLN . . . . . . . . . . . . . 1.5 tt0 -141.3 119.27 11.92 Favored 'General case' 0 N--CA 1.465 0.323 0 O-C-N 120.716 -1.24 . . . . 0.0 111.192 -175.56 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 99' ' ' LEU . . . . . 0.439 ' HB3' ' HB2' ' A' ' 110' ' ' TYR . 8.5 tp -70.85 107.29 3.95 Favored 'General case' 0 C--O 1.237 0.408 0 C-N-CA 126.957 2.103 . . . . 0.0 108.489 177.675 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 100' ' ' THR . . . . . . . . . . . . . 3.2 m -88.37 117.29 27.19 Favored 'General case' 0 C--N 1.327 -0.371 0 N-CA-C 106.0 -1.852 . . . . 0.0 106.0 172.778 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 101' ' ' LEU . . . . . . . . . . . . . 1.1 mm? -110.09 147.67 33.19 Favored 'General case' 0 CA--C 1.515 -0.367 0 N-CA-C 108.822 -0.807 . . . . 0.0 108.822 171.424 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 102' ' ' ALA . . . . . . . . . . . . . . . -149.09 161.27 42.29 Favored 'General case' 0 CA--C 1.53 0.209 0 C-N-CA 124.023 0.929 . . . . 0.0 109.654 166.289 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 103' ' ' THR . . . . . . . . . . . . . 1.6 p -147.7 177.19 9.49 Favored 'General case' 0 C--N 1.327 -0.385 0 C-N-CA 127.76 2.424 . . . . 0.0 107.358 159.682 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 104' ' ' ALA . . . . . . . . . . . . . . . -56.11 -25.04 44.18 Favored 'General case' 0 CA--C 1.534 0.334 0 CA-C-O 118.796 -0.621 . . . . 0.0 112.532 162.258 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 105' ' ' LYS . . . . . . . . . . . . . 24.5 mmtt -71.3 -82.41 0.04 OUTLIER 'General case' 0 N--CA 1.456 -0.141 0 C-N-CA 123.476 0.71 . . . . 0.0 109.392 170.835 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 106' ' ' GLN . . . . . . . . . . . . . 14.7 pt20 -156.29 176.6 12.47 Favored 'General case' 0 C--O 1.236 0.358 0 CA-C-O 121.401 0.619 . . . . 0.0 112.635 -171.057 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 107' ' ' THR . . . . . . . . . . . . . 0.8 OUTLIER -120.78 134.99 55.27 Favored 'General case' 0 C--O 1.232 0.172 0 C-N-CA 127.775 2.43 . . . . 0.0 108.848 -168.288 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 108' ' ' LEU . . . . . . . . . . . . . 2.4 mm? -117.29 151.22 37.41 Favored 'General case' 0 C--O 1.236 0.383 0 N-CA-C 107.843 -1.169 . . . . 0.0 107.843 176.904 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 109' ' ' THR . . . . . . . . . . . . . 0.1 OUTLIER -119.29 107.48 13.45 Favored 'General case' 0 C--N 1.324 -0.503 0 N-CA-C 103.564 -2.754 . . . . 0.0 103.564 179.614 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 110' ' ' TYR . . . . . 0.439 ' HB2' ' HB3' ' A' ' 99' ' ' LEU . 67.1 m-85 -110.77 134.05 52.82 Favored 'General case' 0 N--CA 1.447 -0.611 0 N-CA-C 108.645 -0.872 . . . . 0.0 108.645 173.555 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 111' ' ' LYS . . . . . . . . . . . . . 2.5 tmtt? -94.21 142.63 27.18 Favored 'General case' 0 C--N 1.322 -0.628 0 N-CA-C 108.246 -1.02 . . . . 0.0 108.246 -178.387 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 112' ' ' LEU . . . . . . . . . . . . . 56.8 tp -66.27 105.74 1.5 Allowed 'General case' 0 C--N 1.329 -0.31 0 N-CA-C 107.547 -1.279 . . . . 0.0 107.547 169.064 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 113' ' ' ALA . . . . . . . . . . . . . . . -137.72 98.38 3.66 Favored 'General case' 0 CA--C 1.516 -0.353 0 N-CA-C 107.038 -1.467 . . . . 0.0 107.038 177.846 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 114' ' ' ASP . . . . . . . . . . . . . 30.9 t0 -96.65 44.61 1.06 Allowed 'General case' 0 C--N 1.325 -0.494 0 CA-C-O 123.67 1.7 . . . . 0.0 111.244 -169.115 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 115' ' ' LEU . . . . . . . . . . . . . 13.2 mt -70.37 8.38 0.82 Allowed 'General case' 0 N--CA 1.451 -0.406 0 C-N-CA 129.235 3.014 . . . . 0.0 111.23 -176.065 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 116' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -54.28 -34.79 61.64 Favored 'General case' 0 N--CA 1.454 -0.23 0 C-N-CA 124.747 1.219 . . . . 0.0 113.36 -158.029 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 117' ' ' ASN . . . . . . . . . . . . . 50.1 t-20 . . . . . 0 C--O 1.238 0.479 0 C-N-CA 125.111 1.365 . . . . 0.0 110.637 -171.241 . . . . . . . . 0 0 . 1 . 013 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 18.9 ttt . . . . . 0 C--O 1.236 0.385 0 N-CA-C 109.311 -0.626 . . . . 0.0 109.311 . . . . . . . . . 0 0 . 1 . 013 nuclear nobuild full ' A' A ' 2' ' ' VAL . . . . . . . . . . . . . 7.5 p -55.12 129.51 16.48 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.439 0 N-CA-C 109.397 -0.594 . . . . 0.0 109.397 175.78 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 3' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -122.64 159.93 50.93 Favored Pre-proline 0 N--CA 1.449 -0.487 0 N-CA-C 109.867 -0.42 . . . . 0.0 109.867 -179.164 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 4' ' ' PRO . . . . . . . . . . . . . 36.6 Cg_endo -70.67 -37.03 7.47 Favored 'Trans proline' 0 N--CA 1.464 -0.262 0 C-N-CA 122.472 2.115 . . . . 0.0 112.799 -173.757 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 5' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -57.84 -54.17 49.97 Favored 'General case' 0 C--N 1.328 -0.365 0 C-N-CA 125.788 1.635 . . . . 0.0 109.67 -179.289 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 6' ' ' GLN . . . . . . . . . . . . . 12.6 pt20 -67.02 25.34 0.02 OUTLIER 'General case' 0 CA--C 1.545 0.772 0 C-N-CA 126.24 1.816 . . . . 0.0 114.779 177.917 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 7' ' ' LEU . . . . . . . . . . . . . 97.4 mt -141.74 -49.41 0.39 Allowed 'General case' 0 N--CA 1.451 -0.398 0 C-N-CA 127.249 2.219 . . . . 0.0 108.869 -177.761 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 8' ' ' GLN . . . . . . . . . . . . . 0.1 OUTLIER -46.94 -6.3 0.01 OUTLIER 'General case' 0 N--CA 1.471 0.623 0 C-N-CA 130.119 3.367 . . . . 0.0 118.215 -177.914 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 9' ' ' HIS . . . . . . . . . . . . . 32.0 p80 -145.77 10.84 1.22 Allowed 'General case' 0 C--N 1.325 -0.463 0 CA-C-N 119.641 1.109 . . . . 0.0 112.972 174.798 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 10' ' ' HIS . . . . . . . . . . . . . 32.0 m-70 -100.69 163.96 12.09 Favored 'General case' 0 C--O 1.238 0.489 0 C-N-CA 123.711 0.804 . . . . 0.0 109.733 -176.631 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 11' ' ' ARG . . . . . 0.407 HH21 ' CD ' ' A' ' 30' ' ' GLU . 4.4 ttt85 -126.96 145.69 50.6 Favored 'General case' 0 CA--C 1.514 -0.407 0 C-N-CA 125.456 1.502 . . . . 0.0 107.811 173.184 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 12' ' ' PHE . . . . . . . . . . . . . 42.4 m-85 -136.21 148.13 47.96 Favored 'General case' 0 N--CA 1.445 -0.724 0 N-CA-C 105.717 -1.957 . . . . 0.0 105.717 179.478 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 13' ' ' VAL . . . . . . . . . . . . . 2.5 t -122.2 148.99 25.55 Favored 'Isoleucine or valine' 0 C--O 1.24 0.583 0 C-N-CA 125.413 1.485 . . . . 0.0 108.492 178.981 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 14' ' ' LEU . . . . . . . . . . . . . 7.5 tp -77.37 80.74 3.86 Favored 'General case' 0 N--CA 1.447 -0.596 0 O-C-N 124.418 1.074 . . . . 0.0 109.835 -178.471 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -61.08 -34.97 75.77 Favored 'General case' 0 CA--C 1.534 0.341 0 C-N-CA 123.969 0.908 . . . . 0.0 110.047 -179.961 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 3.2 m -165.83 143.69 5.71 Favored 'General case' 0 CA--C 1.535 0.373 0 O-C-N 121.35 -0.844 . . . . 0.0 111.717 176.368 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 17' ' ' VAL . . . . . . . . . . . . . 2.8 t -97.31 161.13 2.86 Favored 'Isoleucine or valine' 0 CA--C 1.542 0.644 0 C-N-CA 126.396 1.878 . . . . 0.0 108.25 -177.371 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 18' ' ' ASN . . . . . . . . . . . . . 19.9 t30 -51.85 -32.12 30.67 Favored 'General case' 0 N--CA 1.473 0.692 0 C-N-CA 123.438 0.695 . . . . 0.0 112.416 167.4 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . -78.66 -54.48 4.23 Favored Glycine 0 N--CA 1.445 -0.736 0 CA-C-O 119.039 -0.867 . . . . 0.0 111.842 -178.36 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 8.5 mtmt -168.87 166.35 6.49 Favored Pre-proline 0 N--CA 1.466 0.331 0 C-N-CA 126.709 2.003 . . . . 0.0 110.444 -168.703 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 21' ' ' PRO . . . . . . . . . . . . . 36.3 Cg_endo -58.29 161.93 12.98 Favored 'Trans proline' 0 N--CA 1.457 -0.648 0 C-N-CA 121.57 1.514 . . . . 0.0 111.151 163.572 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 22' ' ' VAL . . . . . . . . . . . . . 11.6 p -141.7 127.9 19.25 Favored 'Isoleucine or valine' 0 CA--C 1.529 0.162 0 C-N-CA 124.014 0.926 . . . . 0.0 108.677 175.267 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 23' ' ' THR . . . . . . . . . . . . . 0.6 OUTLIER -136.41 130.94 33.47 Favored 'General case' 0 N--CA 1.451 -0.377 0 N-CA-C 106.678 -1.601 . . . . 0.0 106.678 171.842 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 24' ' ' SER . . . . . . . . . . . . . 0.5 OUTLIER -126.74 67.59 1.25 Allowed 'General case' 0 N--CA 1.453 -0.315 0 N-CA-C 106.886 -1.524 . . . . 0.0 106.886 178.673 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 25' ' ' ASP . . . . . . . . . . . . . 2.0 t70 65.38 -70.69 0.09 Allowed 'General case' 0 C--O 1.233 0.2 0 C-N-CA 128.772 2.829 . . . . 0.0 113.878 173.003 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 26' ' ' LYS . . . . . . . . . . . . . 16.1 ttmt -145.88 -7.86 0.56 Allowed 'General case' 0 CA--C 1.531 0.217 0 C-N-CA 126.414 1.886 . . . . 0.0 111.928 175.07 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 27' ' ' ASN . . . . . . . . . . . . . 80.0 m-20 -124.18 73.33 57.64 Favored Pre-proline 0 C--O 1.232 0.135 0 C-N-CA 124.607 1.163 . . . . 0.0 108.424 -174.303 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 28' ' ' PRO . . . . . . . . . . . . . 55.5 Cg_endo -69.72 173.21 11.27 Favored 'Trans proline' 0 N--CA 1.457 -0.645 0 C-N-CA 123.259 2.639 . . . . 0.0 112.728 179.115 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 29' ' ' PRO . . . . . . . . . . . . . 34.8 Cg_endo -65.7 64.83 0.4 Allowed 'Trans proline' 0 CA--C 1.537 0.637 0 C-N-CA 125.145 3.897 . . . . 0.0 112.301 166.517 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 30' ' ' GLU . . . . . 0.407 ' CD ' HH21 ' A' ' 11' ' ' ARG . 4.5 pt-20 -79.99 169.68 17.52 Favored 'General case' 0 CA--C 1.538 0.489 0 O-C-N 120.592 -1.318 . . . . 0.0 110.218 175.203 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 31' ' ' ILE . . . . . . . . . . . . . 9.1 tt -145.48 143.5 21.84 Favored 'Isoleucine or valine' 0 C--O 1.238 0.45 0 N-CA-C 106.676 -1.602 . . . . 0.0 106.676 -179.058 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 32' ' ' SER . . . . . . . . . . . . . 80.4 p -140.08 150.5 44.41 Favored 'General case' 0 C--O 1.236 0.368 0 N-CA-C 108.762 -0.829 . . . . 0.0 108.762 174.139 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 33' ' ' PHE . . . . . . . . . . . . . 9.0 m-30 -127.66 133.11 49.63 Favored 'General case' 0 CA--C 1.535 0.385 0 C-N-CA 127.063 2.145 . . . . 0.0 105.237 -169.669 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 34' ' ' GLY . . . . . . . . . . . . . . . -112.43 -166.74 17.34 Favored Glycine 0 N--CA 1.471 0.999 0 C-N-CA 124.761 1.172 . . . . 0.0 111.642 -179.371 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 35' ' ' GLU . . . . . . . . . . . . . 16.8 tt0 -69.93 32.67 0.04 OUTLIER 'General case' 0 CA--C 1.546 0.823 0 C-N-CA 127.931 2.492 . . . . 0.0 116.143 -164.802 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 1.1 mmtm -157.16 10.98 0.21 Allowed 'General case' 0 N--CA 1.44 -0.959 0 C-N-CA 127.919 2.488 . . . . 0.0 116.609 -166.209 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 37' ' ' MET . . . . . . . . . . . . . 41.1 mmm 53.66 21.02 2.4 Favored 'General case' 0 CA--C 1.555 1.153 0 CA-C-N 120.129 1.332 . . . . 0.0 112.106 -161.576 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 38' ' ' MET . . . . . . . . . . . . . 11.0 mmm -69.76 165.6 21.05 Favored 'General case' 0 C--O 1.227 -0.127 0 O-C-N 120.178 -1.576 . . . . 0.0 110.979 177.765 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 39' ' ' ILE . . . . . . . . . . . . . 58.5 mt -137.27 138.03 45.66 Favored 'Isoleucine or valine' 0 C--O 1.237 0.411 0 O-C-N 121.85 -0.531 . . . . 0.0 109.749 -176.401 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 40' ' ' SER . . . . . . . . . . . . . 9.3 p -143.85 118.52 9.81 Favored 'General case' 0 CA--C 1.539 0.55 0 C-N-CA 125.194 1.398 . . . . 0.0 109.465 171.728 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 41' ' ' GLY . . . . . . . . . . . . . . . -157.48 -173.93 26.53 Favored Glycine 0 CA--C 1.533 1.187 0 C-N-CA 125.169 1.366 . . . . 0.0 111.138 178.114 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 42' ' ' SER . . . . . . . . . . . . . 74.0 p -157.39 94.2 1.36 Allowed 'General case' 0 C--O 1.223 -0.297 0 C-N-CA 124.208 1.003 . . . . 0.0 110.311 178.754 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 43' ' ' MET . . . . . . . . . . . . . 2.2 mmt -67.01 -40.98 87.4 Favored 'General case' 0 CA--C 1.534 0.331 0 CA-C-O 120.978 0.418 . . . . 0.0 110.868 176.622 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 44' ' ' CYS . . . . . 1.285 ' SG ' ' SG ' ' A' ' 70' ' ' CYS . 33.1 t -151.12 -63.24 0.19 Allowed 'General case' 0 N--CA 1.448 -0.554 0 N-CA-C 104.808 -2.293 . . . . 0.0 104.808 158.457 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 45' ' ' ASN . . . . . . . . . . . . . 71.4 m-20 -83.67 30.0 0.51 Allowed 'General case' 0 CA--C 1.528 0.134 0 C-N-CA 126.47 1.908 . . . . 0.0 114.328 -168.798 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 46' ' ' ARG . . . . . . . . . . . . . 61.7 mtt180 59.25 167.56 0.06 Allowed 'General case' 0 N--CA 1.472 0.649 0 C-N-CA 126.117 1.767 . . . . 0.0 110.965 -171.668 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 47' ' ' PHE . . . . . . . . . . . . . 34.8 p90 -159.31 167.2 29.49 Favored 'General case' 0 C--O 1.239 0.55 0 N-CA-C 108.506 -0.924 . . . . 0.0 108.506 154.122 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 48' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -162.1 137.03 7.07 Favored 'General case' 0 C--O 1.238 0.48 0 N-CA-C 108.352 -0.981 . . . . 0.0 108.352 177.529 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 49' ' ' GLY . . . . . . . . . . . . . . . -170.9 162.48 35.43 Favored Glycine 0 C--N 1.339 0.703 0 N-CA-C 110.209 -1.157 . . . . 0.0 110.209 172.152 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 50' ' ' GLU . . . . . . . . . . . . . 40.3 mt-10 -74.13 101.33 3.9 Favored 'General case' 0 C--O 1.237 0.407 0 C-N-CA 124.323 1.049 . . . . 0.0 108.442 170.258 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 51' ' ' GLY . . . . . . . . . . . . . . . -68.63 -179.46 19.4 Favored Glycine 0 CA--C 1.535 1.341 0 C-N-CA 123.542 0.592 . . . . 0.0 112.561 164.269 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 52' ' ' LYS . . . . . . . . . . . . . 13.9 ttmt -156.0 161.26 40.5 Favored 'General case' 0 CA--C 1.535 0.373 0 C-N-CA 126.373 1.869 . . . . 0.0 108.835 176.257 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 53' ' ' LEU . . . . . 0.406 HD13 ' N ' ' A' ' 54' ' ' SER . 1.2 tm? -146.67 129.59 16.32 Favored 'General case' 0 CA--C 1.519 -0.214 0 N-CA-C 105.597 -2.001 . . . . 0.0 105.597 174.162 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 54' ' ' SER . . . . . 0.406 ' N ' HD13 ' A' ' 53' ' ' LEU . 2.2 t -152.25 -33.84 0.13 Allowed 'General case' 0 CA--C 1.536 0.426 0 CA-C-N 117.642 0.201 . . . . 0.0 111.258 162.9 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 55' ' ' ASN . . . . . . . . . . . . . 20.0 p-10 -131.33 31.15 4.4 Favored 'General case' 0 CA--C 1.534 0.36 0 C-N-CA 128.052 2.541 . . . . 0.0 111.2 -164.761 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 56' ' ' GLY . . . . . . . . . . . . . . . 60.56 31.65 75.51 Favored Glycine 0 CA--C 1.532 1.1 0 O-C-N 121.591 -0.693 . . . . 0.0 111.645 -176.72 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 57' ' ' GLU . . . . . . . . . . . . . 33.5 tt0 -134.15 139.6 45.98 Favored 'General case' 0 C--O 1.237 0.426 0 N-CA-C 107.631 -1.248 . . . . 0.0 107.631 177.528 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 58' ' ' LEU . . . . . . . . . . . . . 56.6 tp -120.59 95.92 4.92 Favored 'General case' 0 CA--C 1.534 0.349 0 C-N-CA 127.806 2.442 . . . . 0.0 108.843 -176.198 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 59' ' ' THR . . . . . . . . . . . . . 15.6 p -98.48 137.61 36.91 Favored 'General case' 0 C--O 1.237 0.434 0 C-N-CA 124.982 1.313 . . . . 0.0 110.671 174.719 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 60' ' ' ALA . . . . . . . . . . . . . . . -123.32 85.46 2.42 Favored 'General case' 0 CA--C 1.536 0.411 0 C-N-CA 125.145 1.378 . . . . 0.0 111.476 171.888 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 61' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -53.19 -15.45 0.91 Allowed 'General case' 0 N--CA 1.455 -0.189 0 C-N-CA 128.82 2.848 . . . . 0.0 117.151 -178.903 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 62' ' ' GLY . . . . . . . . . . . . . . . -148.8 45.66 0.7 Allowed Glycine 0 CA--C 1.52 0.392 0 C-N-CA 124.734 1.159 . . . . 0.0 110.985 -174.379 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 63' ' ' LEU . . . . . . . . . . . . . 9.3 tp -55.91 139.82 44.85 Favored 'General case' 0 N--CA 1.446 -0.649 0 N-CA-C 108.831 -0.803 . . . . 0.0 108.831 168.171 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 64' ' ' ALA . . . . . . . . . . . . . . . -127.13 162.02 27.1 Favored 'General case' 0 C--N 1.327 -0.373 0 N-CA-C 108.17 -1.048 . . . . 0.0 108.17 166.35 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 65' ' ' MET . . . . . . . . . . . . . 0.1 OUTLIER -150.5 177.09 10.34 Favored 'General case' 0 CA--C 1.538 0.507 0 C-N-CA 126.468 1.907 . . . . 0.0 108.591 -175.571 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 66' ' ' THR . . . . . . . . . . . . . 25.4 p -118.0 -178.21 3.45 Favored 'General case' 0 N--CA 1.469 0.524 0 C-N-CA 125.141 1.376 . . . . 0.0 111.12 -178.401 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 67' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -126.2 87.27 2.65 Favored 'General case' 0 C--O 1.236 0.353 0 C-N-CA 123.858 0.863 . . . . 0.0 110.477 172.955 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 68' ' ' MET . . . . . . . . . . . . . 37.0 mtm -132.16 -166.13 1.69 Allowed 'General case' 0 CA--C 1.537 0.471 0 C-N-CA 128.161 2.584 . . . . 0.0 108.534 174.424 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 69' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -145.57 173.95 11.6 Favored 'General case' 0 CA--C 1.539 0.531 0 C-N-CA 125.183 1.393 . . . . 0.0 109.645 174.692 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 70' ' ' CYS . . . . . 1.285 ' SG ' ' SG ' ' A' ' 44' ' ' CYS . 73.0 m -130.48 14.08 5.5 Favored 'General case' 0 C--O 1.234 0.284 0 N-CA-C 114.174 1.176 . . . . 0.0 114.174 -172.707 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 71' ' ' ALA . . . . . . . . . . . . . . . 60.8 10.4 2.68 Favored 'General case' 0 CA--C 1.534 0.338 0 C-N-CA 124.943 1.297 . . . . 0.0 113.271 178.419 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 72' ' ' ASN . . . . . . . . . . . . . 0.2 OUTLIER -133.46 164.96 40.25 Favored Pre-proline 0 CA--C 1.547 0.828 0 C-N-CA 125.213 1.405 . . . . 0.0 107.26 168.667 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 73' ' ' PRO . . . . . . . . . . . . . 60.7 Cg_endo -82.25 -45.91 0.07 OUTLIER 'Trans proline' 0 N--CA 1.46 -0.454 0 C-N-CA 123.71 2.94 . . . . 0.0 111.917 175.157 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 74' ' ' GLN . . . . . . . . . . . . . 58.7 tt0 -47.95 -53.93 14.43 Favored 'General case' 0 C--O 1.223 -0.29 0 C-N-CA 126.394 1.878 . . . . 0.0 110.615 -171.55 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 75' ' ' LEU . . . . . . . . . . . . . 55.0 mt -60.28 -37.18 79.67 Favored 'General case' 0 CA--C 1.535 0.403 0 C-N-CA 125.764 1.626 . . . . 0.0 110.875 -178.567 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 76' ' ' ASN . . . . . . . . . . . . . 1.7 t-20 -73.03 -4.68 33.95 Favored 'General case' 0 N--CA 1.469 0.483 0 C-N-CA 126.198 1.799 . . . . 0.0 111.938 177.926 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 77' ' ' GLU . . . . . . . . . . . . . 1.0 OUTLIER -113.65 -24.4 9.22 Favored 'General case' 0 CA--C 1.535 0.394 0 C-N-CA 125.265 1.426 . . . . 0.0 110.439 170.609 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 78' ' ' LEU . . . . . . . . . . . . . 6.2 mp -63.99 -36.66 84.7 Favored 'General case' 0 N--CA 1.464 0.253 0 O-C-N 120.842 -1.161 . . . . 0.0 109.861 170.453 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 79' ' ' ASP . . . . . . . . . . . . . 0.0 OUTLIER -56.95 -32.69 66.27 Favored 'General case' 0 CA--C 1.53 0.182 0 C-N-CA 123.816 0.846 . . . . 0.0 111.38 173.958 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 80' ' ' ASN . . . . . . . . . . . . . 12.2 m-20 -91.22 -28.57 17.73 Favored 'General case' 0 N--CA 1.452 -0.356 0 C-N-CA 123.017 0.527 . . . . 0.0 110.529 178.558 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 81' ' ' THR . . . . . . . . . . . . . 29.7 m -54.02 -65.14 0.62 Allowed 'General case' 0 CA--C 1.534 0.348 0 C-N-CA 124.926 1.29 . . . . 0.0 108.7 171.27 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 82' ' ' ILE . . . . . . . . . . . . . 10.4 tp -64.18 -35.1 72.8 Favored 'Isoleucine or valine' 0 C--O 1.234 0.284 0 O-C-N 121.84 -0.537 . . . . 0.0 111.011 -171.539 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 83' ' ' SER . . . . . . . . . . . . . 8.6 m -64.3 -40.92 96.92 Favored 'General case' 0 N--CA 1.443 -0.804 0 CA-C-O 118.305 -0.855 . . . . 0.0 111.983 -170.605 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 84' ' ' GLU . . . . . 0.48 ' OE1' ' HE2' ' A' ' 105' ' ' LYS . 4.6 mt-10 -77.86 -39.5 43.15 Favored 'General case' 0 N--CA 1.45 -0.432 0 CA-C-O 118.497 -0.763 . . . . 0.0 110.963 175.421 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 85' ' ' MET . . . . . . . . . . . . . 96.0 mtp -57.88 -49.15 77.68 Favored 'General case' 0 N--CA 1.463 0.201 0 CA-C-O 121.919 0.866 . . . . 0.0 108.725 -173.147 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 86' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -71.7 -25.49 62.11 Favored 'General case' 0 N--CA 1.453 -0.32 0 C-N-CA 123.714 0.806 . . . . 0.0 112.861 -177.197 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 87' ' ' LYS . . . . . . . . . . . . . 6.5 tptm -73.81 -49.74 23.84 Favored 'General case' 0 CA--C 1.516 -0.328 0 N-CA-C 108.338 -0.986 . . . . 0.0 108.338 -178.292 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 88' ' ' GLU . . . . . . . . . . . . . 5.6 mm-40 -69.83 -38.86 76.66 Favored 'General case' 0 N--CA 1.447 -0.616 0 O-C-N 124.449 1.093 . . . . 0.0 110.254 -177.177 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 89' ' ' GLY . . . . . . . . . . . . . . . 126.09 92.27 0.85 Allowed Glycine 0 C--N 1.339 0.695 0 N-CA-C 109.125 -1.59 . . . . 0.0 109.125 -179.594 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 90' ' ' ALA . . . . . . . . . . . . . . . -69.66 136.38 51.05 Favored 'General case' 0 N--CA 1.452 -0.341 0 N-CA-C 106.983 -1.488 . . . . 0.0 106.983 178.388 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 91' ' ' GLN . . . . . . . . . . . . . 4.9 mp0 -68.78 136.43 52.76 Favored 'General case' 0 N--CA 1.442 -0.845 0 N-CA-C 104.385 -2.45 . . . . 0.0 104.385 167.617 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 92' ' ' VAL . . . . . . . . . . . . . 4.0 p -127.47 122.58 59.74 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.392 0 N-CA-C 105.88 -1.896 . . . . 0.0 105.88 -177.27 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 93' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -139.23 92.4 2.59 Favored 'General case' 0 C--N 1.33 -0.277 0 N-CA-C 108.475 -0.935 . . . . 0.0 108.475 178.914 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 94' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -89.54 107.37 19.04 Favored 'General case' 0 C--N 1.333 -0.14 0 N-CA-C 106.809 -1.552 . . . . 0.0 106.809 174.125 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 95' ' ' THR . . . . . . . . . . . . . 13.4 t -67.8 -163.22 0.03 OUTLIER 'General case' 0 CA--C 1.536 0.424 0 C-N-CA 125.822 1.649 . . . . 0.0 108.767 169.588 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 96' ' ' ALA . . . . . . . . . . . . . . . -44.62 -40.95 6.21 Favored 'General case' 0 CA--C 1.544 0.714 0 O-C-N 120.288 -1.507 . . . . 0.0 112.421 178.929 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 97' ' ' ASN . . . . . . . . . . . . . 9.9 p30 -157.12 4.02 0.14 Allowed 'General case' 0 CA--C 1.541 0.619 0 N-CA-C 114.839 1.422 . . . . 0.0 114.839 -170.135 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 98' ' ' GLN . . . . . . . . . . . . . 8.5 tt0 -126.96 129.89 49.02 Favored 'General case' 0 N--CA 1.464 0.257 0 CA-C-N 120.361 1.437 . . . . 0.0 109.649 -176.809 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 99' ' ' LEU . . . . . 0.439 ' HB3' ' HB2' ' A' ' 110' ' ' TYR . 9.9 tp -81.32 133.56 35.45 Favored 'General case' 0 N--CA 1.449 -0.482 0 C-N-CA 123.864 0.866 . . . . 0.0 109.275 175.584 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 100' ' ' THR . . . . . . . . . . . . . 1.1 m -115.13 128.15 56.02 Favored 'General case' 0 C--N 1.323 -0.575 0 N-CA-C 105.223 -2.14 . . . . 0.0 105.223 171.247 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 101' ' ' LEU . . . . . . . . . . . . . 8.5 mp -112.74 163.96 13.95 Favored 'General case' 0 CA--C 1.512 -0.49 0 N-CA-C 110.073 -0.343 . . . . 0.0 110.073 163.311 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 102' ' ' ALA . . . . . . . . . . . . . . . -151.81 160.68 43.48 Favored 'General case' 0 C--N 1.325 -0.488 0 C-N-CA 126.764 2.026 . . . . 0.0 106.187 158.418 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 103' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -165.84 178.63 6.4 Favored 'General case' 0 N--CA 1.444 -0.73 0 C-N-CA 129.17 2.988 . . . . 0.0 106.208 164.134 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 104' ' ' ALA . . . . . . . . . . . . . . . -46.86 -45.06 20.06 Favored 'General case' 0 CA--C 1.533 0.292 0 O-C-N 121.417 -0.802 . . . . 0.0 111.089 169.511 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 105' ' ' LYS . . . . . 0.48 ' HE2' ' OE1' ' A' ' 84' ' ' GLU . 22.0 mttm -58.04 -74.32 0.06 Allowed 'General case' 0 C--N 1.343 0.284 0 N-CA-C 112.202 0.445 . . . . 0.0 112.202 179.955 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 106' ' ' GLN . . . . . . . . . . . . . 8.8 pt20 -163.0 -174.46 3.89 Favored 'General case' 0 C--N 1.33 -0.274 0 C-N-CA 123.247 0.619 . . . . 0.0 109.743 -173.368 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 107' ' ' THR . . . . . . . . . . . . . 2.1 t -105.51 166.2 10.6 Favored 'General case' 0 CA--C 1.539 0.55 0 C-N-CA 125.6 1.56 . . . . 0.0 107.924 168.746 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 108' ' ' LEU . . . . . . . . . . . . . 76.6 mt -139.92 150.43 44.55 Favored 'General case' 0 C--O 1.237 0.436 0 C-N-CA 126.556 1.942 . . . . 0.0 106.517 169.425 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 109' ' ' THR . . . . . . . . . . . . . 4.9 m -123.48 108.47 12.7 Favored 'General case' 0 C--O 1.238 0.497 0 N-CA-C 107.92 -1.141 . . . . 0.0 107.92 176.152 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 110' ' ' TYR . . . . . 0.439 ' HB2' ' HB3' ' A' ' 99' ' ' LEU . 75.2 m-85 -110.17 156.06 21.13 Favored 'General case' 0 N--CA 1.453 -0.282 0 N-CA-C 109.684 -0.487 . . . . 0.0 109.684 179.302 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 111' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -127.93 134.59 49.33 Favored 'General case' 0 C--O 1.236 0.377 0 CA-C-O 118.0 -1.0 . . . . 0.0 108.582 -172.394 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 112' ' ' LEU . . . . . . . . . . . . . 64.1 tp -60.63 82.28 0.01 OUTLIER 'General case' 0 CA--C 1.534 0.344 0 C-N-CA 127.911 2.484 . . . . 0.0 110.653 177.568 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 113' ' ' ALA . . . . . . . . . . . . . . . -115.39 83.0 1.85 Allowed 'General case' 0 C--N 1.33 -0.262 0 N-CA-C 106.015 -1.846 . . . . 0.0 106.015 172.673 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 114' ' ' ASP . . . . . . . . . . . . . 3.0 p-10 -98.2 38.55 1.31 Allowed 'General case' 0 C--N 1.332 -0.155 0 C-N-CA 123.809 0.844 . . . . 0.0 110.848 -176.382 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 115' ' ' LEU . . . . . . . . . . . . . 37.0 mt 55.34 18.04 2.38 Favored 'General case' 0 N--CA 1.468 0.466 0 C-N-CA 127.306 2.242 . . . . 0.0 113.348 179.871 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 116' ' ' MET . . . . . . . . . . . . . 4.6 ptm -61.12 6.17 0.05 Allowed 'General case' 0 CA--C 1.544 0.731 0 C-N-CA 128.574 2.75 . . . . 0.0 115.199 179.768 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 117' ' ' ASN . . . . . . . . . . . . . 22.4 t-20 . . . . . 0 C--O 1.234 0.258 0 O-C-N 120.508 -1.37 . . . . 0.0 110.937 172.761 . . . . . . . . 0 0 . 1 . 014 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 CA--C 1.534 0.36 0 CA-C-O 121.827 0.823 . . . . 0.0 110.837 . . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 2' ' ' VAL . . . . . . . . . . . . . 8.7 p -57.11 152.09 2.83 Favored 'Isoleucine or valine' 0 CA--C 1.544 0.737 0 C-N-CA 126.672 1.989 . . . . 0.0 110.521 164.115 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 3' ' ' THR . . . . . . . . . . . . . 29.6 p -128.03 162.32 50.62 Favored Pre-proline 0 CA--C 1.537 0.467 0 O-C-N 120.993 -1.067 . . . . 0.0 110.594 176.573 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 4' ' ' PRO . . . . . . . . . . . . . 18.1 Cg_endo -65.99 -41.48 13.45 Favored 'Trans proline' 0 C--N 1.345 0.394 0 C-N-CA 122.436 2.091 . . . . 0.0 112.54 175.117 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 5' ' ' GLU . . . . . . . . . . . . . 2.9 mt-10 -57.33 -50.03 74.23 Favored 'General case' 0 C--N 1.329 -0.286 0 C-N-CA 124.163 0.985 . . . . 0.0 111.016 -176.425 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 6' ' ' GLN . . . . . . . . . . . . . 5.5 pt20 -71.7 14.56 0.19 Allowed 'General case' 0 CA--C 1.541 0.604 0 N-CA-C 114.649 1.351 . . . . 0.0 114.649 -170.951 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 7' ' ' LEU . . . . . . . . . . . . . 94.1 mt -126.22 -52.51 1.51 Allowed 'General case' 0 CA--C 1.516 -0.344 0 C-N-CA 126.358 1.863 . . . . 0.0 109.27 -170.555 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 8' ' ' GLN . . . . . . . . . . . . . 2.0 mt-30 -44.9 -20.67 0.04 OUTLIER 'General case' 0 CA--C 1.539 0.538 0 C-N-CA 127.829 2.452 . . . . 0.0 116.701 -176.187 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 9' ' ' HIS . . . . . . . . . . . . . 33.2 p80 -138.66 19.33 2.69 Favored 'General case' 0 CA--C 1.537 0.446 0 C-N-CA 123.825 0.85 . . . . 0.0 113.245 177.769 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 10' ' ' HIS . . . . . . . . . . . . . 78.1 m-70 -118.6 118.46 31.74 Favored 'General case' 0 CA--C 1.531 0.246 0 C-N-CA 124.104 0.961 . . . . 0.0 108.438 179.22 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 11' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -74.5 140.85 44.83 Favored 'General case' 0 N--CA 1.465 0.284 0 N-CA-C 108.692 -0.855 . . . . 0.0 108.692 175.916 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 12' ' ' PHE . . . . . . . . . . . . . 3.3 m-85 -121.19 162.25 20.47 Favored 'General case' 0 N--CA 1.446 -0.633 0 CA-C-O 124.749 2.214 . . . . 0.0 108.762 163.98 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 13' ' ' VAL . . . . . . . . . . . . . 0.0 OUTLIER -136.79 145.98 29.25 Favored 'Isoleucine or valine' 0 C--N 1.31 -1.112 0 C-N-CA 130.143 3.377 . . . . 0.0 106.873 -179.218 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 14' ' ' LEU . . . . . . . . . . . . . 0.8 OUTLIER -69.75 140.92 53.5 Favored 'General case' 0 CA--C 1.504 -0.805 0 N-CA-C 106.532 -1.655 . . . . 0.0 106.532 166.555 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -117.29 -55.7 2.3 Favored 'General case' 0 N--CA 1.44 -0.952 0 O-C-N 124.222 0.951 . . . . 0.0 108.859 177.017 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 55.3 p -133.43 113.22 12.28 Favored 'General case' 0 N--CA 1.447 -0.616 0 CA-C-O 122.364 1.078 . . . . 0.0 109.841 -173.548 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 17' ' ' VAL . . . . . . . . . . . . . 3.2 t -74.25 160.0 5.4 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.45 0 C-N-CA 125.485 1.514 . . . . 0.0 107.648 179.639 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 18' ' ' ASN . . . . . . . . . . . . . 0.2 OUTLIER -44.75 -35.99 2.97 Favored 'General case' 0 N--CA 1.466 0.371 0 C-N-CA 125.536 1.534 . . . . 0.0 113.773 174.795 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . -107.4 -8.84 30.28 Favored Glycine 0 CA--C 1.528 0.855 0 CA-C-O 116.88 -2.067 . . . . 0.0 115.392 -173.519 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 20' ' ' LYS . . . . . 0.428 ' HB2' ' HD2' ' A' ' 21' ' ' PRO . 16.0 ptpt 174.62 165.21 0.35 Allowed Pre-proline 0 N--CA 1.476 0.833 0 CA-C-N 120.497 2.149 . . . . 0.0 112.146 178.742 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 21' ' ' PRO . . . . . 0.428 ' HD2' ' HB2' ' A' ' 20' ' ' LYS . 45.5 Cg_endo -62.12 173.69 3.04 Favored 'Trans proline' 0 CA--C 1.534 0.499 0 C-N-CA 123.284 2.656 . . . . 0.0 111.856 164.064 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 22' ' ' VAL . . . . . . . . . . . . . 9.0 p -145.6 150.99 15.16 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.508 0 CA-C-O 121.66 0.743 . . . . 0.0 111.013 168.428 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 23' ' ' THR . . . . . . . . . . . . . 14.6 p -115.47 103.96 11.28 Favored 'General case' 0 N--CA 1.452 -0.326 0 C-N-CA 126.458 1.903 . . . . 0.0 107.338 172.743 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 24' ' ' SER . . . . . . . . . . . . . 14.9 m -127.72 75.73 1.62 Allowed 'General case' 0 C--N 1.332 -0.154 0 N-CA-C 106.88 -1.526 . . . . 0.0 106.88 -179.07 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 25' ' ' ASP . . . . . . . . . . . . . 97.2 m-20 -81.79 14.3 2.75 Favored 'General case' 0 N--CA 1.468 0.431 0 C-N-CA 123.917 0.887 . . . . 0.0 111.873 -169.927 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 26' ' ' LYS . . . . . . . . . . . . . 32.8 ttpt -148.88 114.8 5.72 Favored 'General case' 0 N--CA 1.45 -0.447 0 N-CA-C 105.881 -1.896 . . . . 0.0 105.881 179.947 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 27' ' ' ASN . . . . . . . . . . . . . 0.0 OUTLIER 43.6 73.76 0.89 Allowed Pre-proline 0 CA--C 1.546 0.804 0 C-N-CA 127.73 2.412 . . . . 0.0 109.788 -172.724 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 28' ' ' PRO . . . . . . . . . . . . . 9.3 Cg_endo -60.0 164.53 11.98 Favored 'Trans proline' 0 CA--C 1.538 0.677 0 CA-C-N 120.952 1.376 . . . . 0.0 111.988 -176.091 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 29' ' ' PRO . . . . . . . . . . . . . 61.5 Cg_endo -63.9 92.89 0.18 Allowed 'Trans proline' 0 N--CA 1.452 -0.934 0 N-CA-C 106.972 -1.972 . . . . 0.0 106.972 161.045 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 30' ' ' GLU . . . . . . . . . . . . . 7.9 pt-20 -123.24 157.81 32.28 Favored 'General case' 0 C--N 1.32 -0.715 0 C-N-CA 124.652 1.181 . . . . 0.0 108.112 -168.199 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 31' ' ' ILE . . . . . 0.503 HD11 HG23 ' A' ' 39' ' ' ILE . 16.3 tt -143.48 109.83 1.51 Allowed 'Isoleucine or valine' 0 N--CA 1.453 -0.293 0 N-CA-C 108.223 -1.029 . . . . 0.0 108.223 178.596 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 32' ' ' SER . . . . . . . . . . . . . 22.9 t -88.31 171.77 9.92 Favored 'General case' 0 N--CA 1.445 -0.684 0 N-CA-C 107.341 -1.355 . . . . 0.0 107.341 159.684 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 33' ' ' PHE . . . . . . . . . . . . . 92.0 m-85 -133.73 -170.09 2.43 Favored 'General case' 0 N--CA 1.441 -0.893 0 C-N-CA 125.467 1.507 . . . . 0.0 107.327 178.08 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 34' ' ' GLY . . . . . . . . . . . . . . . 170.87 -163.43 36.5 Favored Glycine 0 N--CA 1.444 -0.771 0 N-CA-C 109.57 -1.412 . . . . 0.0 109.57 172.142 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 35' ' ' GLU . . . . . . . . . . . . . 2.2 tt0 -55.76 157.09 4.44 Favored 'General case' 0 CA--C 1.534 0.334 0 C-N-CA 124.229 1.012 . . . . 0.0 112.096 -162.378 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 30.2 mtmt 52.74 20.83 1.69 Allowed 'General case' 0 CA--C 1.537 0.448 0 C-N-CA 124.235 1.014 . . . . 0.0 113.109 -168.94 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 37' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER 61.93 29.07 17.71 Favored 'General case' 0 CA--C 1.542 0.666 0 C-N-CA 125.475 1.51 . . . . 0.0 110.638 -175.967 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 38' ' ' MET . . . . . . . . . . . . . 0.7 OUTLIER -60.32 162.05 6.53 Favored 'General case' 0 C--O 1.233 0.232 0 O-C-N 120.794 -1.191 . . . . 0.0 111.633 172.957 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 39' ' ' ILE . . . . . 0.503 HG23 HD11 ' A' ' 31' ' ' ILE . 19.7 mt -122.96 135.21 63.78 Favored 'Isoleucine or valine' 0 C--O 1.237 0.401 0 C-N-CA 126.123 1.769 . . . . 0.0 107.217 -174.262 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 40' ' ' SER . . . . . . . . . . . . . 56.8 m -137.49 114.53 10.74 Favored 'General case' 0 C--O 1.226 -0.156 0 N-CA-C 108.019 -1.104 . . . . 0.0 108.019 170.983 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 41' ' ' GLY . . . . . . . . . . . . . . . -146.96 174.65 26.7 Favored Glycine 0 C--N 1.335 0.495 0 CA-C-N 119.335 0.97 . . . . 0.0 112.53 177.288 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 42' ' ' SER . . . . . 0.409 ' HA ' ' HA ' ' A' ' 46' ' ' ARG . 8.4 t -150.75 70.7 1.01 Allowed 'General case' 0 C--O 1.226 -0.137 0 C-N-CA 123.567 0.747 . . . . 0.0 110.55 -172.009 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 43' ' ' MET . . . . . . . . . . . . . 82.8 mmm -54.71 -62.82 1.41 Allowed 'General case' 0 C--N 1.344 0.336 0 N-CA-C 108.324 -0.991 . . . . 0.0 108.324 173.475 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 44' ' ' CYS . . . . . 1.283 ' SG ' ' SG ' ' A' ' 70' ' ' CYS . 8.8 t -139.33 -50.43 0.51 Allowed 'General case' 0 N--CA 1.451 -0.387 0 C-N-CA 123.625 0.77 . . . . 0.0 110.548 165.664 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 45' ' ' ASN . . . . . . . . . . . . . 48.6 m-80 -103.69 19.35 20.03 Favored 'General case' 0 N--CA 1.472 0.649 0 CA-C-N 119.973 1.26 . . . . 0.0 113.342 -171.309 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 46' ' ' ARG . . . . . 0.409 ' HA ' ' HA ' ' A' ' 42' ' ' SER . 0.0 OUTLIER 66.04 152.47 0.06 Allowed 'General case' 0 N--CA 1.464 0.253 0 C-N-CA 125.431 1.493 . . . . 0.0 111.043 -177.848 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' A' A ' 47' ' ' PHE . . . . . . . . . . . . . 25.0 p90 -154.54 168.36 26.98 Favored 'General case' 0 N--CA 1.447 -0.611 0 CA-C-O 122.768 1.27 . . . . 0.0 108.621 171.26 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 48' ' ' SER . . . . . . . . . . . . . 3.9 p -152.15 171.94 17.13 Favored 'General case' 0 N--CA 1.44 -0.973 0 CA-C-N 113.889 -1.505 . . . . 0.0 108.027 177.597 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 49' ' ' GLY . . . . . . . . . . . . . . . 179.25 163.78 30.76 Favored Glycine 0 N--CA 1.445 -0.73 0 N-CA-C 109.337 -1.505 . . . . 0.0 109.337 164.628 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 50' ' ' GLU . . . . . . . . . . . . . 13.5 pt-20 -82.99 95.37 7.99 Favored 'General case' 0 N--CA 1.44 -0.939 0 N-CA-C 105.572 -2.011 . . . . 0.0 105.572 165.032 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 51' ' ' GLY . . . . . . . . . . . . . . . -70.13 169.93 45.38 Favored Glycine 0 N--CA 1.447 -0.62 0 N-CA-C 109.781 -1.328 . . . . 0.0 109.781 167.85 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 52' ' ' LYS . . . . . . . . . . . . . 2.1 tppm? -153.27 146.42 24.66 Favored 'General case' 0 N--CA 1.452 -0.344 0 N-CA-C 107.72 -1.215 . . . . 0.0 107.72 169.585 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 53' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -121.33 82.39 1.93 Allowed 'General case' 0 CA--C 1.515 -0.385 0 N-CA-C 106.236 -1.765 . . . . 0.0 106.236 -178.992 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 1.5 t -103.91 -53.53 2.74 Favored 'General case' 0 N--CA 1.448 -0.567 0 N-CA-C 108.222 -1.029 . . . . 0.0 108.222 178.502 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 55' ' ' ASN . . . . . . . . . . . . . 17.6 p-10 -132.39 28.88 4.32 Favored 'General case' 0 CA--C 1.537 0.474 0 C-N-CA 125.889 1.676 . . . . 0.0 112.749 -163.954 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 56' ' ' GLY . . . . . . . . . . . . . . . 69.26 30.25 71.69 Favored Glycine 0 CA--C 1.53 1.007 0 O-C-N 121.146 -0.971 . . . . 0.0 111.806 -179.077 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 57' ' ' GLU . . . . . . . . . . . . . 42.8 tt0 -131.84 126.27 33.85 Favored 'General case' 0 N--CA 1.449 -0.5 0 N-CA-C 107.28 -1.378 . . . . 0.0 107.28 -178.176 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 58' ' ' LEU . . . . . 0.502 ' HB2' HG21 ' A' ' 92' ' ' VAL . 49.5 tp -102.6 103.62 13.94 Favored 'General case' 0 C--O 1.234 0.274 0 C-N-CA 124.073 0.949 . . . . 0.0 109.163 173.109 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 59' ' ' THR . . . . . . . . . . . . . 2.8 p -93.04 153.44 18.7 Favored 'General case' 0 CA--C 1.532 0.273 0 C-N-CA 122.883 0.473 . . . . 0.0 110.478 168.439 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 60' ' ' ALA . . . . . . . . . . . . . . . -155.34 106.3 2.55 Favored 'General case' 0 C--O 1.234 0.256 0 C-N-CA 125.58 1.552 . . . . 0.0 108.399 153.852 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 61' ' ' LYS . . . . . . . . . . . . . 29.1 ttpt -79.48 -25.3 41.91 Favored 'General case' 0 CA--C 1.535 0.365 0 C-N-CA 123.226 0.611 . . . . 0.0 110.638 168.157 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 62' ' ' GLY . . . . . . . . . . . . . . . -83.83 37.45 2.82 Favored Glycine 0 C--N 1.334 0.434 0 C-N-CA 126.443 1.973 . . . . 0.0 112.852 -176.399 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 63' ' ' LEU . . . . . 0.457 HD22 ' HA ' ' A' ' 83' ' ' SER . 0.5 OUTLIER -82.03 81.33 8.02 Favored 'General case' 0 N--CA 1.444 -0.729 0 CA-C-O 121.857 0.837 . . . . 0.0 111.7 -164.096 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' A' A ' 64' ' ' ALA . . . . . . . . . . . . . . . -72.46 131.43 42.55 Favored 'General case' 0 C--N 1.327 -0.402 0 CA-C-N 115.278 -0.874 . . . . 0.0 108.98 176.09 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 65' ' ' MET . . . . . . . . . . . . . 54.9 mtp -130.97 -178.22 4.72 Favored 'General case' 0 CA--C 1.543 0.691 0 C-N-CA 128.239 2.616 . . . . 0.0 109.832 179.666 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 66' ' ' THR . . . . . . . . . . . . . 18.2 p -116.68 -168.93 1.54 Allowed 'General case' 0 N--CA 1.472 0.643 0 C-N-CA 125.339 1.456 . . . . 0.0 111.834 -179.171 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 67' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -138.35 79.97 1.77 Allowed 'General case' 0 N--CA 1.452 -0.36 0 C-N-CA 126.556 1.943 . . . . 0.0 107.014 -177.024 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 68' ' ' MET . . . . . . . . . . . . . 76.1 mtm -131.72 -160.31 1.04 Allowed 'General case' 0 C--N 1.325 -0.475 0 C-N-CA 126.804 2.042 . . . . 0.0 107.575 178.962 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 69' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -143.53 155.96 44.47 Favored 'General case' 0 N--CA 1.445 -0.685 0 C-N-CA 124.993 1.317 . . . . 0.0 110.205 160.382 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 70' ' ' CYS . . . . . 1.283 ' SG ' ' SG ' ' A' ' 44' ' ' CYS . 1.6 p -92.0 -9.01 44.47 Favored 'General case' 0 C--N 1.321 -0.663 0 C-N-CA 126.946 2.099 . . . . 0.0 112.001 171.006 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 71' ' ' ALA . . . . . . . . . . . . . . . 59.64 5.99 0.77 Allowed 'General case' 0 CA--C 1.538 0.503 0 C-N-CA 126.675 1.99 . . . . 0.0 114.183 -167.636 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 72' ' ' ASN . . . . . . . . . . . . . 21.2 t-20 -111.24 144.66 30.91 Favored Pre-proline 0 CA--C 1.533 0.301 0 C-N-CA 124.828 1.251 . . . . 0.0 108.567 174.362 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 73' ' ' PRO . . . . . . . . . . . . . 87.5 Cg_endo -77.48 -47.05 0.13 Allowed 'Trans proline' 0 CA--C 1.534 0.513 0 C-N-CA 122.652 2.235 . . . . 0.0 111.912 -178.471 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 74' ' ' GLN . . . . . . . . . . . . . 15.4 tt0 -59.12 -45.75 90.11 Favored 'General case' 0 N--CA 1.452 -0.361 0 C-N-CA 127.381 2.272 . . . . 0.0 110.175 -171.749 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 75' ' ' LEU . . . . . . . . . . . . . 98.6 mt -65.06 -42.99 93.71 Favored 'General case' 0 N--CA 1.452 -0.344 0 C-N-CA 125.138 1.375 . . . . 0.0 110.498 177.687 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 76' ' ' ASN . . . . . . . . . . . . . 0.6 OUTLIER -60.55 -44.99 95.53 Favored 'General case' 0 N--CA 1.468 0.473 0 C-N-CA 123.854 0.861 . . . . 0.0 111.679 177.977 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 77' ' ' GLU . . . . . . . . . . . . . 21.3 tp10 -63.99 -34.5 78.15 Favored 'General case' 0 CA--C 1.536 0.435 0 C-N-CA 123.699 0.8 . . . . 0.0 111.23 175.077 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 78' ' ' LEU . . . . . . . . . . . . . 21.7 mt -64.2 -20.49 66.06 Favored 'General case' 0 CA--C 1.533 0.3 0 CA-C-O 118.166 -0.921 . . . . 0.0 112.259 178.682 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 79' ' ' ASP . . . . . . . . . . . . . 67.6 m-20 -65.1 -27.67 68.92 Favored 'General case' 0 N--CA 1.467 0.406 0 CA-C-N 119.641 1.109 . . . . 0.0 111.39 172.153 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 80' ' ' ASN . . . . . . . . . . . . . 0.9 OUTLIER -76.12 -52.93 9.09 Favored 'General case' 0 N--CA 1.455 -0.214 0 N-CA-C 107.749 -1.204 . . . . 0.0 107.749 175.85 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 81' ' ' THR . . . . . 0.837 HG21 HE21 ' A' ' 106' ' ' GLN . 28.9 m -47.98 -57.27 5.97 Favored 'General case' 0 CA--C 1.535 0.391 0 C-N-CA 124.066 0.946 . . . . 0.0 110.468 178.482 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 82' ' ' ILE . . . . . . . . . . . . . 10.7 tp -58.13 -39.98 75.26 Favored 'Isoleucine or valine' 0 C--O 1.233 0.193 0 CA-C-N 119.538 1.063 . . . . 0.0 111.401 -172.851 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 83' ' ' SER . . . . . 0.457 ' HA ' HD22 ' A' ' 63' ' ' LEU . 28.6 t -60.65 -53.9 51.88 Favored 'General case' 0 N--CA 1.446 -0.645 0 C-N-CA 123.572 0.749 . . . . 0.0 109.008 -177.459 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 84' ' ' GLU . . . . . . . . . . . . . 9.7 tt0 -76.34 -16.21 59.8 Favored 'General case' 0 CA--C 1.539 0.53 0 N-CA-C 112.765 0.654 . . . . 0.0 112.765 -175.765 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 85' ' ' MET . . . . . . . . . . . . . 77.6 mtp -67.41 -61.18 2.03 Favored 'General case' 0 C--N 1.34 0.175 0 CA-C-N 120.175 1.352 . . . . 0.0 107.499 166.657 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 86' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -63.45 -29.09 70.43 Favored 'General case' 0 C--N 1.33 -0.249 0 C-N-CA 124.63 1.172 . . . . 0.0 112.025 -172.614 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 87' ' ' LYS . . . . . . . . . . . . . 10.9 mttt -64.4 -34.88 79.2 Favored 'General case' 0 C--N 1.333 -0.116 0 CA-C-N 118.752 0.706 . . . . 0.0 110.735 179.703 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 88' ' ' GLU . . . . . . . . . . . . . 9.4 mm-40 -105.07 0.56 27.66 Favored 'General case' 0 CA--C 1.53 0.2 0 C-N-CA 124.669 1.188 . . . . 0.0 111.845 -167.876 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 89' ' ' GLY . . . . . . . . . . . . . . . 86.77 96.68 0.84 Allowed Glycine 0 C--N 1.336 0.545 0 N-CA-C 108.797 -1.721 . . . . 0.0 108.797 -177.432 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 90' ' ' ALA . . . . . . . . . . . . . . . -78.29 135.23 37.49 Favored 'General case' 0 N--CA 1.449 -0.481 0 N-CA-C 109.074 -0.713 . . . . 0.0 109.074 175.759 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 91' ' ' GLN . . . . . . . . . . . . . 2.4 mp0 -72.76 112.14 8.53 Favored 'General case' 0 N--CA 1.449 -0.481 0 N-CA-C 105.548 -2.019 . . . . 0.0 105.548 176.125 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 92' ' ' VAL . . . . . 0.502 HG21 ' HB2' ' A' ' 58' ' ' LEU . 55.4 t -104.15 105.94 19.4 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.35 0 N-CA-C 106.551 -1.648 . . . . 0.0 106.551 -178.731 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 93' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER -121.58 91.49 3.53 Favored 'General case' 0 CA--C 1.516 -0.36 0 N-CA-C 108.478 -0.934 . . . . 0.0 108.478 176.72 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 94' ' ' LEU . . . . . . . . . . . . . 44.0 tp -76.73 134.34 39.22 Favored 'General case' 0 N--CA 1.451 -0.408 0 N-CA-C 107.527 -1.286 . . . . 0.0 107.527 167.519 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 95' ' ' THR . . . . . . . . . . . . . 1.2 t -117.7 178.36 4.43 Favored 'General case' 0 C--N 1.319 -0.746 0 N-CA-C 104.969 -2.234 . . . . 0.0 104.969 169.581 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 96' ' ' ALA . . . . . . . . . . . . . . . -44.78 -21.15 0.05 OUTLIER 'General case' 0 CA--C 1.545 0.758 0 N-CA-C 118.542 2.793 . . . . 0.0 118.542 -157.617 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 97' ' ' ASN . . . . . . . . . . . . . 0.4 OUTLIER -160.35 14.72 0.12 Allowed 'General case' 0 CA--C 1.542 0.643 0 C-N-CA 125.257 1.423 . . . . 0.0 111.68 162.693 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 98' ' ' GLN . . . . . . . . . . . . . 16.4 tt0 -130.57 124.95 32.97 Favored 'General case' 0 N--CA 1.466 0.326 0 O-C-N 120.466 -1.396 . . . . 0.0 109.197 -176.388 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 99' ' ' LEU . . . . . 0.492 ' HB3' ' HB2' ' A' ' 110' ' ' TYR . 12.6 tp -79.06 148.22 32.53 Favored 'General case' 0 C--N 1.326 -0.441 0 C-N-CA 125.875 1.67 . . . . 0.0 109.052 172.676 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 100' ' ' THR . . . . . . . . . . . . . 22.8 m -122.07 129.27 52.25 Favored 'General case' 0 N--CA 1.454 -0.228 0 N-CA-C 106.973 -1.491 . . . . 0.0 106.973 152.077 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 101' ' ' LEU . . . . . . . . . . . . . 1.5 mm? -102.2 100.39 10.59 Favored 'General case' 0 CA--C 1.517 -0.313 0 N-CA-C 105.716 -1.957 . . . . 0.0 105.716 160.703 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 102' ' ' ALA . . . . . . . . . . . . . . . -94.42 151.03 19.7 Favored 'General case' 0 CA--C 1.532 0.286 0 N-CA-C 107.863 -1.162 . . . . 0.0 107.863 167.793 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 103' ' ' THR . . . . . 0.426 HG22 ' H ' ' A' ' 104' ' ' ALA . 0.2 OUTLIER -161.82 177.76 9.58 Favored 'General case' 0 N--CA 1.443 -0.809 0 C-N-CA 126.209 1.803 . . . . 0.0 108.177 166.524 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' A' A ' 104' ' ' ALA . . . . . 0.426 ' H ' HG22 ' A' ' 103' ' ' THR . . . -50.86 -37.87 45.93 Favored 'General case' 0 N--CA 1.447 -0.589 0 C-N-CA 123.418 0.687 . . . . 0.0 112.715 174.05 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 105' ' ' LYS . . . . . . . . . . . . . 0.3 OUTLIER -60.85 -71.99 0.13 Allowed 'General case' 0 C--N 1.342 0.255 0 N-CA-C 112.604 0.594 . . . . 0.0 112.604 178.928 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 106' ' ' GLN . . . . . 0.837 HE21 HG21 ' A' ' 81' ' ' THR . 26.7 mt-30 -150.75 176.86 10.64 Favored 'General case' 0 C--N 1.329 -0.307 0 C-N-CA 127.573 2.349 . . . . 0.0 106.76 -171.956 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 107' ' ' THR . . . . . . . . . . . . . 5.8 t -114.13 149.6 35.39 Favored 'General case' 0 N--CA 1.448 -0.555 0 N-CA-C 106.523 -1.658 . . . . 0.0 106.523 161.697 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 108' ' ' LEU . . . . . . . . . . . . . 78.9 mt -140.59 123.22 16.19 Favored 'General case' 0 C--O 1.237 0.403 0 N-CA-C 106.773 -1.566 . . . . 0.0 106.773 -175.6 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 109' ' ' THR . . . . . . . . . . . . . 24.4 m -89.65 122.27 32.62 Favored 'General case' 0 C--O 1.24 0.566 0 N-CA-C 107.286 -1.376 . . . . 0.0 107.286 176.974 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 110' ' ' TYR . . . . . 0.492 ' HB2' ' HB3' ' A' ' 99' ' ' LEU . 95.4 m-85 -114.32 157.52 22.68 Favored 'General case' 0 N--CA 1.453 -0.324 0 N-CA-C 108.717 -0.846 . . . . 0.0 108.717 174.045 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 111' ' ' LYS . . . . . . . . . . . . . 0.8 OUTLIER -122.38 141.02 52.02 Favored 'General case' 0 C--N 1.332 -0.163 0 C-N-CA 124.029 0.932 . . . . 0.0 109.016 -173.271 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 112' ' ' LEU . . . . . . . . . . . . . 25.3 tp -73.86 54.19 0.49 Allowed 'General case' 0 CA--C 1.534 0.343 0 C-N-CA 128.347 2.659 . . . . 0.0 108.875 171.857 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 113' ' ' ALA . . . . . . . . . . . . . . . -93.64 79.75 4.28 Favored 'General case' 0 N--CA 1.448 -0.526 0 N-CA-C 105.26 -2.126 . . . . 0.0 105.26 174.808 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 114' ' ' ASP . . . . . . . . . . . . . 20.4 t0 -87.44 62.29 7.06 Favored 'General case' 0 C--N 1.327 -0.384 0 CA-C-O 123.745 1.736 . . . . 0.0 109.99 -170.153 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 115' ' ' LEU . . . . . . . . . . . . . 32.5 mt -82.03 10.96 5.64 Favored 'General case' 0 C--N 1.327 -0.387 0 CA-C-N 113.751 -1.568 . . . . 0.0 111.318 -170.992 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 116' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER 53.13 -159.42 0.14 Allowed 'General case' 0 CA--C 1.545 0.755 0 N-CA-C 108.972 -0.751 . . . . 0.0 108.972 -165.399 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 117' ' ' ASN . . . . . . . . . . . . . 9.2 t30 . . . . . 0 C--O 1.235 0.33 0 O-C-N 120.111 -1.618 . . . . 0.0 111.262 -167.674 . . . . . . . . 0 0 . 1 . 015 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 4.6 ttp . . . . . 0 C--O 1.234 0.269 0 N-CA-C 108.195 -1.039 . . . . 0.0 108.195 . . . . . . . . . 0 0 . 1 . 015 nuclear nobuild full ' A' A ' 2' ' ' VAL . . . . . . . . . . . . . 54.2 t -61.89 156.32 4.07 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.446 0 C-N-CA 124.573 1.149 . . . . 0.0 109.861 179.781 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 3' ' ' THR . . . . . 0.419 ' HB ' ' HD2' ' A' ' 4' ' ' PRO . 62.2 p -134.16 165.66 35.05 Favored Pre-proline 0 CA--C 1.53 0.209 0 O-C-N 121.844 -0.535 . . . . 0.0 111.919 170.277 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 4' ' ' PRO . . . . . 0.419 ' HD2' ' HB ' ' A' ' 3' ' ' THR . 29.9 Cg_endo -63.38 -35.96 58.51 Favored 'Trans proline' 0 N--CA 1.459 -0.53 0 C-N-CA 123.116 2.544 . . . . 0.0 113.791 170.951 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 5' ' ' GLU . . . . . . . . . . . . . 57.2 tt0 -57.37 -49.63 75.55 Favored 'General case' 0 C--N 1.325 -0.48 0 C-N-CA 123.217 0.607 . . . . 0.0 111.116 -171.935 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 6' ' ' GLN . . . . . . . . . . . . . 18.4 pt20 -68.56 14.22 0.08 Allowed 'General case' 0 CA--C 1.537 0.447 0 C-N-CA 127.374 2.27 . . . . 0.0 114.491 -178.259 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 7' ' ' LEU . . . . . . . . . . . . . 72.1 mt -134.7 -49.54 0.77 Allowed 'General case' 0 N--CA 1.456 -0.129 0 C-N-CA 124.449 1.1 . . . . 0.0 112.372 -170.726 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 8' ' ' GLN . . . . . . . . . . . . . 0.2 OUTLIER -52.65 -1.35 0.02 OUTLIER 'General case' 0 N--CA 1.466 0.362 0 C-N-CA 128.518 2.727 . . . . 0.0 117.902 -172.771 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 9' ' ' HIS . . . . . . . . . . . . . 91.8 m-70 -143.55 10.94 1.66 Allowed 'General case' 0 CA--C 1.535 0.393 0 CA-C-N 120.269 1.395 . . . . 0.0 111.695 172.538 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 10' ' ' HIS . . . . . . . . . . . . . 81.7 m-70 -108.42 115.26 29.77 Favored 'General case' 0 N--CA 1.452 -0.346 0 C-N-CA 124.909 1.284 . . . . 0.0 108.563 -167.892 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 11' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -70.38 142.08 52.13 Favored 'General case' 0 N--CA 1.464 0.27 0 N-CA-C 107.777 -1.194 . . . . 0.0 107.777 169.726 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 12' ' ' PHE . . . . . . . . . . . . . 41.9 m-85 -125.47 164.61 20.09 Favored 'General case' 0 N--CA 1.444 -0.76 0 C-N-CA 125.623 1.569 . . . . 0.0 107.874 162.459 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 13' ' ' VAL . . . . . . . . . . . . . 4.3 t -134.29 146.91 30.44 Favored 'Isoleucine or valine' 0 C--O 1.236 0.345 0 N-CA-C 107.784 -1.191 . . . . 0.0 107.784 -178.794 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 14' ' ' LEU . . . . . . . . . . . . . 27.2 tp -75.18 91.28 2.6 Favored 'General case' 0 N--CA 1.454 -0.252 0 O-C-N 123.787 0.679 . . . . 0.0 109.402 -175.301 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 0.7 OUTLIER -66.44 -42.38 87.74 Favored 'General case' 0 C--O 1.237 0.397 0 C-N-CA 124.656 1.182 . . . . 0.0 109.514 -177.134 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -161.9 152.95 18.02 Favored 'General case' 0 N--CA 1.449 -0.51 0 CA-C-O 121.737 0.78 . . . . 0.0 111.174 -174.146 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 17' ' ' VAL . . . . . . . . . . . . . 2.0 t -116.72 161.29 15.58 Favored 'Isoleucine or valine' 0 C--O 1.235 0.324 0 N-CA-C 107.011 -1.477 . . . . 0.0 107.011 -179.53 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 18' ' ' ASN . . . . . . . . . . . . . 17.9 t30 -51.17 -42.2 60.68 Favored 'General case' 0 N--CA 1.46 0.07 0 C-N-CA 123.147 0.579 . . . . 0.0 111.902 176.846 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . -62.54 -72.89 0.58 Allowed Glycine 0 CA--C 1.525 0.697 0 N-CA-C 110.159 -1.176 . . . . 0.0 110.159 174.265 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 17.0 mttt -165.74 166.88 9.58 Favored Pre-proline 0 C--N 1.332 -0.176 0 C-N-CA 128.239 2.616 . . . . 0.0 108.405 -171.445 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 21' ' ' PRO . . . . . . . . . . . . . 56.8 Cg_endo -58.96 169.43 3.51 Favored 'Trans proline' 0 N--CA 1.455 -0.751 0 CA-C-N 120.389 1.175 . . . . 0.0 110.679 172.389 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 22' ' ' VAL . . . . . . . . . . . . . 2.7 t -105.97 162.4 5.06 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.396 0 N-CA-C 107.067 -1.457 . . . . 0.0 107.067 174.922 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 23' ' ' THR . . . . . . . . . . . . . 0.6 OUTLIER -136.96 81.0 1.85 Allowed 'General case' 0 C--N 1.329 -0.289 0 C-N-CA 124.3 1.04 . . . . 0.0 108.533 -172.868 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 24' ' ' SER . . . . . . . . . . . . . 27.7 m -128.88 100.51 5.71 Favored 'General case' 0 C--N 1.325 -0.458 0 C-N-CA 125.701 1.6 . . . . 0.0 107.179 -175.637 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 25' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER -75.1 -16.06 60.58 Favored 'General case' 0 N--CA 1.467 0.405 0 C-N-CA 125.765 1.626 . . . . 0.0 112.151 -174.164 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 26' ' ' LYS . . . . . . . . . . . . . 20.4 tttp -143.4 136.72 28.09 Favored 'General case' 0 N--CA 1.448 -0.554 0 N-CA-C 105.748 -1.945 . . . . 0.0 105.748 -174.679 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 27' ' ' ASN . . . . . . . . . . . . . 42.8 m-20 44.93 66.62 4.96 Favored Pre-proline 0 CA--C 1.547 0.839 0 C-N-CA 125.844 1.657 . . . . 0.0 110.862 178.895 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 28' ' ' PRO . . . . . . . . . . . . . 56.2 Cg_endo -65.87 173.82 6.48 Favored 'Trans proline' 0 C--N 1.346 0.413 0 C-N-CA 123.988 3.125 . . . . 0.0 112.751 -176.275 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 29' ' ' PRO . . . . . . . . . . . . . 70.3 Cg_endo -72.82 93.79 0.79 Allowed 'Trans proline' 0 N--CA 1.446 -1.272 0 N-CA-C 108.397 -1.424 . . . . 0.0 108.397 157.359 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 30' ' ' GLU . . . . . . . . . . . . . 0.2 OUTLIER -98.38 177.64 5.29 Favored 'General case' 0 C--N 1.327 -0.403 0 O-C-N 120.546 -1.346 . . . . 0.0 109.686 167.754 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 31' ' ' ILE . . . . . . . . . . . . . 9.0 tt -147.54 114.33 0.98 Allowed 'Isoleucine or valine' 0 N--CA 1.451 -0.378 0 N-CA-C 106.952 -1.499 . . . . 0.0 106.952 171.348 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 32' ' ' SER . . . . . . . . . . . . . 15.1 m -116.11 159.61 21.5 Favored 'General case' 0 C--O 1.238 0.477 0 N-CA-C 108.902 -0.777 . . . . 0.0 108.902 174.441 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 33' ' ' PHE . . . . . . . . . . . . . 29.0 m-85 -130.55 152.55 49.8 Favored 'General case' 0 N--CA 1.448 -0.555 0 N-CA-C 108.364 -0.976 . . . . 0.0 108.364 175.862 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 34' ' ' GLY . . . . . . . . . . . . . . . -117.98 -178.44 17.26 Favored Glycine 0 C--N 1.332 0.317 0 N-CA-C 109.568 -1.413 . . . . 0.0 109.568 171.13 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 35' ' ' GLU . . . . . . . . . . . . . 3.8 pt-20 -63.22 -26.17 68.67 Favored 'General case' 0 C--N 1.324 -0.513 0 C-N-CA 128.671 2.788 . . . . 0.0 112.527 -158.359 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 0.3 OUTLIER -85.2 13.44 6.35 Favored 'General case' 0 N--CA 1.437 -1.121 0 C-N-CA 129.296 3.038 . . . . 0.0 114.308 173.352 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 37' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER 60.8 14.78 5.38 Favored 'General case' 0 CA--C 1.55 0.946 0 C-N-CA 127.394 2.278 . . . . 0.0 112.522 -168.305 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 38' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -54.58 160.51 1.77 Allowed 'General case' 0 N--CA 1.467 0.416 0 O-C-N 119.912 -1.742 . . . . 0.0 110.623 177.658 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 39' ' ' ILE . . . . . . . . . . . . . 17.9 mt -132.12 120.7 44.53 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.514 0 N-CA-C 105.555 -2.017 . . . . 0.0 105.555 -177.546 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 40' ' ' SER . . . . . . . . . . . . . 17.3 m -129.18 89.1 2.8 Favored 'General case' 0 CA--C 1.535 0.378 0 C-N-CA 126.131 1.772 . . . . 0.0 108.607 -174.674 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 41' ' ' GLY . . . . . . . . . . . . . . . -135.61 -167.91 11.42 Favored Glycine 0 CA--C 1.538 1.487 0 C-N-CA 124.304 0.954 . . . . 0.0 110.95 -173.735 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 42' ' ' SER . . . . . . . . . . . . . 23.6 t -171.91 93.02 0.14 Allowed 'General case' 0 CA--C 1.535 0.379 0 C-N-CA 128.247 2.619 . . . . 0.0 108.525 177.497 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 43' ' ' MET . . . . . . . . . . . . . 2.6 mmt -63.74 -51.1 66.46 Favored 'General case' 0 C--O 1.231 0.107 0 N-CA-C 108.651 -0.87 . . . . 0.0 108.651 170.761 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 44' ' ' CYS . . . . . 1.302 ' SG ' ' SG ' ' A' ' 70' ' ' CYS . 48.9 t -148.79 -66.06 0.23 Allowed 'General case' 0 CA--C 1.514 -0.427 0 N-CA-C 108.182 -1.044 . . . . 0.0 108.182 169.023 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 45' ' ' ASN . . . . . . . . . . . . . 1.1 m-80 -75.93 17.36 0.33 Allowed 'General case' 0 CA--C 1.534 0.347 0 C-N-CA 127.835 2.454 . . . . 0.0 112.549 -172.612 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 46' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER 61.68 161.32 0.07 Allowed 'General case' 0 N--CA 1.463 0.207 0 C-N-CA 125.855 1.662 . . . . 0.0 111.545 -163.952 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 47' ' ' PHE . . . . . . . . . . . . . 35.0 p90 -158.81 159.78 35.5 Favored 'General case' 0 C--N 1.329 -0.308 0 N-CA-C 107.541 -1.281 . . . . 0.0 107.541 153.348 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 48' ' ' SER . . . . . . . . . . . . . 1.4 m -151.91 158.47 43.22 Favored 'General case' 0 C--O 1.237 0.427 0 N-CA-C 108.561 -0.903 . . . . 0.0 108.561 161.075 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 49' ' ' GLY . . . . . . . . . . . . . . . -177.76 166.68 37.12 Favored Glycine 0 CA--C 1.52 0.389 0 N-CA-C 110.136 -1.186 . . . . 0.0 110.136 179.578 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 50' ' ' GLU . . . . . . . . . . . . . 43.4 mt-10 -88.51 98.26 11.54 Favored 'General case' 0 N--CA 1.449 -0.488 0 N-CA-C 107.575 -1.268 . . . . 0.0 107.575 -176.832 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 51' ' ' GLY . . . . . . . . . . . . . . . -59.61 169.87 6.54 Favored Glycine 0 CA--C 1.531 1.083 0 CA-C-N 115.737 -0.665 . . . . 0.0 112.424 172.106 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 52' ' ' LYS . . . . . . . . . . . . . 35.6 ttpt -155.02 147.03 23.6 Favored 'General case' 0 C--O 1.235 0.327 0 O-C-N 121.549 -0.971 . . . . 0.0 111.142 169.606 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 53' ' ' LEU . . . . . . . . . . . . . 24.2 tp -134.77 139.73 45.37 Favored 'General case' 0 N--CA 1.453 -0.324 0 C-N-CA 127.575 2.35 . . . . 0.0 107.484 170.148 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 54' ' ' SER . . . . . 0.411 ' H ' ' H ' ' A' ' 55' ' ' ASN . 1.3 t -162.21 -14.77 0.04 OUTLIER 'General case' 0 CA--C 1.541 0.606 0 C-N-CA 125.574 1.55 . . . . 0.0 110.39 163.917 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 55' ' ' ASN . . . . . 0.411 ' H ' ' H ' ' A' ' 54' ' ' SER . 43.9 m-20 -123.44 14.12 9.54 Favored 'General case' 0 CA--C 1.541 0.601 0 C-N-CA 124.761 1.224 . . . . 0.0 113.099 -170.407 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 56' ' ' GLY . . . . . . . . . . . . . . . 72.09 19.7 78.61 Favored Glycine 0 CA--C 1.533 1.183 0 CA-C-N 120.429 1.468 . . . . 0.0 112.672 -172.24 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 57' ' ' GLU . . . . . . . . . . . . . 19.7 tt0 -130.01 149.84 51.55 Favored 'General case' 0 CA--C 1.541 0.607 0 C-N-CA 125.187 1.395 . . . . 0.0 107.958 -176.726 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 58' ' ' LEU . . . . . . . . . . . . . 66.2 tp -114.72 124.74 52.57 Favored 'General case' 0 N--CA 1.465 0.291 0 CA-C-N 119.603 1.092 . . . . 0.0 109.066 177.516 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 59' ' ' THR . . . . . . . . . . . . . 11.8 p -123.01 159.47 28.32 Favored 'General case' 0 C--N 1.326 -0.42 0 C-N-CA 126.171 1.788 . . . . 0.0 110.15 169.531 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 60' ' ' ALA . . . . . 0.618 ' HB2' ' HB3' ' A' ' 86' ' ' LEU . . . -80.54 169.62 17.44 Favored 'General case' 0 N--CA 1.451 -0.423 0 C-N-CA 126.191 1.796 . . . . 0.0 113.468 162.532 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 61' ' ' LYS . . . . . . . . . . . . . 77.6 tttt -135.79 121.51 19.66 Favored 'General case' 0 N--CA 1.441 -0.876 0 N-CA-C 105.211 -2.144 . . . . 0.0 105.211 147.212 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 62' ' ' GLY . . . . . . . . . . . . . . . 104.41 -61.25 0.41 Allowed Glycine 0 CA--C 1.526 0.73 0 CA-C-O 118.575 -1.125 . . . . 0.0 113.775 160.569 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 63' ' ' LEU . . . . . . . . . . . . . 2.5 tp 44.85 87.79 0.02 OUTLIER 'General case' 0 CA--C 1.54 0.578 0 C-N-CA 128.305 2.642 . . . . 0.0 113.591 -175.499 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 64' ' ' ALA . . . . . . . . . . . . . . . -71.57 147.44 47.63 Favored 'General case' 0 C--N 1.33 -0.25 0 N-CA-C 107.094 -1.446 . . . . 0.0 107.094 162.05 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 65' ' ' MET . . . . . . . . . . . . . 63.9 mtp -147.06 -171.11 3.7 Favored 'General case' 0 CA--C 1.542 0.666 0 C-N-CA 126.806 2.042 . . . . 0.0 107.625 174.679 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 66' ' ' THR . . . . . . . . . . . . . 3.9 p -139.15 -168.82 2.52 Favored 'General case' 0 CA--C 1.546 0.812 0 C-N-CA 124.494 1.118 . . . . 0.0 109.847 176.785 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 67' ' ' ARG . . . . . . . . . . . . . 16.6 mmt85 -119.18 28.44 8.24 Favored 'General case' 0 N--CA 1.473 0.716 0 C-N-CA 127.322 2.249 . . . . 0.0 111.935 177.934 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 68' ' ' MET . . . . . . . . . . . . . 77.4 mtm -74.98 -169.7 0.96 Allowed 'General case' 0 CA--C 1.541 0.621 0 O-C-N 120.632 -1.293 . . . . 0.0 109.698 178.651 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 69' ' ' MET . . . . . . . . . . . . . 1.0 OUTLIER -149.63 176.68 10.44 Favored 'General case' 0 CA--C 1.522 -0.134 0 C-N-CA 125.531 1.532 . . . . 0.0 109.626 174.321 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 70' ' ' CYS . . . . . 1.302 ' SG ' ' SG ' ' A' ' 44' ' ' CYS . 75.9 m -133.8 15.38 3.96 Favored 'General case' 0 CA--C 1.537 0.461 0 C-N-CA 124.225 1.01 . . . . 0.0 111.658 179.986 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 71' ' ' ALA . . . . . . . . . . . . . . . 60.6 -25.75 0.04 OUTLIER 'General case' 0 CA--C 1.537 0.455 0 C-N-CA 130.184 3.394 . . . . 0.0 115.308 -171.212 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 72' ' ' ASN . . . . . . . . . . . . . 19.8 t30 -96.42 144.56 28.04 Favored Pre-proline 0 C--O 1.236 0.347 0 C-N-CA 124.116 0.967 . . . . 0.0 110.366 -176.552 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 73' ' ' PRO . . . . . . . . . . . . . 53.5 Cg_endo -73.72 -38.19 2.55 Favored 'Trans proline' 0 N--CA 1.46 -0.447 0 C-N-CA 122.044 1.829 . . . . 0.0 112.284 -174.6 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 74' ' ' GLN . . . . . . . . . . . . . 63.1 tt0 -52.48 -46.25 66.5 Favored 'General case' 0 C--O 1.224 -0.277 0 CA-C-N 118.973 0.806 . . . . 0.0 110.661 -178.378 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 75' ' ' LEU . . . . . . . . . . . . . 90.0 mt -66.12 -37.65 86.26 Favored 'General case' 0 CA--C 1.534 0.347 0 O-C-N 121.873 -0.517 . . . . 0.0 111.623 -179.557 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 76' ' ' ASN . . . . . . . . . . . . . 0.8 OUTLIER -76.05 -28.92 57.84 Favored 'General case' 0 N--CA 1.467 0.38 0 CA-C-N 118.936 0.789 . . . . 0.0 111.691 -178.483 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 77' ' ' GLU . . . . . . . . . . . . . 3.3 tp10 -65.75 -36.64 84.14 Favored 'General case' 0 CA--C 1.533 0.321 0 C-N-CA 125.047 1.339 . . . . 0.0 109.008 166.729 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 78' ' ' LEU . . . . . . . . . . . . . 5.2 mp -70.63 -13.17 61.98 Favored 'General case' 0 N--CA 1.453 -0.298 0 O-C-N 121.121 -0.987 . . . . 0.0 113.55 -177.429 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 79' ' ' ASP . . . . . . . . . . . . . 13.4 t70 -52.99 -58.28 7.51 Favored 'General case' 0 C--O 1.231 0.12 0 C-N-CA 124.725 1.21 . . . . 0.0 110.696 163.273 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 80' ' ' ASN . . . . . . . . . . . . . 13.4 p30 -75.33 -35.7 61.15 Favored 'General case' 0 N--CA 1.444 -0.731 0 N-CA-C 109.605 -0.517 . . . . 0.0 109.605 -173.525 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 81' ' ' THR . . . . . . . . . . . . . 32.6 m -48.43 -53.15 18.86 Favored 'General case' 0 N--CA 1.447 -0.606 0 C-N-CA 125.29 1.436 . . . . 0.0 110.349 174.29 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 82' ' ' ILE . . . . . . . . . . . . . 8.9 tp -77.2 -38.31 27.15 Favored 'Isoleucine or valine' 0 C--N 1.341 0.231 0 CA-C-N 120.069 1.304 . . . . 0.0 111.586 -178.686 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 83' ' ' SER . . . . . . . . . . . . . 4.2 t -50.46 -50.96 51.0 Favored 'General case' 0 C--O 1.238 0.467 0 C-N-CA 123.679 0.791 . . . . 0.0 109.851 -179.904 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 84' ' ' GLU . . . . . . . . . . . . . 0.5 OUTLIER -67.41 -44.64 78.31 Favored 'General case' 0 N--CA 1.45 -0.444 0 C-N-CA 124.46 1.104 . . . . 0.0 112.006 -178.451 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 85' ' ' MET . . . . . . . . . . . . . 90.2 mtp -66.8 -23.41 66.05 Favored 'General case' 0 C--O 1.232 0.16 0 CA-C-O 121.864 0.84 . . . . 0.0 110.7 -166.667 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 86' ' ' LEU . . . . . 0.618 ' HB3' ' HB2' ' A' ' 60' ' ' ALA . 2.8 mm? -98.02 -31.42 12.16 Favored 'General case' 0 N--CA 1.446 -0.664 0 C-N-CA 125.301 1.44 . . . . 0.0 110.413 -177.814 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 87' ' ' LYS . . . . . . . . . . . . . 54.0 mttt -66.6 -49.91 64.77 Favored 'General case' 0 N--CA 1.439 -0.986 0 N-CA-C 107.438 -1.319 . . . . 0.0 107.438 179.16 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 88' ' ' GLU . . . . . . . . . . . . . 31.2 mt-10 -89.15 -8.44 53.68 Favored 'General case' 0 CA--C 1.532 0.265 0 N-CA-C 113.169 0.804 . . . . 0.0 113.169 -168.115 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 89' ' ' GLY . . . . . . . . . . . . . . . 83.54 138.91 3.63 Favored Glycine 0 C--N 1.337 0.588 0 C-N-CA 124.358 0.98 . . . . 0.0 112.423 175.45 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 90' ' ' ALA . . . . . . . . . . . . . . . -131.48 154.03 49.16 Favored 'General case' 0 CA--C 1.514 -0.426 0 N-CA-C 114.127 1.158 . . . . 0.0 114.127 -165.275 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 91' ' ' GLN . . . . . . . . . . . . . 9.0 mp0 -70.36 129.22 38.71 Favored 'General case' 0 N--CA 1.445 -0.709 0 N-CA-C 104.242 -2.503 . . . . 0.0 104.242 163.1 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 92' ' ' VAL . . . . . . . . . . . . . 3.3 p -128.6 77.32 0.55 Allowed 'Isoleucine or valine' 0 C--N 1.325 -0.489 0 N-CA-C 106.512 -1.662 . . . . 0.0 106.512 -177.135 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 93' ' ' ASP . . . . . . . . . . . . . 2.4 m-20 -72.32 147.65 46.12 Favored 'General case' 0 N--CA 1.448 -0.546 0 N-CA-C 107.206 -1.405 . . . . 0.0 107.206 172.537 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 94' ' ' LEU . . . . . . . . . . . . . 61.1 tp -142.07 102.73 4.18 Favored 'General case' 0 N--CA 1.448 -0.534 0 N-CA-C 107.909 -1.145 . . . . 0.0 107.909 171.283 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 95' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -70.67 179.48 2.58 Favored 'General case' 0 N--CA 1.442 -0.855 0 CA-C-N 114.771 -1.104 . . . . 0.0 108.825 168.486 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 96' ' ' ALA . . . . . . . . . . . . . . . -47.07 -33.01 4.53 Favored 'General case' 0 CA--C 1.535 0.401 0 C-N-CA 126.273 1.829 . . . . 0.0 115.173 -169.955 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 97' ' ' ASN . . . . . . . . . . . . . 0.0 OUTLIER -148.35 6.8 0.76 Allowed 'General case' 0 CA--C 1.537 0.445 0 C-N-CA 126.325 1.85 . . . . 0.0 110.69 -173.897 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 98' ' ' GLN . . . . . . . . . . . . . 24.7 tt0 -143.46 111.41 6.09 Favored 'General case' 0 CA--C 1.529 0.156 0 CA-C-N 119.566 1.076 . . . . 0.0 109.899 -164.9 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 99' ' ' LEU . . . . . 0.446 ' HB3' ' HB2' ' A' ' 110' ' ' TYR . 10.9 tp -66.79 147.37 53.35 Favored 'General case' 0 C--O 1.235 0.321 0 C-N-CA 125.63 1.572 . . . . 0.0 107.745 170.744 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 100' ' ' THR . . . . . . . . . . . . . 85.3 m -143.46 100.69 3.65 Favored 'General case' 0 C--N 1.326 -0.439 0 N-CA-C 106.638 -1.615 . . . . 0.0 106.638 169.506 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 101' ' ' LEU . . . . . . . . . . . . . 3.2 mm? -81.37 146.33 30.38 Favored 'General case' 0 CA--C 1.517 -0.303 0 N-CA-C 107.651 -1.241 . . . . 0.0 107.651 175.571 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 102' ' ' ALA . . . . . . . . . . . . . . . -143.46 152.03 41.04 Favored 'General case' 0 C--O 1.235 0.336 0 C-N-CA 123.679 0.792 . . . . 0.0 109.7 164.126 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 103' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -151.61 173.92 14.07 Favored 'General case' 0 C--N 1.326 -0.448 0 C-N-CA 126.93 2.092 . . . . 0.0 108.735 179.631 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 104' ' ' ALA . . . . . . . . . . . . . . . -49.85 -19.19 0.62 Allowed 'General case' 0 CA--C 1.536 0.419 0 N-CA-C 115.44 1.644 . . . . 0.0 115.44 164.392 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 105' ' ' LYS . . . . . . . . . . . . . 23.8 mmtt -87.95 -74.15 0.46 Allowed 'General case' 0 N--CA 1.455 -0.19 0 CA-C-N 119.775 1.171 . . . . 0.0 109.245 172.67 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 106' ' ' GLN . . . . . . . . . . . . . 13.4 mt-30 -150.34 179.76 7.86 Favored 'General case' 0 N--CA 1.462 0.151 0 C-N-CA 124.644 1.178 . . . . 0.0 109.835 -160.862 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 107' ' ' THR . . . . . . . . . . . . . 3.5 t -135.22 125.51 26.36 Favored 'General case' 0 CA--C 1.538 0.506 0 C-N-CA 124.587 1.155 . . . . 0.0 109.699 177.777 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 108' ' ' LEU . . . . . . . . . . . . . 8.5 mp -119.44 149.02 42.56 Favored 'General case' 0 C--O 1.234 0.245 0 C-N-CA 126.746 2.018 . . . . 0.0 109.337 -172.257 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 109' ' ' THR . . . . . . . . . . . . . 32.2 m -121.27 124.69 45.24 Favored 'General case' 0 N--CA 1.451 -0.419 0 N-CA-C 108.338 -0.986 . . . . 0.0 108.338 -173.022 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 110' ' ' TYR . . . . . 0.446 ' HB2' ' HB3' ' A' ' 99' ' ' LEU . 32.3 m-85 -124.39 163.86 20.88 Favored 'General case' 0 CA--C 1.518 -0.272 0 N-CA-C 109.482 -0.562 . . . . 0.0 109.482 -179.98 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 111' ' ' LYS . . . . . 0.511 ' HE2' ' HB2' ' A' ' 113' ' ' ALA . 0.5 OUTLIER -128.0 140.08 52.18 Favored 'General case' 0 CA--C 1.514 -0.405 0 CA-C-O 117.54 -1.219 . . . . 0.0 108.883 -171.734 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' A' A ' 112' ' ' LEU . . . . . . . . . . . . . 28.9 tp -71.85 47.01 0.13 Allowed 'General case' 0 CA--C 1.54 0.592 0 C-N-CA 127.386 2.275 . . . . 0.0 110.079 175.078 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 113' ' ' ALA . . . . . 0.511 ' HB2' ' HE2' ' A' ' 111' ' ' LYS . . . -78.96 82.32 5.15 Favored 'General case' 0 N--CA 1.446 -0.644 0 N-CA-C 106.489 -1.671 . . . . 0.0 106.489 166.225 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 114' ' ' ASP . . . . . . . . . . . . . 45.1 t0 -89.07 88.59 7.62 Favored 'General case' 0 CA--C 1.506 -0.73 0 N-CA-C 107.421 -1.325 . . . . 0.0 107.421 173.908 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 115' ' ' LEU . . . . . . . . . . . . . 23.1 mt -108.76 4.83 24.11 Favored 'General case' 0 C--N 1.323 -0.545 0 CA-C-N 113.634 -1.621 . . . . 0.0 110.94 -175.374 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 116' ' ' MET . . . . . . . . . . . . . 9.1 ttp -175.82 156.53 1.83 Allowed 'General case' 0 C--O 1.238 0.46 0 C-N-CA 125.069 1.348 . . . . 0.0 110.084 -175.388 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 117' ' ' ASN . . . . . . . . . . . . . 0.9 OUTLIER . . . . . 0 N--CA 1.469 0.523 0 O-C-N 121.411 -0.806 . . . . 0.0 110.961 171.168 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 C--O 1.237 0.424 0 N-CA-C 110.069 -0.345 . . . . 0.0 110.069 . . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 2' ' ' VAL . . . . . . . . . . . . . 7.3 p -55.63 142.89 9.54 Favored 'Isoleucine or valine' 0 N--CA 1.447 -0.59 0 C-N-CA 124.133 0.973 . . . . 0.0 109.331 175.377 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 3' ' ' THR . . . . . . . . . . . . . 0.8 OUTLIER -130.74 162.88 52.44 Favored Pre-proline 0 C--N 1.327 -0.403 0 C-N-CA 124.953 1.301 . . . . 0.0 109.196 -176.939 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 4' ' ' PRO . . . . . . . . . . . . . 30.7 Cg_endo -65.53 -34.52 42.25 Favored 'Trans proline' 0 N--CA 1.457 -0.636 0 C-N-CA 122.275 1.984 . . . . 0.0 111.731 -178.579 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 5' ' ' GLU . . . . . . . . . . . . . 55.1 tt0 -58.63 -55.13 39.02 Favored 'General case' 0 C--N 1.322 -0.61 0 C-N-CA 124.731 1.212 . . . . 0.0 110.656 -177.156 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 6' ' ' GLN . . . . . . . . . . . . . 21.3 pt20 -66.35 12.65 0.06 Allowed 'General case' 0 CA--C 1.541 0.635 0 C-N-CA 125.348 1.459 . . . . 0.0 113.793 177.829 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 7' ' ' LEU . . . . . . . . . . . . . 82.4 mt -124.46 -47.19 1.86 Allowed 'General case' 0 N--CA 1.454 -0.238 0 C-N-CA 126.378 1.871 . . . . 0.0 110.456 177.815 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 8' ' ' GLN . . . . . . . . . . . . 0.259 3.3 pt20 -56.34 -14.53 2.98 Favored 'General case' 0 N--CA 1.472 0.66 0 N-CA-C 114.874 1.435 . . . . 0.0 114.874 -176.361 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 9' ' ' HIS . . . . . . . . . . . . . 10.6 m-70 -124.92 16.64 8.58 Favored 'General case' 0 C--N 1.32 -0.685 0 C-N-CA 124.489 1.116 . . . . 0.0 111.274 -174.811 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 10' ' ' HIS . . . . . . . . . . . . . 97.8 m-70 -142.53 121.3 12.67 Favored 'General case' 0 CA--C 1.541 0.63 0 C-N-CA 125.711 1.604 . . . . 0.0 110.805 -179.879 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 11' ' ' ARG . . . . . . . . . . . . . 4.4 ptm85 -78.67 160.18 27.64 Favored 'General case' 0 N--CA 1.467 0.397 0 C-N-CA 124.853 1.261 . . . . 0.0 109.578 174.164 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 12' ' ' PHE . . . . . . . . . . . . . 34.2 m-85 -140.03 134.74 31.84 Favored 'General case' 0 C--N 1.329 -0.286 0 C-N-CA 123.926 0.891 . . . . 0.0 110.664 -179.171 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 13' ' ' VAL . . . . . . . . . . . . . 11.0 p -120.88 144.21 30.55 Favored 'Isoleucine or valine' 0 C--O 1.233 0.226 0 O-C-N 121.192 -0.942 . . . . 0.0 110.149 -179.213 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 14' ' ' LEU . . . . . . . . . . . . . 35.0 tp -79.42 86.56 5.11 Favored 'General case' 0 C--N 1.332 -0.193 0 C-N-CA 124.959 1.304 . . . . 0.0 110.598 -169.383 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 4.0 mm-40 -55.44 -42.3 74.02 Favored 'General case' 0 C--O 1.235 0.322 0 C-N-CA 124.527 1.131 . . . . 0.0 111.022 176.169 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 22.3 t -155.11 142.98 19.98 Favored 'General case' 0 N--CA 1.452 -0.369 0 CA-C-O 121.918 0.866 . . . . 0.0 110.962 174.571 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 17' ' ' VAL . . . . . . . . . . . . . 44.3 t -67.2 171.15 0.85 Allowed 'Isoleucine or valine' 0 C--O 1.24 0.594 0 N-CA-C 107.235 -1.394 . . . . 0.0 107.235 159.42 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 18' ' ' ASN . . . . . . . . . . . . . 0.2 OUTLIER -46.65 -44.47 18.44 Favored 'General case' 0 CA--C 1.528 0.129 0 C-N-CA 124.245 1.018 . . . . 0.0 111.503 170.888 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . -86.73 -58.57 1.9 Allowed Glycine 0 N--CA 1.446 -0.649 0 O-C-N 124.223 0.952 . . . . 0.0 110.988 -166.421 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 24.3 mttt -149.42 166.15 15.95 Favored Pre-proline 0 C--O 1.238 0.493 0 C-N-CA 126.286 1.834 . . . . 0.0 110.449 -173.178 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 21' ' ' PRO . . . . . . . . . . . . . 42.4 Cg_endo -56.11 171.27 0.86 Allowed 'Trans proline' 0 N--CA 1.455 -0.793 0 C-N-CA 122.082 1.854 . . . . 0.0 111.897 164.329 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 22' ' ' VAL . . . . . . . . . . . . . 4.1 p -128.37 147.15 32.94 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.341 0 C-N-CA 124.775 1.23 . . . . 0.0 108.415 -178.757 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 23' ' ' THR . . . . . . . . . . . . . 1.4 p -110.61 145.57 37.64 Favored 'General case' 0 N--CA 1.452 -0.358 0 C-N-CA 124.734 1.214 . . . . 0.0 109.38 179.172 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 24' ' ' SER . . . . . . . . . . . . . 23.3 t -150.27 137.91 19.88 Favored 'General case' 0 N--CA 1.437 -1.096 0 C-N-CA 127.5 2.32 . . . . 0.0 105.247 176.483 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 25' ' ' ASP . . . . . . . . . . . . . 37.4 t70 -49.74 -59.27 3.97 Favored 'General case' 0 C--N 1.32 -0.706 0 C-N-CA 124.098 0.959 . . . . 0.0 111.905 171.875 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 26' ' ' LYS . . . . . . . . . . . . . 11.2 tttt -153.47 -3.58 0.2 Allowed 'General case' 0 N--CA 1.47 0.542 0 N-CA-C 113.946 1.091 . . . . 0.0 113.946 -175.97 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 27' ' ' ASN . . . . . . . . . . . . . 43.4 m-80 -127.02 83.36 66.2 Favored Pre-proline 0 C--O 1.234 0.263 0 N-CA-C 107.543 -1.28 . . . . 0.0 107.543 -176.249 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 28' ' ' PRO . . . . . . . . . . . . . 49.2 Cg_endo -65.77 162.86 32.86 Favored 'Trans proline' 0 N--CA 1.453 -0.909 0 C-N-CA 121.817 1.678 . . . . 0.0 110.633 -176.559 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 29' ' ' PRO . . . . . . . . . . . . . 30.0 Cg_endo -65.29 84.8 0.2 Allowed 'Trans proline' 0 N--CA 1.449 -1.131 0 C-N-CA 122.437 2.091 . . . . 0.0 108.512 162.913 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 30' ' ' GLU . . . . . . . . . . . . . 11.6 pt-20 -105.49 162.21 13.67 Favored 'General case' 0 C--O 1.241 0.622 0 C-N-CA 124.337 1.055 . . . . 0.0 108.31 169.709 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 31' ' ' ILE . . . . . . . . . . . . . 20.2 tt -138.53 137.19 43.63 Favored 'Isoleucine or valine' 0 N--CA 1.447 -0.622 0 C-N-CA 127.606 2.363 . . . . 0.0 105.501 177.894 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 32' ' ' SER . . . . . . . . . . . . . 1.5 m -131.39 163.72 27.26 Favored 'General case' 0 N--CA 1.447 -0.622 0 N-CA-C 107.974 -1.121 . . . . 0.0 107.974 174.159 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 33' ' ' PHE . . . . . . . . . . . . . 35.3 m-85 -131.65 166.6 21.1 Favored 'General case' 0 N--CA 1.445 -0.679 0 N-CA-C 107.097 -1.446 . . . . 0.0 107.097 -179.698 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 34' ' ' GLY . . . . . . . . . . . . . . . 166.93 141.15 3.07 Favored Glycine 0 CA--C 1.503 -0.659 0 N-CA-C 108.208 -1.957 . . . . 0.0 108.208 -174.966 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 35' ' ' GLU . . . . . . . . . . . . . 90.8 mt-10 59.64 108.83 0.02 OUTLIER 'General case' 0 C--O 1.222 -0.348 0 C-N-CA 127.698 2.399 . . . . 0.0 110.675 -176.612 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 35.5 mtpt 61.48 12.31 4.33 Favored 'General case' 0 N--CA 1.473 0.701 0 N-CA-C 115.312 1.597 . . . . 0.0 115.312 169.486 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 37' ' ' MET . . . . . . . . . . . . . 13.5 mmm 58.06 49.84 10.97 Favored 'General case' 0 CA--C 1.537 0.479 0 C-N-CA 124.35 1.06 . . . . 0.0 112.488 -161.097 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 38' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -63.27 167.13 5.48 Favored 'General case' 0 N--CA 1.452 -0.346 0 O-C-N 120.624 -1.298 . . . . 0.0 109.279 150.017 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 39' ' ' ILE . . . . . . . . . . . . . 10.3 mt -132.61 133.46 59.53 Favored 'Isoleucine or valine' 0 C--O 1.238 0.477 0 C-N-CA 125.503 1.521 . . . . 0.0 107.214 -179.223 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 40' ' ' SER . . . . . . . . . . . . . 16.4 m -131.47 151.84 51.22 Favored 'General case' 0 C--N 1.33 -0.268 0 N-CA-C 106.887 -1.523 . . . . 0.0 106.887 156.361 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 41' ' ' GLY . . . . . . . . . . . . . . . -178.06 178.42 48.51 Favored Glycine 0 N--CA 1.446 -0.699 0 N-CA-C 109.767 -1.333 . . . . 0.0 109.767 174.158 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 42' ' ' SER . . . . . . . . . . . . . 6.1 p -151.95 84.53 1.28 Allowed 'General case' 0 N--CA 1.445 -0.687 0 N-CA-C 108.978 -0.749 . . . . 0.0 108.978 -169.673 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 43' ' ' MET . . . . . . . . . . . . . 17.5 mmm -60.81 -46.38 90.73 Favored 'General case' 0 C--N 1.341 0.228 0 N-CA-C 108.43 -0.952 . . . . 0.0 108.43 169.726 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 44' ' ' CYS . . . . . 1.282 ' SG ' ' SG ' ' A' ' 70' ' ' CYS . 2.2 t -159.84 -66.93 0.07 Allowed 'General case' 0 N--CA 1.433 -1.319 0 N-CA-C 105.14 -2.17 . . . . 0.0 105.14 165.559 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 45' ' ' ASN . . . . . . . . . . . . . 5.0 m-80 -74.63 10.96 1.14 Allowed 'General case' 0 N--CA 1.471 0.595 0 C-N-CA 125.633 1.573 . . . . 0.0 114.682 -166.89 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 46' ' ' ARG . . . . . . . . . . . . . 6.7 mmm-85 56.46 164.79 0.02 OUTLIER 'General case' 0 C--N 1.332 -0.195 0 C-N-CA 126.671 1.988 . . . . 0.0 112.695 -169.329 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 47' ' ' PHE . . . . . . . . . . . . . 53.0 p90 -167.05 165.21 15.84 Favored 'General case' 0 C--N 1.325 -0.496 0 C-N-CA 125.561 1.544 . . . . 0.0 107.727 178.403 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 48' ' ' SER . . . . . . . . . . . . . 0.5 OUTLIER -168.54 141.37 2.93 Favored 'General case' 0 C--N 1.329 -0.303 0 C-N-CA 125.611 1.564 . . . . 0.0 107.742 171.688 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 49' ' ' GLY . . . . . . . . . . . . . . . -152.94 163.33 30.44 Favored Glycine 0 CA--C 1.53 1.028 0 N-CA-C 111.019 -0.832 . . . . 0.0 111.019 175.21 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 50' ' ' GLU . . . . . . . . . . . . . 9.9 pt-20 -63.76 83.18 0.03 OUTLIER 'General case' 0 CA--C 1.538 0.504 0 C-N-CA 128.258 2.623 . . . . 0.0 110.038 172.432 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 51' ' ' GLY . . . . . . . . . . . . . . . -63.8 -76.79 0.26 Allowed Glycine 0 N--CA 1.466 0.635 0 O-C-N 121.386 -0.821 . . . . 0.0 113.355 -166.754 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 52' ' ' LYS . . . . . . . . . . . . . 3.4 ttpm? 57.33 126.94 0.0 OUTLIER 'General case' 0 C--N 1.331 -0.208 0 C-N-CA 130.631 3.573 . . . . 0.0 112.797 176.518 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 53' ' ' LEU . . . . . . . . . . . . . 32.4 tp -125.07 119.45 28.67 Favored 'General case' 0 N--CA 1.467 0.405 0 O-C-N 121.643 -0.661 . . . . 0.0 110.339 -174.341 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 10.0 t -145.1 -17.09 0.5 Allowed 'General case' 0 CA--C 1.539 0.551 0 C-N-CA 125.185 1.394 . . . . 0.0 110.692 178.703 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 55' ' ' ASN . . . . . . . . . . . . . 6.6 m-20 -129.3 6.65 5.33 Favored 'General case' 0 CA--C 1.536 0.416 0 CA-C-N 119.331 0.969 . . . . 0.0 112.275 -159.734 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 56' ' ' GLY . . . . . . . . . . . . . . . 75.06 4.66 73.25 Favored Glycine 0 CA--C 1.532 1.124 0 O-C-N 121.451 -0.781 . . . . 0.0 112.237 -165.792 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 57' ' ' GLU . . . . . . . . . . . . . 33.2 tt0 -121.03 131.24 54.16 Favored 'General case' 0 C--O 1.234 0.28 0 CA-C-N 118.443 1.121 . . . . 0.0 108.698 -169.052 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 58' ' ' LEU . . . . . . . . . . . . . 47.0 tp -116.65 98.64 6.64 Favored 'General case' 0 C--O 1.236 0.352 0 C-N-CA 124.814 1.246 . . . . 0.0 108.864 173.713 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 59' ' ' THR . . . . . . . . . . . . . 2.1 p -85.34 169.73 13.44 Favored 'General case' 0 C--N 1.327 -0.379 0 C-N-CA 123.961 0.904 . . . . 0.0 111.945 172.492 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 60' ' ' ALA . . . . . . . . . . . . . . . -142.94 103.76 4.22 Favored 'General case' 0 N--CA 1.455 -0.18 0 C-N-CA 125.995 1.718 . . . . 0.0 109.437 148.567 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 61' ' ' LYS . . . . . . . . . . . . . 45.5 tttt -69.23 -18.45 63.88 Favored 'General case' 0 CA--C 1.542 0.672 0 CA-C-O 118.892 -0.575 . . . . 0.0 111.988 173.598 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 62' ' ' GLY . . . . . . . . . . . . . . . -102.84 -83.85 1.75 Allowed Glycine 0 CA--C 1.526 0.73 0 C-N-CA 124.521 1.058 . . . . 0.0 110.764 176.382 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 63' ' ' LEU . . . . . . . . . . . . . 2.4 tp 65.03 79.06 0.26 Allowed 'General case' 0 N--CA 1.448 -0.546 0 C-N-CA 129.442 3.097 . . . . 0.0 114.379 -178.003 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 64' ' ' ALA . . . . . . . . . . . . . . . -70.09 92.65 0.76 Allowed 'General case' 0 CA--C 1.539 0.525 0 C-N-CA 125.121 1.368 . . . . 0.0 112.367 178.591 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 65' ' ' MET . . . . . . . . . . . . . 52.8 mtp -99.22 173.81 6.61 Favored 'General case' 0 N--CA 1.472 0.628 0 C-N-CA 124.649 1.18 . . . . 0.0 111.45 176.205 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 66' ' ' THR . . . . . . . . . . . . . 5.5 p -115.76 -164.84 0.98 Allowed 'General case' 0 CA--C 1.547 0.836 0 C-N-CA 124.725 1.21 . . . . 0.0 112.104 -178.429 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 67' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -141.26 31.53 1.73 Allowed 'General case' 0 N--CA 1.474 0.772 0 C-N-CA 126.449 1.9 . . . . 0.0 112.332 -173.265 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 68' ' ' MET . . . . . . . . . . . . . 76.6 mtm -76.71 179.97 5.72 Favored 'General case' 0 CA--C 1.545 0.785 0 C-N-CA 125.302 1.441 . . . . 0.0 109.969 173.079 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 69' ' ' MET . . . . . . . . . . . . . 1.5 mpp? -110.91 168.63 9.34 Favored 'General case' 0 C--O 1.237 0.417 0 C-N-CA 128.415 2.686 . . . . 0.0 109.702 172.915 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 70' ' ' CYS . . . . . 1.282 ' SG ' ' SG ' ' A' ' 44' ' ' CYS . 1.7 m -140.12 150.26 44.05 Favored 'General case' 0 N--CA 1.469 0.487 0 C-N-CA 125.161 1.384 . . . . 0.0 112.427 176.522 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 71' ' ' ALA . . . . . . . . . . . . . . . -70.29 -10.96 60.47 Favored 'General case' 0 CA--C 1.534 0.354 0 C-N-CA 126.039 1.736 . . . . 0.0 114.91 -174.443 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 72' ' ' ASN . . . . . . . . . . . . . 61.3 t30 -135.67 142.53 41.22 Favored Pre-proline 0 C--O 1.235 0.303 0 N-CA-C 105.756 -1.942 . . . . 0.0 105.756 177.716 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 73' ' ' PRO . . . . . . . . . . . . . 87.2 Cg_endo -84.56 -23.95 2.55 Favored 'Trans proline' 0 N--CA 1.458 -0.575 0 CA-C-N 120.536 1.227 . . . . 0.0 111.384 -163.862 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 74' ' ' GLN . . . . . . . . . . . . . 57.4 tt0 -60.06 -43.63 95.29 Favored 'General case' 0 N--CA 1.452 -0.332 0 C-N-CA 123.574 0.75 . . . . 0.0 109.004 175.311 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 75' ' ' LEU . . . . . . . . . . . . . 65.3 mt -59.25 -45.91 89.91 Favored 'General case' 0 C--N 1.341 0.199 0 CA-C-N 118.213 0.461 . . . . 0.0 110.309 178.726 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 76' ' ' ASN . . . . . . . . . . . . . 27.2 t-20 -64.83 -49.63 69.85 Favored 'General case' 0 C--O 1.222 -0.368 0 N-CA-C 108.892 -0.781 . . . . 0.0 108.892 -176.768 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 77' ' ' GLU . . . . . . . . . . . . . 8.4 tt0 -56.61 -34.5 67.29 Favored 'General case' 0 CA--C 1.537 0.471 0 C-N-CA 125.392 1.477 . . . . 0.0 112.754 -178.961 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 78' ' ' LEU . . . . . . . . . . . . . 3.5 mp -67.51 -14.01 62.56 Favored 'General case' 0 C--O 1.236 0.348 0 C-N-CA 125.056 1.343 . . . . 0.0 112.758 -179.574 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 79' ' ' ASP . . . . . . . . . . . . . 5.0 p-10 -60.23 -38.0 82.05 Favored 'General case' 0 CA--C 1.52 -0.196 0 CA-C-N 119.217 0.917 . . . . 0.0 111.531 176.355 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 80' ' ' ASN . . . . . . . . . . . . . 63.3 m-20 -77.26 -38.81 50.17 Favored 'General case' 0 N--CA 1.445 -0.675 0 CA-C-O 118.11 -0.948 . . . . 0.0 109.999 178.02 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 81' ' ' THR . . . . . . . . . . . . . 41.7 m -54.62 -52.76 61.22 Favored 'General case' 0 C--N 1.341 0.199 0 CA-C-N 118.983 0.81 . . . . 0.0 109.73 179.336 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 82' ' ' ILE . . . . . . . . . . . . . 9.6 tp -65.63 -36.89 78.69 Favored 'Isoleucine or valine' 0 CA--C 1.531 0.216 0 CA-C-N 118.842 0.746 . . . . 0.0 110.273 -175.182 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 83' ' ' SER . . . . . . . . . . . . . 10.8 t -58.11 -49.33 77.32 Favored 'General case' 0 C--O 1.234 0.269 0 CA-C-N 117.994 0.361 . . . . 0.0 110.897 174.819 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 84' ' ' GLU . . . . . . . . . . . . . 78.1 tt0 -78.18 -7.64 57.32 Favored 'General case' 0 C--N 1.327 -0.411 0 C-N-CA 126.593 1.957 . . . . 0.0 111.62 -175.557 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 85' ' ' MET . . . . . . . . . . . . . 81.5 mtp -90.28 -52.19 5.06 Favored 'General case' 0 CA--C 1.515 -0.371 0 CA-C-N 120.999 1.727 . . . . 0.0 110.373 167.243 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 86' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -66.47 -29.67 69.85 Favored 'General case' 0 N--CA 1.453 -0.293 0 CA-C-O 118.816 -0.612 . . . . 0.0 110.882 -169.387 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 87' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -58.84 -56.82 17.29 Favored 'General case' 0 N--CA 1.452 -0.357 0 CA-C-N 119.345 0.975 . . . . 0.0 112.405 -171.933 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 88' ' ' GLU . . . . . . . . . . . . . 81.1 mt-10 -73.39 -34.98 65.81 Favored 'General case' 0 C--N 1.331 -0.204 0 C-N-CA 123.137 0.575 . . . . 0.0 110.855 -175.327 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 89' ' ' GLY . . . . . . . . . . . . . . . 123.13 104.35 1.71 Allowed Glycine 0 C--N 1.333 0.365 0 N-CA-C 107.373 -2.291 . . . . 0.0 107.373 -176.108 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 90' ' ' ALA . . . . . . . . . . . . . . . -74.96 137.15 41.42 Favored 'General case' 0 N--CA 1.451 -0.424 0 N-CA-C 107.873 -1.158 . . . . 0.0 107.873 170.768 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 91' ' ' GLN . . . . . . . . . . . . . 17.9 mp0 -65.83 121.98 16.28 Favored 'General case' 0 N--CA 1.442 -0.844 0 N-CA-C 104.738 -2.319 . . . . 0.0 104.738 159.369 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 92' ' ' VAL . . . . . . . . . . . . . 25.2 t -107.33 119.91 57.76 Favored 'Isoleucine or valine' 0 N--CA 1.44 -0.968 0 N-CA-C 104.83 -2.285 . . . . 0.0 104.83 174.229 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 93' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -134.33 104.04 5.98 Favored 'General case' 0 N--CA 1.452 -0.338 0 N-CA-C 107.049 -1.463 . . . . 0.0 107.049 176.773 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 94' ' ' LEU . . . . . . . . . . . . . 27.1 tp -98.2 118.49 34.95 Favored 'General case' 0 CA--C 1.515 -0.39 0 N-CA-C 106.823 -1.547 . . . . 0.0 106.823 173.854 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 95' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -80.71 -165.4 0.88 Allowed 'General case' 0 C--N 1.323 -0.569 0 C-N-CA 124.429 1.091 . . . . 0.0 109.494 165.846 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 96' ' ' ALA . . . . . . . . . . . . . . . -47.74 -52.13 19.67 Favored 'General case' 0 CA--C 1.541 0.633 0 O-C-N 120.524 -1.36 . . . . 0.0 113.143 -179.887 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 97' ' ' ASN . . . . . . . . . . . . . 0.0 OUTLIER -135.26 8.52 3.43 Favored 'General case' 0 N--CA 1.478 0.961 0 N-CA-C 114.05 1.129 . . . . 0.0 114.05 -177.942 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 98' ' ' GLN . . . . . . . . . . . . . 18.4 tt0 -136.79 124.78 22.79 Favored 'General case' 0 N--CA 1.453 -0.294 0 O-C-N 121.233 -0.917 . . . . 0.0 109.371 -170.111 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 99' ' ' LEU . . . . . 0.461 HD22 ' CD2' ' A' ' 101' ' ' LEU . 1.0 OUTLIER -88.45 142.24 27.88 Favored 'General case' 0 N--CA 1.449 -0.515 0 C-N-CA 125.453 1.501 . . . . 0.0 109.229 175.521 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild full ' A' A ' 100' ' ' THR . . . . . . . . . . . . . 79.3 m -122.99 115.55 22.07 Favored 'General case' 0 C--N 1.322 -0.622 0 N-CA-C 105.436 -2.061 . . . . 0.0 105.436 171.685 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 101' ' ' LEU . . . . . 0.461 ' CD2' HD22 ' A' ' 99' ' ' LEU . 0.6 OUTLIER -112.93 101.35 9.41 Favored 'General case' 0 CA--C 1.51 -0.585 0 C-N-CA 126.109 1.764 . . . . 0.0 107.153 -179.05 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild full ' A' A ' 102' ' ' ALA . . . . . . . . . . . . . . . -117.69 152.49 35.12 Favored 'General case' 0 C--N 1.326 -0.444 0 C-N-CA 123.284 0.634 . . . . 0.0 109.59 -177.622 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 103' ' ' THR . . . . . . . . . . . . . 0.4 OUTLIER -159.09 176.12 12.66 Favored 'General case' 0 N--CA 1.44 -0.97 0 C-N-CA 126.481 1.912 . . . . 0.0 106.659 176.147 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 104' ' ' ALA . . . . . . . . . . . . . . . -62.58 -14.01 37.82 Favored 'General case' 0 CA--C 1.536 0.424 0 N-CA-C 113.338 0.866 . . . . 0.0 113.338 173.669 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 105' ' ' LYS . . . . . . . . . . . . . 12.6 tppt? -73.79 -75.76 0.14 Allowed 'General case' 0 N--CA 1.437 -1.084 0 C-N-CA 125.302 1.441 . . . . 0.0 107.461 176.154 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 106' ' ' GLN . . . . . . . . . . . . . 14.5 mt-30 -165.27 178.78 6.66 Favored 'General case' 0 CA--C 1.542 0.646 0 C-N-CA 128.605 2.762 . . . . 0.0 104.834 -169.213 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 107' ' ' THR . . . . . . . . . . . . . 4.6 t -131.42 141.85 49.92 Favored 'General case' 0 CA--C 1.539 0.547 0 C-N-CA 124.796 1.238 . . . . 0.0 110.237 -173.533 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 108' ' ' LEU . . . . . . . . . . . . . 8.9 mp -126.21 154.34 43.41 Favored 'General case' 0 C--O 1.234 0.265 0 C-N-CA 128.419 2.687 . . . . 0.0 108.596 -171.146 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 109' ' ' THR . . . . . . . . . . . . . 27.2 m -123.01 117.74 26.17 Favored 'General case' 0 N--CA 1.466 0.363 0 C-N-CA 123.409 0.684 . . . . 0.0 109.238 173.911 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 110' ' ' TYR . . . . . . . . . . . . . 73.9 m-85 -108.86 160.72 15.76 Favored 'General case' 0 CA--C 1.539 0.523 0 C-N-CA 123.461 0.704 . . . . 0.0 109.508 174.772 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 111' ' ' LYS . . . . . . . . . . . . . 2.1 tppt? -114.83 147.69 39.5 Favored 'General case' 0 N--CA 1.467 0.413 0 C-N-CA 124.603 1.161 . . . . 0.0 110.068 -178.944 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 112' ' ' LEU . . . . . . . . . . . . . 23.9 tp -73.43 38.33 0.09 Allowed 'General case' 0 CA--C 1.542 0.654 0 C-N-CA 127.379 2.272 . . . . 0.0 111.871 171.76 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 113' ' ' ALA . . . . . . . . . . . . . . . -77.05 88.06 3.56 Favored 'General case' 0 C--N 1.324 -0.535 0 O-C-N 119.234 -2.166 . . . . 0.0 109.453 -176.878 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 114' ' ' ASP . . . . . . . . . . . . 0.31 29.8 p-10 -105.3 55.99 0.69 Allowed 'General case' 0 N--CA 1.464 0.264 0 CA-C-O 123.712 1.72 . . . . 0.0 113.324 -173.134 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 115' ' ' LEU . . . . . 0.555 ' H ' HD23 ' A' ' 115' ' ' LEU . 0.1 OUTLIER -64.29 4.64 0.33 Allowed 'General case' 0 CA--C 1.54 0.571 0 C-N-CA 129.331 3.052 . . . . 0.0 114.726 174.175 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild full ' A' A ' 116' ' ' MET . . . . . . . . . . . . . 4.2 ppp? -78.6 -20.05 51.32 Favored 'General case' 0 C--N 1.325 -0.484 0 O-C-N 120.777 -1.202 . . . . 0.0 110.304 169.104 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 117' ' ' ASN . . . . . . . . . . . . . 3.9 p-10 . . . . . 0 N--CA 1.452 -0.348 0 N-CA-C 109.091 -0.707 . . . . 0.0 109.091 175.814 . . . . . . . . 0 0 . 1 . 017 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 24.6 tpp . . . . . 0 C--O 1.24 0.597 0 N-CA-C 108.895 -0.78 . . . . 0.0 108.895 . . . . . . . . . 0 0 . 1 . 017 nuclear nobuild full ' A' A ' 2' ' ' VAL . . . . . . . . . . . . . 10.0 p -53.9 118.71 1.25 Allowed 'Isoleucine or valine' 0 N--CA 1.449 -0.485 0 C-N-CA 123.884 0.873 . . . . 0.0 109.128 -178.016 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 3' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -128.56 157.53 74.71 Favored Pre-proline 0 N--CA 1.449 -0.501 0 N-CA-C 109.287 -0.634 . . . . 0.0 109.287 -167.776 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 4' ' ' PRO . . . . . . . . . . . . . 21.7 Cg_endo -63.62 -48.45 5.66 Favored 'Trans proline' 0 N--CA 1.456 -0.691 0 C-N-CA 122.74 2.293 . . . . 0.0 111.787 -176.469 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 5' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER -68.17 -12.66 61.32 Favored 'General case' 0 C--N 1.325 -0.491 0 N-CA-C 113.722 1.008 . . . . 0.0 113.722 -173.007 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 6' ' ' GLN . . . . . . . . . . . . . 11.1 pt20 -93.85 15.21 17.18 Favored 'General case' 0 CA--C 1.54 0.566 0 N-CA-C 113.908 1.077 . . . . 0.0 113.908 167.442 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 7' ' ' LEU . . . . . . . . . . . . . 90.6 mt -129.88 -44.76 1.18 Allowed 'General case' 0 N--CA 1.469 0.508 0 C-N-CA 124.569 1.148 . . . . 0.0 111.949 -175.639 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 8' ' ' GLN . . . . . . . . . . . . . 1.5 mp0 -56.64 2.32 0.02 OUTLIER 'General case' 0 N--CA 1.472 0.671 0 N-CA-C 118.353 2.723 . . . . 0.0 118.353 -176.059 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 9' ' ' HIS . . . . . . . . . . . . . 5.7 m-70 -139.66 10.58 2.46 Favored 'General case' 0 C--N 1.319 -0.739 0 C-N-CA 127.946 2.498 . . . . 0.0 112.516 179.95 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 10' ' ' HIS . . . . . . . . . . . . . 27.8 m-70 -133.25 110.54 10.17 Favored 'General case' 0 N--CA 1.455 -0.214 0 C-N-CA 124.153 0.981 . . . . 0.0 108.687 -161.462 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 11' ' ' ARG . . . . . 0.442 ' HD3' ' H ' ' A' ' 115' ' ' LEU . 20.7 ttt-85 -68.74 147.11 52.28 Favored 'General case' 0 N--CA 1.465 0.315 0 N-CA-C 108.444 -0.947 . . . . 0.0 108.444 172.915 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 12' ' ' PHE . . . . . . . . . . . . . 46.5 m-85 -127.83 161.07 29.87 Favored 'General case' 0 N--CA 1.45 -0.448 0 N-CA-C 107.648 -1.242 . . . . 0.0 107.648 165.502 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 13' ' ' VAL . . . . . 0.425 ' HA ' ' HA ' ' A' ' 30' ' ' GLU . 7.5 p -131.44 143.17 41.33 Favored 'Isoleucine or valine' 0 CA--C 1.512 -0.484 0 N-CA-C 108.188 -1.041 . . . . 0.0 108.188 172.045 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 14' ' ' LEU . . . . . . . . . . . . . 5.6 tt -70.04 110.19 4.96 Favored 'General case' 0 N--CA 1.441 -0.903 0 N-CA-C 107.874 -1.158 . . . . 0.0 107.874 179.977 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 15' ' ' GLU . . . . . 0.432 ' H ' ' HA ' ' A' ' 110' ' ' TYR . 3.1 tt0 -86.0 -42.05 14.33 Favored 'General case' 0 N--CA 1.438 -1.043 0 O-C-N 124.013 0.821 . . . . 0.0 110.217 -169.371 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 12.6 p -154.33 142.81 20.66 Favored 'General case' 0 N--CA 1.448 -0.555 0 CA-C-O 121.735 0.779 . . . . 0.0 109.834 168.369 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 17' ' ' VAL . . . . . 0.574 HG12 ' H ' ' A' ' 18' ' ' ASN . 23.2 t -75.62 175.08 0.76 Allowed 'Isoleucine or valine' 0 CA--C 1.536 0.409 0 N-CA-C 107.028 -1.471 . . . . 0.0 107.028 168.401 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 18' ' ' ASN . . . . . 0.574 ' H ' HG12 ' A' ' 17' ' ' VAL . 10.6 t30 -43.9 -51.6 7.44 Favored 'General case' 0 C--N 1.34 0.194 0 C-N-CA 124.533 1.133 . . . . 0.0 112.628 -171.554 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . -78.29 -66.21 1.77 Allowed Glycine 0 N--CA 1.444 -0.812 0 O-C-N 123.725 0.641 . . . . 0.0 111.609 176.28 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 0.8 OUTLIER -139.68 165.75 29.06 Favored Pre-proline 0 CA--C 1.532 0.259 0 CA-C-N 117.752 0.776 . . . . 0.0 112.917 -159.126 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 21' ' ' PRO . . . . . . . . . . . . . 56.5 Cg_endo -61.46 -176.9 0.19 Allowed 'Trans proline' 0 N--CA 1.457 -0.654 0 C-N-CA 124.094 3.196 . . . . 0.0 113.185 176.627 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 22' ' ' VAL . . . . . . . . . . . . . 81.6 t -120.86 155.36 24.36 Favored 'Isoleucine or valine' 0 N--CA 1.448 -0.544 0 C-N-CA 126.576 1.95 . . . . 0.0 109.208 -179.227 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 23' ' ' THR . . . . . . . . . . . . . 11.3 t -141.17 114.36 8.63 Favored 'General case' 0 C--O 1.235 0.292 0 CA-C-O 123.259 1.504 . . . . 0.0 111.844 168.169 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 24' ' ' SER . . . . . . . . . . . . . 39.1 t -158.18 94.91 1.33 Allowed 'General case' 0 C--N 1.319 -0.74 0 N-CA-C 105.017 -2.216 . . . . 0.0 105.017 172.433 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 25' ' ' ASP . . . . . . . . . . . . . 0.7 OUTLIER -80.06 38.97 0.42 Allowed 'General case' 0 N--CA 1.468 0.451 0 C-N-CA 125.467 1.507 . . . . 0.0 110.552 -176.297 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 26' ' ' LYS . . . . . . . . . . . . . 33.0 ttpt -151.28 -46.73 0.11 Allowed 'General case' 0 CA--C 1.508 -0.654 0 O-C-N 120.268 -1.52 . . . . 0.0 112.083 178.181 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 27' ' ' ASN . . . . . . . . . . . . . 0.0 OUTLIER -150.79 83.27 5.8 Favored Pre-proline 0 C--N 1.319 -0.739 0 N-CA-C 106.708 -1.59 . . . . 0.0 106.708 176.644 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 28' ' ' PRO . . . . . . . . . . . . . 75.2 Cg_endo -71.19 170.74 17.48 Favored 'Trans proline' 0 N--CA 1.454 -0.83 0 C-N-CA 122.171 1.914 . . . . 0.0 109.257 167.561 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 29' ' ' PRO . . . . . . . . . . . . . 37.6 Cg_endo -70.85 63.91 2.43 Favored 'Trans proline' 0 N--CA 1.457 -0.656 0 C-N-CA 124.065 3.177 . . . . 0.0 111.063 173.469 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 30' ' ' GLU . . . . . 0.425 ' HA ' ' HA ' ' A' ' 13' ' ' VAL . 2.4 pt-20 -78.66 168.82 19.2 Favored 'General case' 0 C--O 1.239 0.505 0 O-C-N 120.09 -1.631 . . . . 0.0 109.2 172.608 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 31' ' ' ILE . . . . . . . . . . . . . 14.4 tt -144.16 152.68 15.62 Favored 'Isoleucine or valine' 0 C--O 1.237 0.434 0 N-CA-C 107.641 -1.244 . . . . 0.0 107.641 -177.202 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 32' ' ' SER . . . . . . . . . . . . . 41.1 p -147.09 165.89 28.55 Favored 'General case' 0 N--CA 1.444 -0.747 0 CA-C-O 121.666 0.746 . . . . 0.0 109.372 178.154 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 33' ' ' PHE . . . . . . . . . . . . . 78.5 m-85 -146.13 125.67 13.27 Favored 'General case' 0 N--CA 1.445 -0.713 0 N-CA-C 105.623 -1.992 . . . . 0.0 105.623 -168.373 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 34' ' ' GLY . . . . . . . . . . . . . . . -156.19 167.13 33.31 Favored Glycine 0 CA--C 1.53 1.02 0 N-CA-C 109.631 -1.387 . . . . 0.0 109.631 160.729 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 35' ' ' GLU . . . . . . . . . . . . . 4.6 mt-10 56.54 89.63 0.04 OUTLIER 'General case' 0 N--CA 1.468 0.438 0 C-N-CA 126.945 2.098 . . . . 0.0 113.869 168.641 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 44.3 mtmt 74.14 32.35 1.03 Allowed 'General case' 0 N--CA 1.474 0.769 0 C-N-CA 127.472 2.309 . . . . 0.0 113.204 176.097 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 37' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER 59.03 33.86 23.21 Favored 'General case' 0 CA--C 1.54 0.585 0 C-N-CA 123.791 0.836 . . . . 0.0 110.21 -176.931 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 38' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -67.5 171.38 6.22 Favored 'General case' 0 N--CA 1.453 -0.278 0 O-C-N 120.902 -1.124 . . . . 0.0 111.115 170.535 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 39' ' ' ILE . . . . . . . . . . . . . 27.6 mt -137.33 109.34 6.72 Favored 'Isoleucine or valine' 0 C--O 1.235 0.325 0 N-CA-C 108.061 -1.089 . . . . 0.0 108.061 -176.452 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 40' ' ' SER . . . . . . . . . . . . . 34.7 m -90.1 137.93 31.94 Favored 'General case' 0 C--N 1.33 -0.246 0 C-N-CA 123.601 0.76 . . . . 0.0 109.027 158.642 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 41' ' ' GLY . . . . . . . . . . . . . . . -160.6 -179.33 35.29 Favored Glycine 0 CA--C 1.525 0.668 0 N-CA-C 110.254 -1.139 . . . . 0.0 110.254 165.257 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 42' ' ' SER . . . . . 0.508 ' HB3' ' HA ' ' A' ' 46' ' ' ARG . 1.8 p -160.34 92.78 1.0 Allowed 'General case' 0 N--CA 1.454 -0.24 0 CA-C-N 118.841 1.32 . . . . 0.0 111.254 174.439 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 43' ' ' MET . . . . . . . . . . . . . 9.2 mmt -64.73 -66.94 0.48 Allowed 'General case' 0 C--O 1.232 0.149 0 N-CA-C 109.498 -0.556 . . . . 0.0 109.498 175.316 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 44' ' ' CYS . . . . . 1.283 ' SG ' ' SG ' ' A' ' 70' ' ' CYS . 44.8 t -132.72 -59.83 0.89 Allowed 'General case' 0 N--CA 1.452 -0.358 0 N-CA-C 106.426 -1.694 . . . . 0.0 106.426 168.449 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 45' ' ' ASN . . . . . . . . . . . . . 4.8 m120 -80.34 27.56 0.34 Allowed 'General case' 0 C--N 1.328 -0.329 0 C-N-CA 128.665 2.786 . . . . 0.0 112.064 -165.453 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 46' ' ' ARG . . . . . 0.508 ' HA ' ' HB3' ' A' ' 42' ' ' SER . 0.0 OUTLIER 52.55 -166.19 0.06 Allowed 'General case' 0 C--N 1.327 -0.41 0 C-N-CA 124.769 1.228 . . . . 0.0 108.021 -157.275 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild full ' A' A ' 47' ' ' PHE . . . . . 0.481 ' HA ' ' HB3' ' A' ' 65' ' ' MET . 6.3 p90 -178.42 170.43 1.69 Allowed 'General case' 0 C--O 1.237 0.446 0 C-N-CA 129.19 2.996 . . . . 0.0 107.984 147.616 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 48' ' ' SER . . . . . . . . . . . . . 1.5 p -166.1 160.63 16.53 Favored 'General case' 0 C--N 1.322 -0.6 0 C-N-CA 126.192 1.797 . . . . 0.0 108.751 178.153 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 49' ' ' GLY . . . . . . . . . . . . . . . 177.83 163.1 28.98 Favored Glycine 0 C--N 1.332 0.337 0 N-CA-C 110.721 -0.951 . . . . 0.0 110.721 163.16 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 50' ' ' GLU . . . . . . . . . . . . . 11.1 pt-20 -68.52 100.31 1.09 Allowed 'General case' 0 N--CA 1.449 -0.493 0 CA-C-O 122.048 0.928 . . . . 0.0 108.721 173.525 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 51' ' ' GLY . . . . . . . . . . . . . . . -77.04 171.88 55.14 Favored Glycine 0 CA--C 1.529 0.945 0 C-N-CA 124.224 0.916 . . . . 0.0 111.912 171.421 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 52' ' ' LYS . . . . . . . . . . . . . 6.2 ttpm? -156.9 148.62 22.57 Favored 'General case' 0 N--CA 1.464 0.247 0 C-N-CA 124.916 1.287 . . . . 0.0 108.066 166.444 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 53' ' ' LEU . . . . . . . . . . . . . 50.7 tp -148.37 142.65 26.18 Favored 'General case' 0 C--N 1.338 0.069 0 C-N-CA 124.512 1.125 . . . . 0.0 109.141 174.655 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 23.1 t -156.21 -61.88 0.1 Allowed 'General case' 0 CA--C 1.535 0.393 0 C-N-CA 125.389 1.475 . . . . 0.0 107.792 173.599 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 55' ' ' ASN . . . . . . . . . . . . . 20.7 p-10 -65.46 -58.67 5.25 Favored 'General case' 0 N--CA 1.464 0.265 0 C-N-CA 125.711 1.604 . . . . 0.0 113.016 177.818 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 56' ' ' GLY . . . . . . . . . . . . . . . 150.96 14.16 0.08 OUTLIER Glycine 0 CA--C 1.529 0.944 0 C-N-CA 123.489 0.566 . . . . 0.0 111.911 -163.573 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 57' ' ' GLU . . . . . . . . . . . . . 26.8 tt0 -131.96 115.84 16.37 Favored 'General case' 0 CA--C 1.533 0.29 0 CA-C-N 118.185 0.992 . . . . 0.0 109.146 -175.654 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 58' ' ' LEU . . . . . . . . . . . . . 37.8 tp -93.13 102.4 14.71 Favored 'General case' 0 C--O 1.236 0.366 0 C-N-CA 127.291 2.237 . . . . 0.0 110.159 -177.503 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 59' ' ' THR . . . . . . . . . . . . . 18.2 p -94.68 163.59 13.31 Favored 'General case' 0 CA--C 1.533 0.313 0 C-N-CA 122.945 0.498 . . . . 0.0 110.036 168.122 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 60' ' ' ALA . . . . . . . . . . . . . . . -147.24 103.48 3.58 Favored 'General case' 0 C--N 1.342 0.273 0 C-N-CA 123.673 0.789 . . . . 0.0 111.218 155.465 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 61' ' ' LYS . . . . . . . . . . . . . 73.6 tttt -86.47 77.62 9.4 Favored 'General case' 0 N--CA 1.463 0.18 0 C-N-CA 124.496 1.118 . . . . 0.0 109.48 178.201 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 62' ' ' GLY . . . . . . . . . . . . . . . 148.01 80.44 0.03 OUTLIER Glycine 0 N--CA 1.464 0.526 0 N-CA-C 110.161 -1.176 . . . . 0.0 110.161 175.14 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 63' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -117.47 83.22 1.95 Allowed 'General case' 0 N--CA 1.439 -0.98 0 C-N-CA 124.294 1.038 . . . . 0.0 110.065 -159.609 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 64' ' ' ALA . . . . . . . . . . . . . . . -77.68 96.17 4.79 Favored 'General case' 0 C--O 1.244 0.777 0 C-N-CA 126.034 1.733 . . . . 0.0 112.134 179.756 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 65' ' ' MET . . . . . 0.481 ' HB3' ' HA ' ' A' ' 47' ' ' PHE 0.259 6.5 ptm -124.61 172.3 9.35 Favored 'General case' 0 CA--C 1.531 0.235 0 C-N-CA 123.706 0.803 . . . . 0.0 109.787 170.611 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild full ' A' A ' 66' ' ' THR . . . . . . . . . . . . . 15.8 p -104.85 -165.09 1.1 Allowed 'General case' 0 C--N 1.326 -0.455 0 C-N-CA 124.371 1.068 . . . . 0.0 109.503 -162.25 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 67' ' ' ARG . . . . . . . . . . . . . 0.5 OUTLIER -133.5 26.03 4.09 Favored 'General case' 0 C--O 1.237 0.404 0 C-N-CA 125.416 1.486 . . . . 0.0 112.075 -178.181 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 68' ' ' MET . . . . . . . . . . . . . 18.2 ptm -73.26 -169.68 0.67 Allowed 'General case' 0 CA--C 1.536 0.436 0 C-N-CA 125.321 1.448 . . . . 0.0 110.467 172.693 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 69' ' ' MET . . . . . . . . . . . . . 0.8 OUTLIER -142.6 -179.16 6.14 Favored 'General case' 0 C--O 1.238 0.49 0 C-N-CA 127.157 2.183 . . . . 0.0 109.03 -179.715 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 70' ' ' CYS . . . . . 1.283 ' SG ' ' SG ' ' A' ' 44' ' ' CYS . 70.0 m -149.21 163.71 36.86 Favored 'General case' 0 N--CA 1.455 -0.194 0 C-N-CA 124.417 1.087 . . . . 0.0 111.157 -176.581 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 71' ' ' ALA . . . . . . . . . . . . . . . -69.65 11.9 0.23 Allowed 'General case' 0 CA--C 1.54 0.592 0 C-N-CA 126.377 1.871 . . . . 0.0 113.874 178.214 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 72' ' ' ASN . . . . . . . . . . . . . 13.7 t30 -147.3 143.72 18.53 Favored Pre-proline 0 C--O 1.235 0.305 0 O-C-N 120.667 -1.27 . . . . 0.0 108.598 179.991 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 73' ' ' PRO . . . . . . . . . . . . . 68.1 Cg_endo -75.63 -25.42 10.92 Favored 'Trans proline' 0 N--CA 1.459 -0.556 0 C-N-CA 122.055 1.837 . . . . 0.0 111.601 179.919 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 74' ' ' GLN . . . . . . . . . . . . . 54.1 tt0 -70.13 -48.53 57.1 Favored 'General case' 0 N--CA 1.451 -0.385 0 C-N-CA 124.129 0.971 . . . . 0.0 109.606 -179.341 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 75' ' ' LEU . . . . . . . . . . . . . 41.5 mt -54.71 -45.15 73.97 Favored 'General case' 0 N--CA 1.471 0.612 0 CA-C-N 118.873 0.761 . . . . 0.0 109.149 174.528 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 76' ' ' ASN . . . . . . . . . . . . . 15.0 t-20 -61.07 -39.62 90.58 Favored 'General case' 0 CA--C 1.535 0.366 0 C-N-CA 124.236 1.015 . . . . 0.0 111.166 -175.787 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 77' ' ' GLU . . . . . . . . . . . . . 5.8 tm-20 -81.45 -30.8 33.33 Favored 'General case' 0 N--CA 1.455 -0.221 0 C-N-CA 125.721 1.608 . . . . 0.0 113.349 -177.889 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 78' ' ' LEU . . . . . . . . . . . . . 9.2 mt -61.12 -25.92 67.32 Favored 'General case' 0 N--CA 1.466 0.341 0 C-N-CA 123.231 0.612 . . . . 0.0 112.393 -179.796 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 79' ' ' ASP . . . . . . . . . . . . . 4.2 t70 -47.64 -49.56 26.94 Favored 'General case' 0 CA--C 1.517 -0.295 0 C-N-CA 125.912 1.685 . . . . 0.0 111.416 165.632 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 80' ' ' ASN . . . . . . . . . . . . . 2.7 m120 -74.34 -36.55 63.65 Favored 'General case' 0 N--CA 1.448 -0.568 0 CA-C-O 118.364 -0.827 . . . . 0.0 109.714 -175.234 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 81' ' ' THR . . . . . . . . . . . . . 89.9 m -54.11 -63.06 1.27 Allowed 'General case' 0 C--N 1.344 0.357 0 N-CA-C 108.054 -1.091 . . . . 0.0 108.054 172.152 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 82' ' ' ILE . . . . . 0.4 HD12 ' SD ' ' A' ' 85' ' ' MET . 10.9 tp -65.76 -39.05 83.7 Favored 'Isoleucine or valine' 0 N--CA 1.449 -0.506 0 CA-C-O 118.97 -0.538 . . . . 0.0 110.433 -165.643 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 83' ' ' SER . . . . . . . . . . . . . 8.6 t -61.55 -49.37 76.95 Favored 'General case' 0 N--CA 1.447 -0.592 0 N-CA-C 109.312 -0.625 . . . . 0.0 109.312 -177.842 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 84' ' ' GLU . . . . . . . . . . . . . 3.6 tp10 -67.55 -22.38 65.41 Favored 'General case' 0 CA--C 1.537 0.455 0 C-N-CA 123.738 0.815 . . . . 0.0 111.856 179.813 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 85' ' ' MET . . . . . 0.449 ' HA ' HG21 ' A' ' 103' ' ' THR . 7.1 ptm -87.6 -41.3 13.53 Favored 'General case' 0 CA--C 1.515 -0.388 0 N-CA-C 106.236 -1.765 . . . . 0.0 106.236 -171.691 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 86' ' ' LEU . . . . . . . . . . . . . 2.3 mm? -67.56 -25.57 65.86 Favored 'General case' 0 N--CA 1.439 -1.011 0 C-N-CA 119.272 -0.971 . . . . 0.0 111.926 -173.043 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 87' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -64.87 -53.95 38.62 Favored 'General case' 0 N--CA 1.448 -0.56 0 CA-C-O 118.799 -0.62 . . . . 0.0 110.785 -175.09 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 88' ' ' GLU . . . . . . . . . . . . . 12.4 pt-20 -71.49 -41.76 68.91 Favored 'General case' 0 C--O 1.234 0.255 0 CA-C-O 118.876 -0.583 . . . . 0.0 112.41 -176.092 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 89' ' ' GLY . . . . . . . . . . . . . . . 126.53 93.96 0.89 Allowed Glycine 0 C--N 1.334 0.457 0 N-CA-C 108.879 -1.689 . . . . 0.0 108.879 -173.405 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 90' ' ' ALA . . . . . . . . . . . . . . . -69.4 136.79 52.14 Favored 'General case' 0 N--CA 1.447 -0.612 0 N-CA-C 108.818 -0.808 . . . . 0.0 108.818 176.805 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 91' ' ' GLN . . . . . . . . . . . . . 29.0 mm-40 -74.89 92.71 2.57 Favored 'General case' 0 N--CA 1.446 -0.64 0 N-CA-C 105.011 -2.218 . . . . 0.0 105.011 177.974 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 92' ' ' VAL . . . . . . . . . . . . . 7.5 p -86.67 132.13 33.08 Favored 'Isoleucine or valine' 0 N--CA 1.443 -0.78 0 N-CA-C 106.007 -1.849 . . . . 0.0 106.007 179.955 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 93' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -137.61 152.43 49.35 Favored 'General case' 0 C--N 1.323 -0.559 0 N-CA-C 106.489 -1.671 . . . . 0.0 106.489 167.334 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 94' ' ' LEU . . . . . . . . . . . . . 54.1 tp -132.69 100.51 4.96 Favored 'General case' 0 CA--C 1.514 -0.429 0 CA-C-O 121.7 0.762 . . . . 0.0 108.968 -179.463 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 95' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -64.18 169.47 4.47 Favored 'General case' 0 C--N 1.323 -0.547 0 CA-C-N 113.718 -1.583 . . . . 0.0 109.831 164.099 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 96' ' ' ALA . . . . . . . . . . . . . . . -44.67 -24.54 0.2 Allowed 'General case' 0 N--CA 1.469 0.499 0 C-N-CA 127.952 2.501 . . . . 0.0 116.95 -170.93 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 97' ' ' ASN . . . . . . . . . . . . . 0.0 OUTLIER -155.39 6.71 0.24 Allowed 'General case' 0 CA--C 1.542 0.653 0 C-N-CA 126.551 1.94 . . . . 0.0 111.09 170.299 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 98' ' ' GLN . . . . . . . . . . . . . 25.7 tt0 -127.69 110.44 12.66 Favored 'General case' 0 N--CA 1.469 0.498 0 C-N-CA 125.383 1.473 . . . . 0.0 110.643 -170.382 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 99' ' ' LEU . . . . . 0.548 ' HB3' ' HB2' ' A' ' 110' ' ' TYR . 11.1 tp -75.01 143.72 43.44 Favored 'General case' 0 C--N 1.321 -0.667 0 C-N-CA 127.573 2.349 . . . . 0.0 108.037 173.606 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 100' ' ' THR . . . . . . . . . . . . . 4.6 m -132.81 118.91 19.58 Favored 'General case' 0 C--N 1.327 -0.378 0 N-CA-C 106.669 -1.604 . . . . 0.0 106.669 175.342 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 101' ' ' LEU . . . . . . . . . . . . . 2.7 mm? -115.59 111.08 20.14 Favored 'General case' 0 CA--C 1.513 -0.459 0 N-CA-C 106.099 -1.815 . . . . 0.0 106.099 174.521 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 102' ' ' ALA . . . . . . . . . . . . . . . -106.15 158.08 17.09 Favored 'General case' 0 C--N 1.326 -0.421 0 N-CA-C 108.331 -0.989 . . . . 0.0 108.331 162.775 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 103' ' ' THR . . . . . 0.449 HG21 ' HA ' ' A' ' 85' ' ' MET . 1.8 m -157.09 -179.28 8.05 Favored 'General case' 0 N--CA 1.436 -1.163 0 N-CA-C 105.596 -2.002 . . . . 0.0 105.596 171.853 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 104' ' ' ALA . . . . . . . . . . . . . . . -50.6 -39.01 48.8 Favored 'General case' 0 N--CA 1.451 -0.394 0 C-N-CA 122.683 0.393 . . . . 0.0 111.379 172.14 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 105' ' ' LYS . . . . . . . . . . . . . 4.5 tmtt? -61.69 -67.19 0.43 Allowed 'General case' 0 CA--C 1.532 0.279 0 N-CA-C 114.56 1.318 . . . . 0.0 114.56 -177.67 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 106' ' ' GLN . . . . . . . . . . . . . 8.9 pt20 -167.01 -173.45 2.35 Favored 'General case' 0 C--O 1.238 0.474 0 C-N-CA 126.477 1.911 . . . . 0.0 107.997 -178.993 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 107' ' ' THR . . . . . . . . . . . . . 14.8 t -118.47 140.26 50.15 Favored 'General case' 0 CA--C 1.534 0.345 0 C-N-CA 123.314 0.645 . . . . 0.0 109.869 174.008 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 108' ' ' LEU . . . . . . . . . . . . . 53.5 mt -125.11 138.15 54.17 Favored 'General case' 0 C--O 1.236 0.348 0 C-N-CA 127.726 2.41 . . . . 0.0 106.521 -178.513 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 109' ' ' THR . . . . . . . . . . . . . 31.5 m -112.38 144.96 40.94 Favored 'General case' 0 C--O 1.235 0.3 0 N-CA-C 107.793 -1.188 . . . . 0.0 107.793 179.992 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 110' ' ' TYR . . . . . 0.548 ' HB2' ' HB3' ' A' ' 99' ' ' LEU . 34.4 m-85 -130.5 172.77 11.54 Favored 'General case' 0 C--O 1.233 0.209 0 C-N-CA 123.987 0.915 . . . . 0.0 111.158 -178.918 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 111' ' ' LYS . . . . . . . . . . . . . 8.8 tppt? -125.79 143.87 50.88 Favored 'General case' 0 CA--C 1.514 -0.414 0 C-N-CA 124.885 1.274 . . . . 0.0 109.679 173.202 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 112' ' ' LEU . . . . . . . . . . . . . 43.7 tp -74.07 51.91 0.43 Allowed 'General case' 0 CA--C 1.539 0.535 0 C-N-CA 125.999 1.72 . . . . 0.0 108.93 165.159 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 113' ' ' ALA . . . . . . . . . . . . . . . -85.32 91.27 8.13 Favored 'General case' 0 N--CA 1.451 -0.406 0 O-C-N 119.84 -1.788 . . . . 0.0 106.421 170.238 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 114' ' ' ASP . . . . . . . . . . . . . 43.5 t0 -94.25 75.67 3.98 Favored 'General case' 0 CA--C 1.513 -0.457 0 CA-C-O 123.664 1.697 . . . . 0.0 109.243 -178.59 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 115' ' ' LEU . . . . . 0.442 ' H ' ' HD3' ' A' ' 11' ' ' ARG . 30.4 mt -94.85 26.44 3.58 Favored 'General case' 0 C--N 1.323 -0.582 0 CA-C-N 112.871 -1.968 . . . . 0.0 109.453 -174.297 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 116' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -56.18 132.65 51.06 Favored 'General case' 0 N--CA 1.454 -0.27 0 CA-C-O 121.056 0.455 . . . . 0.0 110.143 176.698 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 117' ' ' ASN . . . . . . . . . . . . . 18.4 p30 . . . . . 0 C--O 1.238 0.488 0 C-N-CA 124.805 1.242 . . . . 0.0 110.437 167.401 . . . . . . . . 0 0 . 1 . 018 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 29.5 ttm . . . . . 0 N--CA 1.452 -0.355 0 CA-C-O 121.157 0.503 . . . . 0.0 109.877 . . . . . . . . . 0 0 . 1 . 018 nuclear nobuild full ' A' A ' 2' ' ' VAL . . . . . . . . . . . . . 7.7 p -50.18 151.73 0.6 Allowed 'Isoleucine or valine' 0 CA--C 1.536 0.419 0 C-N-CA 127.377 2.271 . . . . 0.0 111.838 173.238 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 3' ' ' THR . . . . . . . . . . . . . 20.6 p -134.95 165.05 39.62 Favored Pre-proline 0 CA--C 1.533 0.316 0 C-N-CA 123.382 0.673 . . . . 0.0 110.581 177.468 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 4' ' ' PRO . . . . . . . . . . . . . 9.7 Cg_endo -58.28 -36.33 97.81 Favored 'Trans proline' 0 C--O 1.235 0.343 0 C-N-CA 122.999 2.466 . . . . 0.0 113.452 175.828 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 5' ' ' GLU . . . . . . . . . . . . . 0.2 OUTLIER -61.18 -44.29 97.53 Favored 'General case' 0 CA--C 1.538 0.505 0 C-N-CA 124.198 0.999 . . . . 0.0 111.765 -174.947 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 6' ' ' GLN . . . . . . . . . . . . . 15.7 pt20 -75.14 18.94 0.17 Allowed 'General case' 0 CA--C 1.542 0.642 0 C-N-CA 125.306 1.442 . . . . 0.0 112.573 177.279 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 7' ' ' LEU . . . . . . . . . . . . . 81.4 mt -136.71 -51.35 0.68 Allowed 'General case' 0 N--CA 1.469 0.485 0 CA-C-N 119.843 1.202 . . . . 0.0 113.073 -174.12 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 8' ' ' GLN . . . . . . . . . . . . . 0.2 OUTLIER -44.04 -28.75 0.51 Allowed 'General case' 0 N--CA 1.473 0.679 0 N-CA-C 115.712 1.745 . . . . 0.0 115.712 -176.16 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 9' ' ' HIS . . . . . . . . . . . . . 79.5 m-70 -131.43 32.27 4.22 Favored 'General case' 0 C--O 1.238 0.489 0 C-N-CA 123.392 0.677 . . . . 0.0 111.82 -173.562 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 10' ' ' HIS . . . . . . . . . . . . . 98.4 m-70 -129.34 113.67 15.25 Favored 'General case' 0 N--CA 1.452 -0.339 0 C-N-CA 124.995 1.318 . . . . 0.0 109.634 176.537 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 11' ' ' ARG . . . . . . . . . . . . . 17.0 ttt180 -69.64 150.09 47.4 Favored 'General case' 0 C--O 1.233 0.214 0 N-CA-C 108.678 -0.86 . . . . 0.0 108.678 166.511 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 12' ' ' PHE . . . . . . . . . . . . . 99.0 m-85 -138.89 157.98 45.05 Favored 'General case' 0 CA--C 1.503 -0.84 0 CA-C-O 123.994 1.854 . . . . 0.0 108.655 171.018 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 13' ' ' VAL . . . . . 0.405 ' HA ' ' HA ' ' A' ' 30' ' ' GLU . 0.0 OUTLIER -126.7 131.36 71.24 Favored 'Isoleucine or valine' 0 C--N 1.311 -1.103 0 CA-C-N 113.008 -1.906 . . . . 0.0 106.09 -176.358 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild full ' A' A ' 14' ' ' LEU . . . . . . . . . . . . . 26.5 tp -65.64 102.61 0.75 Allowed 'General case' 0 CA--C 1.515 -0.375 0 N-CA-C 107.629 -1.248 . . . . 0.0 107.629 175.963 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -86.2 -52.87 5.38 Favored 'General case' 0 N--CA 1.443 -0.822 0 N-CA-C 107.652 -1.24 . . . . 0.0 107.652 -172.188 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -138.15 123.95 19.95 Favored 'General case' 0 C--O 1.235 0.33 0 CA-C-O 121.573 0.701 . . . . 0.0 110.248 -173.9 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 17' ' ' VAL . . . . . . . . . . . . . 11.3 t -75.86 170.52 1.47 Allowed 'Isoleucine or valine' 0 C--O 1.237 0.437 0 N-CA-C 107.621 -1.252 . . . . 0.0 107.621 172.847 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 18' ' ' ASN . . . . . . . . . . . . . 0.3 OUTLIER -58.17 -20.57 42.0 Favored 'General case' 0 CA--C 1.536 0.424 0 CA-C-O 117.873 -1.06 . . . . 0.0 112.896 168.475 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . -106.85 -64.53 0.61 Allowed Glycine 0 C--N 1.341 0.856 0 C-N-CA 125.491 1.52 . . . . 0.0 111.887 -174.896 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 25.1 mmtm -136.04 164.45 43.04 Favored Pre-proline 0 N--CA 1.469 0.495 0 CA-C-N 118.814 1.307 . . . . 0.0 110.55 -176.86 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 21' ' ' PRO . . . . . . . . . . . . . 57.2 Cg_endo -66.4 153.38 78.25 Favored 'Trans proline' 0 CA--C 1.537 0.659 0 N-CA-C 108.605 -1.344 . . . . 0.0 108.605 159.632 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 22' ' ' VAL . . . . . . . . . . . . . 11.7 t -89.51 158.4 2.96 Favored 'Isoleucine or valine' 0 C--O 1.24 0.601 0 N-CA-C 108.961 -0.755 . . . . 0.0 108.961 176.563 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 23' ' ' THR . . . . . . . . . . . . . 3.1 m -130.7 124.38 31.4 Favored 'General case' 0 CA--C 1.532 0.259 0 C-N-CA 125.143 1.377 . . . . 0.0 107.954 178.453 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 24' ' ' SER . . . . . . . . . . . . . 5.4 m -153.6 136.08 15.07 Favored 'General case' 0 N--CA 1.452 -0.331 0 C-N-CA 127.46 2.304 . . . . 0.0 106.921 -167.595 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 25' ' ' ASP . . . . . . . . . . . . . 2.9 t70 -47.95 -84.06 0.01 OUTLIER 'General case' 0 N--CA 1.472 0.634 0 C-N-CA 127.281 2.232 . . . . 0.0 110.266 -179.752 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 26' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -135.62 -1.36 2.53 Favored 'General case' 0 CA--C 1.531 0.214 0 C-N-CA 125.484 1.514 . . . . 0.0 112.753 173.923 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 27' ' ' ASN . . . . . . . . . . . . . 60.6 m-80 -115.62 81.25 8.92 Favored Pre-proline 0 CA--C 1.532 0.286 0 C-N-CA 126.092 1.757 . . . . 0.0 107.426 -179.038 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 28' ' ' PRO . . . . . . . . . . . . . 19.0 Cg_endo -68.76 169.09 18.36 Favored 'Trans proline' 0 CA--C 1.534 0.506 0 C-N-CA 123.067 2.511 . . . . 0.0 113.659 177.093 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 29' ' ' PRO . . . . . . . . . . . . . 13.6 Cg_endo -62.43 109.91 0.96 Allowed 'Trans proline' 0 N--CA 1.449 -1.131 0 N-CA-C 107.226 -1.875 . . . . 0.0 107.226 145.763 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 30' ' ' GLU . . . . . 0.405 ' HA ' ' HA ' ' A' ' 13' ' ' VAL . 10.4 pt-20 -130.21 165.04 23.2 Favored 'General case' 0 C--N 1.318 -0.767 0 C-N-CA 127.996 2.519 . . . . 0.0 106.046 175.847 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 31' ' ' ILE . . . . . . . . . . . . . 20.3 tt -145.47 146.13 19.88 Favored 'Isoleucine or valine' 0 N--CA 1.447 -0.609 0 C-N-CA 125.556 1.542 . . . . 0.0 107.189 -177.401 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 32' ' ' SER . . . . . . . . . . . . . 27.5 p -133.07 172.85 12.09 Favored 'General case' 0 N--CA 1.441 -0.905 0 C-N-CA 126.022 1.729 . . . . 0.0 107.373 168.223 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 33' ' ' PHE . . . . . . . . . . . . . 98.8 m-85 -137.13 -173.22 3.4 Favored 'General case' 0 N--CA 1.448 -0.535 0 N-CA-C 107.919 -1.141 . . . . 0.0 107.919 -174.663 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 34' ' ' GLY . . . . . . . . . . . . . . . 176.42 -160.43 28.05 Favored Glycine 0 N--CA 1.451 -0.333 0 N-CA-C 109.385 -1.486 . . . . 0.0 109.385 170.545 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 35' ' ' GLU . . . . . . . . . . . . . 1.9 tt0 -52.95 154.25 2.98 Favored 'General case' 0 N--CA 1.448 -0.56 0 C-N-CA 125.016 1.326 . . . . 0.0 111.84 -167.894 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 11.7 mtpt 52.78 26.99 4.92 Favored 'General case' 0 CA--C 1.536 0.423 0 CA-C-O 117.956 -1.021 . . . . 0.0 112.195 -169.193 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 37' ' ' MET . . . . . . . . . . . . . 31.4 mmm 54.95 26.48 7.99 Favored 'General case' 0 CA--C 1.542 0.659 0 C-N-CA 124.823 1.249 . . . . 0.0 111.14 -174.95 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 38' ' ' MET . . . . . . . . . . . . . 25.3 mmm -56.0 155.69 6.09 Favored 'General case' 0 CA--C 1.519 -0.213 0 O-C-N 121.055 -1.028 . . . . 0.0 110.444 175.521 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 39' ' ' ILE . . . . . . . . . . . . . 10.4 mt -123.91 135.61 62.96 Favored 'Isoleucine or valine' 0 N--CA 1.449 -0.511 0 C-N-CA 124.793 1.237 . . . . 0.0 107.815 -175.073 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 40' ' ' SER . . . . . . . . . . . . . 66.6 m -131.04 121.09 24.42 Favored 'General case' 0 N--CA 1.45 -0.437 0 N-CA-C 106.495 -1.669 . . . . 0.0 106.495 169.233 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 41' ' ' GLY . . . . . . . . . . . . . . . -164.82 165.2 37.43 Favored Glycine 0 C--O 1.237 0.291 0 N-CA-C 108.994 -1.642 . . . . 0.0 108.994 179.331 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 42' ' ' SER . . . . . 0.628 ' HA ' ' HA ' ' A' ' 46' ' ' ARG . 92.0 p -157.56 108.41 2.26 Favored 'General case' 0 N--CA 1.444 -0.752 0 CA-C-N 117.596 0.698 . . . . 0.0 111.681 -176.667 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 43' ' ' MET . . . . . . . . . . . . . 7.2 mmt -87.4 -58.43 2.58 Favored 'General case' 0 N--CA 1.451 -0.401 0 C-N-CA 124.121 0.968 . . . . 0.0 109.322 -177.533 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 44' ' ' CYS . . . . . 1.301 ' SG ' ' SG ' ' A' ' 70' ' ' CYS . 43.6 t -155.29 -19.11 0.11 Allowed 'General case' 0 CA--C 1.535 0.379 0 N-CA-C 112.442 0.534 . . . . 0.0 112.442 -179.406 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 45' ' ' ASN . . . . . . . . . . . . . 2.8 m-80 -125.95 16.36 7.96 Favored 'General case' 0 N--CA 1.473 0.687 0 C-N-CA 125.997 1.719 . . . . 0.0 109.413 179.68 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 46' ' ' ARG . . . . . 0.628 ' HA ' ' HA ' ' A' ' 42' ' ' SER 0.376 6.0 ptt180 44.05 -172.48 0.01 OUTLIER 'General case' 0 CA--C 1.536 0.413 0 C-N-CA 127.469 2.308 . . . . 0.0 113.623 -161.956 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild full ' A' A ' 47' ' ' PHE . . . . . . . . . . . . . 21.5 p90 -173.5 162.96 4.33 Favored 'General case' 0 N--CA 1.472 0.646 0 C-N-CA 125.672 1.589 . . . . 0.0 109.151 164.33 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 48' ' ' SER . . . . . . . . . . . . . 7.6 p -155.02 135.1 13.04 Favored 'General case' 0 N--CA 1.449 -0.512 0 C-N-CA 123.998 0.919 . . . . 0.0 108.649 178.134 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 49' ' ' GLY . . . . . . . . . . . . . . . -169.0 165.39 38.89 Favored Glycine 0 C--N 1.337 0.616 0 N-CA-C 110.014 -1.234 . . . . 0.0 110.014 171.519 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 50' ' ' GLU . . . . . . . . . . . . . 2.4 pt-20 -83.48 103.17 12.62 Favored 'General case' 0 N--CA 1.442 -0.867 0 CA-C-O 122.619 1.199 . . . . 0.0 108.796 178.588 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 51' ' ' GLY . . . . . . . . . . . . . . . -58.23 174.97 2.47 Favored Glycine 0 CA--C 1.539 1.559 0 CA-C-N 114.647 -1.16 . . . . 0.0 111.112 163.223 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 52' ' ' LYS . . . . . . . . . . . . . 29.8 ttpt -142.71 159.01 43.06 Favored 'General case' 0 C--N 1.329 -0.315 0 N-CA-C 106.006 -1.85 . . . . 0.0 106.006 156.651 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 53' ' ' LEU . . . . . . . . . . . . . 49.5 tp -148.08 95.29 2.45 Favored 'General case' 0 N--CA 1.447 -0.62 0 N-CA-C 107.195 -1.409 . . . . 0.0 107.195 170.23 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 2.4 t -137.58 6.37 2.73 Favored 'General case' 0 CA--C 1.533 0.3 0 CA-C-N 115.498 -0.773 . . . . 0.0 111.196 174.627 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 55' ' ' ASN . . . . . 0.45 HD21 ' CB ' ' A' ' 57' ' ' GLU . 7.9 p-10 -142.74 -21.15 0.66 Allowed 'General case' 0 C--O 1.222 -0.394 0 CA-C-O 117.672 -1.156 . . . . 0.0 114.035 175.725 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 56' ' ' GLY . . . . . . . . . . . . . . . 119.28 7.92 9.72 Favored Glycine 0 CA--C 1.529 0.943 0 CA-C-N 119.29 0.95 . . . . 0.0 112.945 -172.099 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 57' ' ' GLU . . . . . 0.45 ' CB ' HD21 ' A' ' 55' ' ' ASN . 41.3 tt0 -127.16 128.37 46.04 Favored 'General case' 0 C--O 1.235 0.303 0 CA-C-N 118.841 1.32 . . . . 0.0 108.299 -173.836 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 58' ' ' LEU . . . . . . . . . . . . . 52.5 tp -100.42 94.25 6.06 Favored 'General case' 0 CA--C 1.531 0.216 0 C-N-CA 125.628 1.571 . . . . 0.0 108.924 177.505 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 59' ' ' THR . . . . . . . . . . . . . 40.8 p -91.42 146.51 23.75 Favored 'General case' 0 C--O 1.235 0.327 0 N-CA-C 108.129 -1.063 . . . . 0.0 108.129 162.745 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 60' ' ' ALA . . . . . . . . . . . . . . . -140.93 102.37 4.25 Favored 'General case' 0 C--N 1.334 -0.1 0 C-N-CA 124.491 1.116 . . . . 0.0 108.392 166.998 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 61' ' ' LYS . . . . . . . . . . . . . 49.6 mttp -65.4 -60.88 2.49 Favored 'General case' 0 N--CA 1.442 -0.837 0 C-N-CA 124.545 1.138 . . . . 0.0 111.856 -171.148 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 62' ' ' GLY . . . . . . . . . . . . . . . -55.35 -59.93 9.66 Favored Glycine 0 C--O 1.227 -0.282 0 C-N-CA 125.047 1.308 . . . . 0.0 111.262 -165.388 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 63' ' ' LEU . . . . . . . . . . . . . 3.8 tp 49.17 60.86 3.46 Favored 'General case' 0 N--CA 1.445 -0.696 0 C-N-CA 127.646 2.379 . . . . 0.0 113.817 168.962 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 64' ' ' ALA . . . . . . . . . . . . . . . -78.88 135.06 36.9 Favored 'General case' 0 C--N 1.324 -0.525 0 CA-C-N 115.845 -0.616 . . . . 0.0 111.192 -178.004 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 65' ' ' MET . . . . . . . . . . . . . 66.4 mtp -133.57 -175.17 3.73 Favored 'General case' 0 CA--C 1.547 0.84 0 C-N-CA 124.985 1.314 . . . . 0.0 111.288 -172.874 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 66' ' ' THR . . . . . . . . . . . . . 30.0 p -107.78 -164.81 1.0 Allowed 'General case' 0 N--CA 1.47 0.565 0 C-N-CA 127.604 2.361 . . . . 0.0 110.887 177.807 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 67' ' ' ARG . . . . . . . . . . . . . 2.1 mpp_? -132.81 87.44 2.41 Favored 'General case' 0 C--O 1.232 0.15 0 C-N-CA 126.821 2.048 . . . . 0.0 107.215 173.187 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 68' ' ' MET . . . . . . . . . . . . . 10.0 mtm -139.43 162.44 35.03 Favored 'General case' 0 N--CA 1.467 0.418 0 C-N-CA 123.878 0.871 . . . . 0.0 113.061 -173.017 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 69' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -119.01 164.17 15.87 Favored 'General case' 0 C--O 1.235 0.302 0 C-N-CA 127.492 2.317 . . . . 0.0 106.991 171.953 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 70' ' ' CYS . . . . . 1.301 ' SG ' ' SG ' ' A' ' 44' ' ' CYS . 57.5 m -140.36 23.89 2.32 Favored 'General case' 0 N--CA 1.474 0.733 0 C-N-CA 124.033 0.933 . . . . 0.0 112.73 -175.149 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 71' ' ' ALA . . . . . . . . . . . . . . . 54.6 -1.29 0.02 OUTLIER 'General case' 0 CA--C 1.511 -0.534 0 N-CA-C 117.586 2.439 . . . . 0.0 117.586 -176.602 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 72' ' ' ASN . . . . . . . . . . . . . 0.0 OUTLIER -138.58 144.05 40.64 Favored Pre-proline 0 N--CA 1.441 -0.913 0 CA-C-N 118.833 0.742 . . . . 0.0 109.512 167.928 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 73' ' ' PRO . . . . . . . . . . . . . 74.5 Cg_endo -74.97 -20.64 16.73 Favored 'Trans proline' 0 N--CA 1.45 -1.086 0 C-N-CA 121.944 1.763 . . . . 0.0 111.853 -178.056 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 74' ' ' GLN . . . . . . . . . . . . . 39.4 tt0 -58.54 -45.82 88.1 Favored 'General case' 0 CA--C 1.531 0.248 0 CA-C-N 120.606 1.548 . . . . 0.0 110.607 -177.184 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 75' ' ' LEU . . . . . . . . . . . . . 83.4 mt -66.75 -41.51 87.68 Favored 'General case' 0 CA--C 1.522 -0.117 0 C-N-CA 123.843 0.857 . . . . 0.0 110.122 175.911 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 76' ' ' ASN . . . . . . . . . . . . . 3.0 t-20 -59.79 -45.33 92.65 Favored 'General case' 0 C--O 1.219 -0.505 0 C-N-CA 124.052 0.941 . . . . 0.0 110.294 -177.403 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 77' ' ' GLU . . . . . . . . . . . . . 29.7 mt-10 -56.46 -43.01 79.13 Favored 'General case' 0 N--CA 1.448 -0.542 0 C-N-CA 125.508 1.523 . . . . 0.0 111.02 175.43 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 78' ' ' LEU . . . . . . . . . . . . . 0.7 OUTLIER -61.08 -32.05 71.71 Favored 'General case' 0 C--N 1.339 0.121 0 CA-C-O 118.253 -0.879 . . . . 0.0 112.355 -177.808 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 79' ' ' ASP . . . . . . . . . . . . . 0.0 OUTLIER -54.26 -39.82 67.2 Favored 'General case' 0 CA--C 1.535 0.398 0 C-N-CA 124.127 0.971 . . . . 0.0 112.902 174.311 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 80' ' ' ASN . . . . . . . . . . . . . 6.9 p30 -87.29 -37.8 16.86 Favored 'General case' 0 CA--C 1.518 -0.272 0 CA-C-N 119.001 0.819 . . . . 0.0 109.849 175.834 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 81' ' ' THR . . . . . . . . . . . . . 32.7 m -53.24 -54.44 36.14 Favored 'General case' 0 N--CA 1.455 -0.186 0 O-C-N 123.856 0.723 . . . . 0.0 109.18 -174.513 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 82' ' ' ILE . . . . . . . . . . . . . 10.7 tp -64.54 -32.94 59.87 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.475 0 C-N-CA 122.824 0.45 . . . . 0.0 111.356 -176.968 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 83' ' ' SER . . . . . . . . . . . . . 36.4 p -64.08 -53.41 50.24 Favored 'General case' 0 N--CA 1.443 -0.775 0 N-CA-C 109.647 -0.501 . . . . 0.0 109.647 -171.35 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 84' ' ' GLU . . . . . . . . . . . . . 2.4 tp10 -62.72 -42.08 99.47 Favored 'General case' 0 N--CA 1.449 -0.502 0 C-N-CA 124.734 1.213 . . . . 0.0 109.261 -176.421 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 85' ' ' MET . . . . . . . . . . . . . 78.9 mtp -60.28 -41.41 93.29 Favored 'General case' 0 C--N 1.343 0.323 0 C-N-CA 123.778 0.831 . . . . 0.0 110.18 179.141 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 86' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -80.44 -19.35 46.32 Favored 'General case' 0 C--N 1.332 -0.19 0 O-C-N 121.436 -0.79 . . . . 0.0 112.096 -176.657 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 87' ' ' LYS . . . . . . . . . . . . . 2.4 mptm? -76.46 -55.4 5.57 Favored 'General case' 0 N--CA 1.447 -0.584 0 CA-C-O 118.198 -0.906 . . . . 0.0 109.537 169.622 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 88' ' ' GLU . . . . . . . . . . . . . 21.1 pt-20 -69.06 -24.66 64.19 Favored 'General case' 0 CA--C 1.535 0.368 0 CA-C-N 118.768 0.713 . . . . 0.0 111.376 -177.004 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 89' ' ' GLY . . . . . . . . . . . . . . . 106.57 99.14 2.6 Favored Glycine 0 C--N 1.337 0.591 0 N-CA-C 110.106 -1.198 . . . . 0.0 110.106 174.848 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 90' ' ' ALA . . . . . . . . . . . . . . . -74.1 133.67 42.86 Favored 'General case' 0 N--CA 1.446 -0.665 0 C-N-CA 123.075 0.55 . . . . 0.0 110.158 -175.68 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 91' ' ' GLN . . . . . . . . . . . . . 1.8 mp0 -73.04 125.2 27.08 Favored 'General case' 0 N--CA 1.452 -0.356 0 N-CA-C 105.447 -2.057 . . . . 0.0 105.447 170.403 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 92' ' ' VAL . . . . . . . . . . . . . 25.5 t -122.21 126.72 74.7 Favored 'Isoleucine or valine' 0 N--CA 1.446 -0.628 0 N-CA-C 107.743 -1.206 . . . . 0.0 107.743 -174.579 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 93' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -135.38 80.7 1.85 Allowed 'General case' 0 N--CA 1.451 -0.376 0 N-CA-C 106.767 -1.568 . . . . 0.0 106.767 177.679 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 94' ' ' LEU . . . . . . . . . . . . . 1.6 tm? -84.75 102.79 13.29 Favored 'General case' 0 CA--C 1.514 -0.432 0 N-CA-C 107.433 -1.321 . . . . 0.0 107.433 173.726 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 95' ' ' THR . . . . . . . . . . . . . 1.1 m -82.58 177.71 8.57 Favored 'General case' 0 C--N 1.322 -0.611 0 CA-C-N 114.064 -1.425 . . . . 0.0 108.244 178.45 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 96' ' ' ALA . . . . . . . . . . . . . . . -52.62 -20.17 2.86 Favored 'General case' 0 CA--C 1.539 0.554 0 N-CA-C 114.574 1.324 . . . . 0.0 114.574 -173.607 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 97' ' ' ASN . . . . . . . . . . . . . 17.4 p30 -146.62 -10.15 0.47 Allowed 'General case' 0 N--CA 1.467 0.419 0 N-CA-C 116.553 2.057 . . . . 0.0 116.553 160.388 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 98' ' ' GLN . . . . . . . . . . . . . 6.2 tt0 -112.9 128.96 56.61 Favored 'General case' 0 N--CA 1.47 0.549 0 CA-C-N 122.092 2.223 . . . . 0.0 111.356 -178.526 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 99' ' ' LEU . . . . . 0.452 HD22 ' CD2' ' A' ' 101' ' ' LEU . 0.3 OUTLIER -84.24 122.97 29.62 Favored 'General case' 0 C--O 1.235 0.299 0 C-N-CA 125.012 1.325 . . . . 0.0 107.768 170.293 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild full ' A' A ' 100' ' ' THR . . . . . . . . . . . . . 5.1 m -110.18 127.82 55.14 Favored 'General case' 0 C--N 1.326 -0.444 0 N-CA-C 107.239 -1.393 . . . . 0.0 107.239 171.52 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 101' ' ' LEU . . . . . 0.452 ' CD2' HD22 ' A' ' 99' ' ' LEU . 2.7 mm? -114.49 143.12 45.46 Favored 'General case' 0 CA--C 1.514 -0.431 0 C-N-CA 125.464 1.506 . . . . 0.0 108.959 172.353 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 102' ' ' ALA . . . . . . . . . . . . . . . -144.8 159.62 42.59 Favored 'General case' 0 C--O 1.235 0.303 0 C-N-CA 124.936 1.295 . . . . 0.0 108.432 161.693 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 103' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -160.61 174.83 13.42 Favored 'General case' 0 N--CA 1.443 -0.781 0 C-N-CA 126.308 1.843 . . . . 0.0 108.014 170.416 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 104' ' ' ALA . . . . . . . . . . . . . . . -62.25 -28.72 69.91 Favored 'General case' 0 C--O 1.235 0.296 0 O-C-N 121.743 -0.598 . . . . 0.0 111.588 176.395 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 105' ' ' LYS . . . . . . . . . . . . . 8.9 mmtm -69.58 -84.77 0.03 OUTLIER 'General case' 0 N--CA 1.45 -0.434 0 C-N-CA 123.505 0.722 . . . . 0.0 109.769 167.014 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 106' ' ' GLN . . . . . . . . . . . . . 23.3 mt-30 -141.37 -169.83 2.95 Favored 'General case' 0 C--N 1.328 -0.362 0 C-N-CA 123.656 0.782 . . . . 0.0 109.364 -158.711 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 107' ' ' THR . . . . . . . . . . . . . 1.1 t -149.69 147.31 27.92 Favored 'General case' 0 N--CA 1.45 -0.455 0 N-CA-C 106.287 -1.746 . . . . 0.0 106.287 -168.773 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 108' ' ' LEU . . . . . . . . . . . . . 36.8 mt -144.87 160.74 40.81 Favored 'General case' 0 N--CA 1.465 0.324 0 N-CA-C 107.634 -1.247 . . . . 0.0 107.634 -177.503 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 109' ' ' THR . . . . . . . . . . . . . 63.6 m -133.0 133.91 43.76 Favored 'General case' 0 C--O 1.236 0.353 0 N-CA-C 107.609 -1.256 . . . . 0.0 107.609 169.649 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 110' ' ' TYR . . . . . . . . . . . . . 19.1 m-85 -118.32 178.86 4.29 Favored 'General case' 0 C--O 1.236 0.345 0 C-N-CA 124.231 1.013 . . . . 0.0 108.981 178.77 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 111' ' ' LYS . . . . . . . . . . . . . 1.0 OUTLIER -139.13 138.83 37.35 Favored 'General case' 0 N--CA 1.455 -0.215 0 CA-C-O 118.02 -0.99 . . . . 0.0 110.879 178.045 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 112' ' ' LEU . . . . . . . . . . . . . 22.5 tp -60.53 19.68 0.01 OUTLIER 'General case' 0 CA--C 1.544 0.718 0 C-N-CA 131.309 3.843 . . . . 0.0 114.839 175.643 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 113' ' ' ALA . . . . . . . . . . . . . . . -67.82 84.59 0.21 Allowed 'General case' 0 CA--C 1.541 0.609 0 O-C-N 120.233 -1.542 . . . . 0.0 111.082 179.91 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 114' ' ' ASP . . . . . . . . . . . . . 23.4 t0 -93.16 33.3 1.21 Allowed 'General case' 0 N--CA 1.47 0.541 0 CA-C-O 122.974 1.368 . . . . 0.0 110.791 -176.447 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 115' ' ' LEU . . . . . . . . . . . . . 26.2 mt 57.57 12.29 1.51 Allowed 'General case' 0 CA--C 1.544 0.717 0 C-N-CA 125.636 1.574 . . . . 0.0 112.975 -174.212 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 116' ' ' MET . . . . . . . . . . . . . 2.9 ttp -124.15 139.49 53.88 Favored 'General case' 0 N--CA 1.442 -0.83 0 C-N-CA 128.943 2.897 . . . . 0.0 103.875 163.962 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 117' ' ' ASN . . . . . . . . . . . . . 4.0 m120 . . . . . 0 C--O 1.234 0.265 0 CA-C-O 119.087 -0.482 . . . . 0.0 111.67 -171.644 . . . . . . . . 0 0 . 1 . 019 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 C--O 1.237 0.429 0 N-CA-C 111.097 0.036 . . . . 0.0 111.097 . . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 2' ' ' VAL . . . . . 0.451 HG23 HE21 ' A' ' 6' ' ' GLN . 7.2 p -57.92 139.25 17.81 Favored 'Isoleucine or valine' 0 C--O 1.238 0.455 0 O-C-N 123.595 0.56 . . . . 0.0 110.063 175.834 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 3' ' ' THR . . . . . . . . . . . . . 0.8 OUTLIER -121.9 165.05 21.68 Favored Pre-proline 0 N--CA 1.448 -0.53 0 C-N-CA 124.01 0.924 . . . . 0.0 110.173 179.3 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 4' ' ' PRO . . . . . . . . . . . . . 18.3 Cg_endo -61.78 -50.63 4.99 Favored 'Trans proline' 0 N--CA 1.454 -0.832 0 C-N-CA 122.281 1.987 . . . . 0.0 111.133 174.338 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 5' ' ' GLU . . . . . . . . . . . . . 13.9 tt0 -55.01 -40.31 70.02 Favored 'General case' 0 CA--C 1.536 0.407 0 C-N-CA 124.244 1.018 . . . . 0.0 112.613 -168.513 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 6' ' ' GLN . . . . . 0.451 HE21 HG23 ' A' ' 2' ' ' VAL . 12.1 pt20 -73.14 14.65 0.28 Allowed 'General case' 0 CA--C 1.538 0.518 0 C-N-CA 125.433 1.493 . . . . 0.0 113.938 179.96 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 7' ' ' LEU . . . . . . . . . . . . . 88.6 mt -129.74 -46.29 1.16 Allowed 'General case' 0 C--N 1.34 0.168 0 C-N-CA 125.081 1.352 . . . . 0.0 110.478 -176.017 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 8' ' ' GLN . . . . . . . . . . . . . 2.3 mp0 -49.01 -15.34 0.1 Allowed 'General case' 0 N--CA 1.473 0.715 0 C-N-CA 127.078 2.151 . . . . 0.0 116.697 -178.944 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 9' ' ' HIS . . . . . . . . . . . . . 94.6 m-70 -130.23 13.5 5.62 Favored 'General case' 0 C--N 1.325 -0.473 0 C-N-CA 124.828 1.251 . . . . 0.0 112.492 -175.819 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 10' ' ' HIS . . . . . . . . . . . . . 46.9 m-70 -125.66 138.9 53.92 Favored 'General case' 0 C--O 1.238 0.462 0 C-N-CA 124.815 1.246 . . . . 0.0 107.987 -173.325 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 11' ' ' ARG . . . . . . . . . . . . . 21.6 ttt180 -95.0 146.7 24.07 Favored 'General case' 0 N--CA 1.465 0.279 0 C-N-CA 125.531 1.533 . . . . 0.0 109.754 174.277 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 12' ' ' PHE . . . . . . . . . . . . . 35.5 m-85 -134.26 156.14 48.93 Favored 'General case' 0 N--CA 1.441 -0.914 0 CA-C-O 123.675 1.702 . . . . 0.0 109.253 175.198 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 13' ' ' VAL . . . . . . . . . . . . . 0.0 OUTLIER -138.96 130.82 36.36 Favored 'Isoleucine or valine' 0 C--N 1.313 -1.002 0 CA-C-N 113.03 -1.895 . . . . 0.0 107.242 -172.713 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 14' ' ' LEU . . . . . . . . . . . . . 11.6 tp -64.86 102.72 0.62 Allowed 'General case' 0 N--CA 1.45 -0.475 0 N-CA-C 106.392 -1.707 . . . . 0.0 106.392 176.148 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 15' ' ' GLU . . . . . 0.484 ' HG3' ' HE2' ' A' ' 111' ' ' LYS . 1.3 tm-20 -85.33 -41.38 15.55 Favored 'General case' 0 N--CA 1.449 -0.495 0 N-CA-C 108.91 -0.774 . . . . 0.0 108.91 -173.826 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 5.8 p -151.92 142.71 22.91 Favored 'General case' 0 N--CA 1.442 -0.833 0 CA-C-O 122.442 1.115 . . . . 0.0 109.342 169.229 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 17' ' ' VAL . . . . . 0.51 HG12 ' H ' ' A' ' 18' ' ' ASN . 2.2 t -70.22 175.86 0.57 Allowed 'Isoleucine or valine' 0 CA--C 1.54 0.582 0 N-CA-C 107.111 -1.44 . . . . 0.0 107.111 168.253 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 18' ' ' ASN . . . . . 0.51 ' H ' HG12 ' A' ' 17' ' ' VAL . 0.6 OUTLIER -44.88 -24.01 0.18 Allowed 'General case' 0 CA--C 1.539 0.53 0 C-N-CA 127.473 2.309 . . . . 0.0 116.391 -172.467 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild full ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . -163.89 17.54 0.12 Allowed Glycine 0 CA--C 1.532 1.141 0 CA-C-O 118.356 -1.247 . . . . 0.0 113.413 170.512 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 40.9 mtmt -145.97 155.54 51.47 Favored Pre-proline 0 N--CA 1.469 0.523 0 CA-C-N 120.412 2.106 . . . . 0.0 109.519 -178.032 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 21' ' ' PRO . . . . . . . . . . . . . 80.9 Cg_endo -72.34 171.59 16.66 Favored 'Trans proline' 0 N--CA 1.45 -1.053 0 C-N-CA 122.118 1.879 . . . . 0.0 110.812 176.544 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 22' ' ' VAL . . . . . . . . . . . . . 3.8 p -120.1 165.37 15.58 Favored 'Isoleucine or valine' 0 CA--C 1.54 0.581 0 C-N-CA 124.349 1.059 . . . . 0.0 111.973 178.184 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 23' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -77.15 -175.8 3.78 Favored 'General case' 0 CA--C 1.545 0.778 0 C-N-CA 127.26 2.224 . . . . 0.0 112.503 -175.525 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 24' ' ' SER . . . . . . . . . . . . . 19.6 m 69.17 67.11 0.27 Allowed 'General case' 0 N--CA 1.452 -0.344 0 C-N-CA 128.995 2.918 . . . . 0.0 114.663 160.574 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 25' ' ' ASP . . . . . . . . . . . . . 6.5 m-20 -46.54 -38.9 10.03 Favored 'General case' 0 CA--C 1.538 0.483 0 C-N-CA 125.699 1.6 . . . . 0.0 113.308 176.324 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 26' ' ' LYS . . . . . . . . . . . . . 77.9 tttt -95.42 -17.9 21.15 Favored 'General case' 0 N--CA 1.466 0.335 0 O-C-N 120.874 -1.141 . . . . 0.0 112.501 -175.853 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 27' ' ' ASN . . . . . . . . . . . . . 4.1 p30 -150.44 69.62 8.83 Favored Pre-proline 0 CA--C 1.534 0.335 0 C-N-CA 124.136 0.974 . . . . 0.0 110.437 -177.015 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 28' ' ' PRO . . . . . . . . . . . . . 40.8 Cg_endo -65.38 162.49 33.38 Favored 'Trans proline' 0 N--CA 1.46 -0.5 0 C-N-CA 122.126 1.884 . . . . 0.0 111.279 -176.802 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 29' ' ' PRO . . . . . . . . . . . . . 18.6 Cg_endo -62.52 87.02 0.11 Allowed 'Trans proline' 0 N--CA 1.453 -0.873 0 C-N-CA 123.562 2.842 . . . . 0.0 109.416 160.211 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 30' ' ' GLU . . . . . . . . . . . . . 1.1 pt-20 -97.23 158.74 15.3 Favored 'General case' 0 N--CA 1.447 -0.576 0 C-N-CA 124.765 1.226 . . . . 0.0 108.292 173.504 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 31' ' ' ILE . . . . . . . . . . . . . 16.4 tt -139.06 137.09 42.36 Favored 'Isoleucine or valine' 0 N--CA 1.443 -0.777 0 N-CA-C 105.456 -2.053 . . . . 0.0 105.456 179.558 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 32' ' ' SER . . . . . . . . . . . . . 68.7 p -136.46 160.12 39.72 Favored 'General case' 0 C--N 1.321 -0.663 0 N-CA-C 106.804 -1.554 . . . . 0.0 106.804 170.151 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 33' ' ' PHE . . . . . . . . . . . . . 58.1 m-85 -118.38 164.67 14.89 Favored 'General case' 0 C--N 1.326 -0.445 0 N-CA-C 108.088 -1.078 . . . . 0.0 108.088 179.462 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 34' ' ' GLY . . . . . . . . . . . . . . . 167.91 142.4 3.47 Favored Glycine 0 N--CA 1.448 -0.542 0 N-CA-C 109.017 -1.633 . . . . 0.0 109.017 177.305 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 35' ' ' GLU . . . . . . . . . . . . . 0.3 OUTLIER 57.28 116.01 0.01 OUTLIER 'General case' 0 CA--C 1.537 0.461 0 C-N-CA 129.264 3.026 . . . . 0.0 114.481 168.947 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 8.6 mtmm 59.08 18.31 6.27 Favored 'General case' 0 N--CA 1.473 0.694 0 O-C-N 120.453 -1.404 . . . . 0.0 113.057 -173.091 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 37' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER 58.85 35.73 24.35 Favored 'General case' 0 CA--C 1.535 0.398 0 C-N-CA 124.843 1.257 . . . . 0.0 110.242 -174.163 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 38' ' ' MET . . . . . . . . . . . . . 9.2 mtp -69.05 164.49 22.32 Favored 'General case' 0 N--CA 1.45 -0.428 0 O-C-N 121.469 -0.77 . . . . 0.0 110.307 167.947 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 39' ' ' ILE . . . . . . . . . . . . . 9.3 mt -122.59 139.93 47.94 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.439 0 C-N-CA 126.485 1.914 . . . . 0.0 106.92 179.115 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 40' ' ' SER . . . . . . . . . . . . . 73.1 m -124.14 149.16 46.58 Favored 'General case' 0 N--CA 1.454 -0.239 0 C-N-CA 125.604 1.562 . . . . 0.0 108.364 163.223 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 41' ' ' GLY . . . . . . . . . . . . . . . 172.84 -178.8 44.69 Favored Glycine 0 CA--C 1.523 0.592 0 N-CA-C 109.221 -1.552 . . . . 0.0 109.221 172.199 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 42' ' ' SER . . . . . . . . . . . . . 40.4 t -142.0 154.61 45.14 Favored 'General case' 0 N--CA 1.449 -0.496 0 N-CA-C 107.303 -1.369 . . . . 0.0 107.303 162.569 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 43' ' ' MET . . . . . . . . . . . . . 14.9 mmt -107.03 -53.01 2.67 Favored 'General case' 0 N--CA 1.454 -0.247 0 N-CA-C 107.43 -1.322 . . . . 0.0 107.43 159.211 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 44' ' ' CYS . . . . . 1.298 ' SG ' ' SG ' ' A' ' 70' ' ' CYS . 12.7 t -151.06 -50.57 0.12 Allowed 'General case' 0 CA--C 1.534 0.338 0 N-CA-C 107.114 -1.439 . . . . 0.0 107.114 176.738 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 45' ' ' ASN . . . . . . . . . . . . . 14.1 m-80 -88.39 16.06 6.94 Favored 'General case' 0 CA--C 1.518 -0.25 0 C-N-CA 125.276 1.43 . . . . 0.0 113.967 -175.837 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 46' ' ' ARG . . . . . . . . . . . . . 3.9 mmt180 58.23 172.26 0.06 Allowed 'General case' 0 N--CA 1.465 0.277 0 C-N-CA 123.86 0.864 . . . . 0.0 110.459 -168.775 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 47' ' ' PHE . . . . . . . . . . . . . 48.7 p90 -163.59 172.35 14.47 Favored 'General case' 0 C--O 1.241 0.618 0 C-N-CA 123.841 0.856 . . . . 0.0 109.712 161.232 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 48' ' ' SER . . . . . . . . . . . . . 1.7 p -173.93 143.99 0.99 Allowed 'General case' 0 N--CA 1.449 -0.518 0 C-N-CA 124.898 1.279 . . . . 0.0 108.863 177.205 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 49' ' ' GLY . . . . . . . . . . . . . . . -176.91 169.83 42.35 Favored Glycine 0 CA--C 1.524 0.628 0 O-C-N 121.25 -0.906 . . . . 0.0 112.455 172.776 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 50' ' ' GLU . . . . . . . . . . . . . 17.3 mt-10 -72.31 94.83 1.64 Allowed 'General case' 0 N--CA 1.461 0.092 0 C-N-CA 124.922 1.289 . . . . 0.0 108.257 171.851 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 51' ' ' GLY . . . . . . . . . . . . . . . -58.98 -65.91 3.16 Favored Glycine 0 C--O 1.226 -0.385 0 C-N-CA 125.818 1.675 . . . . 0.0 113.193 -177.555 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 52' ' ' LYS . . . . . . . . . . . . . 2.5 ttmp? 70.57 138.48 0.04 OUTLIER 'General case' 0 C--N 1.326 -0.443 0 C-N-CA 128.041 2.537 . . . . 0.0 112.655 178.018 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 53' ' ' LEU . . . . . . . . . . . . . 24.8 tp -147.09 102.55 3.52 Favored 'General case' 0 C--O 1.236 0.347 0 C-N-CA 123.637 0.775 . . . . 0.0 109.801 179.734 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 2.0 t -153.09 19.48 0.57 Allowed 'General case' 0 CA--C 1.54 0.574 0 C-N-CA 123.775 0.83 . . . . 0.0 111.658 176.525 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 55' ' ' ASN . . . . . . . . . . . . . 11.9 p30 -146.03 3.69 0.94 Allowed 'General case' 0 N--CA 1.47 0.55 0 N-CA-C 113.847 1.055 . . . . 0.0 113.847 164.985 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 56' ' ' GLY . . . . . . . . . . . . . . . 95.68 16.14 40.51 Favored Glycine 0 CA--C 1.527 0.814 0 CA-C-N 119.495 1.043 . . . . 0.0 112.511 -175.695 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 57' ' ' GLU . . . . . . . . . . . . . 23.6 tt0 -136.04 156.67 48.38 Favored 'General case' 0 CA--C 1.537 0.472 0 C-N-CA 124.426 1.09 . . . . 0.0 108.331 -174.618 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 58' ' ' LEU . . . . . . . . . . . . . 38.9 tp -129.62 97.22 4.46 Favored 'General case' 0 CA--C 1.541 0.597 0 C-N-CA 125.182 1.393 . . . . 0.0 110.502 -173.109 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 59' ' ' THR . . . . . . . . . . . . . 2.7 p -113.07 104.99 12.93 Favored 'General case' 0 N--CA 1.474 0.746 0 C-N-CA 127.575 2.35 . . . . 0.0 112.203 -175.448 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 60' ' ' ALA . . . . . . . . . . . . . . . -72.73 126.05 28.97 Favored 'General case' 0 C--O 1.233 0.201 0 O-C-N 122.119 -0.363 . . . . 0.0 110.917 176.583 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 61' ' ' LYS . . . . . . . . . . . . . 16.2 ttpt -77.96 46.25 0.57 Allowed 'General case' 0 CA--C 1.543 0.692 0 C-N-CA 124.909 1.284 . . . . 0.0 113.68 -177.866 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 62' ' ' GLY . . . . . . . . . . . . . . . 134.33 -21.95 3.8 Favored Glycine 0 N--CA 1.474 1.207 0 O-C-N 120.708 -1.245 . . . . 0.0 114.84 170.732 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 63' ' ' LEU . . . . . . . . . . . . . 1.6 tp 44.89 80.06 0.04 OUTLIER 'General case' 0 CA--C 1.546 0.816 0 C-N-CA 128.008 2.523 . . . . 0.0 114.424 169.143 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 64' ' ' ALA . . . . . . . . . . . . . . . -65.18 100.03 0.42 Allowed 'General case' 0 CA--C 1.545 0.765 0 C-N-CA 127.166 2.187 . . . . 0.0 114.056 -175.132 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 65' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -108.55 175.3 5.51 Favored 'General case' 0 N--CA 1.484 1.263 0 C-N-CA 125.11 1.364 . . . . 0.0 111.433 -173.02 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 66' ' ' THR . . . . . . . . . . . . . 17.0 p -118.12 -165.65 1.13 Allowed 'General case' 0 N--CA 1.478 0.926 0 C-N-CA 126.146 1.778 . . . . 0.0 111.462 -177.618 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 67' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -142.79 75.99 1.51 Allowed 'General case' 0 N--CA 1.474 0.733 0 C-N-CA 125.463 1.505 . . . . 0.0 109.559 177.897 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 68' ' ' MET . . . . . . . . . . . . . 51.5 mtm -126.12 164.72 20.29 Favored 'General case' 0 C--N 1.326 -0.434 0 C-N-CA 129.592 3.157 . . . . 0.0 108.604 -179.423 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 69' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -113.63 163.32 15.12 Favored 'General case' 0 N--CA 1.449 -0.523 0 C-N-CA 126.246 1.819 . . . . 0.0 107.016 173.302 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 70' ' ' CYS . . . . . 1.298 ' SG ' ' SG ' ' A' ' 44' ' ' CYS . 0.5 OUTLIER -121.89 -6.94 9.01 Favored 'General case' 0 C--N 1.323 -0.548 0 C-N-CA 126.284 1.833 . . . . 0.0 114.276 -170.081 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild full ' A' A ' 71' ' ' ALA . . . . . . . . . . . . . . . 61.17 4.2 0.84 Allowed 'General case' 0 CA--C 1.538 0.503 0 C-N-CA 125.361 1.464 . . . . 0.0 114.597 -172.403 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 72' ' ' ASN . . . . . . . . . . . . . 25.0 t30 -132.61 142.5 45.08 Favored Pre-proline 0 N--CA 1.472 0.641 0 CA-C-N 120.67 1.577 . . . . 0.0 108.575 160.457 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 73' ' ' PRO . . . . . . . . . . . . . 70.0 Cg_endo -79.25 -29.36 3.17 Favored 'Trans proline' 0 C--N 1.346 0.401 0 C-N-CA 122.124 1.883 . . . . 0.0 112.179 -169.986 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 74' ' ' GLN . . . . . . . . . . . . . 31.8 tt0 -60.52 -39.63 88.53 Favored 'General case' 0 C--O 1.221 -0.42 0 CA-C-N 116.691 -0.231 . . . . 0.0 110.419 -179.751 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 75' ' ' LEU . . . . . . . . . . . . . 69.5 mt -66.84 -37.73 85.03 Favored 'General case' 0 N--CA 1.467 0.399 0 O-C-N 121.834 -0.541 . . . . 0.0 109.895 174.328 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 76' ' ' ASN . . . . . . . . . . . . . 2.2 t-20 -64.52 -46.37 83.19 Favored 'General case' 0 C--O 1.22 -0.491 0 C-N-CA 125.182 1.393 . . . . 0.0 111.45 -177.663 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 77' ' ' GLU . . . . . . . . . . . . . 8.2 pt-20 -71.3 -30.2 65.95 Favored 'General case' 0 N--CA 1.468 0.455 0 CA-C-N 119.564 1.074 . . . . 0.0 111.935 177.237 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 78' ' ' LEU . . . . . . . . . . . . . 1.0 OUTLIER -61.09 -35.94 78.35 Favored 'General case' 0 C--N 1.329 -0.308 0 C-N-CA 124.13 0.972 . . . . 0.0 109.346 177.388 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 79' ' ' ASP . . . . . . . . . . . . . 0.0 OUTLIER -59.12 -29.03 67.09 Favored 'General case' 0 N--CA 1.463 0.188 0 C-N-CA 124.074 0.95 . . . . 0.0 112.489 173.603 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 80' ' ' ASN . . . . . . . . . . . . . 10.9 t30 -97.68 -20.04 17.87 Favored 'General case' 0 N--CA 1.452 -0.37 0 C-N-CA 124.082 0.953 . . . . 0.0 111.366 -178.842 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 81' ' ' THR . . . . . . . . . . . . . 20.4 m -69.8 -57.95 4.48 Favored 'General case' 0 N--CA 1.448 -0.545 0 N-CA-C 107.051 -1.462 . . . . 0.0 107.051 172.208 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 82' ' ' ILE . . . . . . . . . . . . . 8.9 tp -66.74 -39.91 84.81 Favored 'Isoleucine or valine' 0 N--CA 1.454 -0.269 0 C-N-CA 124.058 0.943 . . . . 0.0 111.333 -170.264 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 83' ' ' SER . . . . . . . . . . . . . 43.3 p -50.15 -49.23 52.78 Favored 'General case' 0 C--O 1.236 0.389 0 C-N-CA 124.542 1.137 . . . . 0.0 110.621 -176.141 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 84' ' ' GLU . . . . . . . . . . . . . 0.9 OUTLIER -70.94 -40.29 72.13 Favored 'General case' 0 N--CA 1.447 -0.582 0 CA-C-O 117.386 -1.293 . . . . 0.0 112.108 178.919 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 85' ' ' MET . . . . . . . . . . . . . 91.8 mtp -58.81 -41.37 86.61 Favored 'General case' 0 C--N 1.347 0.472 0 CA-C-N 120.94 1.7 . . . . 0.0 109.117 -176.279 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 86' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -77.56 -27.77 51.58 Favored 'General case' 0 C--O 1.232 0.179 0 C-N-CA 123.899 0.88 . . . . 0.0 112.043 -175.859 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 87' ' ' LYS . . . . . . . . . . . . . 64.5 mttt -76.34 -52.0 10.82 Favored 'General case' 0 N--CA 1.446 -0.672 0 N-CA-C 108.601 -0.888 . . . . 0.0 108.601 176.765 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 88' ' ' GLU . . . . . . . . . . . . . 18.0 mm-40 -51.19 -51.34 54.69 Favored 'General case' 0 CA--C 1.527 0.072 0 C-N-CA 125.242 1.417 . . . . 0.0 109.511 176.641 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 89' ' ' GLY . . . . . . . . . . . . . . . 106.67 133.16 7.28 Favored Glycine 0 C--N 1.335 0.523 0 N-CA-C 107.677 -2.169 . . . . 0.0 107.677 -166.653 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 90' ' ' ALA . . . . . . . . . . . . . . . -138.19 142.72 40.02 Favored 'General case' 0 CA--C 1.516 -0.35 0 C-N-CA 123.708 0.803 . . . . 0.0 109.695 -168.333 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 91' ' ' GLN . . . . . . . . . . . . . 6.0 mp0 -72.31 129.15 37.74 Favored 'General case' 0 N--CA 1.444 -0.775 0 N-CA-C 105.206 -2.146 . . . . 0.0 105.206 -177.098 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 92' ' ' VAL . . . . . . . . . . . . . 7.5 p -122.14 127.35 75.23 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.325 0 N-CA-C 106.947 -1.501 . . . . 0.0 106.947 -175.9 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 93' ' ' ASP . . . . . . . . . . . . . 0.8 OUTLIER -142.76 94.54 2.65 Favored 'General case' 0 C--O 1.234 0.253 0 N-CA-C 107.822 -1.177 . . . . 0.0 107.822 -173.452 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 94' ' ' LEU . . . . . . . . . . . . . 0.9 OUTLIER -99.45 102.65 14.28 Favored 'General case' 0 CA--C 1.515 -0.371 0 N-CA-C 107.069 -1.456 . . . . 0.0 107.069 176.043 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 95' ' ' THR . . . . . . . . . . . . . 5.8 t -78.02 -168.81 1.36 Allowed 'General case' 0 CA--C 1.536 0.407 0 O-C-N 125.043 1.465 . . . . 0.0 107.9 178.975 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 96' ' ' ALA . . . . . . . . . . . . . . . -53.15 -23.29 7.87 Favored 'General case' 0 CA--C 1.541 0.599 0 N-CA-C 114.041 1.126 . . . . 0.0 114.041 -175.075 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 97' ' ' ASN . . . . . . . . . . . . . 30.2 p30 -158.19 6.35 0.13 Allowed 'General case' 0 N--CA 1.473 0.697 0 N-CA-C 116.247 1.943 . . . . 0.0 116.247 164.757 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 98' ' ' GLN . . . . . . . . . . . . . 3.2 tt0 -121.6 130.53 53.56 Favored 'General case' 0 N--CA 1.471 0.6 0 CA-C-N 121.216 1.826 . . . . 0.0 110.743 -176.766 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 99' ' ' LEU . . . . . 0.465 ' HB3' ' HB2' ' A' ' 110' ' ' TYR . 14.5 tp -83.77 138.84 33.06 Favored 'General case' 0 C--O 1.232 0.168 0 O-C-N 121.523 -0.736 . . . . 0.0 110.145 171.768 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 100' ' ' THR . . . . . . . . . . . . . 28.8 m -120.74 120.14 34.78 Favored 'General case' 0 N--CA 1.448 -0.556 0 N-CA-C 105.773 -1.936 . . . . 0.0 105.773 159.433 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 101' ' ' LEU . . . . . . . . . . . . . 3.2 mm? -96.77 138.59 34.1 Favored 'General case' 0 CA--C 1.505 -0.753 0 N-CA-C 106.661 -1.607 . . . . 0.0 106.661 149.376 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 102' ' ' ALA . . . . . . . . . . . . . . . -131.98 154.04 49.72 Favored 'General case' 0 C--N 1.327 -0.411 0 N-CA-C 107.319 -1.363 . . . . 0.0 107.319 165.529 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 103' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -162.94 172.2 15.44 Favored 'General case' 0 N--CA 1.442 -0.845 0 C-N-CA 127.815 2.446 . . . . 0.0 107.891 176.274 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 104' ' ' ALA . . . . . . . . . . . . . . . -53.47 -29.97 38.52 Favored 'General case' 0 CA--C 1.537 0.471 0 C-N-CA 124.16 0.984 . . . . 0.0 113.103 174.94 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 105' ' ' LYS . . . . . . . . . . . . . 53.2 mmtt -70.7 -72.39 0.21 Allowed 'General case' 0 C--O 1.232 0.138 0 C-N-CA 123.61 0.764 . . . . 0.0 111.815 175.143 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 106' ' ' GLN . . . . . . . . . . . . . 2.6 pt20 -154.57 -168.48 2.93 Favored 'General case' 0 C--O 1.232 0.168 0 C-N-CA 123.49 0.716 . . . . 0.0 110.169 -178.983 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 107' ' ' THR . . . . . . . . . . . . . 7.2 t -130.64 152.91 49.49 Favored 'General case' 0 N--CA 1.446 -0.637 0 C-N-CA 126.284 1.834 . . . . 0.0 107.583 176.264 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 108' ' ' LEU . . . . . . . . . . . . . 3.5 mm? -121.63 166.29 14.47 Favored 'General case' 0 C--O 1.237 0.442 0 C-N-CA 125.193 1.397 . . . . 0.0 109.995 174.179 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 109' ' ' THR . . . . . . . . . . . . . 9.4 m -130.96 106.6 8.52 Favored 'General case' 0 N--CA 1.448 -0.565 0 N-CA-C 107.94 -1.133 . . . . 0.0 107.94 166.225 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 110' ' ' TYR . . . . . 0.465 ' HB2' ' HB3' ' A' ' 99' ' ' LEU . 49.6 m-85 -98.96 165.26 11.84 Favored 'General case' 0 C--O 1.235 0.308 0 N-CA-C 108.946 -0.761 . . . . 0.0 108.946 172.668 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 111' ' ' LYS . . . . . 0.484 ' HE2' ' HG3' ' A' ' 15' ' ' GLU . 5.0 tppt? -122.39 146.18 47.58 Favored 'General case' 0 C--O 1.226 -0.134 0 C-N-CA 124.249 1.02 . . . . 0.0 110.144 178.932 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 112' ' ' LEU . . . . . . . . . . . . . 26.1 tp -69.65 17.82 0.05 OUTLIER 'General case' 0 CA--C 1.546 0.795 0 C-N-CA 128.813 2.845 . . . . 0.0 113.519 -177.736 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 113' ' ' ALA . . . . . . . . . . . . . . . -60.54 90.19 0.02 OUTLIER 'General case' 0 CA--C 1.534 0.361 0 C-N-CA 126.023 1.729 . . . . 0.0 111.794 -168.397 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 114' ' ' ASP . . . . . . . . . . . . . 27.2 t0 -87.35 45.44 1.27 Allowed 'General case' 0 CA--C 1.51 -0.592 0 CA-C-O 122.901 1.334 . . . . 0.0 111.494 -168.864 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 115' ' ' LEU . . . . . . . . . . . . . 2.8 mt -76.62 5.45 7.47 Favored 'General case' 0 CA--C 1.54 0.56 0 CA-C-N 115.358 -0.837 . . . . 0.0 109.963 -173.746 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 116' ' ' MET . . . . . . . . . . . . . 6.5 tpt 65.27 124.42 0.02 OUTLIER 'General case' 0 CA--C 1.537 0.472 0 C-N-CA 130.203 3.401 . . . . 0.0 111.887 -176.439 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 117' ' ' ASN . . . . . . . . . . . . . 76.0 m-20 . . . . . 0 C--O 1.24 0.597 0 C-N-CA 126.485 1.914 . . . . 0.0 111.661 -172.556 . . . . . . . . 0 0 . 1 stop_ save_